0 B11R0.148 C#CCCCCCCNC(C)C ca199a80175f95ec47bd5a46102aa6cf [0,0,0,0,0,0|2,0,2]=4 1 B11R0.148 C#CCCCCCCOC(C)C e6c97bbc6fe4b3280867bc2803557ae1 [0,0,0,0,0,0|2,0,2]=4 2 B11R0.148 C#CCCCCCNCC(C)C fd06fa02d95a078dbb3431cdab2af2d2 [0,0,0,0,0,0|2,0,2]=4 3 B11R0.148 C#CCCCCCNCC(C)O 43463605856da98cfac9cf2d44926a90 [0,0,0,0,0,0|1,0,2]=3 4 B11R0.148 C#CCCCCCNC[C@@H](C)O 58079971d41db5c4d376e2ded4be1f22 [0,0,0,0,0,0|1,0,2]=3 5 B11R0.148 C#CCCCCCNC[C@H](C)O c9a45c122f4d80efb4ab8ff22393445f [0,0,0,0,0,0|1,0,2]=3 6 B11R0.148 C#CCCCCCOCC(C)C a61121922450f0e9c5ff580ce4a514b7 [0,0,0,0,0,0|2,0,2]=4 7 B11R0.148 C#CCCCCCOCC(C)F f6abf1f7b6acfa0da20fd07b05feb3c3 [0,0,0,0,0,0|2,0,2]=4 8 B11R0.148 C#CCCCCCOCC(C)S 88abd660b4c0a35f6bf1137455b18b27 [0,0,0,0,0,0|1,1,2]=4 9 B11R0.148 C#CCCCCCOC[C@@H](C)F 169ad61d866548f489e4d149b1985c96 [0,0,0,0,0,0|2,0,2]=4 10 B11R0.148 C#CCCCCCOC[C@H](C)F d991330e1f3923c9c41b21434104c1b4 [0,0,0,0,0,0|2,0,2]=4 11 B11R0.148 C#CCCCCNCCC(C)C ffe9f88e3ab2bdb9d108fa7fa330c836 [0,0,0,0,0,0|2,0,2]=4 12 B11R0.148 C#CCCCCNCCC(C)O 3894fa65a423ebedb72f3ea62e61651c [0,0,0,0,0,0|1,0,2]=3 13 B11R0.148 C#CCCCCNCC[C@@H](C)O 2de4a19273c94843f17bc6c2225c8a77 [0,0,0,0,0,0|1,0,2]=3 14 B11R0.148 C#CCCCCNCC[C@H](C)O e2afea60ff4a103152998da6657dd6df [0,0,0,0,0,0|1,0,2]=3 15 B11R0.148 C#CCCCCOCCC(C)C f3d5e55ff7341739a5e4b007fab64fb3 [0,0,0,0,0,0|2,0,2]=4 16 B11R0.148 C#CCCCNCCCC(C)C d8fe70c77b3cfd9eb15368ad1fba7f31 [0,0,0,0,0,0|2,0,2]=4 17 B11R0.148 C#CCCCNCCCC(C)O bffb32940fc689f4836783dc8faec4fa [0,0,0,0,0,0|1,0,2]=3 18 B11R0.148 C#CCCCOCCCC(C)C cc29f1ba4cd9396b6c824b4c7561f29f [0,0,0,0,0,0|2,0,2]=4 19 B11R0.148 C#CCCNCCCCC(C)C f77375ab77eddd4ccc785a71269a481e [0,0,0,0,0,0|2,0,2]=4 20 B11R0.148 C#CCCNCCCCC(C)O 9f7f7af9f1cb8f1259e8635f23eda46e [0,0,0,0,0,0|1,0,2]=3 21 B11R0.148 C#CCCNCCCC[C@@H](C)O 93d38f47f222bad166b24a545be755c6 [0,0,0,0,0,0|1,0,2]=3 22 B11R0.148 C#CCCOCCCCC(C)C f68f147b068a29234e7ad059e8ef7eea [0,0,0,0,0,0|2,0,2]=4 23 B11R0.148 C#CCNCCCCCC(C)C 0c94352d28097abd7f605f7e983d1187 [0,0,0,0,0,0|2,0,2]=4 24 B11R0.148 C#CCOCCCCCC(C)C d673a1af0e23ad3f49e2c6af3b6337e2 [0,0,0,0,0,0|2,0,2]=4 25 B11R0.148 C#CCOCCNCCC(C)O cc2042aee894acf79fbd5cb13c706538 [0,0,0,0,0,0|2,0,2]=4 26 B11R0.148 C#CCOCCNCC[C@@H](C)O 9bde25d05e4992349e7cb63f44d77085 [0,0,0,0,0,0|2,0,2]=4 27 B11R0.148 C#CCOCCNCC[C@H](C)O 755e4ef0dfed0646ef64075eb75b6116 [0,0,0,0,0,0|2,0,2]=4 28 B11R0.148 C/C=C/CCCOCCC(C)C 962d87afe070bc9ccb52c528c2e16511 [0,0,0,0,0,0|2,0,2]=4 29 B11R0.148 C/C=C/CCOCCCC(C)C dd51f39174850bb5ffe76b27ab9463be [0,0,0,0,0,0|2,0,2]=4 30 B11R0.148 C/C=C/COCCCCC(C)C 7585b8ea5dc13e8dab24c7fb7780bb3c [0,0,0,0,0,0|2,0,2]=4 31 B11R0.148 C/C=C\CCCNCCC(C)C 5f9cbf731c3eafa8c17ee0eb7370ecba [0,0,0,0,0,0|2,0,2]=4 32 B11R0.148 C/C=C\CCCNCCC(C)O ba7125d3efd9f755d874b46216146458 [0,0,0,0,0,0|1,0,2]=3 33 B11R0.148 C/C=C\CCCNCC[C@@H](C)O 76c2c5107916fc9f56c907b1b653f4be [0,0,0,0,0,0|1,0,2]=3 34 B11R0.148 C/C=C\CCCNCC[C@H](C)O 33c35d3155604a4673c86124d4778f69 [0,0,0,0,0,0|1,0,2]=3 35 B11R0.148 C/C=C\CCCOCCC(C)C b0e96552cf338a5eb0c0a9728f57fd06 [0,0,0,0,0,0|2,0,2]=4 36 B11R0.148 C/C=C\COCCCCC(C)C c784be99fedb586f5e5c6ed928be4ee5 [0,0,0,0,0,0|2,0,2]=4 37 B11R0.148 C=C(Br)CCOCCCCCC a6f96aa10bef0cb6b12500bf2b506dde [0,0,0,0,0,0|2,0,2]=4 38 B11R0.148 C=C(Br)CNCCCCCCC a2c5c3a5c8b39ffc6201a20725555b17 [0,0,0,0,0,0|2,0,2]=4 39 B11R0.148 C=C(Br)COCCCCCCC 2d3f57176c9c65c11b1e93be7df8b6f4 [0,0,0,0,0,0|2,0,2]=4 40 B11R0.148 C=C(C)CCCNCCCCC 2a61d6a86b53b2d6ed8ca64bfa3ebb10 [0,0,0,0,0,0|2,0,1]=3 41 B11R0.148 C=C(C)CCCNCCCCCl c8731ba1f70d8bc13a2e4a40391f9ac0 [0,0,0,0,0,0|3,0,1]=4 42 B11R0.148 C=C(C)CCCNCCCCO 7572f60f6a5b76abf8c2da2af891eb7b [0,0,0,0,0,0|3,0,1]=4 43 B11R0.148 C=C(C)CCCNCCCCS 0775800d0bad2dccb14d485132f98d28 [0,0,0,0,0,0|3,0,1]=4 44 B11R0.148 C=C(C)CCCNCCCOC c9150017886d1482c8b895f9303b099d [0,0,0,0,0,0|3,0,1]=4 45 B11R0.148 C=C(C)CCCNCCCSC a786008002f512f0dfee23897df0246b [0,0,0,0,0,0|3,0,1]=4 46 B11R0.148 C=C(C)CCCNCCOCC 7d4408525a548f819a4a439218b86c6b [0,0,0,0,0,0|3,0,1]=4 47 B11R0.148 C=C(C)CCCNCCSCC 5cd28aff6971764f2b140194b2a3898b [0,0,0,0,0,0|3,0,1]=4 48 B11R0.148 C=C(C)CCCOCCCCC 7ddee3a31fabfc9464b6764c3b9e7cff [0,0,0,0,0,0|2,0,1]=3 49 B11R0.148 C=C(C)CCCOCCCCF 26b3343d7eb194f86527dbdbaadea1a1 [0,0,0,0,0,0|3,0,1]=4 50 B11R0.148 C=C(C)CCCOCCCCS 72887831882c777b2d08bdeaee97b3d5 [0,0,0,0,0,0|3,0,1]=4 51 B11R0.148 C=C(C)CCCOCCCOC cfb76832c98f1b24c2b6910849e874a9 [0,0,0,0,0,0|3,0,1]=4 52 B11R0.148 C=C(C)CCCOCCCSC f709d11388c937542d3f01d13f28b4bc [0,0,0,0,0,0|3,0,1]=4 53 B11R0.148 C=C(C)CCCOCCOCC 1f01a8c58a9f41f11eafa6ecde513af8 [0,0,0,0,0,0|3,0,1]=4 54 B11R0.148 C=C(C)CCCOCCSCC 1d6fc1edadc5e44f2933e7ab7320822b [0,0,0,0,0,0|3,0,1]=4 55 B11R0.148 C=C(C)CCNCCCCCC 7e6410037cc055178b065ec8aa195598 [0,0,0,0,0,0|2,0,1]=3 56 B11R0.148 C=C(C)CCNCCCCCCl 48a2f78ae0d81b19e97870726aadd7d2 [0,0,0,0,0,0|3,0,1]=4 57 B11R0.148 C=C(C)CCNCCCCCF e4049c627170f66e2443e7ae56fc1a31 [0,0,0,0,0,0|3,0,1]=4 58 B11R0.148 C=C(C)CCNCCCCCO c6f3f71deefab5553eb8df4230d39cdd [0,0,0,0,0,0|3,0,1]=4 59 B11R0.148 C=C(C)CCNCCCCOC 2374a065e58ae3e114dd815950b6af1b [0,0,0,0,0,0|3,0,1]=4 60 B11R0.148 C=C(C)CCNCCCCSC 1f14cb8a68c9d13e21b0b4ea6067130e [0,0,0,0,0,0|3,0,1]=4 61 B11R0.148 C=C(C)CCNCCCOCC ff704d26de364b46d8c436a83f70fd2e [0,0,0,0,0,0|3,0,1]=4 62 B11R0.148 C=C(C)CCNCCCSCC 8c0505be17453f9c4ddd86b5bdf953e1 [0,0,0,0,0,0|3,0,1]=4 63 B11R0.148 C=C(C)CCNCCOCCC 38f2e6beb7d9f3f335cd6ec192d47d4f [0,0,0,0,0,0|3,0,1]=4 64 B11R0.148 C=C(C)CCNCOCCCC 5a2b25e6d30d6eafc145eea57137942d [0,0,0,0,0,0|3,0,1]=4 65 B11R0.148 C=C(C)CCOCCCCCC f3b42b02f97b5ae546a5d0ce100d5f9b [0,0,0,0,0,0|2,0,1]=3 66 B11R0.148 C=C(C)CCOCCCCCF 1cd7d278cca05628b6323907ef8139b0 [0,0,0,0,0,0|3,0,1]=4 67 B11R0.148 C=C(C)CCOCCCCOC 6c68902b59439ef02db1827c81ac86e5 [0,0,0,0,0,0|3,0,1]=4 68 B11R0.148 C=C(C)CCOCCCCSC f4cc9617da459842d98d117720309ec6 [0,0,0,0,0,0|3,0,1]=4 69 B11R0.148 C=C(C)CCOCCCOCC 61def538ce613515ea5ce21b11143c01 [0,0,0,0,0,0|3,0,1]=4 70 B11R0.148 C=C(C)CCOCCCSCC 7397b0b72e3a11c422be6f76310489fe [0,0,0,0,0,0|3,0,1]=4 71 B11R0.148 C=C(C)CCOCCOCCC cb715321bec56439eb639e3e8e48a990 [0,0,0,0,0,0|3,0,1]=4 72 B11R0.148 C=C(C)CCOCCSCCC 6071b176c37be307e50540c8a1de3d5a [0,0,0,0,0,0|3,0,1]=4 73 B11R0.148 C=C(C)CCOCOCCCC 42fd3e6ac5c48ab1e865d86cdea89fe7 [0,0,0,0,0,0|3,0,1]=4 74 B11R0.148 C=C(C)CNCCCCCCC b09be588b32545d66c354051c751378d [0,0,0,0,0,0|2,0,1]=3 75 B11R0.148 C=C(C)CNCCCCCCCl 2fdfdf8f4ed56f8465697d9b05e118f7 [0,0,0,0,0,0|3,0,1]=4 76 B11R0.148 C=C(C)CNCCCCCCF 17fed7ab7f2f7d912fa59394c63a539e [0,0,0,0,0,0|3,0,1]=4 77 B11R0.148 C=C(C)CNCCCCCCO e3371219b61ce074e30708f3fdbea6a0 [0,0,0,0,0,0|3,0,1]=4 78 B11R0.148 C=C(C)CNCCCCCOC 29952e825f42e6ab1f39f33dd8b42201 [0,0,0,0,0,0|3,0,1]=4 79 B11R0.148 C=C(C)CNCCCCSCC c180cc5b9c11b8eacd9459f3bc13ff91 [0,0,0,0,0,0|3,0,1]=4 80 B11R0.148 C=C(C)CNCCCOCCC cb469497c96d22c2eafd39e21892bf2c [0,0,0,0,0,0|3,0,1]=4 81 B11R0.148 C=C(C)CNCCOCCCC ae6ee3ea65b0e44b189ffe8a53dab9de [0,0,0,0,0,0|3,0,1]=4 82 B11R0.148 C=C(C)COCCCCCCC 6e86eb79eebc0414260368e904a927e1 [0,0,0,0,0,0|2,0,1]=3 83 B11R0.148 C=C(C)COCCCCCCF 380bb7bd21d3f8f1d87af05d88324047 [0,0,0,0,0,0|3,0,1]=4 84 B11R0.148 C=C(C)COCCCCCCS 3f0f1a29aec0b299137fee03b115444c [0,0,0,0,0,0|3,0,1]=4 85 B11R0.148 C=C(C)COCCCCCOC ed97d18a550e659e47226632b251e7bb [0,0,0,0,0,0|3,0,1]=4 86 B11R0.148 C=C(C)COCCCOCCC cf5cc5a18d508235c9f5414fa129b4cf [0,0,0,0,0,0|3,0,1]=4 87 B11R0.148 C=C(C)COCCOCCCC 01d4de70de3af1ba59b4d422fb0d6d4e [0,0,0,0,0,0|3,0,1]=4 88 B11R0.148 C=C(C)COCCSCCCC f1e3c253a1b49c4853ab945b5a2eb533 [0,0,0,0,0,0|3,0,1]=4 89 B11R0.148 C=C(Cl)CNCCCCCCC 7a0fa4242a58853f2d6992ce3c58e601 [0,0,0,0,0,0|2,0,2]=4 90 B11R0.148 C=C(Cl)COCCCCCCC 2ebbdffeb133533b445815f4f9debd40 [0,0,0,0,0,0|2,0,2]=4 91 B11R0.148 C=C(F)CNCCCCCCC 33b7a963b6b3a4d0ec93076c10be1825 [0,0,0,0,0,0|2,0,2]=4 92 B11R0.148 C=C(F)COCCCCCCC 8f56dd536e780ef08f69e4d7538969de [0,0,0,0,0,0|2,0,2]=4 93 B11R0.148 C=C(I)COCCCCCCC 1f40c8fadf0ee0af29c66374f033ff62 [0,0,0,0,0,0|2,0,2]=4 94 B11R0.148 C=CCCCCCCOC(C)C 57a172052ef6843f2f72eb1a00ce441e [0,0,0,0,0,0|2,0,2]=4 95 B11R0.148 C=CCCCCCNCC(C)C e3ee762c60b2434a8103b160f55d4463 [0,0,0,0,0,0|2,0,2]=4 96 B11R0.148 C=CCCCCCNCC(C)O 5783f9ad3af4ab634089fb320b9348d8 [0,0,0,0,0,0|1,0,2]=3 97 B11R0.148 C=CCCCCCNC[C@@H](C)O fb984aba24381375c3f25338bfe312ce [0,0,0,0,0,0|1,0,2]=3 98 B11R0.148 C=CCCCCCNC[C@H](C)O b8102f1688f28097ef389368006145a2 [0,0,0,0,0,0|1,0,2]=3 99 B11R0.148 C=CCCCCCOCC(C)C 4e55d40511b56eb7d22206e4904a105f [0,0,0,0,0,0|2,0,2]=4 100 B11R0.148 C=CCCCCCOCC(C)F 813b1d001b1d2d035252b3bfaa2100cd [0,0,0,0,0,0|2,0,2]=4 101 B11R0.148 C=CCCCCCOCC(C)S c3e2fd41b5006864a7d43750ed69295b [0,0,0,0,0,0|1,1,2]=4 102 B11R0.148 C=CCCCCCOC[C@@H](C)F 825a4fbded6e1762764591dcef1ac2c9 [0,0,0,0,0,0|2,0,2]=4 103 B11R0.148 C=CCCCCCOC[C@H](C)F 81862bbd0cd44e82acd28beb6ee36ee9 [0,0,0,0,0,0|2,0,2]=4 104 B11R0.148 C=CCCCCNCCC(C)C 158375db785f61c3339d93e89a88e56d [0,0,0,0,0,0|2,0,2]=4 105 B11R0.148 C=CCCCCNCCC(C)O 9775f9f85f7ad6616600bc9d903aa57a [0,0,0,0,0,0|1,0,2]=3 106 B11R0.148 C=CCCCCNCC[C@@H](C)O 281ed651455aa4299ec6f6a5b9dbbc02 [0,0,0,0,0,0|1,0,2]=3 107 B11R0.148 C=CCCCCNCC[C@H](C)O 0353515686f8b47cfa1725a469a840df [0,0,0,0,0,0|1,0,2]=3 108 B11R0.148 C=CCCCCOCCC(C)C 751752d7fe51d912648ef9a09238bba9 [0,0,0,0,0,0|2,0,2]=4 109 B11R0.148 C=CCCCNCCCC(C)C d5d358ecf426909222848658b6290a9d [0,0,0,0,0,0|2,0,2]=4 110 B11R0.148 C=CCCCNCCCC(C)O 37c09fdce0f2a1ff492d03bb75ea7ce3 [0,0,0,0,0,0|1,0,2]=3 111 B11R0.148 C=CCCCOCCCC(C)C 75191be53cd65333ab5d49bff8ef2685 [0,0,0,0,0,0|2,0,2]=4 112 B11R0.148 C=CCCNCCCCC(C)C c2beb7f017e80829398372b93b824468 [0,0,0,0,0,0|2,0,2]=4 113 B11R0.148 C=CCCNCCCCC(C)O d05a1b5d3e77e9adb9eff93eecec6c5e [0,0,0,0,0,0|1,0,2]=3 114 B11R0.148 C=CCCNCCCC[C@@H](C)O 8f328e1752482249385e822d3238144d [0,0,0,0,0,0|1,0,2]=3 115 B11R0.148 C=CCCOCCCCC(C)C f6bda8b7c158535f791755a9ce160e8f [0,0,0,0,0,0|2,0,2]=4 116 B11R0.148 C=CCNCCCCCC(C)C ff15c3c17f1c7966dca038c34306642c [0,0,0,0,0,0|2,0,2]=4 117 B11R0.148 C=CCOCCCCCC(C)C bbe0eca2170c1b3465975e7c964e0473 [0,0,0,0,0,0|2,0,2]=4 118 B11R0.148 C=CCOCCNCCC(C)O ee49b905615e2326f86359a0e0806d74 [0,0,0,0,0,0|2,0,2]=4 119 B11R0.148 C=CCOCCNCC[C@@H](C)O dd7e690e3dc15d244db1ba4dfbc4e8d6 [0,0,0,0,0,0|2,0,2]=4 120 B11R0.148 C=CCOCCNCC[C@H](C)O 5821d442eebe541cb5a194db990a613f [0,0,0,0,0,0|2,0,2]=4 121 B11R0.148 C=COCCCNCCC(C)O 94c52f0decbf1550010996feb2f78f26 [0,0,0,0,0,0|2,0,2]=4 122 B11R0.148 C=COCCNCCCC(C)O f9fca8a35e9ae8d30f90325f0be10ef2 [0,0,0,0,0,0|2,0,2]=4 123 B11R0.148 CC#CCCCOCCC(C)C dcc736145adc4f373e3ffd9a0d8adcda [0,0,0,0,0,0|2,0,2]=4 124 B11R0.148 CC#CCCOCCCC(C)C b7b61b4299457ab9db696abe70b2cb79 [0,0,0,0,0,0|2,0,2]=4 125 B11R0.148 CC#CCNCCCCC(C)C 6dc38a47a4365b312b9a9fdd5dfe201d [0,0,0,0,0,0|2,0,2]=4 126 B11R0.148 CC#CCNCCCCC(C)O 1a38d04ba7b02ab28b7b3c702e29edbf [0,0,0,0,0,0|1,0,2]=3 127 B11R0.148 CC#CCNCCCC[C@@H](C)O 7121bb5c0db6d3bdbe50dc96855284ba [0,0,0,0,0,0|1,0,2]=3 128 B11R0.148 CC#CCOCCCCC(C)C d2da52b0c5a70b5942e6ee45770668d4 [0,0,0,0,0,0|2,0,2]=4 129 B11R0.148 CC(=O)CCCCCNCCBr 2814ea2073b8c89939c64a8e09a7e233 [0,0,0,0,0,0|2,0,2]=4 130 B11R0.148 CC(=O)CCCCCNCCF 265cbbf874da51a095cb484ec0438d5a [0,0,0,0,0,0|2,0,2]=4 131 B11R0.148 CC(=O)CCCCCNCCI 249e58dc239dab6a72796538d51ba9e8 [0,0,0,0,0,0|2,0,2]=4 132 B11R0.148 CC(=O)CCCCCNCCO 3e8a33401594d0af1994ed5e283e0ea1 [0,0,0,0,0,0|2,0,2]=4 133 B11R0.148 CC(=O)CCCCCNCCS 4b42acf5020fe410d7a756528278b61a [0,0,0,0,0,0|2,0,2]=4 134 B11R0.148 CC(=O)CCCCCOCCF acfcd3da13be6392ab1838f8edfa9eaf [0,0,0,0,0,0|2,0,2]=4 135 B11R0.148 CC(=O)CCCCCOCCS ae67aed9b0d9b06fefa17b6ef4dcaef7 [0,0,0,0,0,0|2,0,2]=4 136 B11R0.148 CC(=O)CCCCNCCCCl 7c7b146c40c0acfb48aadb4e09bd4ce6 [0,0,0,0,0,0|2,0,2]=4 137 B11R0.148 CC(=O)CCCCNCCCO 5a85a5734691c87d84615e5d2effcf14 [0,0,0,0,0,0|2,0,2]=4 138 B11R0.148 CC(=O)CCCCOCCCF a5a3ce24067ae081ca443bc54de8acf1 [0,0,0,0,0,0|2,0,2]=4 139 B11R0.148 CC(=O)CCCCOCCCS a7c6975baa6fe8aa2c12bfb3cf806d65 [0,0,0,0,0,0|2,0,2]=4 140 B11R0.148 CC(=O)CCCNCCCCCl 1c197c6bb43dcf367a806b907cd1775a [0,0,0,0,0,0|2,0,2]=4 141 B11R0.148 CC(=O)CCCNCCCCO 50b6d540f864c9eb03851c0461d95814 [0,0,0,0,0,0|2,0,2]=4 142 B11R0.148 CC(=O)CCCNCCCCS 3984288bc637b2b6153052a7460caacb [0,0,0,0,0,0|2,0,2]=4 143 B11R0.148 CC(=O)CCCOCCCCF 5c7c199705317ad51fae8cb22f6ec3e8 [0,0,0,0,0,0|2,0,2]=4 144 B11R0.148 CC(=O)CCCOCCCCS 3689bb9ac1af1c3856b69e96e09668af [0,0,0,0,0,0|2,0,2]=4 145 B11R0.148 CC(=O)CCNCCCCCCl 55a8ea3d98c3c99a6dc9bb6e45f49262 [0,0,0,0,0,0|2,0,2]=4 146 B11R0.148 CC(=O)CCNCCCCCO 3e39b9d8eb28be289794d5a85c7d3904 [0,0,0,0,0,0|2,0,2]=4 147 B11R0.148 CC(=O)CCOCCCCCF 6bb0a71e61b30b8b2e877852ef4f0b17 [0,0,0,0,0,0|2,0,2]=4 148 B11R0.148 CC(=O)CNCCCCCCF e5220e4b1eb66b48d5fb2be647d0f093 [0,0,0,0,0,0|2,0,2]=4 149 B11R0.148 CC(=O)CNCCCCCCO 5ae8b5dcf45a271724ef32cc715e5de7 [0,0,0,0,0,0|2,0,2]=4 150 B11R0.148 CC(=O)COCCCCCCF f9ddf83656d1768dec73eb1308c462ef [0,0,0,0,0,0|2,0,2]=4 151 B11R0.148 CC(=O)NCCCCCCCO 375247c5b76fff4f96757dfebee6b6e0 [0,0,0,0,0,0|2,0,2]=4 152 B11R0.148 CC(C)CCCCCCNC=O 3f1822f5ff2ee7d8a1105bf77a829c4f [0,0,0,0,0,0|3,0,1]=4 153 B11R0.148 CC(C)CCCCCCNCF 07e7547058968009f62cd6ff16da8999 [0,0,0,0,0,0|3,0,0]=3 154 B11R0.148 CC(C)CCCCCCNCO c67da97a578ef941f715194c999211cb [0,0,0,0,0,0|3,0,0]=3 155 B11R0.148 CC(C)CCCCCCOCF 36d479357b5e82829446ef28eb8b1a82 [0,0,0,0,0,0|3,0,0]=3 156 B11R0.148 CC(C)CCCCCNCC#N 6e87c579a595ddc88715c630679b5937 [0,0,0,0,0,0|3,0,1]=4 157 B11R0.148 CC(C)CCCCCNCC=O 13c5ec72322b2fafd2766312f8a39bff [0,0,0,0,0,0|3,0,1]=4 158 B11R0.148 CC(C)CCCCCNCCBr 5bfae438793f7454f530d32498555515 [0,0,0,0,0,0|3,0,0]=3 159 B11R0.148 CC(C)CCCCCNCCF 311121f2b56de7f318343b5af1e4861e [0,0,0,0,0,0|3,0,0]=3 160 B11R0.148 CC(C)CCCCCNCCI ac42970a37b4763097f36a692f8763dc [0,0,0,0,0,0|3,0,0]=3 161 B11R0.148 CC(C)CCCCCNCCO 32c9507b6eccf4ed605d3d1f4db0ad0a [0,0,0,0,0,0|3,0,0]=3 162 B11R0.148 CC(C)CCCCCNCCS 5dd0a8e19fa133bba1024533db5929fd [0,0,0,0,0,0|3,0,0]=3 163 B11R0.148 CC(C)CCCCCOCC#N 2d02067baff8182ed0c7c7e0319dc880 [0,0,0,0,0,0|3,0,1]=4 164 B11R0.148 CC(C)CCCCCOCC=O 390c9abe458938127a14ae4ddcd90aca [0,0,0,0,0,0|3,0,1]=4 165 B11R0.148 CC(C)CCCCCOCCF 053e5e9ce8475118f344fef73ec64ee6 [0,0,0,0,0,0|3,0,0]=3 166 B11R0.148 CC(C)CCCCCOCCS e3c032b65206d340dcbdbe7befa98100 [0,0,0,0,0,0|3,0,0]=3 167 B11R0.148 CC(C)CCCCNCCC#N 32d1ef634552e4050931970aa62ef08f [0,0,0,0,0,0|3,0,1]=4 168 B11R0.148 CC(C)CCCCNCCCCl 7e3a0b0eef096d0effc10b07b8a71a29 [0,0,0,0,0,0|3,0,0]=3 169 B11R0.148 CC(C)CCCCNCCCO 66fccb49cc596f23a13457d139f2281e [0,0,0,0,0,0|3,0,0]=3 170 B11R0.148 CC(C)CCCCNCCON 806c62449970b746ec044d0eaed72815 [0,0,0,0,0,0|4,0,0]=4 171 B11R0.148 CC(C)CCCCOCCC#N e7e9b8bdb4d59bda3021d38bf436eddd [0,0,0,0,0,0|3,0,1]=4 172 B11R0.148 CC(C)CCCCOCCC=O 6b54c6ed6055dfd8bb6d5b44e1d4c0af [0,0,0,0,0,0|3,0,1]=4 173 B11R0.148 CC(C)CCCCOCCCF f22022e643c6f9df748ddfda7066398d [0,0,0,0,0,0|3,0,0]=3 174 B11R0.148 CC(C)CCCCOCCCS f157574aeb835abda8a836a9bb318fe8 [0,0,0,0,0,0|3,0,0]=3 175 B11R0.148 CC(C)CCCNCCCC#N 5880ee1d6f66d2a8573cd86ac063d549 [0,0,0,0,0,0|3,0,1]=4 176 B11R0.148 CC(C)CCCNCCCC=O 0702fa670a0afe56ec3750251cad2c69 [0,0,0,0,0,0|3,0,1]=4 177 B11R0.148 CC(C)CCCNCCCCCl b66c5839a7aec3d9fde3e7b06e3afb88 [0,0,0,0,0,0|3,0,0]=3 178 B11R0.148 CC(C)CCCNCCCCF 5b62733b7f63a4d70558560c2c7a14e4 [0,0,0,0,0,0|3,0,0]=3 179 B11R0.148 CC(C)CCCNCCCCO f480653b3df19ce94d31cd5ad807be07 [0,0,0,0,0,0|3,0,0]=3 180 B11R0.148 CC(C)CCCNCCCCS 76b3911ddaa63cc704f4ef8bbfbd7dd8 [0,0,0,0,0,0|3,0,0]=3 181 B11R0.148 CC(C)CCCOCCCC#N 10e6a2ab21c0c49a5fbe3dc1f2cc91cd [0,0,0,0,0,0|3,0,1]=4 182 B11R0.148 CC(C)CCCOCCCC=O ffc3c41a9ad33489edd06975d48286e2 [0,0,0,0,0,0|3,0,1]=4 183 B11R0.148 CC(C)CCCOCCCCF 86092488479b01357dff047de51d9649 [0,0,0,0,0,0|3,0,0]=3 184 B11R0.148 CC(C)CCCOCCCCS f641a54416f77e2e6a29b94f34090526 [0,0,0,0,0,0|3,0,0]=3 185 B11R0.148 CC(C)CCNCCCCC#N 80b17b4cec49b3a20705a7d81e5555d1 [0,0,0,0,0,0|3,0,1]=4 186 B11R0.148 CC(C)CCNCCCCC=O 68332bf2381c16e84e03b83948d5cb22 [0,0,0,0,0,0|3,0,1]=4 187 B11R0.148 CC(C)CCNCCCCCCl adc4a73350d78ab8734e29fd29aa9a28 [0,0,0,0,0,0|3,0,0]=3 188 B11R0.148 CC(C)CCNCCCCCF 98458253075d1b8fc07366d1e30172af [0,0,0,0,0,0|3,0,0]=3 189 B11R0.148 CC(C)CCNCCCCCO fc49ec5c15f39f3a7337721d9235656e [0,0,0,0,0,0|3,0,0]=3 190 B11R0.148 CC(C)CCNCCCCON 414394e43359cdf98e0238911ee26128 [0,0,0,0,0,0|4,0,0]=4 191 B11R0.148 CC(C)CCNCCOCCO 4a3a70eb57e9e5d40f6f89e5df83e729 [0,0,0,0,0,0|4,0,0]=4 192 B11R0.148 CC(C)CCNCCOCCS a02871a1da5ba6289a98ab47e5651d0c [0,0,0,0,0,0|4,0,0]=4 193 B11R0.148 CC(C)CCNCCSCCO 3481692462a8eb670bc4437cfecbb82d [0,0,0,0,0,0|4,0,0]=4 194 B11R0.148 CC(C)CCOCCCCC#N d2cb22228ce009b868e3e86e641f794b [0,0,0,0,0,0|3,0,1]=4 195 B11R0.148 CC(C)CCOCCCCC=O 5e369a23d4928b276f632455b4e3ea3e [0,0,0,0,0,0|3,0,1]=4 196 B11R0.148 CC(C)CCOCCCCCF 263dc4239d195e2d75744d8b8f7dca45 [0,0,0,0,0,0|3,0,0]=3 197 B11R0.148 CC(C)CCOCCOCCF 43ba486bbf74af10421d789f98888b14 [0,0,0,0,0,0|4,0,0]=4 198 B11R0.148 CC(C)CCOCCOCCS eed1383bde38284f1c30091a1d5adea9 [0,0,0,0,0,0|4,0,0]=4 199 B11R0.148 CC(C)CNCCCCCC#N 72c77afd195b70033ad78b4560445087 [0,0,0,0,0,0|3,0,1]=4 200 B11R0.148 CC(C)CNCCCCCC=O a883d3cf6db767faa0cc74f8edd20b50 [0,0,0,0,0,0|3,0,1]=4 201 B11R0.148 CC(C)CNCCCCCCCl fb7a963c923d80447b890dad6814e45d [0,0,0,0,0,0|3,0,0]=3 202 B11R0.148 CC(C)CNCCCCCCF fcaaec7a06d96e75efe11e2ff627dbf6 [0,0,0,0,0,0|3,0,0]=3 203 B11R0.148 CC(C)CNCCCCCCO ff6d9ee46e52197dee5255a09adb5386 [0,0,0,0,0,0|3,0,0]=3 204 B11R0.148 CC(C)CNCCCOCCO 40320f3181f243375868bac4ef793e62 [0,0,0,0,0,0|4,0,0]=4 205 B11R0.148 CC(C)CNCCOCCCO c4ab08f2ad883ac30df2d52d85a592df [0,0,0,0,0,0|4,0,0]=4 206 B11R0.148 CC(C)COCCCCCC#N 08e8a2515324fe8c07aa2b3b057a479c [0,0,0,0,0,0|3,0,1]=4 207 B11R0.148 CC(C)COCCCCCC=O fcc48a95ed6abbc7907c59d30bb7f88e [0,0,0,0,0,0|3,0,1]=4 208 B11R0.148 CC(C)COCCCCCCF 3d0d1a42b0e4886a3a26fdbd34de3d18 [0,0,0,0,0,0|3,0,0]=3 209 B11R0.148 CC(C)COCCCCCCS b80d7e4caeef24a8a7885a1b586e8b78 [0,0,0,0,0,0|3,0,0]=3 210 B11R0.148 CC(C)COCCCNCCF c5eecc0e4a05033b7bb82b394bd16324 [0,0,0,0,0,0|4,0,0]=4 211 B11R0.148 CC(C)COCCCNCCO 5523b8bda6980b859f61656796c0a2a5 [0,0,0,0,0,0|4,0,0]=4 212 B11R0.148 CC(C)COCCCNCCS 480c7d3c36851f3c2341cbd0fe04e0af [0,0,0,0,0,0|4,0,0]=4 213 B11R0.148 CC(C)COCCCOCCF aee02837d071a1666f305f27a0409c86 [0,0,0,0,0,0|4,0,0]=4 214 B11R0.148 CC(C)COCCCOCCS a2b71a5675adb6e999d320774118a11e [0,0,0,0,0,0|4,0,0]=4 215 B11R0.148 CC(C)COCCNCCCCl 78529005f9e0791abd5874c2de32a9e1 [0,0,0,0,0,0|4,0,0]=4 216 B11R0.148 CC(C)COCCNCCCO 22e30f46eb7b56bb549b3a3c326c497e [0,0,0,0,0,0|4,0,0]=4 217 B11R0.148 CC(C)COCCOCCCF 259edd9fa829566eb5fb51f678f517e4 [0,0,0,0,0,0|4,0,0]=4 218 B11R0.148 CC(C)COCCOCCCS 39fd5c104adb07a2c1dd58f7072e9c8e [0,0,0,0,0,0|4,0,0]=4 219 B11R0.148 CC(C)CSCCCCNCF 8c7f194813a5b6789cabc11d1a3caa6b [0,0,0,0,0,0|4,0,0]=4 220 B11R0.148 CC(C)CSCCCCNCO f96d487a45f8aa32ca5de6fb1389ccdc [0,0,0,0,0,0|4,0,0]=4 221 B11R0.148 CC(C)CSCCCOCCF b515ed92930e7858e19ff8ef4cccf888 [0,0,0,0,0,0|4,0,0]=4 222 B11R0.148 CC(C)CSCCCOCCS 24805e498b7681ac7a7a0c94f4e4da28 [0,0,0,0,0,0|4,0,0]=4 223 B11R0.148 CC(C)CSCCOCCCF 3bcea13d8cedf0c54c8e2c1b340d4da6 [0,0,0,0,0,0|4,0,0]=4 224 B11R0.148 CC(C)CSCCOCCCS 2974362d777fb8fea6c46abbefa02ab1 [0,0,0,0,0,0|4,0,0]=4 225 B11R0.148 CC(C)NCCCCCCCO c837ff2d926a42272236a6f998018725 [0,0,0,0,0,0|3,0,0]=3 226 B11R0.148 CC(C)NCCCCSCCO 2c868b830ab25af0ff7e360883ef4bdd [0,0,0,0,0,0|4,0,0]=4 227 B11R0.148 CC(C)NCCCOCCCO fb68545dd245eb5005035f230bed1579 [0,0,0,0,0,0|4,0,0]=4 228 B11R0.148 CC(C)OCCCCCCC#N cd9f30ed71e82ff21f80bf44813c5188 [0,0,0,0,0,0|3,0,1]=4 229 B11R0.148 CC(C)OCCCCCCC=O c8cae6b6fc9895c219b721a4db375751 [0,0,0,0,0,0|3,0,1]=4 230 B11R0.148 CC(C)OCCCNCCCF bdda768572ecd88b5a1d02680b552d25 [0,0,0,0,0,0|4,0,0]=4 231 B11R0.148 CC(C)OCCCNCCCO ce796548e262da553cfdbcb620504e47 [0,0,0,0,0,0|4,0,0]=4 232 B11R0.148 CC(C)OCCCNCCCS b848358b1e47e30c595e496b366e330e [0,0,0,0,0,0|4,0,0]=4 233 B11R0.148 CC(C)OCCCOCCCF 8ea21deb05adffec2de519798665811c [0,0,0,0,0,0|4,0,0]=4 234 B11R0.148 CC(C)OCCCOCCCS d8082fd40b1d6637a5576909480a3a81 [0,0,0,0,0,0|4,0,0]=4 235 B11R0.148 CC(C)OCCNCCCCCl 5a1d1c4f1956433e2fdd0f12a1a1101b [0,0,0,0,0,0|4,0,0]=4 236 B11R0.148 CC(C)OCCNCCCCF b4d02eb2b954a48e9685f9edfdc81340 [0,0,0,0,0,0|4,0,0]=4 237 B11R0.148 CC(C)OCCNCCCCO be173305c5b747f684d834ee581639e1 [0,0,0,0,0,0|4,0,0]=4 238 B11R0.148 CC(C)OCCNCCCCS 3953be1b833b40e1ad3730400ca547f0 [0,0,0,0,0,0|4,0,0]=4 239 B11R0.148 CC(C)OCCOCCCCF 252d32d2d37caacf547ca2d45d01dbb8 [0,0,0,0,0,0|4,0,0]=4 240 B11R0.148 CC(C)OCCOCCCCS efc5b4ba20b15926bc4e36d15b2974cb [0,0,0,0,0,0|4,0,0]=4 241 B11R0.148 CC(C)OCNCCCCCCl eb7da8b7ecb7199d52c93fe842a02464 [0,0,0,0,0,0|4,0,0]=4 242 B11R0.148 CC(C)OCNCCCCCO 76db31cfb0b94007e16489bf6a856cf4 [0,0,0,0,0,0|4,0,0]=4 243 B11R0.148 CC(C)SCCCNCCCF 45e2b2fcb60fb33c22cf63b0583f104a [0,0,0,0,0,0|4,0,0]=4 244 B11R0.148 CC(C)SCCCNCCCO 7399d2a4d46949d298d3e2a8d0b67f05 [0,0,0,0,0,0|4,0,0]=4 245 B11R0.148 CC(C)SCCCNCCCS eecac66c00435a223226885359ea2660 [0,0,0,0,0,0|4,0,0]=4 246 B11R0.148 CC(C)SCCCOCCCF f67fd2d0eb1f09842e513b19c2ded1c1 [0,0,0,0,0,0|4,0,0]=4 247 B11R0.148 CC(C)SCCCOCCCS ce6da86acf46e6d2ddd388d0dd1e4988 [0,0,0,0,0,0|4,0,0]=4 248 B11R0.148 CC(C)SCCNCCCCCl 4078dfb9c3a72d5ff2d0927e03ce58b1 [0,0,0,0,0,0|4,0,0]=4 249 B11R0.148 CC(C)SCCNCCCCO fc85932b134297b0cc9d024729cf1339 [0,0,0,0,0,0|4,0,0]=4 250 B11R0.148 CC(C)SCCNCCCCS b9ceb4dcd6f1480f70ae135b75752681 [0,0,0,0,0,0|4,0,0]=4 251 B11R0.148 CC(C)SCCOCCCCF 3942a6ec1543071a49dbbc86192f6027 [0,0,0,0,0,0|4,0,0]=4 252 B11R0.148 CC(C)SCCOCCCCS a350691df9fed755a00a432dba19bd4d [0,0,0,0,0,0|4,0,0]=4 253 B11R0.148 CC(F)COCCCCCC#N e36138b3f9ea718b6682c86eba50d145 [0,0,0,0,0,0|3,0,1]=4 254 B11R0.148 CC(F)COCCCCCC=O a525072f5bd7ac396260ccb2528bf800 [0,0,0,0,0,0|3,0,1]=4 255 B11R0.148 CC(F)COCCCCCCF 0419c55c08be45e2ff9c141d2ac1b7d0 [0,0,0,0,0,0|3,0,0]=3 256 B11R0.148 CC(O)CCCCNCCC#N 0514a77aed651111a75492a18a8a2642 [0,0,0,0,0,0|2,0,1]=3 257 B11R0.148 CC(O)CCCCNCCCCl 82e45c1ce88e44235d045bdc773fc20d [0,0,0,0,0,0|2,0,0]=2 258 B11R0.148 CC(O)CCCCNCCCO c21e68376b74a4270591e394eb58b490 [0,0,0,0,0,0|2,0,0]=2 259 B11R0.148 CC(O)CCCCNCCON fc2c36fdfbcb9912d2241e47ffb45eaa [0,0,0,0,0,0|3,0,0]=3 260 B11R0.148 CC(O)CCCNCC#CCO fad7592398dac790ed2759887e1c81d8 [0,0,0,0,0,0|2,0,2]=4 261 B11R0.148 CC(O)CCCNCCCC#N 8d025945582efb5f675b95149c821bc6 [0,0,0,0,0,0|2,0,1]=3 262 B11R0.148 CC(O)CCCNCCCCCl 0025e61905595b4183c78484c6ac6353 [0,0,0,0,0,0|2,0,0]=2 263 B11R0.148 CC(O)CCCNCCCCO 3793e3cf16ce7d82568c302cad84803a [0,0,0,0,0,0|2,0,0]=2 264 B11R0.148 CC(O)CCCNCCCCS 5e9fef9fba36d0d44964e7a251c656af [0,0,0,0,0,0|2,0,0]=2 265 B11R0.148 CC(O)CCNCCCCC#N a6d6947747d99cddcf630743f3182e56 [0,0,0,0,0,0|2,0,1]=3 266 B11R0.148 CC(O)CCNCCCCC=O 70737627ac14d6796e688af3fb3817ad [0,0,0,0,0,0|2,0,1]=3 267 B11R0.148 CC(O)CCNCCCCCCl af5b3f409236dd9461c4e9723383c715 [0,0,0,0,0,0|2,0,0]=2 268 B11R0.148 CC(O)CCNCCCCCF c0f7e3239303be23f708ac5238b7ee17 [0,0,0,0,0,0|2,0,0]=2 269 B11R0.148 CC(O)CCNCCCCCO b1137dcf863a1f0f413c1d6c91a9e0b1 [0,0,0,0,0,0|2,0,0]=2 270 B11R0.148 CC(O)CCNCCCCON de2ec5b7ef6a3deeb04130a7e10c25d7 [0,0,0,0,0,0|3,0,0]=3 271 B11R0.148 CC(O)CCNCCOCC#N 3d3b6cf805b21d82252a158948e37982 [0,0,0,0,0,0|3,0,1]=4 272 B11R0.148 CC(O)CCNCCOCC=O 94248ca33dbdbc589ab4468cd8b833d5 [0,0,0,0,0,0|3,0,1]=4 273 B11R0.148 CC(O)CCNCCOCCO bcbc94634604a20e287c82202be6f970 [0,0,0,0,0,0|3,0,0]=3 274 B11R0.148 CC(O)CCNCCOCCS 94e31dcf863958414d39a0ac5a1049d6 [0,0,0,0,0,0|3,0,0]=3 275 B11R0.148 CC(O)CCNCCSCCO c1a50927505f9f41ba9bdf2b85ac0b53 [0,0,0,0,0,0|3,0,0]=3 276 B11R0.148 CC(O)CNCCCCCC#N 30146ad2c3782e5df4f3376aca254009 [0,0,0,0,0,0|2,0,1]=3 277 B11R0.148 CC(O)CNCCCCCC=O 9095a8ab3651e62ca00cbd11d2b34e30 [0,0,0,0,0,0|2,0,1]=3 278 B11R0.148 CC(O)CNCCCCCCCl ab3a2559e3a1c323e11a57f0e5845650 [0,0,0,0,0,0|2,0,0]=2 279 B11R0.148 CC(O)CNCCCCCCF 204b7a8ba6869b1a7efa6b88d525a835 [0,0,0,0,0,0|2,0,0]=2 280 B11R0.148 CC(O)CNCCCCCCO 36eca31e338ce79c2fd6b65828843992 [0,0,0,0,0,0|2,0,0]=2 281 B11R0.148 CC(O)CNCCCOCCO e64c58e4b604cbd61c1a65ca674300aa [0,0,0,0,0,0|3,0,0]=3 282 B11R0.148 CC(O)CNCCOCCCO 57378eb39fdecb944c2a794b7f98e571 [0,0,0,0,0,0|3,0,0]=3 283 B11R0.148 CC(O)CNCCOCCON 0d5013f2f185682f96f66f4637463f8d [0,0,0,0,0,0|4,0,0]=4 284 B11R0.148 CC(O)CNCCSSCCO 27f3c38976523ecb5b99b18905abbaa4 [0,0,0,0,0,0|4,0,0]=4 285 B11R0.148 CC(S)COCCCCCC#N ebd7c35c2db4cd2103b4e29b107ec7c8 [0,0,0,0,0,0|2,1,1]=4 286 B11R0.148 CC(S)COCCCCCC=O 2846753772e273c7c179d86e866a6e42 [0,0,0,0,0,0|2,1,1]=4 287 B11R0.148 CC(S)COCCCCCCF b7a2a1405464ead274775b1ed0da78c4 [0,0,0,0,0,0|2,1,0]=3 288 B11R0.148 CC/C=C/CCOCCC(C)C 0c409bbce4f0953e5714918144060bc0 [0,0,0,0,0,0|2,0,2]=4 289 B11R0.148 CC/C=C/CNCCCC(C)C dd92a520afe2c7227f226d879c8c4223 [0,0,0,0,0,0|2,0,2]=4 290 B11R0.148 CC/C=C/COCCCC(C)C 8d5313ce42fe76520ae4b4f08c512cca [0,0,0,0,0,0|2,0,2]=4 291 B11R0.148 CC/C=C\CCCCOC(C)C e04104864f3cbf170a036c5860e894ad [0,0,0,0,0,0|2,0,2]=4 292 B11R0.148 CC/C=C\CCCOCC(C)C f8bf2f68b16ad84043bbf53ff7974f2b [0,0,0,0,0,0|2,0,2]=4 293 B11R0.148 CC/C=C\CCNCCC(C)C 6a3cabd009c8f25df7594bac6c761814 [0,0,0,0,0,0|2,0,2]=4 294 B11R0.148 CC/C=C\CCNCCC(C)O c665383f5fbf967ba7cfc2537fb515ab [0,0,0,0,0,0|1,0,2]=3 295 B11R0.148 CC/C=C\CCNCC[C@@H](C)O 7c9b7f670eefb8999e7ad7fc265a06c6 [0,0,0,0,0,0|1,0,2]=3 296 B11R0.148 CC/C=C\CCNCC[C@H](C)O 55c96021768f05b6ad6bfef79bc6610d [0,0,0,0,0,0|1,0,2]=3 297 B11R0.148 CC/C=C\CCOCCC(C)C 5dbcceee9676e5d2ec6618069adfb935 [0,0,0,0,0,0|2,0,2]=4 298 B11R0.148 CC/C=C\COCCCC(C)C c74ef8b6d3de5c4612de62973b0cf9b3 [0,0,0,0,0,0|2,0,2]=4 299 B11R0.148 CC=CCCCOCCC(C)C 42aa7259db997d65a8a2bd4af62b98ef [0,0,0,0,0,0|2,0,2]=4 300 B11R0.148 CC=CCNCCCCC(C)C 53c6e636215e2fed4b5fd31485ee6d7d [0,0,0,0,0,0|2,0,2]=4 301 B11R0.148 CC=CCNCCCCC(C)O 816c12272573a005bebb88d47fb3b653 [0,0,0,0,0,0|1,0,2]=3 302 B11R0.148 CC=CCNCCCC[C@@H](C)O 4d0e10532762972cacd71480313b8261 [0,0,0,0,0,0|1,0,2]=3 303 B11R0.148 CC=CCOCCCCC(C)C 53aee0d6adcb73e5269f489f2284278e [0,0,0,0,0,0|2,0,2]=4 304 B11R0.148 CCC#CCCOCCC(C)C 86bf9496347c7822f90044c2dc56a7b9 [0,0,0,0,0,0|2,0,2]=4 305 B11R0.148 CCC#CCNCCCC(C)C 41b9f37a7649c95beee13faaa791e502 [0,0,0,0,0,0|2,0,2]=4 306 B11R0.148 CCC#CCOCCCC(C)C 0c2ed2198ba36fbd9e74749645769487 [0,0,0,0,0,0|2,0,2]=4 307 B11R0.148 CCC/C=C/CCCOC(C)C fca6975d48f6ae32f4a3c200341884fd [0,0,0,0,0,0|2,0,2]=4 308 B11R0.148 CCC/C=C/CNCCC(C)C 6f8c333c26a56543fa151f740e3c6e90 [0,0,0,0,0,0|2,0,2]=4 309 B11R0.148 CCC/C=C/CNCCC(C)O 89fad9391cc06b506b7c0ec51c8d288b [0,0,0,0,0,0|1,0,2]=3 310 B11R0.148 CCC/C=C/CNCC[C@@H](C)O 22cae726a89ef20c7dc05a17dbd382ed [0,0,0,0,0,0|1,0,2]=3 311 B11R0.148 CCC/C=C/CNCC[C@H](C)O 1958e30635c0e57ac10c4c45d0cb9b1a [0,0,0,0,0,0|1,0,2]=3 312 B11R0.148 CCC/C=C/COCCC(C)C 6d75d8990c157242cfcc3b961a9d1a1a [0,0,0,0,0,0|2,0,2]=4 313 B11R0.148 CCC/C=C\CCCOC(C)C f838c4d4cc1e4b0f7f5c96ce294b04d4 [0,0,0,0,0,0|2,0,2]=4 314 B11R0.148 CCC/C=C\CCOCC(C)C b74dab49cada38c15b5404cab4868f85 [0,0,0,0,0,0|2,0,2]=4 315 B11R0.148 CCC/C=C\CNCCC(C)C 7ea17bd0cd2a7709c492e168a283ec80 [0,0,0,0,0,0|2,0,2]=4 316 B11R0.148 CCC/C=C\CNCCC(C)O e8db7340212b5e0da4cf4275df7cb386 [0,0,0,0,0,0|1,0,2]=3 317 B11R0.148 CCC/C=C\CNCC[C@@H](C)O 3025fedac0f9544a202214dee6dd5c78 [0,0,0,0,0,0|1,0,2]=3 318 B11R0.148 CCC/C=C\CNCC[C@H](C)O 89aff8df427ff1b6c6f7e53bfa2ac462 [0,0,0,0,0,0|1,0,2]=3 319 B11R0.148 CCC/C=C\COCCC(C)C c5479b045151e057ab4dc16410f97d0c [0,0,0,0,0,0|2,0,2]=4 320 B11R0.148 CCCC#CCCOCC(C)C 50b316f079d93a950ff086096beebc67 [0,0,0,0,0,0|2,0,2]=4 321 B11R0.148 CCCC#CCOCCC(C)C c3f2e6bf383e6d0cb4f534ac26398dd0 [0,0,0,0,0,0|2,0,2]=4 322 B11R0.148 CCCC/C=C/CNCC(C)C 7a789f1689393d08143703e711d4b409 [0,0,0,0,0,0|2,0,2]=4 323 B11R0.148 CCCC/C=C/CNCC(C)O 9ee3da7f4a6c2644145d5a60ad5533e4 [0,0,0,0,0,0|1,0,2]=3 324 B11R0.148 CCCC/C=C/CNC[C@@H](C)O ba3897740d8a71ab13c816a796594c12 [0,0,0,0,0,0|1,0,2]=3 325 B11R0.148 CCCC/C=C/CNC[C@H](C)O c0a11071e6a5392813d32dd134bd1434 [0,0,0,0,0,0|1,0,2]=3 326 B11R0.148 CCCC/C=C/COCC(C)C 9040116257f467894290d7eab03d4451 [0,0,0,0,0,0|2,0,2]=4 327 B11R0.148 CCCC/C=C/COCC(C)F 2f4605998e1ae10988a94362c384302f [0,0,0,0,0,0|2,0,2]=4 328 B11R0.148 CCCC/C=C/COCC(C)S 9ab6f4ceb0f7d2c89dfcdc9ede520261 [0,0,0,0,0,0|1,1,2]=4 329 B11R0.148 CCCC/C=C/COC[C@@H](C)F bbd47e6833a3438ff9ed7cf5061d97eb [0,0,0,0,0,0|2,0,2]=4 330 B11R0.148 CCCC/C=C/COC[C@H](C)F c3e17484959aac402d71b1474d8a2472 [0,0,0,0,0,0|2,0,2]=4 331 B11R0.148 CCCC/C=C\CCOC(C)C 89a52c48c6e32a89b86b0236e123d37f [0,0,0,0,0,0|2,0,2]=4 332 B11R0.148 CCCC/C=C\CNCC(C)C 9bff76718e3a43599d02b18c86d86c69 [0,0,0,0,0,0|2,0,2]=4 333 B11R0.148 CCCC/C=C\CNCC(C)O e3ee2750312fb24a99d3059bd9425b2c [0,0,0,0,0,0|1,0,2]=3 334 B11R0.148 CCCC/C=C\CNC[C@@H](C)O e66c5c0c8171dae2454ba88aae25bc59 [0,0,0,0,0,0|1,0,2]=3 335 B11R0.148 CCCC/C=C\CNC[C@H](C)O 028303a43d776784969fd6779bee966b [0,0,0,0,0,0|1,0,2]=3 336 B11R0.148 CCCC/C=C\COCC(C)C 2359268ed2748930965e8dcf242402f1 [0,0,0,0,0,0|2,0,2]=4 337 B11R0.148 CCCC/C=C\COCC(C)F a2ac7f201c54c6fdcdf315dd111312ba [0,0,0,0,0,0|2,0,2]=4 338 B11R0.148 CCCC/C=C\COCC(C)S 4980b8005446c1a5cd35caf85ab77680 [0,0,0,0,0,0|1,1,2]=4 339 B11R0.148 CCCC/C=C\COC[C@@H](C)F 9660753b5d1018765d4e3cf532016241 [0,0,0,0,0,0|2,0,2]=4 340 B11R0.148 CCCC/C=C\COC[C@H](C)F da88a4568dd9fdd4ea1413f4251603d9 [0,0,0,0,0,0|2,0,2]=4 341 B11R0.148 CCCCC#CCCOC(C)C c3b32ee8a3f03f531a4751e49d1caf2b [0,0,0,0,0,0|2,0,2]=4 342 B11R0.148 CCCCC#CCOCC(C)C 474421a86769d740b641e726f215a385 [0,0,0,0,0,0|2,0,2]=4 343 B11R0.148 CCCCC/C=C/COC(C)C 202fb39b8f6d6bc927c68e6d7c25ec4b [0,0,0,0,0,0|2,0,2]=4 344 B11R0.148 CCCCCC#CCOC(C)C bfc06720e8c0fd7918d141d4952cf172 [0,0,0,0,0,0|2,0,2]=4 345 B11R0.148 CCCCCCCCNC(=O)C 9209ef01a8d3ac54b45708fef3a289cf [0,0,0,0,0,0|1,0,2]=3 346 B11R0.148 CCCCCCCCNC(C)C f8be70ea57d82353a700029658149a3c [0,0,0,0,0,0|2,0,0]=2 347 B11R0.148 CCCCCCCCOC(C)C 9ea4ce62ae8de285c4f7fbe1b0cab410 [0,0,0,0,0,0|2,0,0]=2 348 B11R0.148 CCCCCCCNCC(=O)C ac5ad78030b2337dde4637cf4e637be8 [0,0,0,0,0,0|1,0,2]=3 349 B11R0.148 CCCCCCCNCC(=O)N 2fdb0dfccf9f802c713cfdaa07ea8b3d [0,0,0,0,0,0|2,0,2]=4 350 B11R0.148 CCCCCCCNCC(=O)O 604ac707776db9c80f9dbe81aba07aab [0,0,0,0,0,0|2,0,1]=3 351 B11R0.148 CCCCCCCNCC(C)C a6f5f3319ec648228042e08d701693df [0,0,0,0,0,0|2,0,0]=2 352 B11R0.148 CCCCCCCNCC(C)O 4ec41632ad94b262d50d201b12eea63c [0,0,0,0,0,0|1,0,0]=1 353 B11R0.148 CCCCCCCNCC(F)F 98a23d5ff913760df8927fe1c2637ed0 [0,0,0,0,0,0|3,0,0]=3 354 B11R0.148 CCCCCCCNCN(C)C c7da38a67066758badf6ec7b2263b114 [0,0,0,0,0,0|3,0,0]=3 355 B11R0.148 CCCCCCCNC[C@@H](C)O 2f370e1df4cf53b1cc448becf8319123 [0,0,0,0,0,0|1,0,0]=1 356 B11R0.148 CCCCCCCNC[C@H](C)O ffa725a82af0b73a341a438150dba913 [0,0,0,0,0,0|1,0,0]=1 357 B11R0.148 CCCCCCCNC[N+](=O)[O-] c0679a4f548ff0671049820f57ae631f [0,0,0,0,0,0|3,0,1]=4 358 B11R0.148 CCCCCCCOCC(=O)C dc592c317774d5dcca7353cd0379c413 [0,0,0,0,0,0|1,0,2]=3 359 B11R0.148 CCCCCCCOCC(=O)N e5e33b5f144e3b12955641244340651b [0,0,0,0,0,0|2,0,2]=4 360 B11R0.148 CCCCCCCOCC(=O)O 2e9c1bc97c278d8f4eec0fc057b4f886 [0,0,0,0,0,0|2,0,1]=3 361 B11R0.148 CCCCCCCOCC(=S)N ea69c6884831d0bc2d9a37abf4288eb5 [0,0,0,0,0,0|2,1,1]=4 362 B11R0.148 CCCCCCCOCC(C)C ad3ae6978b7cab5e4f36953662c27905 [0,0,0,0,0,0|2,0,0]=2 363 B11R0.148 CCCCCCCOCC(C)F 33a0b8718e62e417560f50061beac913 [0,0,0,0,0,0|2,0,0]=2 364 B11R0.148 CCCCCCCOCC(C)S 334a25565096fb2521cc4f67349f8197 [0,0,0,0,0,0|1,1,0]=2 365 B11R0.148 CCCCCCCOCC(F)F f4aeee014af9241eeaa3faa59643b9b3 [0,0,0,0,0,0|3,0,0]=3 366 B11R0.148 CCCCCCCOCN(C)C f6b916735482abc78d11dccfc9c6846d [0,0,0,0,0,0|3,0,0]=3 367 B11R0.148 CCCCCCCOCS(=O)O a9e9ed12c8e5ec5a425575bf0efe96a6 [0,0,0,0,0,0|3,0,0]=3 368 B11R0.148 CCCCCCCOC[C@@H](C)F f33eaea45680a42f69cd64fc91fbe87f [0,0,0,0,0,0|2,0,0]=2 369 B11R0.148 CCCCCCCOC[C@H](C)F ac3873facc4a14eeb0ce41b7cc7d7a71 [0,0,0,0,0,0|2,0,0]=2 370 B11R0.148 CCCCCCCOC[N+](=O)[O-] 3f9cbc61a4053c393efda689f3dc606a [0,0,0,0,0,0|3,0,1]=4 371 B11R0.148 CCCCCCNC/C=C(/C)\I de46a617e926fa7265c7ea6a0d6454b4 [0,0,0,0,0,0|2,0,2]=4 372 B11R0.148 CCCCCCNC/C=C(\C)/Cl 5e1e5f5c0eae22e6ce2fa87264437d45 [0,0,0,0,0,0|2,0,2]=4 373 B11R0.148 CCCCCCNCC=C(C)C 268cde1eac403971a29775244b20f6fb [0,0,0,0,0,0|2,0,2]=4 374 B11R0.148 CCCCCCNCC=C(C)Cl 9b26f9313727dabf75856a169d7d9509 [0,0,0,0,0,0|2,0,2]=4 375 B11R0.148 CCCCCCNCC=C(C)I 4649296a1e9af8c45e014cea46a02b0d [0,0,0,0,0,0|2,0,2]=4 376 B11R0.148 CCCCCCNCCC(=O)C dae7d5a91b1ed61fc00f967bfae50950 [0,0,0,0,0,0|1,0,2]=3 377 B11R0.148 CCCCCCNCCC(=O)N 56cad85fb9e1e012d0ba0b01c59f0ee9 [0,0,0,0,0,0|2,0,2]=4 378 B11R0.148 CCCCCCNCCC(=O)O 8d33e817dab78094c47164cc7392c6c0 [0,0,0,0,0,0|2,0,1]=3 379 B11R0.148 CCCCCCNCCC(=S)N 0f339dc41df1d7ce9e93328d64a9e97e [0,0,0,0,0,0|2,1,1]=4 380 B11R0.148 CCCCCCNCCC(C)C 135d433468be89f5a4b50279268055b1 [0,0,0,0,0,0|2,0,0]=2 381 B11R0.148 CCCCCCNCCC(C)O b61f5b6cff5c878fd1c98373352f3fc1 [0,0,0,0,0,0|1,0,0]=1 382 B11R0.148 CCCCCCNCCC(F)F f204747981d382370cfc771627ba36f0 [0,0,0,0,0,0|3,0,0]=3 383 B11R0.148 CCCCCCNCCN(C)C feca8b54bbb8ece79ee6eb8dd4407d43 [0,0,0,0,0,0|3,0,0]=3 384 B11R0.148 CCCCCCNCCS(=O)C 475c88c63a6ae669c4c216d277e2870d [0,0,0,0,0,0|2,0,1]=3 385 B11R0.148 CCCCCCNCCS(=O)O c59e7a819938a1baeb219ab5b5f69d6b [0,0,0,0,0,0|3,0,0]=3 386 B11R0.148 CCCCCCNCC[C@@H](C)O 5073f91f32a9c4b3d6ac7aff2d46c023 [0,0,0,0,0,0|1,0,0]=1 387 B11R0.148 CCCCCCNCC[C@H](C)O 87478981820d3d93e2f171457dfcd978 [0,0,0,0,0,0|1,0,0]=1 388 B11R0.148 CCCCCCNCOC(=O)C 1c1a5627acb6c3fcacc91b183f2cb953 [0,0,0,0,0,0|2,0,2]=4 389 B11R0.148 CCCCCCNCOC(C)C 5eb95ccd66322531ca3ff1369740f669 [0,0,0,0,0,0|3,0,0]=3 390 B11R0.148 CCCCCCOC/C=C(/C)\Cl 3217da00020186109ac684268f3a4229 [0,0,0,0,0,0|2,0,2]=4 391 B11R0.148 CCCCCCOC/C=C(/C)\I 42d6eaabbd9ccb5371b986581e746e3c [0,0,0,0,0,0|2,0,2]=4 392 B11R0.148 CCCCCCOC/C=C(\C)/Cl fe5511dbc0d53edaf2e45e378bf83eb9 [0,0,0,0,0,0|2,0,2]=4 393 B11R0.148 CCCCCCOCC=C(C)C 01521535f7ea090dd629b3eba93168e9 [0,0,0,0,0,0|2,0,2]=4 394 B11R0.148 CCCCCCOCC=C(C)Cl 449202f9925926f3cc218782fb7d580a [0,0,0,0,0,0|2,0,2]=4 395 B11R0.148 CCCCCCOCC=C(C)I 8716b7b87fe38c49ecc86d416f4d13fd [0,0,0,0,0,0|2,0,2]=4 396 B11R0.148 CCCCCCOCCC(=O)C ba6ca6ffd5fb9c6cc4e8d129cf77ebb5 [0,0,0,0,0,0|1,0,2]=3 397 B11R0.148 CCCCCCOCCC(=O)N 54320f1e572400bcb39399fa00db0727 [0,0,0,0,0,0|2,0,2]=4 398 B11R0.148 CCCCCCOCCC(=O)O 4717319825633e38fbcaeec5411785fc [0,0,0,0,0,0|2,0,1]=3 399 B11R0.148 CCCCCCOCCC(C)C f11cf86494cac2c289cc293249eaba1a [0,0,0,0,0,0|2,0,0]=2 400 B11R0.148 CCCCCCOCCC(F)F 557344c55868e1bf03b2646f878a1ba6 [0,0,0,0,0,0|3,0,0]=3 401 B11R0.148 CCCCCCOCCN(C)C 95bea298cb2735202435a59ed6005be9 [0,0,0,0,0,0|3,0,0]=3 402 B11R0.148 CCCCCCOCCS(=O)C 48fd1036c35525fa02a6d7c816b35e4a [0,0,0,0,0,0|2,0,1]=3 403 B11R0.148 CCCCCCOCC[N+](=O)[O-] de5eb72a8a9f184e849a2b75f8c48976 [0,0,0,0,0,0|3,0,1]=4 404 B11R0.148 CCCCCCOCNC(=O)C 821b7a0837138668b121aff777d67519 [0,0,0,0,0,0|2,0,2]=4 405 B11R0.148 CCCCCCOCOC(=O)C 7357a2b41ac7b5a18efb5ca4e2678b36 [0,0,0,0,0,0|2,0,2]=4 406 B11R0.148 CCCCCCOCOC(C)C d0cfab7370c150d3300d4ffdecfbe6d3 [0,0,0,0,0,0|3,0,0]=3 407 B11R0.148 CCCCCNC/C=C/C(C)C d7d2cc7b858d16bae64842f05b6b9796 [0,0,0,0,0,0|2,0,2]=4 408 B11R0.148 CCCCCNCCC=C(C)C d6637617b4955445c507124ad86b540e [0,0,0,0,0,0|2,0,2]=4 409 B11R0.148 CCCCCNCCCC(=O)C ae79e8ea156a5e770911e0ef57b141fd [0,0,0,0,0,0|1,0,2]=3 410 B11R0.148 CCCCCNCCCC(=O)N 6cb86dd703d81819cb42e7bbe50cbf67 [0,0,0,0,0,0|2,0,2]=4 411 B11R0.148 CCCCCNCCCC(=O)O ce92314d02facc18c8164866ccc58acb [0,0,0,0,0,0|2,0,1]=3 412 B11R0.148 CCCCCNCCCC(C)C 0361d464bc19c58076a87dd228c3e508 [0,0,0,0,0,0|2,0,0]=2 413 B11R0.148 CCCCCNCCCC(C)O 6e88f019848ff48aa5580012b93e4ead [0,0,0,0,0,0|1,0,0]=1 414 B11R0.148 CCCCCNCCCN(C)C 1547883d2249392382111b279fce4865 [0,0,0,0,0,0|3,0,0]=3 415 B11R0.148 CCCCCNCCCS(=O)C 987b67a292910faec3dd3726262729bb [0,0,0,0,0,0|2,0,1]=3 416 B11R0.148 CCCCCNCCC[N+](=O)[O-] 10b9119f7a09d0e3363d31224254b5b4 [0,0,0,0,0,0|3,0,1]=4 417 B11R0.148 CCCCCNCCNC(=O)C 7ff8c0f5354f73956142fbe6902b9879 [0,0,0,0,0,0|2,0,2]=4 418 B11R0.148 CCCCCNCCOC(=O)C 729f700d5178f65d822ba15d79799d97 [0,0,0,0,0,0|2,0,2]=4 419 B11R0.148 CCCCCNCCOC(C)C b57e74e61b3907dd5e5c738fd2374ef8 [0,0,0,0,0,0|3,0,0]=3 420 B11R0.148 CCCCCNCCOC(F)F 8e9dadeedb850c9558d864bd1084b39b [0,0,0,0,0,0|4,0,0]=4 421 B11R0.148 CCCCCNCCSC(=O)C d915aac4f03ed25f4f02a1b6cd47cc5d [0,0,0,0,0,0|2,0,2]=4 422 B11R0.148 CCCCCNCCSC(C)C ffdf85c3d23aa8266db58893d1aa2844 [0,0,0,0,0,0|3,0,0]=3 423 B11R0.148 CCCCCOC/C=C/C(C)C afb911daeb4fd0404f914e7e073954e3 [0,0,0,0,0,0|2,0,2]=4 424 B11R0.148 CCCCCOCCC=C(C)C 474567c7ad39799d75b5ca9d8bdddc96 [0,0,0,0,0,0|2,0,2]=4 425 B11R0.148 CCCCCOCCCC(=O)C 2d5fb2796be532f83de2b588a833a781 [0,0,0,0,0,0|1,0,2]=3 426 B11R0.148 CCCCCOCCCC(=O)N 6551ad614f50be62a9bef870153adc2e [0,0,0,0,0,0|2,0,2]=4 427 B11R0.148 CCCCCOCCCC(C)C 5bb98aa79f2ecd06cca520f7b5a9ee52 [0,0,0,0,0,0|2,0,0]=2 428 B11R0.148 CCCCCOCCCN(C)C dec28adef2736d73e7ec49798eb9dfa7 [0,0,0,0,0,0|3,0,0]=3 429 B11R0.148 CCCCCOCCC[N+](=O)[O-] 74c985d4dc1007b525e7950e6e4d8fab [0,0,0,0,0,0|3,0,1]=4 430 B11R0.148 CCCCCOCCNC(=O)C 89e6bc94e5e2df2872af87ea20002aa7 [0,0,0,0,0,0|2,0,2]=4 431 B11R0.148 CCCCCOCCOC(=O)C ce892e28021cd219f16b0c1b93f354de [0,0,0,0,0,0|2,0,2]=4 432 B11R0.148 CCCCCOCCOC(C)C c0241cd648c55745199f114592d8cee7 [0,0,0,0,0,0|3,0,0]=3 433 B11R0.148 CCCCCOCCOC(F)F 99ce3149aa720696793750b50445d4f9 [0,0,0,0,0,0|4,0,0]=4 434 B11R0.148 CCCCCOCCSC(=O)C 381130fac5641be83bacac00ee2d726c [0,0,0,0,0,0|2,0,2]=4 435 B11R0.148 CCCCCOCCSC(C)C c3490c16ca8798be1fd32d8c18b19bab [0,0,0,0,0,0|3,0,0]=3 436 B11R0.148 CCCCNCCCCC(=O)C 544c9e2e2e33eb4d7d7343bae90cd58e [0,0,0,0,0,0|1,0,2]=3 437 B11R0.148 CCCCNCCCCC(=O)N 314026e751faa5b11c0ecab80061f9d7 [0,0,0,0,0,0|2,0,2]=4 438 B11R0.148 CCCCNCCCCC(=O)O db2891a1a49d26c3dd9a356095c13ecb [0,0,0,0,0,0|2,0,1]=3 439 B11R0.148 CCCCNCCCCC(C)C 1c732e5d1fc6816749b0c146f91075e1 [0,0,0,0,0,0|2,0,0]=2 440 B11R0.148 CCCCNCCCCC(C)O d25cea83b94c590c11c2a73b0c167344 [0,0,0,0,0,0|1,0,0]=1 441 B11R0.148 CCCCNCCCCC(F)F e2711bbdb18d5c94914b14d3121d5454 [0,0,0,0,0,0|3,0,0]=3 442 B11R0.148 CCCCNCCCCN(C)C bff2af05930f9a6d528118d70b9ce386 [0,0,0,0,0,0|3,0,0]=3 443 B11R0.148 CCCCNCCCC[C@@H](C)O 8b68c1025addda349947f3fed9cd8b0f [0,0,0,0,0,0|1,0,0]=1 444 B11R0.148 CCCCNCCCNC(=O)C 6d0de7a58670364332bd2c26e8ee7cdd [0,0,0,0,0,0|2,0,2]=4 445 B11R0.148 CCCCNCCCOC(=O)C 7853525c1345bc50778fe7631411e66c [0,0,0,0,0,0|2,0,2]=4 446 B11R0.148 CCCCNCCCOC(=S)C 73028220c83de81b0b3e572a11606df7 [0,0,0,0,0,0|2,1,1]=4 447 B11R0.148 CCCCNCCCOC(C)C 5d532a264840a56b89b1a56a51203826 [0,0,0,0,0,0|3,0,0]=3 448 B11R0.148 CCCCNCCCOC(F)F ae82ad84306cf5db3936600fd8330d27 [0,0,0,0,0,0|4,0,0]=4 449 B11R0.148 CCCCNCCCSC(=O)C db939ed2d8d03cfa10c8f82ccb5505ff [0,0,0,0,0,0|2,0,2]=4 450 B11R0.148 CCCCNCCCSC(C)C 830e2866f833c0787e52ab3d5fdd8f70 [0,0,0,0,0,0|3,0,0]=3 451 B11R0.148 CCCCNCCOCC(=O)O c3ef0b6e39b500596a34f8201361fc3a [0,0,0,0,0,0|3,0,1]=4 452 B11R0.148 CCCCNCCOCC(C)C 5fc01cd8401a7a12bb22b6534b323fdc [0,0,0,0,0,0|3,0,0]=3 453 B11R0.148 CCCCNCCOCC(F)F 48316daffb8455ff411d16cf6b573f00 [0,0,0,0,0,0|4,0,0]=4 454 B11R0.148 CCCCNCCSCC(=O)O 19c0aa25c2747ad4736c5abc66ee689c [0,0,0,0,0,0|3,0,1]=4 455 B11R0.148 CCCCOCCCCC(=O)C a62f0819767c2537c037059a9981780c [0,0,0,0,0,0|1,0,2]=3 456 B11R0.148 CCCCOCCCCC(=O)N cb00e11a7c4db378275f51f63aaca2e7 [0,0,0,0,0,0|2,0,2]=4 457 B11R0.148 CCCCOCCCCC(=O)O 00e520501e14c3e825ffc7300146a3fe [0,0,0,0,0,0|2,0,1]=3 458 B11R0.148 CCCCOCCCCC(C)C 1e492fd7051ff99c89865c3fbb9848e2 [0,0,0,0,0,0|2,0,0]=2 459 B11R0.148 CCCCOCCCCN(C)C 0e9610248df441680a4fc5f7ea14afab [0,0,0,0,0,0|3,0,0]=3 460 B11R0.148 CCCCOCCCC[N+](=O)[O-] 945fc8d07071bde3444714f6c7856ad4 [0,0,0,0,0,0|3,0,1]=4 461 B11R0.148 CCCCOCCCNC(=O)C 14281244af5a76ea832226605fbb85e4 [0,0,0,0,0,0|2,0,2]=4 462 B11R0.148 CCCCOCCCNC(C)C be24f3e51730bf2a1d3254b17a45253c [0,0,0,0,0,0|3,0,0]=3 463 B11R0.148 CCCCOCCCOC(=O)C 477c462ef377d29beb78f95f82bb25eb [0,0,0,0,0,0|2,0,2]=4 464 B11R0.148 CCCCOCCCOC(=S)C d7aa2aa09240a85edad907d4be4b954e [0,0,0,0,0,0|2,1,1]=4 465 B11R0.148 CCCCOCCCOC(C)C 62f253282cb71fb27b7ae7e331b7477f [0,0,0,0,0,0|3,0,0]=3 466 B11R0.148 CCCCOCCCSC(=O)C 614b19a166ecdbfad1b2d0cb89ad3484 [0,0,0,0,0,0|2,0,2]=4 467 B11R0.148 CCCCOCCCSC(C)C 33daf7cd7c111a6e93bc3cafba8e57aa [0,0,0,0,0,0|3,0,0]=3 468 B11R0.148 CCCCOCCNCC(=O)C 223e03f8df314d1ffe7fa22f1e699f9f [0,0,0,0,0,0|2,0,2]=4 469 B11R0.148 CCCCOCCNCC(=O)O 5e535394d6f535f6322b79b8b1a838be [0,0,0,0,0,0|3,0,1]=4 470 B11R0.148 CCCCOCCNCC(C)C f900ac3cf749acf7a9648cc6b643bbdf [0,0,0,0,0,0|3,0,0]=3 471 B11R0.148 CCCCOCCNCC(C)O 21638369de26bd8dcdd1ce22cb7c6542 [0,0,0,0,0,0|2,0,0]=2 472 B11R0.148 CCCCOCCNCC(F)F 18e45a8ac2a53e67ca21bc46aba7c9ac [0,0,0,0,0,0|4,0,0]=4 473 B11R0.148 CCCCOCCNCN(C)C 18c4474f584a177db82d7ec98b40ffa6 [0,0,0,0,0,0|4,0,0]=4 474 B11R0.148 CCCCOCCNC[C@@H](C)O 22110216e6ac6ac22cb317487440a16a [0,0,0,0,0,0|2,0,0]=2 475 B11R0.148 CCCCOCCNC[C@H](C)O 9b5446281ca28925eafc13772c4e97e0 [0,0,0,0,0,0|2,0,0]=2 476 B11R0.148 CCCCOCCOCC(=O)C a1059fc843b2eaa33e87055a6bc4e6be [0,0,0,0,0,0|2,0,2]=4 477 B11R0.148 CCCCOCCOCC(=O)O f3952d347bddfc2dfd656d051a77ceb9 [0,0,0,0,0,0|3,0,1]=4 478 B11R0.148 CCCCOCCOCC(C)C 5bc69058925797cabf7942443b63928e [0,0,0,0,0,0|3,0,0]=3 479 B11R0.148 CCCCOCCOCC(C)F 33d58cdb98a277b610b30f3887a906f3 [0,0,0,0,0,0|3,0,0]=3 480 B11R0.148 CCCCOCCOCC(C)S 04a9838538e25eadb743d754de09f222 [0,0,0,0,0,0|2,1,0]=3 481 B11R0.148 CCCCOCCOCC(F)F fbaef1e16be519c43ad49a4432af3b45 [0,0,0,0,0,0|4,0,0]=4 482 B11R0.148 CCCCOCCOCN(C)C f4730268d7fcb2540de58ceaed3a0274 [0,0,0,0,0,0|4,0,0]=4 483 B11R0.148 CCCCOCCOCS(=O)O 33a2fbe99da1dea6ea5418c41ee40add [0,0,0,0,0,0|4,0,0]=4 484 B11R0.148 CCCCOCCOC[C@@H](C)F ff20953b20567232b484ae3fd3c2c370 [0,0,0,0,0,0|3,0,0]=3 485 B11R0.148 CCCCOCCOC[C@H](C)F dfc57d5b18a7e9ecbbd0556bfc91a76d [0,0,0,0,0,0|3,0,0]=3 486 B11R0.148 CCCCOCCSCC(C)C 1ca374423b269c3793be941a767760da [0,0,0,0,0,0|3,0,0]=3 487 B11R0.148 CCCCOCNCCC(=O)O 59d3523aaed3910cf6d2b55b40981768 [0,0,0,0,0,0|3,0,1]=4 488 B11R0.148 CCCCOCNCCC(C)C 8bdf283e25309f272900fa44e5b8f006 [0,0,0,0,0,0|3,0,0]=3 489 B11R0.148 CCCCOCNCCC(C)O 148db482aa009f71727e8341be3f6b11 [0,0,0,0,0,0|2,0,0]=2 490 B11R0.148 CCCCOCNCCC(F)F e13ea898f753e2b455a0be1057bfc060 [0,0,0,0,0,0|4,0,0]=4 491 B11R0.148 CCCCOCNCCN(C)C 37fdc1702112085c821fbf94350fc366 [0,0,0,0,0,0|4,0,0]=4 492 B11R0.148 CCCCOCNCCS(=O)C ffd53be59a1b68f36c155cd13b993a08 [0,0,0,0,0,0|3,0,1]=4 493 B11R0.148 CCCCOCNCCS(=O)O 922462d2e6d1cea98d0bc53d7075cb06 [0,0,0,0,0,0|4,0,0]=4 494 B11R0.148 CCCCOCNCC[C@@H](C)O e6c1371cbf0bfa6e9c8730efe0b35016 [0,0,0,0,0,0|2,0,0]=2 495 B11R0.148 CCCCOCNCC[C@H](C)O 1bad416644b19aecf572e308a0d04d6d [0,0,0,0,0,0|2,0,0]=2 496 B11R0.148 CCCCOCOCCC(=O)C 42ce30f9bc9443451f7915bee899e3ba [0,0,0,0,0,0|2,0,2]=4 497 B11R0.148 CCCCOCOCCC(=O)O 1fc55cd284db7eca48e94025d087c373 [0,0,0,0,0,0|3,0,1]=4 498 B11R0.148 CCCCOCOCCC(C)C 70afb007076813320d9de42f9766d9e9 [0,0,0,0,0,0|3,0,0]=3 499 B11R0.148 CCCCOCOCCC(F)F 67eacc230a2da2a0c68041d6132c7345 [0,0,0,0,0,0|4,0,0]=4 500 B11R0.148 CCCCOCOCCN(C)C f2717e984d82c855dbceb2b4bfe4cf44 [0,0,0,0,0,0|4,0,0]=4 501 B11R0.148 CCCCOCOCCS(=O)C 419b0f625e6b8bfb82d349938b2d67c8 [0,0,0,0,0,0|3,0,1]=4 502 B11R0.148 CCCCSCCOCC(=O)O ac797cbb248e6531ce12e2e37d4432b3 [0,0,0,0,0,0|3,0,1]=4 503 B11R0.148 CCCCSCCOCC(C)C f9ca133b6d17694e27e05b8fb6515420 [0,0,0,0,0,0|3,0,0]=3 504 B11R0.148 CCCCSCCOCC(F)F 99de273df419e1a851e01a08a34ab6c1 [0,0,0,0,0,0|4,0,0]=4 505 B11R0.148 CCCCSCCOCN(C)C 72ddf51f535521511f63bb168bd25baf [0,0,0,0,0,0|4,0,0]=4 506 B11R0.148 CCCNCCCCCC(=O)C 354cff2ef02214f278274b1186349715 [0,0,0,0,0,0|1,0,2]=3 507 B11R0.148 CCCNCCCCCC(=O)N 2e59cc5df0185c8509f72f74417558d3 [0,0,0,0,0,0|2,0,2]=4 508 B11R0.148 CCCNCCCCCC(=O)O 040617eb9e641e6c46ed6e1b925655c5 [0,0,0,0,0,0|2,0,1]=3 509 B11R0.148 CCCNCCCCCC(C)C eeb48a0dfda96d56a343194a6bdd680b [0,0,0,0,0,0|2,0,0]=2 510 B11R0.148 CCCNCCCCCC(F)F 1a8aa5fc96eb481f16e40578ac485682 [0,0,0,0,0,0|3,0,0]=3 511 B11R0.148 CCCNCCCCCN(C)C b721302b37aba097430de1a536c35de0 [0,0,0,0,0,0|3,0,0]=3 512 B11R0.148 CCCNCCCCNC(=O)C afc7cb87fbf2cd12eb8fe76075788aed [0,0,0,0,0,0|2,0,2]=4 513 B11R0.148 CCCNCCCCOC(=O)C 5de6dd97eb13f02e3674c0a89f759217 [0,0,0,0,0,0|2,0,2]=4 514 B11R0.148 CCCNCCCCOC(F)F dd1f416b6ebd30d74ddc289cdde33711 [0,0,0,0,0,0|4,0,0]=4 515 B11R0.148 CCCNCCCCSC(=O)C e67c14e897e8fe6720f2feb7de9105a1 [0,0,0,0,0,0|2,0,2]=4 516 B11R0.148 CCCNCCCOCC(=O)O 0fe8426b6f63ee30bea77f979722006c [0,0,0,0,0,0|3,0,1]=4 517 B11R0.148 CCCNCCCOCC(C)C 3ef77a86a79498acfe0823eea26b1c94 [0,0,0,0,0,0|3,0,0]=3 518 B11R0.148 CCCNCCOCCC(=O)O 1f840a8dfeffea9a17d6831074997663 [0,0,0,0,0,0|3,0,1]=4 519 B11R0.148 CCCNCCOCCN(C)C dba1164bf187cf8824a07cdfc4953bf8 [0,0,0,0,0,0|4,0,0]=4 520 B11R0.148 CCCOCCCCCC(=O)C a9dd639cc488907d7b3255974d45f633 [0,0,0,0,0,0|1,0,2]=3 521 B11R0.148 CCCOCCCCCC(=O)N c8deadad22ee695447eda984e0e00b27 [0,0,0,0,0,0|2,0,2]=4 522 B11R0.148 CCCOCCCCCC(=O)O fa333152e0beffd56620c1d14609917b [0,0,0,0,0,0|2,0,1]=3 523 B11R0.148 CCCOCCCCCC(C)C 6a81fc1dfc051a37e19be46130d38b39 [0,0,0,0,0,0|2,0,0]=2 524 B11R0.148 CCCOCCCCCC(F)F 3d7292bf6884ee763dd1c9a2f551c51f [0,0,0,0,0,0|3,0,0]=3 525 B11R0.148 CCCOCCCCCN(C)C a52e7152e306b7fd6b3d9d880170c7ed [0,0,0,0,0,0|3,0,0]=3 526 B11R0.148 CCCOCCCCOC(=O)C 76d456e7ca4c7cd8d390c54bbbefcd78 [0,0,0,0,0,0|2,0,2]=4 527 B11R0.148 CCCOCCCCSC(=O)C 369c27db8c9be1ed6dd5c9b10da52191 [0,0,0,0,0,0|2,0,2]=4 528 B11R0.148 CCCOCCCNCC(=O)C 4d98936bd08942b43acf72033a9b2c2f [0,0,0,0,0,0|2,0,2]=4 529 B11R0.148 CCCOCCCNCC(=O)O 295a16ed1d6368a92e0dacd0d6a7c9c0 [0,0,0,0,0,0|3,0,1]=4 530 B11R0.148 CCCOCCCNCC(C)C 5ae198ca5ad04fa5f3d1fa4ba3bedf16 [0,0,0,0,0,0|3,0,0]=3 531 B11R0.148 CCCOCCCNCC(C)O d6c82e5b454bd2c3c1ef1a72075342a6 [0,0,0,0,0,0|2,0,0]=2 532 B11R0.148 CCCOCCCNCC(F)F c03b8d13b5579338f4af694640bb0c23 [0,0,0,0,0,0|4,0,0]=4 533 B11R0.148 CCCOCCCNCN(C)C 2f8c038b7ba897ba150a5b11323bffd3 [0,0,0,0,0,0|4,0,0]=4 534 B11R0.148 CCCOCCCNC[C@@H](C)O 6e88951d00154414b61d7211b634d068 [0,0,0,0,0,0|2,0,0]=2 535 B11R0.148 CCCOCCCNC[C@H](C)O d00db65afbc8acf57f37b1f7276f5c44 [0,0,0,0,0,0|2,0,0]=2 536 B11R0.148 CCCOCCCOCC(=O)C 809ccbc1f7a0704a8f6d3af11b40fcaf [0,0,0,0,0,0|2,0,2]=4 537 B11R0.148 CCCOCCCOCC(=O)O 1f8662db2650bfb91265d5551bc7d84a [0,0,0,0,0,0|3,0,1]=4 538 B11R0.148 CCCOCCCOCC(C)C a82f1a209fe27386bca80678830be0a0 [0,0,0,0,0,0|3,0,0]=3 539 B11R0.148 CCCOCCCOCC(C)F 61298b0f101999d5345fc7de7c587ab8 [0,0,0,0,0,0|3,0,0]=3 540 B11R0.148 CCCOCCCOCC(C)S cfbebbd795516253c92792bd815b9dd4 [0,0,0,0,0,0|2,1,0]=3 541 B11R0.148 CCCOCCCOCC(F)F 113043c0d4d111413e17cd12c9b732e8 [0,0,0,0,0,0|4,0,0]=4 542 B11R0.148 CCCOCCCOCS(=O)O 69e55982009fd54d35ebcf71dab401fd [0,0,0,0,0,0|4,0,0]=4 543 B11R0.148 CCCOCCCOC[C@@H](C)F 0c67479975d1b40f10eb25839e7e18ad [0,0,0,0,0,0|3,0,0]=3 544 B11R0.148 CCCOCCCOC[C@H](C)F 1d3af9791a115eabac87887255399080 [0,0,0,0,0,0|3,0,0]=3 545 B11R0.148 CCCOCCCSCC(C)C f78a3dd758211e633af9a4e86b3b3a85 [0,0,0,0,0,0|3,0,0]=3 546 B11R0.148 CCCOCCNCCC(=O)C 27f26296f1d645079891271267b1fb1b [0,0,0,0,0,0|2,0,2]=4 547 B11R0.148 CCCOCCNCCC(=O)O 3216e228b5856edae86b90ecacfcf231 [0,0,0,0,0,0|3,0,1]=4 548 B11R0.148 CCCOCCNCCC(C)C 25dd2977b1bcce9e6dea27a897372e91 [0,0,0,0,0,0|3,0,0]=3 549 B11R0.148 CCCOCCNCCC(C)O 9e42e86b2c65219b29026f67ec48a629 [0,0,0,0,0,0|2,0,0]=2 550 B11R0.148 CCCOCCNCCC(F)F f264b38f3fdbd295aa4ed0f2f2844458 [0,0,0,0,0,0|4,0,0]=4 551 B11R0.148 CCCOCCNCCN(C)C 0f98bb3e658b220866a9d665c3219a31 [0,0,0,0,0,0|4,0,0]=4 552 B11R0.148 CCCOCCNCCS(=O)C 4873b7dde81c07f72cc8148db6affdd1 [0,0,0,0,0,0|3,0,1]=4 553 B11R0.148 CCCOCCNCCS(=O)O 7423dd033d54c3a000a3b2077a569114 [0,0,0,0,0,0|4,0,0]=4 554 B11R0.148 CCCOCCNCC[C@@H](C)O 4d6f01ae93be492b4114fb6bd706abf7 [0,0,0,0,0,0|2,0,0]=2 555 B11R0.148 CCCOCCNCC[C@H](C)O aca507be6d5f70b61f2f0120f005d5dc [0,0,0,0,0,0|2,0,0]=2 556 B11R0.148 CCCOCCNCOC(C)C 15a111e7aa0803688c6023392c3cc1fc [0,0,0,0,0,0|4,0,0]=4 557 B11R0.148 CCCOCCOCCC(=O)C f9360e39798c51853ea8dd13387b8f0a [0,0,0,0,0,0|2,0,2]=4 558 B11R0.148 CCCOCCOCCC(=O)O 481e9c6b14336445a42a64879cba16db [0,0,0,0,0,0|3,0,1]=4 559 B11R0.148 CCCOCCOCCC(C)C 767abc8dc4af6e2e6f3740f959b4e8f9 [0,0,0,0,0,0|3,0,0]=3 560 B11R0.148 CCCOCCOCCC(F)F 77ddb3f8e2f288bf11d56abe9c620209 [0,0,0,0,0,0|4,0,0]=4 561 B11R0.148 CCCOCCOCCN(C)C 858f4b4f2640a38d73797f7e5e974200 [0,0,0,0,0,0|4,0,0]=4 562 B11R0.148 CCCOCCOCCS(=O)C 6ea139e69464dc6fd81d92e222cbb550 [0,0,0,0,0,0|3,0,1]=4 563 B11R0.148 CCCOCCOCOC(C)C 5fb5c6a2ca5c4c3f87c0224af2c7e463 [0,0,0,0,0,0|4,0,0]=4 564 B11R0.148 CCCSCCCCNC(=O)C b995a956a32500c52f19eeccf108b053 [0,0,0,0,0,0|2,0,2]=4 565 B11R0.148 CCCSCCCCNC(C)C 53253fb11a8e1c9a0afaa55c1a06ac9c [0,0,0,0,0,0|3,0,0]=3 566 B11R0.148 CCCSCCOCCC(=O)C d89b27589e5966e2907586fbff605623 [0,0,0,0,0,0|2,0,2]=4 567 B11R0.148 CCCSCCOCCC(=O)O 547739abbd1ded8057bcdde3e3594a1e [0,0,0,0,0,0|3,0,1]=4 568 B11R0.148 CCCSCCOCCC(C)C c04148de964fc8819b4f2f99532d2f51 [0,0,0,0,0,0|3,0,0]=3 569 B11R0.148 CCCSCCOCCN(C)C 442d8a52e801e624de15c198c55809d7 [0,0,0,0,0,0|4,0,0]=4 570 B11R0.148 CCCSCCOCCS(=O)C 8b99c2b828314be2223ad8dc9b902f58 [0,0,0,0,0,0|3,0,1]=4 571 B11R0.148 CCCSCCOCOC(C)C a2ed9044499e3a39dbb1ba0c2e8d9881 [0,0,0,0,0,0|4,0,0]=4 572 B11R0.148 CCNCCCCCCC(=O)O e9a5c8afc11b12a621b1b3a6781fbc3e [0,0,0,0,0,0|2,0,1]=3 573 B11R0.148 CCNCCCCCCC(C)C 5ed601e8bc317c5240d8cdd8cca0d3a5 [0,0,0,0,0,0|2,0,0]=2 574 B11R0.148 CCNCCCCCCN(C)C c8bbd02c342bc571071aa980e2435837 [0,0,0,0,0,0|3,0,0]=3 575 B11R0.148 CCNCCCCCNC(=O)C 73d4870ba672365fcc36e846ca9b99bb [0,0,0,0,0,0|2,0,2]=4 576 B11R0.148 CCNCCCCSCC(C)C bd86d87134b2176474c72794200693d1 [0,0,0,0,0,0|3,0,0]=3 577 B11R0.148 CCOCCCCCCC(=O)N 4309c4ad68143dc07468ec85b2f0df7c [0,0,0,0,0,0|2,0,2]=4 578 B11R0.148 CCOCCCCCCC(=O)O c60be55443aee57331a1445b50b93edc [0,0,0,0,0,0|2,0,1]=3 579 B11R0.148 CCOCCCCCCC(C)C 86a3297b0d267c43a1da48814b1341a5 [0,0,0,0,0,0|2,0,0]=2 580 B11R0.148 CCOCCCCCCN(C)C 7e663c03bfe94789767a7c590fb2ecf7 [0,0,0,0,0,0|3,0,0]=3 581 B11R0.148 CCOCCCNCCC(=O)C 46f69c4f1f67e6be60c924b9fca5b953 [0,0,0,0,0,0|2,0,2]=4 582 B11R0.148 CCOCCCNCCC(=O)O 2b2f9d5d9072aa622d59e92279d2763e [0,0,0,0,0,0|3,0,1]=4 583 B11R0.148 CCOCCCNCCC(C)C 15a79e0a8268d3b44f974e1ca9f2f760 [0,0,0,0,0,0|3,0,0]=3 584 B11R0.148 CCOCCCNCCC(C)O 7a079affb633d4a4d30ae4d44cb9883c [0,0,0,0,0,0|2,0,0]=2 585 B11R0.148 CCOCCCNCCC(F)F 1b58a86d16c2d90aefe6e2f99142a663 [0,0,0,0,0,0|4,0,0]=4 586 B11R0.148 CCOCCCNCCN(C)C 23db57f983d7a297c89ec3daced18d4d [0,0,0,0,0,0|4,0,0]=4 587 B11R0.148 CCOCCCNCCS(=O)C aa0b4d168bf0e6e6bd10449c35abb418 [0,0,0,0,0,0|3,0,1]=4 588 B11R0.148 CCOCCCNCCS(=O)O 0c50e1a9960e345eb1009e4ea7070481 [0,0,0,0,0,0|4,0,0]=4 589 B11R0.148 CCOCCCNCC[C@@H](C)O 41e32664e3186fcfdb192342036e224d [0,0,0,0,0,0|2,0,0]=2 590 B11R0.148 CCOCCCNCC[C@H](C)O 0e0610f832c96608f36c453a600feca0 [0,0,0,0,0,0|2,0,0]=2 591 B11R0.148 CCOCCCNCOC(C)C 154885d331a5e9bba4aea2d8a1ddb8e7 [0,0,0,0,0,0|4,0,0]=4 592 B11R0.148 CCOCCCOCCC(=O)C 4f23c7fb5dd33b6e6621ffd123c50673 [0,0,0,0,0,0|2,0,2]=4 593 B11R0.148 CCOCCCOCCC(=O)O 960bfd3fbc61cd9dd8dab5b3be9764c1 [0,0,0,0,0,0|3,0,1]=4 594 B11R0.148 CCOCCCOCCC(C)C 992f0eb2c5913001c3ac6389f786fd77 [0,0,0,0,0,0|3,0,0]=3 595 B11R0.148 CCOCCCOCCC(F)F a33acacaba2248ec5bd923817305a5f4 [0,0,0,0,0,0|4,0,0]=4 596 B11R0.148 CCOCCCOCCN(C)C 460ba88bb3b22336bd76c711ba7428e2 [0,0,0,0,0,0|4,0,0]=4 597 B11R0.148 CCOCCCOCCS(=O)C 1cd30239f5d47d9c2677389593367e40 [0,0,0,0,0,0|3,0,1]=4 598 B11R0.148 CCOCCCOCOC(C)C b1407ca9ec19689e201c2ce20e68d242 [0,0,0,0,0,0|4,0,0]=4 599 B11R0.148 CCOCCNCCCC(=O)C f228f108df37202b13afef73a7689247 [0,0,0,0,0,0|2,0,2]=4 600 B11R0.148 CCOCCNCCCC(=O)O 8e29492c33ef7432580d9c26f2acb055 [0,0,0,0,0,0|3,0,1]=4 601 B11R0.148 CCOCCNCCCC(C)C bfe3f47692a5b90adfc2600822907fb4 [0,0,0,0,0,0|3,0,0]=3 602 B11R0.148 CCOCCNCCCC(C)O f1c4afa02ff802c760d14d637e7d312c [0,0,0,0,0,0|2,0,0]=2 603 B11R0.148 CCOCCNCCCN(C)C 411b4c6fa10954189aeb64f150d64351 [0,0,0,0,0,0|4,0,0]=4 604 B11R0.148 CCOCCNCCCS(=O)C d777344ef01a06bdb929427e2ffab303 [0,0,0,0,0,0|3,0,1]=4 605 B11R0.148 CCOCCNCCOC(C)C 7fec7fc3d71fd51e7d5867a1c72ab9fe [0,0,0,0,0,0|4,0,0]=4 606 B11R0.148 CCOCCNCCSC(C)C f03773b3529d269674c1aef53326afc9 [0,0,0,0,0,0|4,0,0]=4 607 B11R0.148 CCOCCOCCCC(=O)C 14a18b63593837505b3352d7193ebabc [0,0,0,0,0,0|2,0,2]=4 608 B11R0.148 CCOCCOCCCC(=O)O 7188f19f71415130253b8f1d4ffb2ebe [0,0,0,0,0,0|3,0,1]=4 609 B11R0.148 CCOCCOCCCC(C)C ee80548e0b69ffeabf8549293f36ee1b [0,0,0,0,0,0|3,0,0]=3 610 B11R0.148 CCOCCOCCCN(C)C 14649415d830a8e24b413cdb9486b778 [0,0,0,0,0,0|4,0,0]=4 611 B11R0.148 CCOCCOCCNC(C)C 776ff3d92cb43a4cb9e6ac9184ba295f [0,0,0,0,0,0|4,0,0]=4 612 B11R0.148 CCOCCOCCOC(C)C 59e619728c250c026338d7d9be6c3e2f [0,0,0,0,0,0|4,0,0]=4 613 B11R0.148 CCOCCOCCSC(C)C d790cd375a7cfb2aacf8204e3b131468 [0,0,0,0,0,0|4,0,0]=4 614 B11R0.148 CCOCNCCCCC(=O)O aa1ae81ce73a99ebbf1bd5e7fa2b61d8 [0,0,0,0,0,0|3,0,1]=4 615 B11R0.148 CCOCNCCCCC(F)F 68528bcbbbd19ab72127a547ca384e34 [0,0,0,0,0,0|4,0,0]=4 616 B11R0.148 CCOCNCCCCN(C)C 5f42a72639c4a950bedcf3b1b9b92f32 [0,0,0,0,0,0|4,0,0]=4 617 B11R0.148 CCOCNCCCOC(C)C 8f67d92208fc47993c294f9f8b096aba [0,0,0,0,0,0|4,0,0]=4 618 B11R0.148 CCOCNCCCSC(C)C 92e996a6f93e7beb693a325f6eb661fa [0,0,0,0,0,0|4,0,0]=4 619 B11R0.148 CCOCOCCCCC(=O)C 494c300c93d7879b4e62627be935996c [0,0,0,0,0,0|2,0,2]=4 620 B11R0.148 CCOCOCCCCC(C)C 57f453210c8d0ec0d94c7bb57830e1f8 [0,0,0,0,0,0|3,0,0]=3 621 B11R0.148 CCOCOCCCCN(C)C 5e4ac6252e213efcbb184225c51eceea [0,0,0,0,0,0|4,0,0]=4 622 B11R0.148 CCOCOCCCOC(C)C f568958620d3bbbd8c57805ffc6f4ab9 [0,0,0,0,0,0|4,0,0]=4 623 B11R0.148 CCOCOCCCSC(C)C 416d0e9cf423f90d21111e80fe619f26 [0,0,0,0,0,0|4,0,0]=4 624 B11R0.148 CCOCOCCOCC(C)C a1cc1538505e6e7d3665c74a39580aaf [0,0,0,0,0,0|4,0,0]=4 625 B11R0.148 CCOCOCCSCC(C)C 7aa9c9d980fb701d7a80e8d9a0eec64c [0,0,0,0,0,0|4,0,0]=4 626 B11R0.148 CCSCCCCNCC(=O)O 48d23c14c94084e7bff45772097aafd6 [0,0,0,0,0,0|3,0,1]=4 627 B11R0.148 CCSCCCCNCC(C)C fbb9b4544061c0f4fa661102e9d07f9b [0,0,0,0,0,0|3,0,0]=3 628 B11R0.148 CCSCCCCNCC(C)O 7c3aa50bf4e6e962762981b5339b92ac [0,0,0,0,0,0|2,0,0]=2 629 B11R0.148 CCSCCCCNCC(F)F f2b566e8cd73963b2d0fc2d2e261a480 [0,0,0,0,0,0|4,0,0]=4 630 B11R0.148 CCSCCCCNCN(C)C 00491e0b52ac419a3ed23bef8f184500 [0,0,0,0,0,0|4,0,0]=4 631 B11R0.148 CCSCCCCNC[C@@H](C)O 4f3d3b7cfb78207e6d5945de564823ab [0,0,0,0,0,0|2,0,0]=2 632 B11R0.148 CCSCCCCNC[C@H](C)O 3bfac6a94d832caf268f359b97cd65af [0,0,0,0,0,0|2,0,0]=2 633 B11R0.148 CCSCCCNCCC(C)C b69cd444b7de582e2c5b5840845e0cff [0,0,0,0,0,0|3,0,0]=3 634 B11R0.148 CCSCCCNCCC(C)O 9937322b8870d6b84770f258dc11e61f [0,0,0,0,0,0|2,0,0]=2 635 B11R0.148 CCSCCCNCCC(F)F 24402fbea43f93acadde45fb4315a748 [0,0,0,0,0,0|4,0,0]=4 636 B11R0.148 CCSCCCNCCN(C)C fa9b6d814bc9a58c36962246b1439d05 [0,0,0,0,0,0|4,0,0]=4 637 B11R0.148 CCSCCCNCCS(=O)O 26ce23f28bb397f475d4cfe6e6e2aefc [0,0,0,0,0,0|4,0,0]=4 638 B11R0.148 CCSCCCNCC[C@@H](C)O 673513fce6bf6802e1369b196758fe4a [0,0,0,0,0,0|2,0,0]=2 639 B11R0.148 CCSCCCNCC[C@H](C)O f83a5da81c822d34f544e69e34cac1c2 [0,0,0,0,0,0|2,0,0]=2 640 B11R0.148 CCSCCCOCCC(=O)C c42589189df812f9b05f572e4305064f [0,0,0,0,0,0|2,0,2]=4 641 B11R0.148 CCSCCCOCCC(=O)O 295ed2aed1a2219fd17360210752fa06 [0,0,0,0,0,0|3,0,1]=4 642 B11R0.148 CCSCCCOCCC(C)C fba8234ea6757258fbc8a7169452da15 [0,0,0,0,0,0|3,0,0]=3 643 B11R0.148 CCSCCCOCCC(F)F 3111356f5a92791412e9b4745606d3db [0,0,0,0,0,0|4,0,0]=4 644 B11R0.148 CCSCCCOCCN(C)C 3500246da518c09ac64365bcb57fe31c [0,0,0,0,0,0|4,0,0]=4 645 B11R0.148 CCSCCCOCCS(=O)C 9c9aa753dcea3c9876d2be814fa96abc [0,0,0,0,0,0|3,0,1]=4 646 B11R0.148 CCSCCCOCOC(C)C e6b89a25b4ac0566b8b947198f32d926 [0,0,0,0,0,0|4,0,0]=4 647 B11R0.148 CCSCCNCCCC(=O)C 064a7ffcceb38b9394777322ebb69ec8 [0,0,0,0,0,0|2,0,2]=4 648 B11R0.148 CCSCCNCCCC(=O)O e75265f16a8580bfb93e2109f6957cdc [0,0,0,0,0,0|3,0,1]=4 649 B11R0.148 CCSCCNCCCC(C)C 560b7371052a65b699867671123debf2 [0,0,0,0,0,0|3,0,0]=3 650 B11R0.148 CCSCCNCCCC(C)O e6c13131ad4eb421f5fc9a0f72f7aa78 [0,0,0,0,0,0|2,0,0]=2 651 B11R0.148 CCSCCNCCCN(C)C 7b25c361bb0f19347990794e0e003c26 [0,0,0,0,0,0|4,0,0]=4 652 B11R0.148 CCSCCNCCOC(C)C ad63c13e3b92c9ce31f1ad0ec7947dc2 [0,0,0,0,0,0|4,0,0]=4 653 B11R0.148 CCSCCNCCSC(C)C a553dc3fa2a6b7858de168f4463eb2e4 [0,0,0,0,0,0|4,0,0]=4 654 B11R0.148 CCSCCOCCCC(=O)C 8f4393f530065181ad15e664abafcbb1 [0,0,0,0,0,0|2,0,2]=4 655 B11R0.148 CCSCCOCCCC(=O)O be81c63483d7f62e89bb00d9826e624f [0,0,0,0,0,0|3,0,1]=4 656 B11R0.148 CCSCCOCCCC(C)C b151b4bd1bae8dd7ec84ff49cd35f4f5 [0,0,0,0,0,0|3,0,0]=3 657 B11R0.148 CCSCCOCCCN(C)C 7cb17c9d84ec49080bb1795c2835f8c7 [0,0,0,0,0,0|4,0,0]=4 658 B11R0.148 CCSCCOCCOC(C)C eed7110c8e062fd648ba3272fcd302be [0,0,0,0,0,0|4,0,0]=4 659 B11R0.148 CCSCCOCCSC(C)C 8a26a8cd1488678402db60dc6b1eefea [0,0,0,0,0,0|4,0,0]=4 660 B11R0.148 CN(C)CCCCCCNCF 7c5f9d4b1f935c93ce62df1c26676690 [0,0,0,0,0,0|4,0,0]=4 661 B11R0.148 CN(C)CCCCCCNCO 63dbfc8b0f6e635d981f15a9b987ff33 [0,0,0,0,0,0|4,0,0]=4 662 B11R0.148 CN(C)CCCCCCOCF 33994fa90e34e25ab32920b98ecf604e [0,0,0,0,0,0|4,0,0]=4 663 B11R0.148 CN(C)CCCCCNCCF b1f887d7d207836524313823b7b649e7 [0,0,0,0,0,0|4,0,0]=4 664 B11R0.148 CN(C)CCCCCNCCO 55b6d9ea0c94e37f5664a24fa69af18d [0,0,0,0,0,0|4,0,0]=4 665 B11R0.148 CN(C)CCCCCNCCS 67e72682d97eaedb850b86a72c23978e [0,0,0,0,0,0|4,0,0]=4 666 B11R0.148 CN(C)CCCCCOCCF 72aa914941c79e3521785c9036a9f8a5 [0,0,0,0,0,0|4,0,0]=4 667 B11R0.148 CN(C)CCCCCOCCS e938a3d1bc5638c1fde6ed6e3f4902e9 [0,0,0,0,0,0|4,0,0]=4 668 B11R0.148 CN(C)CCCCNCCCCl 052126e744168af67efcc78a81f0b404 [0,0,0,0,0,0|4,0,0]=4 669 B11R0.148 CN(C)CCCCNCCCF 970ef289e3b53ff6e8b027be9d8d4d5f [0,0,0,0,0,0|4,0,0]=4 670 B11R0.148 CN(C)CCCCNCCCO 14c2cb4fefb88f693e4cae2943644dbd [0,0,0,0,0,0|4,0,0]=4 671 B11R0.148 CN(C)CCCCNCCCS 4115a055f701862e8c53630f9071ed09 [0,0,0,0,0,0|4,0,0]=4 672 B11R0.148 CN(C)CCCCOCCCF 44429b9889506d83ccd3f5bc4233cfe2 [0,0,0,0,0,0|4,0,0]=4 673 B11R0.148 CN(C)CCCCOCCCS 89bcbc8711b61d17e85b4a1f5297e96e [0,0,0,0,0,0|4,0,0]=4 674 B11R0.148 CN(C)CCCNCCCCCl e29c3465791a62c369edf84a42000c29 [0,0,0,0,0,0|4,0,0]=4 675 B11R0.148 CN(C)CCCNCCCCF c39c5d2f00d5025a8b1cd5870a8250c7 [0,0,0,0,0,0|4,0,0]=4 676 B11R0.148 CN(C)CCCNCCCCO b73478c1fd3c4a2e4d2bd264d2f10aa7 [0,0,0,0,0,0|4,0,0]=4 677 B11R0.148 CN(C)CCCNCCCCS d0f20a5e2a3b94b6967f427506bd9b4e [0,0,0,0,0,0|4,0,0]=4 678 B11R0.148 CN(C)CCCOCCCCF 82524cf901c44060f57ab95a02e1f801 [0,0,0,0,0,0|4,0,0]=4 679 B11R0.148 CN(C)CCCOCCCCS d01da6df79fe856a5762eb3ed4cc096f [0,0,0,0,0,0|4,0,0]=4 680 B11R0.148 CN(C)CCNCCCCCCl 6c9cdb084cf8a863744c86bbf2158e9c [0,0,0,0,0,0|4,0,0]=4 681 B11R0.148 CN(C)CCNCCCCCF 05962eb8478256b48b580dfa0c030ad0 [0,0,0,0,0,0|4,0,0]=4 682 B11R0.148 CN(C)CCNCCCCCO f20ddf25cf23ca04183fe5465693ddc3 [0,0,0,0,0,0|4,0,0]=4 683 B11R0.148 CN(C)CCOCCCCCF 43942febedf8d972e9345a9d23449a75 [0,0,0,0,0,0|4,0,0]=4 684 B11R0.148 CN(C)CNCCCCCCCl b9736a57ed96c66a6bdb4ff280c85c77 [0,0,0,0,0,0|4,0,0]=4 685 B11R0.148 CN(C)CNCCCCCCO 6d6e67e9179eecfdb4a58aa81ca0991d [0,0,0,0,0,0|4,0,0]=4 686 B11R0.148 CN(C)COCCCCCCF 474a3ddb433b07298fbcd433f5db1279 [0,0,0,0,0,0|4,0,0]=4 687 B11R0.148 CN(C)COCCCCCCS b180f6d61f9c84c81ed61b42f2ff415f [0,0,0,0,0,0|4,0,0]=4 688 B11R0.148 COCC#CCNCCC(C)O ac1796d857d0f4d089a1f3bfd0c1b2b5 [0,0,0,0,0,0|2,0,2]=4 689 B11R0.148 COCC#CCNCC[C@@H](C)O c290bcf0b8aba613a627e5b373eb36b0 [0,0,0,0,0,0|2,0,2]=4 690 B11R0.148 COCC#CCNCC[C@H](C)O 2066373d1f7b334e37958a4237b53634 [0,0,0,0,0,0|2,0,2]=4 691 B11R0.148 COCCCCCCOC(C)C 53aff5b0fa69fbc4868798122d4a89e3 [0,0,0,0,0,0|3,0,0]=3 692 B11R0.148 COCCCCCNCC(=O)C f14a0e7c6184fb994195ce1a50edd828 [0,0,0,0,0,0|2,0,2]=4 693 B11R0.148 COCCCCCNCC(=O)O e9d365c9b641bfa544654729405f2968 [0,0,0,0,0,0|3,0,1]=4 694 B11R0.148 COCCCCCNCC(C)C 6a65251e6a13c60359b0d0345cdbd709 [0,0,0,0,0,0|3,0,0]=3 695 B11R0.148 COCCCCCNCC(C)O 67657b02b2065cfa1827ce4c8181a02e [0,0,0,0,0,0|2,0,0]=2 696 B11R0.148 COCCCCCNCC(F)F 4b90ab692785309163bb28450d053c77 [0,0,0,0,0,0|4,0,0]=4 697 B11R0.148 COCCCCCNCN(C)C cf8fc68af67d377db8081cf1cb334f79 [0,0,0,0,0,0|4,0,0]=4 698 B11R0.148 COCCCCCNC[C@@H](C)O 8063e074c1d5e4b68738c6548127369c [0,0,0,0,0,0|2,0,0]=2 699 B11R0.148 COCCCCCNC[C@H](C)O c8f034cd60e63c96f70e07490a8b848c [0,0,0,0,0,0|2,0,0]=2 700 B11R0.148 COCCCCCOCC(=O)C d37277e1c0f5be693f57271e9f1f4394 [0,0,0,0,0,0|2,0,2]=4 701 B11R0.148 COCCCCCOCC(=O)O 2ece8647978153469dc704b17fef017d [0,0,0,0,0,0|3,0,1]=4 702 B11R0.148 COCCCCCOCC(C)C e1c12515bec6a10050fa567dea619b05 [0,0,0,0,0,0|3,0,0]=3 703 B11R0.148 COCCCCCOCC(C)F eb2546ec2d324c0d3328ce010df636de [0,0,0,0,0,0|3,0,0]=3 704 B11R0.148 COCCCCCOCC(C)S cc8bdb8ce2ca138f1916a66f8429aaf3 [0,0,0,0,0,0|2,1,0]=3 705 B11R0.148 COCCCCCOCC(F)F 0c8040d59c30997bab88390f5d79f5c8 [0,0,0,0,0,0|4,0,0]=4 706 B11R0.148 COCCCCCOCS(=O)O 741a08e6be66276ff6cd81a1454639e7 [0,0,0,0,0,0|4,0,0]=4 707 B11R0.148 COCCCCCOC[C@@H](C)F 8fff72f8b9ff7ad00456a26b315dbf18 [0,0,0,0,0,0|3,0,0]=3 708 B11R0.148 COCCCCCOC[C@H](C)F 1e37e563bb6a5520174f6b454e9721f5 [0,0,0,0,0,0|3,0,0]=3 709 B11R0.148 COCCCCNCCC(=O)C 99d64fad0e8afbca73c8d652d21bae31 [0,0,0,0,0,0|2,0,2]=4 710 B11R0.148 COCCCCNCCC(=O)O d7bbe9fde4ea1411124188ea6025950d [0,0,0,0,0,0|3,0,1]=4 711 B11R0.148 COCCCCNCCC(C)C 252d2964675e9fd09faa0d2a0e15ddea [0,0,0,0,0,0|3,0,0]=3 712 B11R0.148 COCCCCNCCC(C)O cff87372cb5ce90ec34d6c8f1b3b4ffa [0,0,0,0,0,0|2,0,0]=2 713 B11R0.148 COCCCCNCCC(F)F 2b696a1fc72ee0c77b79b2d7757edf2c [0,0,0,0,0,0|4,0,0]=4 714 B11R0.148 COCCCCNCCN(C)C 9f49ec5fe80081c970e8a09f01564525 [0,0,0,0,0,0|4,0,0]=4 715 B11R0.148 COCCCCNCCS(=O)C 01100a3c56b4407a67a8f49a6ca051f6 [0,0,0,0,0,0|3,0,1]=4 716 B11R0.148 COCCCCNCCS(=O)O b8dcdd169fa038b597bf1923574605a9 [0,0,0,0,0,0|4,0,0]=4 717 B11R0.148 COCCCCNCC[C@@H](C)O b20c29a511e2696352a2b4afeee4b6c1 [0,0,0,0,0,0|2,0,0]=2 718 B11R0.148 COCCCCNCC[C@H](C)O 8377f07ca1a0f446a17f7ab401b962ee [0,0,0,0,0,0|2,0,0]=2 719 B11R0.148 COCCCCNCOC(C)C 522dcbc555ab3065fd5b5fc31d378fb4 [0,0,0,0,0,0|4,0,0]=4 720 B11R0.148 COCCCCOCCC(=O)C f1c810eb131cc0cf69e918163bd7c135 [0,0,0,0,0,0|2,0,2]=4 721 B11R0.148 COCCCCOCCC(=O)O a9a7f1dd96d065141ddf56bc5e4dadb6 [0,0,0,0,0,0|3,0,1]=4 722 B11R0.148 COCCCCOCCC(C)C 3eff51dac8b1c7858845964b3f2867d8 [0,0,0,0,0,0|3,0,0]=3 723 B11R0.148 COCCCCOCCC(F)F bdf7d44d1542f8714ea34d606f162d8c [0,0,0,0,0,0|4,0,0]=4 724 B11R0.148 COCCCCOCCN(C)C 70ebb73ee3dfffbb7188d53e1c60bf91 [0,0,0,0,0,0|4,0,0]=4 725 B11R0.148 COCCCCOCCS(=O)C 3f5ee43394d09ac425b5e5e4827d415e [0,0,0,0,0,0|3,0,1]=4 726 B11R0.148 COCCCCOCOC(C)C 14b4201c9c9f2462f1366208053a1e00 [0,0,0,0,0,0|4,0,0]=4 727 B11R0.148 COCCCNCCCC(=O)C 4ccb1c720ecdf7e33d7132d28dd2a288 [0,0,0,0,0,0|2,0,2]=4 728 B11R0.148 COCCCNCCCC(=O)O dfefe79baa8d3de2e2f22b6b63766bcf [0,0,0,0,0,0|3,0,1]=4 729 B11R0.148 COCCCNCCCC(C)C 612019172d548f89e3d496ce161107ea [0,0,0,0,0,0|3,0,0]=3 730 B11R0.148 COCCCNCCCC(C)O e82510b018bd3b6724a60d7dd9a8b04d [0,0,0,0,0,0|2,0,0]=2 731 B11R0.148 COCCCNCCCN(C)C aab2b49c885764ea019f3ed6601bc1a5 [0,0,0,0,0,0|4,0,0]=4 732 B11R0.148 COCCCNCCCS(=O)C 05bb3bf5e3fd558971ca7a045248c170 [0,0,0,0,0,0|3,0,1]=4 733 B11R0.148 COCCCNCCOC(C)C 26f9c682edd46d4daa4d0b5fd7355529 [0,0,0,0,0,0|4,0,0]=4 734 B11R0.148 COCCCNCCSC(C)C 06ed8bf504f360b6c936abe1656b72e6 [0,0,0,0,0,0|4,0,0]=4 735 B11R0.148 COCCCOCCCC(=O)C 87d421651be24118b98fa50f3606c492 [0,0,0,0,0,0|2,0,2]=4 736 B11R0.148 COCCCOCCCC(=O)O 49621db20500d04702119d17ede7109b [0,0,0,0,0,0|3,0,1]=4 737 B11R0.148 COCCCOCCCC(C)C 9aea44b08585a2dd6dfb4709a2cc4a4b [0,0,0,0,0,0|3,0,0]=3 738 B11R0.148 COCCCOCCCN(C)C 318500250ebd343737cbf6378be99323 [0,0,0,0,0,0|4,0,0]=4 739 B11R0.148 COCCCOCCOC(C)C 0eca6d60bcfc71d6d84c83d84cbecdc5 [0,0,0,0,0,0|4,0,0]=4 740 B11R0.148 COCCCOCCSC(C)C a5001763fa377d08ce8d17e0b6dd8be4 [0,0,0,0,0,0|4,0,0]=4 741 B11R0.148 COCCNCCCCC(=O)C 5c740e29f6604eaf8ea19cb01cba1f89 [0,0,0,0,0,0|2,0,2]=4 742 B11R0.148 COCCNCCCCC(=O)O d88042a9f5ae6ecad4def0db5518e485 [0,0,0,0,0,0|3,0,1]=4 743 B11R0.148 COCCNCCCCC(C)C 01f96fc2e6a55a0b3a74dbea50284196 [0,0,0,0,0,0|3,0,0]=3 744 B11R0.148 COCCNCCCCC(C)O d7e529905c1e8c926b9971b6a2056c04 [0,0,0,0,0,0|2,0,0]=2 745 B11R0.148 COCCNCCCCC(F)F 4716fc1501f77fe20f0c6a594c647e86 [0,0,0,0,0,0|4,0,0]=4 746 B11R0.148 COCCNCCCCN(C)C 3ce50f4156456c1e6137d36dce2e1fa7 [0,0,0,0,0,0|4,0,0]=4 747 B11R0.148 COCCNCCCC[C@@H](C)O e0146f541928e12747a321e45778da6a [0,0,0,0,0,0|2,0,0]=2 748 B11R0.148 COCCNCCCOC(C)C e0ba7df3dd356c01e86b06a7754116e7 [0,0,0,0,0,0|4,0,0]=4 749 B11R0.148 COCCNCCCSC(C)C 9e58721e66878ccb31fed27c2f33d0c8 [0,0,0,0,0,0|4,0,0]=4 750 B11R0.148 COCCNCCOCC(C)C e78dd8656d880c3cffed4760719bef44 [0,0,0,0,0,0|4,0,0]=4 751 B11R0.148 COCCOCCCCC(=O)C e1bd35f3a7437c78a11075e0c6413b43 [0,0,0,0,0,0|2,0,2]=4 752 B11R0.148 COCCOCCCCC(=O)O 1bfe81f974cd55b00acd5b66b8e21fb5 [0,0,0,0,0,0|3,0,1]=4 753 B11R0.148 COCCOCCCCC(C)C 3f48677c33098e09bb5c54bc04c7d8bb [0,0,0,0,0,0|3,0,0]=3 754 B11R0.148 COCCOCCCCN(C)C 63e1d26f53f8db7aaa5784ecc7e071de [0,0,0,0,0,0|4,0,0]=4 755 B11R0.148 COCCOCCCNC(C)C 4023b22572d14e00e3ca695d35b0886f [0,0,0,0,0,0|4,0,0]=4 756 B11R0.148 COCCOCCCOC(C)C 5c58cb31361ebb0813e7dd56ef2acebd [0,0,0,0,0,0|4,0,0]=4 757 B11R0.148 COCCOCCCSC(C)C e28cd67cee0f320aa0fc6a080b8e40d5 [0,0,0,0,0,0|4,0,0]=4 758 B11R0.148 COCCOCCNCC(C)C f4c0e579c571454a41fc46493295f646 [0,0,0,0,0,0|4,0,0]=4 759 B11R0.148 COCCOCCNCC(C)O d625820e7470c7666ea38b5234ef5be8 [0,0,0,0,0,0|3,0,0]=3 760 B11R0.148 COCCOCCNC[C@@H](C)O 93264b244439206fe1be975f6f69592c [0,0,0,0,0,0|3,0,0]=3 761 B11R0.148 COCCOCCNC[C@H](C)O 9c6aa2d8a08cda81f6083b00a31055ba [0,0,0,0,0,0|3,0,0]=3 762 B11R0.148 COCCOCCOCC(C)C 6464ccff5622adf0f1f75471f0efcf9a [0,0,0,0,0,0|4,0,0]=4 763 B11R0.148 COCCOCCOCC(C)F ffeece6c020a4ad3b4cc216f03f72172 [0,0,0,0,0,0|4,0,0]=4 764 B11R0.148 COCCOCCOCC(C)S 75f37ca4a61f0c7e6337e513bab74918 [0,0,0,0,0,0|3,1,0]=4 765 B11R0.148 COCCOCCOC[C@@H](C)F 1da87fe53f0d11361de309d8be0b0c08 [0,0,0,0,0,0|4,0,0]=4 766 B11R0.148 COCCOCCOC[C@H](C)F 78e9e4161c4ba5aa39232bec3b7cd269 [0,0,0,0,0,0|4,0,0]=4 767 B11R0.148 COCCOCCSCC(C)C 1cd507e2bc62ab8c30e59beba4e02e7c [0,0,0,0,0,0|4,0,0]=4 768 B11R0.148 COCCOCNCCC(C)C d85c5454adae1c62c9bf9df1e1042379 [0,0,0,0,0,0|4,0,0]=4 769 B11R0.148 COCCOCNCCC(C)O 683072bc263ac688d18f022debe0ebb4 [0,0,0,0,0,0|3,0,0]=3 770 B11R0.148 COCCOCNCC[C@@H](C)O 5e119d3d025b6b054bfb7990c54d23c0 [0,0,0,0,0,0|3,0,0]=3 771 B11R0.148 COCCOCNCC[C@H](C)O 921acd63e20adecd46e421ca2fbc54cc [0,0,0,0,0,0|3,0,0]=3 772 B11R0.148 COCCOCOCCC(C)C e4151472154392793c823b76b38e767b [0,0,0,0,0,0|4,0,0]=4 773 B11R0.148 COCNCCCCCC(=O)O b84fb7ca56aca6e16d69f0a227ea45a4 [0,0,0,0,0,0|3,0,1]=4 774 B11R0.148 COCNCCCCCC(C)C 37dd793220bae436d7726181fa3b5587 [0,0,0,0,0,0|3,0,0]=3 775 B11R0.148 COCNCCCCCN(C)C 0ad70268eb35cd32bdc922f744efbd42 [0,0,0,0,0,0|4,0,0]=4 776 B11R0.148 COCNCCCOCC(C)C f8f05683f92565fc9a34a0edcb13d9d9 [0,0,0,0,0,0|4,0,0]=4 777 B11R0.148 COCOCCCCCC(=O)C 8894b132b8e9272b0a87d56a7ee0b630 [0,0,0,0,0,0|2,0,2]=4 778 B11R0.148 COCOCCCCCC(=O)O 3afdcf882d4b857d276025b0908b1b82 [0,0,0,0,0,0|3,0,1]=4 779 B11R0.148 COCOCCCCCC(C)C f7e5e4a3531eaee210811dc49227ac84 [0,0,0,0,0,0|3,0,0]=3 780 B11R0.148 COCOCCCCCC(F)F 11a785a3bd95852f3d7af7e794a63c8a [0,0,0,0,0,0|4,0,0]=4 781 B11R0.148 COCOCCCCCN(C)C 2fdc3d32c96c53fb3c1d46a7de5e878d [0,0,0,0,0,0|4,0,0]=4 782 B11R0.148 COCOCCCOCC(C)C db5a0f431ec25016d7744a76aae555ff [0,0,0,0,0,0|4,0,0]=4 783 B11R0.148 COCOCCCSCC(C)C ffd6f84a9ee2109e939491ea2f9c128c [0,0,0,0,0,0|4,0,0]=4 784 B11R0.148 COCOCCNCCC(C)C 627e79ce810e0966635ce84cdc9ac4e7 [0,0,0,0,0,0|4,0,0]=4 785 B11R0.148 COCOCCNCCC(C)O 33e073c7da6f71bed64f48c40978f509 [0,0,0,0,0,0|3,0,0]=3 786 B11R0.148 COCOCCNCC[C@@H](C)O 1f9c12366c7562bef78b21443af8351f [0,0,0,0,0,0|3,0,0]=3 787 B11R0.148 COCOCCNCC[C@H](C)O 049fc7ce626c25f6dfbc68f36396ed7c [0,0,0,0,0,0|3,0,0]=3 788 B11R0.148 COCOCCOCCC(C)C 41d5060f15356151e6831e0358ffbdbb [0,0,0,0,0,0|4,0,0]=4 789 B11R0.148 CS(=O)CCCNCCCCF 40299da30668487961f60001a1255368 [0,0,0,0,0,0|3,0,1]=4 790 B11R0.148 CS(=O)CCCNCCCCO 69593a360094bc482e161e00d0d5933e [0,0,0,0,0,0|3,0,1]=4 791 B11R0.148 CS(=O)CCNCCCCCCl 19eb2eb3c3648a6201eb963406dabc37 [0,0,0,0,0,0|3,0,1]=4 792 B11R0.148 CS(=O)CCNCCCCCF bd9c3c8cf93fd414fe0dfb2b1bdacec1 [0,0,0,0,0,0|3,0,1]=4 793 B11R0.148 CS(=O)CCNCCCCCO e6185785b0222db44e4aec754b1f81b1 [0,0,0,0,0,0|3,0,1]=4 794 B11R0.148 CS(=O)CCOCCCCCF 4eb7eaf39036813a49075047d0e73c50 [0,0,0,0,0,0|3,0,1]=4 795 B11R0.148 CSCCCCNCCC(=O)C 1f7db8bdc8277aba598a98a9c4ce4908 [0,0,0,0,0,0|2,0,2]=4 796 B11R0.148 CSCCCCNCCC(=O)O 9409e81796fd35b2e0b4559edafca006 [0,0,0,0,0,0|3,0,1]=4 797 B11R0.148 CSCCCCNCCC(C)C 61649a3139e16bd9d11f8bf6b80b7d5e [0,0,0,0,0,0|3,0,0]=3 798 B11R0.148 CSCCCCNCCC(C)O a4b41d79bf57e3a71d4b41a1535d977e [0,0,0,0,0,0|2,0,0]=2 799 B11R0.148 CSCCCCNCCN(C)C 74b0e1c32a23777d9396a8a17fa20c1f [0,0,0,0,0,0|4,0,0]=4 800 B11R0.148 CSCCCCNCCS(=O)C f955e6535dee2a8362199a62879d9a96 [0,0,0,0,0,0|3,0,1]=4 801 B11R0.148 CSCCCCNCOC(C)C 4756b9865594b6fb39021763c2a3387c [0,0,0,0,0,0|4,0,0]=4 802 B11R0.148 CSCCCCOCCC(=O)C 9eb1c820143deb28ccbdac5fefd19556 [0,0,0,0,0,0|2,0,2]=4 803 B11R0.148 CSCCCCOCCC(=O)O 098451fe3919d093232420bf266192f1 [0,0,0,0,0,0|3,0,1]=4 804 B11R0.148 CSCCCCOCCC(C)C 290ad15488fb48fa2cecb868868d9e29 [0,0,0,0,0,0|3,0,0]=3 805 B11R0.148 CSCCCCOCCN(C)C 5523378b03da9604a7adf07ae2573fee [0,0,0,0,0,0|4,0,0]=4 806 B11R0.148 CSCCCCOCCS(=O)C 4c6bbfb9c9065882070b4601908a51d3 [0,0,0,0,0,0|3,0,1]=4 807 B11R0.148 CSCCCCOCOC(C)C 339b3a5939ab9f97449b8eaf546fc76e [0,0,0,0,0,0|4,0,0]=4 808 B11R0.148 CSCCCNCCCC(=O)C 22c2a84284aa7fbe7690e72ac77f3f99 [0,0,0,0,0,0|2,0,2]=4 809 B11R0.148 CSCCCNCCCC(=O)O 8c251662d46bbe64d437e9d1f67bd41a [0,0,0,0,0,0|3,0,1]=4 810 B11R0.148 CSCCCNCCCC(C)C dc12dc8e9c7f2f894a7f3e9d5ed1d30c [0,0,0,0,0,0|3,0,0]=3 811 B11R0.148 CSCCCNCCCC(C)O 0d872fa43229a3d0574f0ec04a5d0878 [0,0,0,0,0,0|2,0,0]=2 812 B11R0.148 CSCCCNCCCN(C)C 665c0ba708b033546c5b78babb037b90 [0,0,0,0,0,0|4,0,0]=4 813 B11R0.148 CSCCCNCCCS(=O)C 082e555abb8ee07d45fa041ea7f517d1 [0,0,0,0,0,0|3,0,1]=4 814 B11R0.148 CSCCCNCCOC(C)C 18757890954dd41da3dc316a0c6b2c67 [0,0,0,0,0,0|4,0,0]=4 815 B11R0.148 CSCCCNCCSC(C)C ee3e372f085e1da3e2f80b2fed6ef4aa [0,0,0,0,0,0|4,0,0]=4 816 B11R0.148 CSCCCOCCCC(=O)C 5468e78dba08221c943b6f4f7653f163 [0,0,0,0,0,0|2,0,2]=4 817 B11R0.148 CSCCCOCCCC(C)C 7989ea8782c6ac212730d5ea9040f006 [0,0,0,0,0,0|3,0,0]=3 818 B11R0.148 CSCCCOCCCN(C)C 9946ee30d4f96d3221018b61a2372b0b [0,0,0,0,0,0|4,0,0]=4 819 B11R0.148 CSCCCOCCOC(C)C 889417dd61bf572b115bc1072d0547ee [0,0,0,0,0,0|4,0,0]=4 820 B11R0.148 CSCCCOCCSC(C)C 0b2d6fdb4d33a744d6b373a03e74c935 [0,0,0,0,0,0|4,0,0]=4 821 B11R0.148 CSCCNCCCCC(=O)C a38fe99fe24381b306612176189b7551 [0,0,0,0,0,0|2,0,2]=4 822 B11R0.148 CSCCNCCCCC(=O)O 0ac653ab402a0b6c32997eff60de279c [0,0,0,0,0,0|3,0,1]=4 823 B11R0.148 CSCCNCCCCC(C)C 9c98754fa350ba33780dc62c42381957 [0,0,0,0,0,0|3,0,0]=3 824 B11R0.148 CSCCNCCCCC(C)O cba11288cf4a8f8c7d5c3a9c35d3039d [0,0,0,0,0,0|2,0,0]=2 825 B11R0.148 CSCCNCCCCC(F)F 04e0601cd325f2849b4cfd8456a2abd5 [0,0,0,0,0,0|4,0,0]=4 826 B11R0.148 CSCCNCCCCN(C)C fd7a51ef9381689c21ed320edf2b00d5 [0,0,0,0,0,0|4,0,0]=4 827 B11R0.148 CSCCNCCCC[C@@H](C)O acf1c268ee0508a9d39a2e6344a8070a [0,0,0,0,0,0|2,0,0]=2 828 B11R0.148 CSCCNCCCOC(C)C 78ed9266a3d7e8216f7ec474aacb2978 [0,0,0,0,0,0|4,0,0]=4 829 B11R0.148 CSCCNCCCSC(C)C 0624e240a49967ba1b3f6f48d53b4bd8 [0,0,0,0,0,0|4,0,0]=4 830 B11R0.148 CSCCNCCOCC(C)C 259f317a3bb3210246d2a871d8f6274b [0,0,0,0,0,0|4,0,0]=4 831 B11R0.148 CSCCOCCCCC(=O)C 47a2d2ae2f15bfafe11ae3359b2de694 [0,0,0,0,0,0|2,0,2]=4 832 B11R0.148 CSCCOCCCCC(=O)O f3fe1c8d2ae8384b166b285c6df10be0 [0,0,0,0,0,0|3,0,1]=4 833 B11R0.148 CSCCOCCCCC(C)C 1b0511152ce353affc4112f25b6376b9 [0,0,0,0,0,0|3,0,0]=3 834 B11R0.148 CSCCOCCCCN(C)C 99bccb29b462d5aa98965e2c015bdb9f [0,0,0,0,0,0|4,0,0]=4 835 B11R0.148 CSCCOCCCNC(C)C 8542517198876fe4eae1596b29c47aef [0,0,0,0,0,0|4,0,0]=4 836 B11R0.148 CSCCOCCCOC(C)C b507505008dc84fe7f27310739e897ba [0,0,0,0,0,0|4,0,0]=4 837 B11R0.148 CSCCOCCCSC(C)C 28568e54e7c4bd8ff90888d362b23380 [0,0,0,0,0,0|4,0,0]=4 838 B11R0.148 CSCCOCCOCC(C)C f475b135820adde764d5f2bb9071002d [0,0,0,0,0,0|4,0,0]=4 839 B11R0.148 CSCCOCCSCC(C)C 5e071c613ea7cdcbc924e2bf52c06ab8 [0,0,0,0,0,0|4,0,0]=4 840 B11R0.148 CSCNCCCCCC(=O)O 26d2736a3f2658d831b221671ef27c2e [0,0,0,0,0,0|3,0,1]=4 841 B11R0.148 CSCNCCCCCC(C)C faf111e751d55e92d2a3a4275925fd53 [0,0,0,0,0,0|3,0,0]=3 842 B11R0.148 CSCNCCCCCN(C)C c8decad4d122d12739b77ebc6024702e [0,0,0,0,0,0|4,0,0]=4 843 B11R0.148 CSCNCCCOCC(C)C 649914779cf8b2397f852c2e9981c1b8 [0,0,0,0,0,0|4,0,0]=4 844 B11R0.148 CSCOCCCCCC(=O)O 310637b1b9fac0b1bb35b90b669b7b82 [0,0,0,0,0,0|3,0,1]=4 845 B11R0.148 CSCOCCCCCC(C)C c3fbb65fd2da8d826531a0409c44715d [0,0,0,0,0,0|3,0,0]=3 846 B11R0.148 CSCOCCCCCN(C)C 2d592bdd4b327eba48206c1a4c081952 [0,0,0,0,0,0|4,0,0]=4 847 B11R0.148 CSCOCCCOCC(C)C 639754f836ff3cc7f79ea7c16c2ce5db [0,0,0,0,0,0|4,0,0]=4 848 B11R0.148 CSCOCCCSCC(C)C 6b046f4c54acdfeddb14fede192974e0 [0,0,0,0,0,0|4,0,0]=4 849 B11R0.148 C[C@@H](F)COCCCCCC#N 5d42306d967f2d8ba79d74094e25db2b [0,0,0,0,0,0|3,0,1]=4 850 B11R0.148 C[C@@H](F)COCCCCCC=O 01893d07cdcc356b608c250efa003230 [0,0,0,0,0,0|3,0,1]=4 851 B11R0.148 C[C@@H](F)COCCCCCCF 7195dd7a68df18d8e3cec33710e4d129 [0,0,0,0,0,0|3,0,0]=3 852 B11R0.148 C[C@@H](O)CCCCNCCC#N 5e174c8c9c40215fc83a4f8d86744618 [0,0,0,0,0,0|2,0,1]=3 853 B11R0.148 C[C@@H](O)CCCCNCCCCl f8189c1ec7c682797fb0ab04f549b79c [0,0,0,0,0,0|2,0,0]=2 854 B11R0.148 C[C@@H](O)CCCCNCCCO 783f0910fd9a7305a3b3999e4f1a242f [0,0,0,0,0,0|2,0,0]=2 855 B11R0.148 C[C@@H](O)CCCCNCCON bdc7a041bb2da65cc8d488bac6dcfa53 [0,0,0,0,0,0|3,0,0]=3 856 B11R0.148 C[C@@H](O)CCNCCCCC#N a096ad9aaa7c1e5767e81f99b747b020 [0,0,0,0,0,0|2,0,1]=3 857 B11R0.148 C[C@@H](O)CCNCCCCC=O 010600455d2ffa58130661d85aabd0c8 [0,0,0,0,0,0|2,0,1]=3 858 B11R0.148 C[C@@H](O)CCNCCCCCF 4838cef28426dd8ec31647e48b9e845e [0,0,0,0,0,0|2,0,0]=2 859 B11R0.148 C[C@@H](O)CCNCCCCCO b13471bd516df4bd2bedb25c936c8159 [0,0,0,0,0,0|2,0,0]=2 860 B11R0.148 C[C@@H](O)CCNCCCCON 5cb064d57326c46d61e071450b38cd7d [0,0,0,0,0,0|3,0,0]=3 861 B11R0.148 C[C@@H](O)CCNCCOCC#N f43095decee34913518a07d1e619d5ff [0,0,0,0,0,0|3,0,1]=4 862 B11R0.148 C[C@@H](O)CCNCCOCC=O be837c7f4f5af8faff78718e21ffb53e [0,0,0,0,0,0|3,0,1]=4 863 B11R0.148 C[C@@H](O)CCNCCOCCO 736ebd3d9bdefee303cab6b8f4a26bd1 [0,0,0,0,0,0|3,0,0]=3 864 B11R0.148 C[C@@H](O)CNCCCCCC#N 6a7ac328010b9a7e2619037fc91e4901 [0,0,0,0,0,0|2,0,1]=3 865 B11R0.148 C[C@@H](O)CNCCCCCC=O 056623fd9c29f8dba0cccf58483d1dfa [0,0,0,0,0,0|2,0,1]=3 866 B11R0.148 C[C@@H](O)CNCCCCCCCl 161f5eda601f36af3685ec75b9bde82e [0,0,0,0,0,0|2,0,0]=2 867 B11R0.148 C[C@@H](O)CNCCCCCCF ecc51158952d06574fe03a76865c685f [0,0,0,0,0,0|2,0,0]=2 868 B11R0.148 C[C@@H](O)CNCCCCCCO 2408f53f8ed8549405bf9c3a948ce3d5 [0,0,0,0,0,0|2,0,0]=2 869 B11R0.148 C[C@@H](O)CNCCCOCCO bba7a678bfbb947b45ae06ee4ce45bf0 [0,0,0,0,0,0|3,0,0]=3 870 B11R0.148 C[C@@H](O)CNCCOCCCO 2c512a09f77e8e7493f10c787df078de [0,0,0,0,0,0|3,0,0]=3 871 B11R0.148 C[C@@H](O)CNCCOCCON 95475e783662ec40cb869d2fbaf23d92 [0,0,0,0,0,0|4,0,0]=4 872 B11R0.148 C[C@@H](O)CNCCSSCCO 53f274c68490d90b33c236f60086af1e [0,0,0,0,0,0|4,0,0]=4 873 B11R0.148 C[C@H](F)COCCCCCC#N 12e116d394785811d860aaca19f0a083 [0,0,0,0,0,0|3,0,1]=4 874 B11R0.148 C[C@H](F)COCCCCCC=O 420497b4485d23ef8b3f67bd998e6490 [0,0,0,0,0,0|3,0,1]=4 875 B11R0.148 C[C@H](F)COCCCCCCF e547171252828af90962a1b6cb7d4a7e [0,0,0,0,0,0|3,0,0]=3 876 B11R0.148 C[C@H](O)CCNCCCCC#N 48f4614bdf7fd93fd73b4674631e59ab [0,0,0,0,0,0|2,0,1]=3 877 B11R0.148 C[C@H](O)CCNCCCCC=O ea5069562580d7a6455b26185c2a1881 [0,0,0,0,0,0|2,0,1]=3 878 B11R0.148 C[C@H](O)CCNCCCCCF 975ab0ec650e5067c586bb3c4060578e [0,0,0,0,0,0|2,0,0]=2 879 B11R0.148 C[C@H](O)CCNCCCCCO 42357ac6f4fcddf5586a4fd9971d1d01 [0,0,0,0,0,0|2,0,0]=2 880 B11R0.148 C[C@H](O)CCNCCCCON e6c038fd4ab26a49d97232bdedc3fa2e [0,0,0,0,0,0|3,0,0]=3 881 B11R0.148 C[C@H](O)CCNCCOCC#N 43374af82c9c3dc8d346eea6d3a85230 [0,0,0,0,0,0|3,0,1]=4 882 B11R0.148 C[C@H](O)CCNCCOCC=O 4ae9b22230d4a95b1914b9761cc3d8aa [0,0,0,0,0,0|3,0,1]=4 883 B11R0.148 C[C@H](O)CCNCCOCCO 19f2ccae32a8e333b05f6caf5f956828 [0,0,0,0,0,0|3,0,0]=3 884 B11R0.148 C[C@H](O)CNCCCCCC#N 1691b5e98aacde62b7ab66cc7ad57ba2 [0,0,0,0,0,0|2,0,1]=3 885 B11R0.148 C[C@H](O)CNCCCCCC=O 7416b0f1118c4cb76e304ddb613167d2 [0,0,0,0,0,0|2,0,1]=3 886 B11R0.148 C[C@H](O)CNCCCCCCCl 1d8263afe3616d65467e105439de38a2 [0,0,0,0,0,0|2,0,0]=2 887 B11R0.148 C[C@H](O)CNCCCCCCF bb876a35baaddf7c75c2f1cb4598af14 [0,0,0,0,0,0|2,0,0]=2 888 B11R0.148 C[C@H](O)CNCCCCCCO 643e793020ae7e33277250873fb00f80 [0,0,0,0,0,0|2,0,0]=2 889 B11R0.148 C[C@H](O)CNCCCOCCO 9a7e42c1e1cf8783777b4391bb9c665c [0,0,0,0,0,0|3,0,0]=3 890 B11R0.148 C[C@H](O)CNCCOCCCO f097330ec8ac3d1d46b84db900707875 [0,0,0,0,0,0|3,0,0]=3 891 B11R0.148 C[C@H](O)CNCCOCCON 02c1970cf8e1a655d6f5bea82c0f622c [0,0,0,0,0,0|4,0,0]=4 892 B11R0.148 C[C@H](O)CNCCSSCCO 14fb15fbb7bb794d1613e560b0d4cc16 [0,0,0,0,0,0|4,0,0]=4 893 B11R0.148 FC(F)CCCCCNCCI d81c4084fad9fce77f3e6a7da7a4305e [0,0,0,0,0,0|4,0,0]=4 894 B11R0.148 FC(F)CCCCCNCCS 4d34e383aeec2499b0d16f433e3e44cf [0,0,0,0,0,0|4,0,0]=4 895 B11R0.148 FC(F)CCCCCOCCS 7e9dfd4c7b359f674a23bbcbc3937f8d [0,0,0,0,0,0|4,0,0]=4 896 B11R0.148 FC(F)CCCCNCCCS 1ce470b93a579041fbda67567123d53c [0,0,0,0,0,0|4,0,0]=4 897 B11R0.148 FC(F)CNCCCCCCCl bb8ca9e60f1c940fcfe15d13ee4f067f [0,0,0,0,0,0|4,0,0]=4 898 B11R0.148 FC(F)COCCCCCCS 79e5899b40e2e3f0794a0dd3b1ff73e6 [0,0,0,0,0,0|4,0,0]=4 899 B11R0.148 FCCCCCCNCC(F)F de2059c078040f1895d2f897af8fc0da [0,0,0,0,0,0|4,0,0]=4 900 B11R0.148 FCCCCCCOCC(F)F b7bed8ac3c1943298b3c94d9a724bd64 [0,0,0,0,0,0|4,0,0]=4 901 B11R0.148 FCCCCCNCCC(F)F 4af6cfd566c7f9549b202f408b7d80d2 [0,0,0,0,0,0|4,0,0]=4 902 B11R0.148 FCCCCCOCCC(F)F 131f7c4c0f8f09ac2e1f50b832dce00e [0,0,0,0,0,0|4,0,0]=4 903 B11R0.148 FCCCNCCCCC(F)F 3871412aa4bdd01b328b2f84adb6628c [0,0,0,0,0,0|4,0,0]=4 904 B11R0.148 FCCNCCCCCC(F)F 36e6338aecc6a213898bcbd944e1df92 [0,0,0,0,0,0|4,0,0]=4 905 B11R0.148 FCCOCCCCCC(F)F eaf486787e9912f1f554b1d443d7581b [0,0,0,0,0,0|4,0,0]=4 906 B11R0.148 O=C(O)CCCCCCNCF f40d7d9383d25faaad314796ef21d5fa [0,0,0,0,0,0|3,0,1]=4 907 B11R0.148 O=C(O)CCCCCCNCO bb916ffc83ea8180940d031c988dc3e8 [0,0,0,0,0,0|3,0,1]=4 908 B11R0.148 O=C(O)CCCCCCOCF 34a8de1dbb8755f9b03d4a6b70818343 [0,0,0,0,0,0|3,0,1]=4 909 B11R0.148 O=C(O)CCCCCNCCF 2d0f7bc155a9f9712fc1930088d2f57c [0,0,0,0,0,0|3,0,1]=4 910 B11R0.148 O=C(O)CCCCCNCCI 62e1c302fb46da9866e1e9dc257f5926 [0,0,0,0,0,0|3,0,1]=4 911 B11R0.148 O=C(O)CCCCCNCCO 2f78bb25755cc91c2b83437fc93f8565 [0,0,0,0,0,0|3,0,1]=4 912 B11R0.148 O=C(O)CCCCCNCCS 55708f3b44e02e5d397a9462463fa60e [0,0,0,0,0,0|3,0,1]=4 913 B11R0.148 O=C(O)CCCCCOCCF c4ba4a4cd61bb822bfb7152b22c894c0 [0,0,0,0,0,0|3,0,1]=4 914 B11R0.148 O=C(O)CCCCCOCCS 54daf2b20e1360245c618c055d3b8324 [0,0,0,0,0,0|3,0,1]=4 915 B11R0.148 O=C(O)CCCCNCCCCl 7dfa60a025efa69ce573a4155dc51275 [0,0,0,0,0,0|3,0,1]=4 916 B11R0.148 O=C(O)CCCCNCCCF cb609b243fe2249daace5aa4fc3d5443 [0,0,0,0,0,0|3,0,1]=4 917 B11R0.148 O=C(O)CCCCNCCCO 9c5f1e63fc23fa4ad8947f4b10a88356 [0,0,0,0,0,0|3,0,1]=4 918 B11R0.148 O=C(O)CCCCNCCCS 63698fa0bee516f1b0a5a6380ce8c8b9 [0,0,0,0,0,0|3,0,1]=4 919 B11R0.148 O=C(O)CCCCOCCCF c73ed8d5d070d316525e192103423940 [0,0,0,0,0,0|3,0,1]=4 920 B11R0.148 O=C(O)CCCCOCCCS 5298991ccf9dc6658331de62de34a928 [0,0,0,0,0,0|3,0,1]=4 921 B11R0.148 O=C(O)CCCNCCCCF 827217bc28435a5b55a219e4b41c3d32 [0,0,0,0,0,0|3,0,1]=4 922 B11R0.148 O=C(O)CCCNCCCCO 3332bf77c04e3a57bcdc5c455290d6fd [0,0,0,0,0,0|3,0,1]=4 923 B11R0.148 O=C(O)CCCOCCCCF 3d954790f2241d94083a955977aa19c2 [0,0,0,0,0,0|3,0,1]=4 924 B11R0.148 O=C(O)CCNCCCCCCl d3a821819bcc60410809e4904f0f9898 [0,0,0,0,0,0|3,0,1]=4 925 B11R0.148 O=C(O)CCNCCCCCF 46c6006c92eb32a27375ce34a21f8d22 [0,0,0,0,0,0|3,0,1]=4 926 B11R0.148 O=C(O)CCNCCCCCO 5a39465ff3cd1d7a23960289cd66f619 [0,0,0,0,0,0|3,0,1]=4 927 B11R0.148 O=C(O)CCOCCCCCF fabc09b462bdbb3b3613f7ec1f025c51 [0,0,0,0,0,0|3,0,1]=4 928 B11R0.148 O=C(O)CNCCCCCCCl dc32a566986ba7b34107464790e296cc [0,0,0,0,0,0|3,0,1]=4 929 B11R0.148 O=C(O)CNCCCCCCF bce3f1514075f3d2f8204865ec56aef1 [0,0,0,0,0,0|3,0,1]=4 930 B11R0.148 O=C(O)CNCCCCCCO d2379b6809e52a0c5093502cf3d19ff8 [0,0,0,0,0,0|3,0,1]=4 931 B11R0.148 O=C(O)COCCCCCCF 225eb71627e39626696c7d9cbf9693d6 [0,0,0,0,0,0|3,0,1]=4 932 B11R0.148 O=C(O)COCCCCCCS af996bea4ab4a7edbee11c3b6236257b [0,0,0,0,0,0|3,0,1]=4 933 B11R0.148 O=S(O)CCNCCCCCF e366fcf006af824b57068d8d8720cc9a [0,0,0,0,0,0|4,0,0]=4 934 B11R0.148 O=S(O)CCNCCCCCO ce73a3e48c3c84c138670f327c38ec51 [0,0,0,0,0,0|4,0,0]=4 935 B11R0.148 O=S(O)COCCCCCCF 4e5af757d78c76381154134f13443755 [0,0,0,0,0,0|4,0,0]=4 936 B11R0.148 OCCCCCCNCC(F)F 94f179e8c06a88215ac9c67a44574988 [0,0,0,0,0,0|4,0,0]=4 937 B11R0.148 OCCCCCNCCC(F)F 2b107d4e3b46bd36ed1ce4f4813c19f9 [0,0,0,0,0,0|4,0,0]=4 938 B11R0.148 OCCCNCCCCC(F)F 307ab3e49724a3aa9b36496ea7316451 [0,0,0,0,0,0|4,0,0]=4 939 B11R0.148 OCCNCCCCCC(F)F 91996b5e6925422a1e493982ebd26d4e [0,0,0,0,0,0|4,0,0]=4 940 B10R0.4 C#CCCCCNCC(C)O 1466346bce68cb9a89cc30db4d1fadf9 [1,0,0,0,0,0|1,0,2]=4 941 B10R0.4 C#CCCCCNC[C@@H](C)O 8d84814399a90a1ba4bce2fe914788d2 [1,0,0,0,0,0|1,0,2]=4 942 B10R0.4 C#CCCCCNC[C@H](C)O e0b095cbbe52693d9ea2733b3e00072f [1,0,0,0,0,0|1,0,2]=4 943 B10R0.4 C#CCCCNCCC(C)O 8f47342c1b04162fa1720f16bcbed71d [1,0,0,0,0,0|1,0,2]=4 944 B10R0.4 C#CCCCNCC[C@@H](C)O 39c2f6ef13caa4085c2ad87f0864367a [1,0,0,0,0,0|1,0,2]=4 945 B10R0.4 C#CCCCNCC[C@H](C)O 195b6a75a294987039f9d18a74eee9df [1,0,0,0,0,0|1,0,2]=4 946 B10R0.4 C#CCCNCCCC(C)O a4be019bdc646dae4e2eba3791e8ec1c [1,0,0,0,0,0|1,0,2]=4 947 B10R0.4 C#CCNCCCCC(C)O 82f9ef0980ffdd7d2452dd9f81c6c18f [1,0,0,0,0,0|1,0,2]=4 948 B10R0.4 C#CCNCCCC[C@@H](C)O 5bb3c5b5074786e9abded082368567f6 [1,0,0,0,0,0|1,0,2]=4 949 B10R0.4 C/C=C\CCCNCC(C)O d7827ff21f2030c1af39f7fc2b495c8d [1,0,0,0,0,0|1,0,2]=4 950 B10R0.4 C/C=C\CCCNC[C@@H](C)O a3c75449988551d83a1034a8735dd9e5 [1,0,0,0,0,0|1,0,2]=4 951 B10R0.4 C/C=C\CCCNC[C@H](C)O fb56371a3a8fbb3dc92f896cbdd7937e [1,0,0,0,0,0|1,0,2]=4 952 B10R0.4 C=C(C)CCCNCCCC 10e9d5bc2148f814ac87779b16970bb2 [1,0,0,0,0,0|2,0,1]=4 953 B10R0.4 C=C(C)CCCOCCCC f556e23942a670bff2e32fedd43a44e3 [1,0,0,0,0,0|2,0,1]=4 954 B10R0.4 C=C(C)CCNCCCCC 6827c3721728b6bdd5fb962e657afed6 [1,0,0,0,0,0|2,0,1]=4 955 B10R0.4 C=C(C)CCOCCCCC bd422e129da3de0d5182ac59fdf2b775 [1,0,0,0,0,0|2,0,1]=4 956 B10R0.4 C=C(C)CNCCCCCC 57e2209f6875fc62d2bad933ad5990a8 [1,0,0,0,0,0|2,0,1]=4 957 B10R0.4 C=C(C)COCCCCCC 18580082a3e432d96826bd208c01f2c4 [1,0,0,0,0,0|2,0,1]=4 958 B10R0.4 C=CCCCCNCC(C)O 2e1199e38a10fb414efe9bfb0d6d755d [1,0,0,0,0,0|1,0,2]=4 959 B10R0.4 C=CCCCCNC[C@@H](C)O 2e3a337f6f68f0b08366ca477dff1d27 [1,0,0,0,0,0|1,0,2]=4 960 B10R0.4 C=CCCCCNC[C@H](C)O 6bdff9aa00d133d5185364b19ee91bd3 [1,0,0,0,0,0|1,0,2]=4 961 B10R0.4 C=CCCCNCCC(C)O e8bc08af6c121e2da8cb6fdb92c90759 [1,0,0,0,0,0|1,0,2]=4 962 B10R0.4 C=CCCCNCC[C@@H](C)O bccdf8bcf4a2299feb282b3afb3a1dca [1,0,0,0,0,0|1,0,2]=4 963 B10R0.4 C=CCCCNCC[C@H](C)O de3500b79a77b9846290d1b0dfa6333e [1,0,0,0,0,0|1,0,2]=4 964 B10R0.4 C=CCCNCCCC(C)O bc6faf9448115bb6b6ccb490e676e5bf [1,0,0,0,0,0|1,0,2]=4 965 B10R0.4 CC#CCCCNCC(C)O 7702504814f7edff728059c3eb0eb2dc [1,0,0,0,0,0|1,0,2]=4 966 B10R0.4 CC#CCCCNC[C@@H](C)O 175e65eb5c832468edc7768d72b7f5dc [1,0,0,0,0,0|1,0,2]=4 967 B10R0.4 CC#CCCCNC[C@H](C)O 0fe7291541896ace7c6963f82bcfbcb8 [1,0,0,0,0,0|1,0,2]=4 968 B10R0.4 CC#CCNCCCC(C)O f9bb7de5955464bdb7a3578275250947 [1,0,0,0,0,0|1,0,2]=4 969 B10R0.4 CC(C)CCCCCNCF 3746380c787c91d3238a683ee5a311d9 [1,0,0,0,0,0|3,0,0]=4 970 B10R0.4 CC(C)CCCCCNCO 5b099e310508ef1ecc4235c7485b4ac4 [1,0,0,0,0,0|3,0,0]=4 971 B10R0.4 CC(C)CCCCCOCF d85313f599d9d9fffded79153923f3d2 [1,0,0,0,0,0|3,0,0]=4 972 B10R0.4 CC(C)CCCCNCCBr ba86b8f55904f30ab4aed63df391b921 [1,0,0,0,0,0|3,0,0]=4 973 B10R0.4 CC(C)CCCCNCCF b214396653925997332c29c4c556f3b9 [1,0,0,0,0,0|3,0,0]=4 974 B10R0.4 CC(C)CCCCNCCI ba0d05bf9fa4b2329932b5181ae1508b [1,0,0,0,0,0|3,0,0]=4 975 B10R0.4 CC(C)CCCCNCCO c8a319f5c5223594dde8f805c0a27676 [1,0,0,0,0,0|3,0,0]=4 976 B10R0.4 CC(C)CCCCNCCS 88e7ec1a74165c1645d9c3f6b715d18d [1,0,0,0,0,0|3,0,0]=4 977 B10R0.4 CC(C)CCCCOCCF 3784da788f95a661a44c6c3924a92089 [1,0,0,0,0,0|3,0,0]=4 978 B10R0.4 CC(C)CCCCOCCS 92b82fb2c2bed3da0c1b8153f711adbf [1,0,0,0,0,0|3,0,0]=4 979 B10R0.4 CC(C)CCCNCCCCl 6c2281a4c40a355cb49bba5d50acc455 [1,0,0,0,0,0|3,0,0]=4 980 B10R0.4 CC(C)CCCNCCCF 19a9cfc5e38280a364d8c0e9e53a1423 [1,0,0,0,0,0|3,0,0]=4 981 B10R0.4 CC(C)CCCNCCCO eeb0ca79d84d6625d506ca34a673132c [1,0,0,0,0,0|3,0,0]=4 982 B10R0.4 CC(C)CCCNCCCS 96a91ec1f2d089739b4e3c91fc10871f [1,0,0,0,0,0|3,0,0]=4 983 B10R0.4 CC(C)CCCOCCCF 32842131dd4e6bae299a603c9aafafad [1,0,0,0,0,0|3,0,0]=4 984 B10R0.4 CC(C)CCCOCCCS 472aca12f415ca7a7f3024c60328c53c [1,0,0,0,0,0|3,0,0]=4 985 B10R0.4 CC(C)CCNCCCCCl a0bfeb808c69c5fb233e14b27f25bd61 [1,0,0,0,0,0|3,0,0]=4 986 B10R0.4 CC(C)CCNCCCCF 9f958522557d9264029fdac8096162f9 [1,0,0,0,0,0|3,0,0]=4 987 B10R0.4 CC(C)CCNCCCCO 71fbd2989259325f3110820709fb8e95 [1,0,0,0,0,0|3,0,0]=4 988 B10R0.4 CC(C)CCNCCCCS 88258554fcb471105958a571b73dd041 [1,0,0,0,0,0|3,0,0]=4 989 B10R0.4 CC(C)CCOCCCCF 3de101a4d68eb0f151adfa8c068bf273 [1,0,0,0,0,0|3,0,0]=4 990 B10R0.4 CC(C)CCOCCCCS 17e650b4a93e3864db53ab282168911c [1,0,0,0,0,0|3,0,0]=4 991 B10R0.4 CC(C)CNCCCCCCl 3d2e4da5fab45ced1576c5ea6ab53150 [1,0,0,0,0,0|3,0,0]=4 992 B10R0.4 CC(C)CNCCCCCF dcc8ed10c7fa71263a485a38001d8bdc [1,0,0,0,0,0|3,0,0]=4 993 B10R0.4 CC(C)CNCCCCCO d1a8d1a8e5fe429098f5d0a3be0cecd4 [1,0,0,0,0,0|3,0,0]=4 994 B10R0.4 CC(C)COCCCCCF eb745bae9696944320ec2014e01d309a [1,0,0,0,0,0|3,0,0]=4 995 B10R0.4 CC(C)NCCCCCCCl 7349305daff8dbfc9a56a98f676939d1 [1,0,0,0,0,0|3,0,0]=4 996 B10R0.4 CC(C)NCCCCCCO 793bbf69ef5197e3627d029883605ec8 [1,0,0,0,0,0|3,0,0]=4 997 B10R0.4 CC(C)OCCCCCCF 88673863d6e758cd91e41315166c3cb6 [1,0,0,0,0,0|3,0,0]=4 998 B10R0.4 CC(C)OCCCCCCS ab6146c30514ddd5b8724827f23a3953 [1,0,0,0,0,0|3,0,0]=4 999 B10R0.4 CC(F)COCCCCCF df62180cf6e58bb955511b8b02e85d33 [1,0,0,0,0,0|3,0,0]=4 1000 B10R0.4 CC(O)CCCCNCC#N 26ee683a62caaf4b4d458496bec14c1e [1,0,0,0,0,0|2,0,1]=4 1001 B10R0.4 CC(O)CCCCNCCBr 082aa61a43b4ae24e97dc8dc27e0617b [1,0,0,0,0,0|2,0,0]=3 1002 B10R0.4 CC(O)CCCCNCCF fcad69d23d8f8b6d73e8fe73ecadf10d [1,0,0,0,0,0|2,0,0]=3 1003 B10R0.4 CC(O)CCCCNCCI 09c72fb600d7103fca29c52ed7574123 [1,0,0,0,0,0|2,0,0]=3 1004 B10R0.4 CC(O)CCCCNCCO 96ac3f35be2ba96964968bf323d9528d [1,0,0,0,0,0|2,0,0]=3 1005 B10R0.4 CC(O)CCCCNCCS 59ba7dabda2b2948401e41a344a5416c [1,0,0,0,0,0|2,0,0]=3 1006 B10R0.4 CC(O)CCCNCCC#N c83e14a8fba729d03fa2d05031f57de3 [1,0,0,0,0,0|2,0,1]=4 1007 B10R0.4 CC(O)CCCNCCCCl 9c73c18991be2cecb23fd6845fd71184 [1,0,0,0,0,0|2,0,0]=3 1008 B10R0.4 CC(O)CCCNCCCO 241e3e1148b49054f259a4ddacea48eb [1,0,0,0,0,0|2,0,0]=3 1009 B10R0.4 CC(O)CCCNCCON 1ecee827c8cde4e6c14128eb50d6789e [1,0,0,0,0,0|3,0,0]=4 1010 B10R0.4 CC(O)CCNCCCC#N 0d6d1d1d63a255981193fb50ca20e35d [1,0,0,0,0,0|2,0,1]=4 1011 B10R0.4 CC(O)CCNCCCC=O 7500c054765207ac380080e77680f394 [1,0,0,0,0,0|2,0,1]=4 1012 B10R0.4 CC(O)CCNCCCCCl 012cc92abe043a1075336b235b2541f8 [1,0,0,0,0,0|2,0,0]=3 1013 B10R0.4 CC(O)CCNCCCCF f1a44121d0a1c93486e40096f2c41443 [1,0,0,0,0,0|2,0,0]=3 1014 B10R0.4 CC(O)CCNCCCCO b59c8b3cfc77a09216e14ef55d7f056e [1,0,0,0,0,0|2,0,0]=3 1015 B10R0.4 CC(O)CCNCCCCS a99e8933301e024e39186feb2449ca31 [1,0,0,0,0,0|2,0,0]=3 1016 B10R0.4 CC(O)CNCCCCC#N 8fd8a3c93b63647c649104db9e7993c7 [1,0,0,0,0,0|2,0,1]=4 1017 B10R0.4 CC(O)CNCCCCC=O e5927c4b48cfac4bd9dc050ab33d2d1a [1,0,0,0,0,0|2,0,1]=4 1018 B10R0.4 CC(O)CNCCCCCCl 24183013a514e071995d76af67113767 [1,0,0,0,0,0|2,0,0]=3 1019 B10R0.4 CC(O)CNCCCCCF 3dc2b7902c178afc86e568248171ebbe [1,0,0,0,0,0|2,0,0]=3 1020 B10R0.4 CC(O)CNCCCCCO 5cbb8fc264125b25339100f6507f43cc [1,0,0,0,0,0|2,0,0]=3 1021 B10R0.4 CC(O)CNCCCCON 67db01ad337e71c8e7df079258251ef6 [1,0,0,0,0,0|3,0,0]=4 1022 B10R0.4 CC(O)CNCCOCCO 6b49125ff519e264d36d06898d268beb [1,0,0,0,0,0|3,0,0]=4 1023 B10R0.4 CC(O)CNCCOCCS 0d1bf18cd2c1d49a398a820e86cabb9c [1,0,0,0,0,0|3,0,0]=4 1024 B10R0.4 CC(O)CNCCSCCO ae24521ead4b839368617b04d2b2a4e5 [1,0,0,0,0,0|3,0,0]=4 1025 B10R0.4 CC(S)COCCCCCF 12cc684406b8652f26ec730a9d08d8c0 [1,0,0,0,0,0|2,1,0]=4 1026 B10R0.4 CC/C=C/CNCCC(C)O 19fc2e557c2e68b8328150d4367a9e17 [1,0,0,0,0,0|1,0,2]=4 1027 B10R0.4 CC/C=C/CNCC[C@@H](C)O f5efa5365c30802ead22bd2ad334889a [1,0,0,0,0,0|1,0,2]=4 1028 B10R0.4 CC/C=C/CNCC[C@H](C)O 92b6206a6024aecd21b4b42a0fb61f02 [1,0,0,0,0,0|1,0,2]=4 1029 B10R0.4 CC/C=C\CCNCC(C)O 09de50bcb200ab4c2da824b688e8d6cf [1,0,0,0,0,0|1,0,2]=4 1030 B10R0.4 CC/C=C\CCNC[C@@H](C)O 14a326a33b11a1ad77f62297eaa8e3a1 [1,0,0,0,0,0|1,0,2]=4 1031 B10R0.4 CC/C=C\CCNC[C@H](C)O 885b5fbf86635a6c1613673b6fb7e03c [1,0,0,0,0,0|1,0,2]=4 1032 B10R0.4 CC=CCNCCCC(C)O 7d9efee94ec02dcbd0cb83703dda5dcc [1,0,0,0,0,0|1,0,2]=4 1033 B10R0.4 CCC#CCNCCC(C)O c0998a5868f82bc6e6b4ca9fbcf8fc6f [1,0,0,0,0,0|1,0,2]=4 1034 B10R0.4 CCC#CCNCC[C@@H](C)O 0fe463ed42d08d6d1d5424362eee3134 [1,0,0,0,0,0|1,0,2]=4 1035 B10R0.4 CCC#CCNCC[C@H](C)O 7f0526c93846760efbfed19fc26e33a6 [1,0,0,0,0,0|1,0,2]=4 1036 B10R0.4 CCC/C=C/CNCC(C)O 88f4b9025d580f29c24456f15851a0eb [1,0,0,0,0,0|1,0,2]=4 1037 B10R0.4 CCC/C=C/CNC[C@@H](C)O 90fe731cc95a1bb87094f7ebc8d7568b [1,0,0,0,0,0|1,0,2]=4 1038 B10R0.4 CCC/C=C/CNC[C@H](C)O e0cd0f48aaec74442b1334061bd158b2 [1,0,0,0,0,0|1,0,2]=4 1039 B10R0.4 CCC/C=C\CNCC(C)O 96b16a03c90d480780a847b4ffde19d9 [1,0,0,0,0,0|1,0,2]=4 1040 B10R0.4 CCC/C=C\CNC[C@@H](C)O 375a19b3c5843ff281c17a4b98513e64 [1,0,0,0,0,0|1,0,2]=4 1041 B10R0.4 CCC/C=C\CNC[C@H](C)O 969752c5358585189315eeb63e6fb388 [1,0,0,0,0,0|1,0,2]=4 1042 B10R0.4 CCCCCCCNC(=O)C 7ff946498704aad8136855c3c0214f94 [1,0,0,0,0,0|1,0,2]=4 1043 B10R0.4 CCCCCCCNC(C)C 4c96ea7e499316e0ee9e00c46c63a3c1 [1,0,0,0,0,0|2,0,0]=3 1044 B10R0.4 CCCCCCCOC(C)C 27a0a967f36a71c677ab3969b10f24e8 [1,0,0,0,0,0|2,0,0]=3 1045 B10R0.4 CCCCCCNCC(=O)C e3842b8fd2cae14899e78886113beba0 [1,0,0,0,0,0|1,0,2]=4 1046 B10R0.4 CCCCCCNCC(=O)O fb02da52628d24bba2741502ccbc57e6 [1,0,0,0,0,0|2,0,1]=4 1047 B10R0.4 CCCCCCNCC(C)C 1a2401845907eef233dd59227daa3a68 [1,0,0,0,0,0|2,0,0]=3 1048 B10R0.4 CCCCCCNCC(C)O ecfd31bbb27d5c1b28261e6fc506454e [1,0,0,0,0,0|1,0,0]=2 1049 B10R0.4 CCCCCCNCC(F)F 51de30cede759daf5c5775a3c38fc031 [1,0,0,0,0,0|3,0,0]=4 1050 B10R0.4 CCCCCCNCN(C)C 26324c882932f0cac86240d88ad97394 [1,0,0,0,0,0|3,0,0]=4 1051 B10R0.4 CCCCCCNC[C@@H](C)O a3e47df10174193eaf313b4168d20a56 [1,0,0,0,0,0|1,0,0]=2 1052 B10R0.4 CCCCCCNC[C@H](C)O 2eab26b642fa93ab5109cc9827db8367 [1,0,0,0,0,0|1,0,0]=2 1053 B10R0.4 CCCCCCOCC(=O)C c622979e72a3edd318802db3f6123eee [1,0,0,0,0,0|1,0,2]=4 1054 B10R0.4 CCCCCCOCC(=O)O d5f902343f3fbf5baaa362a21e128151 [1,0,0,0,0,0|2,0,1]=4 1055 B10R0.4 CCCCCCOCC(C)C b37c8621ec273a7e26019a803a340e20 [1,0,0,0,0,0|2,0,0]=3 1056 B10R0.4 CCCCCCOCC(C)F dd97ca256682a6fda25577541eecbd12 [1,0,0,0,0,0|2,0,0]=3 1057 B10R0.4 CCCCCCOCC(C)S acb8c91dce03e86d867592ce1fe72f17 [1,0,0,0,0,0|1,1,0]=3 1058 B10R0.4 CCCCCCOCC(F)F a26442e14ba2eb739a794efc864e9e28 [1,0,0,0,0,0|3,0,0]=4 1059 B10R0.4 CCCCCCOCN(C)C fae992de96d645d231407619a49196c0 [1,0,0,0,0,0|3,0,0]=4 1060 B10R0.4 CCCCCCOCS(=O)O 2b6780218bd3498af4d92344e34b6465 [1,0,0,0,0,0|3,0,0]=4 1061 B10R0.4 CCCCCCOC[C@@H](C)F 1f30b59f94e8f4e91c0bf18fdb80d473 [1,0,0,0,0,0|2,0,0]=3 1062 B10R0.4 CCCCCCOC[C@H](C)F 3be682a709018eb770bbeb667cf57929 [1,0,0,0,0,0|2,0,0]=3 1063 B10R0.4 CCCCCNCCC(=O)C 2bb7295af3afb64defefb63687bea421 [1,0,0,0,0,0|1,0,2]=4 1064 B10R0.4 CCCCCNCCC(=O)O c651e7e992c1332ced5d27852e6267f0 [1,0,0,0,0,0|2,0,1]=4 1065 B10R0.4 CCCCCNCCC(C)C 2083eb70c05c1741486a9f522b36bddf [1,0,0,0,0,0|2,0,0]=3 1066 B10R0.4 CCCCCNCCC(C)O 4e6a420569190052d94ccc1ca80cf85c [1,0,0,0,0,0|1,0,0]=2 1067 B10R0.4 CCCCCNCCC(F)F 2f119b6c8f73dfa1dd588f26a6cdc939 [1,0,0,0,0,0|3,0,0]=4 1068 B10R0.4 CCCCCNCCN(C)C d883db9ee430a1f80a9c4d5349cbc7d7 [1,0,0,0,0,0|3,0,0]=4 1069 B10R0.4 CCCCCNCCS(=O)C 889c2eb0c8cfc530bc8152471af86a27 [1,0,0,0,0,0|2,0,1]=4 1070 B10R0.4 CCCCCNCCS(=O)O 40a9496c737aacfd55e5b85a03b28772 [1,0,0,0,0,0|3,0,0]=4 1071 B10R0.4 CCCCCNCC[C@@H](C)O 3f00e28351ebf7b139dd29392d26fe0f [1,0,0,0,0,0|1,0,0]=2 1072 B10R0.4 CCCCCNCC[C@H](C)O 38a781c8f9bc47db57981751900f43d6 [1,0,0,0,0,0|1,0,0]=2 1073 B10R0.4 CCCCCNCOC(C)C 1fe408833fe67caa85eb8f7e5ee02e44 [1,0,0,0,0,0|3,0,0]=4 1074 B10R0.4 CCCCCOCCC(=O)C 7d336bbb7dc5619074d320d9d5eeebd1 [1,0,0,0,0,0|1,0,2]=4 1075 B10R0.4 CCCCCOCCC(=O)O 183ac3fdf6b059104c4c0237bab12aa8 [1,0,0,0,0,0|2,0,1]=4 1076 B10R0.4 CCCCCOCCC(C)C 1aa9f5e40c826e008fbbf8f79c7f1fea [1,0,0,0,0,0|2,0,0]=3 1077 B10R0.4 CCCCCOCCC(F)F 8d7e702fe2461f122e465b548868eb7b [1,0,0,0,0,0|3,0,0]=4 1078 B10R0.4 CCCCCOCCN(C)C 316463ff546cb9d7401f931a893e13eb [1,0,0,0,0,0|3,0,0]=4 1079 B10R0.4 CCCCCOCCS(=O)C 3d066bbbe37fbbf288a2e425fa4215eb [1,0,0,0,0,0|2,0,1]=4 1080 B10R0.4 CCCCCOCOC(C)C 1441e4efb031c4107c38c6573e1ecab4 [1,0,0,0,0,0|3,0,0]=4 1081 B10R0.4 CCCCNCCCC(=O)C a2bda33665ed49237506dfdf7a5fb684 [1,0,0,0,0,0|1,0,2]=4 1082 B10R0.4 CCCCNCCCC(=O)O 638f7b21d5bd5641b607514c8fb8caf4 [1,0,0,0,0,0|2,0,1]=4 1083 B10R0.4 CCCCNCCCC(C)C 1e31d9dbabf6be9187dab46866ffb34e [1,0,0,0,0,0|2,0,0]=3 1084 B10R0.4 CCCCNCCCC(C)O e267dad3accc230faa3bc9e16d970474 [1,0,0,0,0,0|1,0,0]=2 1085 B10R0.4 CCCCNCCCN(C)C a9ece33d88b6945bef9242ad3211e89b [1,0,0,0,0,0|3,0,0]=4 1086 B10R0.4 CCCCNCCCS(=O)C 362c770b2b09d0f84e497dc89cd0ad5b [1,0,0,0,0,0|2,0,1]=4 1087 B10R0.4 CCCCNCCOC(C)C e7d670cad337283426b742bab6f47ebd [1,0,0,0,0,0|3,0,0]=4 1088 B10R0.4 CCCCNCCSC(C)C 07f15c97252f9d8b25969fa93a0d2199 [1,0,0,0,0,0|3,0,0]=4 1089 B10R0.4 CCCCOCCCC(=O)C f0df1029dafc15690be3f3c094f0ad8e [1,0,0,0,0,0|1,0,2]=4 1090 B10R0.4 CCCCOCCCC(C)C eabf9177db773ec6de5ecc0edcb5d082 [1,0,0,0,0,0|2,0,0]=3 1091 B10R0.4 CCCCOCCCN(C)C 3d03ebce4d0f7c18096b62da2a143ba7 [1,0,0,0,0,0|3,0,0]=4 1092 B10R0.4 CCCCOCCNC(C)C d43b4651be436e7a18a143ea0db5475c [1,0,0,0,0,0|3,0,0]=4 1093 B10R0.4 CCCCOCCOC(C)C 86aa7c8545daae2de2013b50e7e899da [1,0,0,0,0,0|3,0,0]=4 1094 B10R0.4 CCCCOCCSC(C)C 86724aa57c48003152df231ad69710c4 [1,0,0,0,0,0|3,0,0]=4 1095 B10R0.4 CCCCOCNCC(C)C fbf0edd18161c9cbcdf7d0b248f3b74c [1,0,0,0,0,0|3,0,0]=4 1096 B10R0.4 CCCCOCNCC(C)O e801f8fbb8dbf94952cf78a13997aeca [1,0,0,0,0,0|2,0,0]=3 1097 B10R0.4 CCCCOCNC[C@@H](C)O 21eb3572cca9b48817c622887eeb3000 [1,0,0,0,0,0|2,0,0]=3 1098 B10R0.4 CCCCOCNC[C@H](C)O 06bdb6bf0acd2ace0c8a3b2a16d610e6 [1,0,0,0,0,0|2,0,0]=3 1099 B10R0.4 CCCCOCOCC(C)C f76cb4f3e2df2a6ccb3df0291b6aa825 [1,0,0,0,0,0|3,0,0]=4 1100 B10R0.4 CCCCOCOCC(C)F cd34d4b694e2051b6a8d4e0268bbc610 [1,0,0,0,0,0|3,0,0]=4 1101 B10R0.4 CCCCOCOCC(C)S f3aaffcd03310a3e20b7d2fe1264264b [1,0,0,0,0,0|2,1,0]=4 1102 B10R0.4 CCCCOCOC[C@@H](C)F ee6e73d719ed609d566c2bfe17d34d6e [1,0,0,0,0,0|3,0,0]=4 1103 B10R0.4 CCCCOCOC[C@H](C)F be928def4baac0f42dbb5257ad9f3746 [1,0,0,0,0,0|3,0,0]=4 1104 B10R0.4 CCCCSCCOC(C)C 2d09dea5ad4f2cd6b2de74e421c7a597 [1,0,0,0,0,0|3,0,0]=4 1105 B10R0.4 CCCNCCCCC(=O)C ab2c95adbd41ecce6f11ada83f1aa463 [1,0,0,0,0,0|1,0,2]=4 1106 B10R0.4 CCCNCCCCC(=O)O d7ced2df62e692539bca6ff33ab8a797 [1,0,0,0,0,0|2,0,1]=4 1107 B10R0.4 CCCNCCCCC(C)C f22e74f3c92982d86e30c1bb0f3509d3 [1,0,0,0,0,0|2,0,0]=3 1108 B10R0.4 CCCNCCCCC(C)O 2f69e7bc2a7ca500502a3e5f1c138b9b [1,0,0,0,0,0|1,0,0]=2 1109 B10R0.4 CCCNCCCCC(F)F f74b67ced21d59e110d7cf2236c9ab87 [1,0,0,0,0,0|3,0,0]=4 1110 B10R0.4 CCCNCCCCN(C)C b1a24a72e2d949934a5a6300b3a57bac [1,0,0,0,0,0|3,0,0]=4 1111 B10R0.4 CCCNCCCC[C@@H](C)O 6ce0e83e6e0d1b17039df927d769e87a [1,0,0,0,0,0|1,0,0]=2 1112 B10R0.4 CCCNCCCOC(C)C 4d860087ee5c767e715f628614b37300 [1,0,0,0,0,0|3,0,0]=4 1113 B10R0.4 CCCNCCCSC(C)C 3033d3fec1c71a1ec80a5bfa5c133572 [1,0,0,0,0,0|3,0,0]=4 1114 B10R0.4 CCCNCCOCC(C)C 938166f9aa8fdbc9fe303167e2e6357b [1,0,0,0,0,0|3,0,0]=4 1115 B10R0.4 CCCOCCCCC(=O)C fd3e516a01dea40bc28ef8e85abe7b9e [1,0,0,0,0,0|1,0,2]=4 1116 B10R0.4 CCCOCCCCC(=O)O b2ac1b83aca818e80a2df2f954405a9e [1,0,0,0,0,0|2,0,1]=4 1117 B10R0.4 CCCOCCCCC(C)C f86f1fee85db6c4439132050b4d45955 [1,0,0,0,0,0|2,0,0]=3 1118 B10R0.4 CCCOCCCCN(C)C f4bdce3025f9c0207403b9cfca0595af [1,0,0,0,0,0|3,0,0]=4 1119 B10R0.4 CCCOCCCNC(C)C 97e56004124f9f1be06a97e18672fb78 [1,0,0,0,0,0|3,0,0]=4 1120 B10R0.4 CCCOCCCOC(C)C 2860ba23bdd84f5d06b46ebf59935d79 [1,0,0,0,0,0|3,0,0]=4 1121 B10R0.4 CCCOCCCSC(C)C 45346ea51d981b2ef27e08d1180f96de [1,0,0,0,0,0|3,0,0]=4 1122 B10R0.4 CCCOCCNCC(C)C 5cd8f594d4236b2933fb695322356b2b [1,0,0,0,0,0|3,0,0]=4 1123 B10R0.4 CCCOCCNCC(C)O 883d1c984751dd118682e5292e4351b5 [1,0,0,0,0,0|2,0,0]=3 1124 B10R0.4 CCCOCCNC[C@@H](C)O 7e13fb025234b05ec2b8676f9c175057 [1,0,0,0,0,0|2,0,0]=3 1125 B10R0.4 CCCOCCNC[C@H](C)O c006c7951defa00f65e2f537374c008d [1,0,0,0,0,0|2,0,0]=3 1126 B10R0.4 CCCOCCOCC(C)C 67c7770602d90fbcb32b20089a953d09 [1,0,0,0,0,0|3,0,0]=4 1127 B10R0.4 CCCOCCOCC(C)F cfc2983fd18123640a563bc92095b11d [1,0,0,0,0,0|3,0,0]=4 1128 B10R0.4 CCCOCCOCC(C)S d255ac834fb3a033a043452b1e619ed0 [1,0,0,0,0,0|2,1,0]=4 1129 B10R0.4 CCCOCCOC[C@@H](C)F a517ceaea4e9109b99bd2e289a3b2e71 [1,0,0,0,0,0|3,0,0]=4 1130 B10R0.4 CCCOCCOC[C@H](C)F 6f3499fb7fa388136022b24ac53a6afd [1,0,0,0,0,0|3,0,0]=4 1131 B10R0.4 CCCOCCSCC(C)C 6cc0266074462b6f0c3a9145b885dd2e [1,0,0,0,0,0|3,0,0]=4 1132 B10R0.4 CCCSCCOCC(C)C 9f141e56f84160364ae0d8e664cb2e31 [1,0,0,0,0,0|3,0,0]=4 1133 B10R0.4 CCNCCCCCC(=O)O 656d004177b3de742f8798a032b0925d [1,0,0,0,0,0|2,0,1]=4 1134 B10R0.4 CCNCCCCCC(C)C 44d0ce1c493c68ed6f77d5a4ff674f45 [1,0,0,0,0,0|2,0,0]=3 1135 B10R0.4 CCNCCCCCN(C)C 9002eb7272027465e16e9a532a042d29 [1,0,0,0,0,0|3,0,0]=4 1136 B10R0.4 CCNCCCOCC(C)C 6c8467724d7ecadfe1405a3ac9f7a881 [1,0,0,0,0,0|3,0,0]=4 1137 B10R0.4 CCOCCCCCC(=O)O 8d0433351c28cc9400e6f6da602a903d [1,0,0,0,0,0|2,0,1]=4 1138 B10R0.4 CCOCCCCCC(C)C 4039d0e82f922e3764f8c5fcab65c456 [1,0,0,0,0,0|2,0,0]=3 1139 B10R0.4 CCOCCCCCN(C)C bbc35baeface79058032b4135cdd3719 [1,0,0,0,0,0|3,0,0]=4 1140 B10R0.4 CCOCCCNCC(C)C 4269b714007b8c9058a682bdadf364dd [1,0,0,0,0,0|3,0,0]=4 1141 B10R0.4 CCOCCCNCC(C)O ad4a068b99e57be5377ca0ec04f2bcfa [1,0,0,0,0,0|2,0,0]=3 1142 B10R0.4 CCOCCCNC[C@@H](C)O 9688c5af15787a17cb5b63018c5524b6 [1,0,0,0,0,0|2,0,0]=3 1143 B10R0.4 CCOCCCNC[C@H](C)O fdd8bce48032164768af5e2352b4e1a9 [1,0,0,0,0,0|2,0,0]=3 1144 B10R0.4 CCOCCCOCC(C)C 56e31891ef7e15ae36db42adbc2077be [1,0,0,0,0,0|3,0,0]=4 1145 B10R0.4 CCOCCCOCC(C)F cd32349fe9f84c11ac6301a75c07df26 [1,0,0,0,0,0|3,0,0]=4 1146 B10R0.4 CCOCCCOCC(C)S 79443915a3e4768d20a4312454101e5a [1,0,0,0,0,0|2,1,0]=4 1147 B10R0.4 CCOCCCOC[C@@H](C)F 6279e74916573b81c5247ec843fe4cc3 [1,0,0,0,0,0|3,0,0]=4 1148 B10R0.4 CCOCCCOC[C@H](C)F b2cf87d4b642b0d91f36a57096268de1 [1,0,0,0,0,0|3,0,0]=4 1149 B10R0.4 CCOCCCSCC(C)C 2ea844d2705023a5bc3ff7e9b984d2e6 [1,0,0,0,0,0|3,0,0]=4 1150 B10R0.4 CCOCCNCCC(C)C 89a89ee936386f8d93b64a4e8411993c [1,0,0,0,0,0|3,0,0]=4 1151 B10R0.4 CCOCCNCCC(C)O b390a94d6125fd156f49fd0f55a910b8 [1,0,0,0,0,0|2,0,0]=3 1152 B10R0.4 CCOCCNCC[C@@H](C)O c98bb3460e7f453f9bdc14bd282e9c29 [1,0,0,0,0,0|2,0,0]=3 1153 B10R0.4 CCOCCNCC[C@H](C)O 93fea68d3ef31be98140e19b8692c68e [1,0,0,0,0,0|2,0,0]=3 1154 B10R0.4 CCOCCOCCC(C)C 923678b55c863171c27f9a49a36aeadc [1,0,0,0,0,0|3,0,0]=4 1155 B10R0.4 CCOCNCCCC(C)C 5e6ec9efde5f0f0855d1731dee5f52d6 [1,0,0,0,0,0|3,0,0]=4 1156 B10R0.4 CCOCOCCCC(C)C 1dba96d729202cea16ab703ee03cbd52 [1,0,0,0,0,0|3,0,0]=4 1157 B10R0.4 CCSCCCCNC(C)C 789b31c819ec6dbddad03b53aebd3b09 [1,0,0,0,0,0|3,0,0]=4 1158 B10R0.4 CCSCCCNCC(C)C 01d87973c6ad1a0769f6130a716f5b31 [1,0,0,0,0,0|3,0,0]=4 1159 B10R0.4 CCSCCCNCC(C)O 2ae047b03815bd8fa410b8cc27ffa5ec [1,0,0,0,0,0|2,0,0]=3 1160 B10R0.4 CCSCCCNC[C@@H](C)O eafaa085e66682b9ccc3dab441e2baba [1,0,0,0,0,0|2,0,0]=3 1161 B10R0.4 CCSCCCNC[C@H](C)O 9ef3d1db1f4c349ed8fdbbe7059f56e4 [1,0,0,0,0,0|2,0,0]=3 1162 B10R0.4 CCSCCCOCC(C)C c0db432965e6890593632b0efe05af39 [1,0,0,0,0,0|3,0,0]=4 1163 B10R0.4 CCSCCCOCC(C)F fafb7da3a94dbe4c492c6db9fc235251 [1,0,0,0,0,0|3,0,0]=4 1164 B10R0.4 CCSCCCOCC(C)S 36a88913b0cab40cd5908dbbe0b7763a [1,0,0,0,0,0|2,1,0]=4 1165 B10R0.4 CCSCCCOC[C@@H](C)F 60e1a8cab0f601a797d3012c0e10cd5f [1,0,0,0,0,0|3,0,0]=4 1166 B10R0.4 CCSCCCOC[C@H](C)F dce8a1d4b438e48958f6e707558d2643 [1,0,0,0,0,0|3,0,0]=4 1167 B10R0.4 CCSCCNCCC(C)C 699cf399b127d79c3e2fd6113aa6861f [1,0,0,0,0,0|3,0,0]=4 1168 B10R0.4 CCSCCNCCC(C)O 18725e6afa4659f729f9a504bad949a6 [1,0,0,0,0,0|2,0,0]=3 1169 B10R0.4 CCSCCNCC[C@@H](C)O a9990d55afb50c01e3334e3bb8a1bea8 [1,0,0,0,0,0|2,0,0]=3 1170 B10R0.4 CCSCCNCC[C@H](C)O a180e4faae517b27311900944a178843 [1,0,0,0,0,0|2,0,0]=3 1171 B10R0.4 CCSCCOCCC(C)C 4a2dd077b692621b2f0216e08aa23d96 [1,0,0,0,0,0|3,0,0]=4 1172 B10R0.4 COCCCCCNC(C)C 033d1b8529bdb793699a87ba638c4c6b [1,0,0,0,0,0|3,0,0]=4 1173 B10R0.4 COCCCCCOC(C)C c14688ef54b6631ecbfbde98ec8209c7 [1,0,0,0,0,0|3,0,0]=4 1174 B10R0.4 COCCCCNCC(C)C 77368a325f379fac5573b7f5fcb384ef [1,0,0,0,0,0|3,0,0]=4 1175 B10R0.4 COCCCCNCC(C)O 1ddb5560abf61a36272459c1e1e06c1f [1,0,0,0,0,0|2,0,0]=3 1176 B10R0.4 COCCCCNC[C@@H](C)O a10c2f65db665caef5a13399777e34d0 [1,0,0,0,0,0|2,0,0]=3 1177 B10R0.4 COCCCCNC[C@H](C)O 1c02f8d0bb6f8040f694605d637e737b [1,0,0,0,0,0|2,0,0]=3 1178 B10R0.4 COCCCCOCC(C)C ad3e80d1de064622463e513eddb48a26 [1,0,0,0,0,0|3,0,0]=4 1179 B10R0.4 COCCCCOCC(C)F 713753f7a6230c0bd0f60ff71ea383fe [1,0,0,0,0,0|3,0,0]=4 1180 B10R0.4 COCCCCOCC(C)S d091e2baee47124e0f0060765f3393a4 [1,0,0,0,0,0|2,1,0]=4 1181 B10R0.4 COCCCCOC[C@@H](C)F 63bd4b4a19a2d43f3b516101bd7efb22 [1,0,0,0,0,0|3,0,0]=4 1182 B10R0.4 COCCCCOC[C@H](C)F 8bd81dcb53b09cb232a51232163ccbb2 [1,0,0,0,0,0|3,0,0]=4 1183 B10R0.4 COCCCNCCC(C)C d15c43a39d942fe7ac9ee01fb82391ee [1,0,0,0,0,0|3,0,0]=4 1184 B10R0.4 COCCCNCCC(C)O d5a7633f1811705245c3d698f9d7dc0a [1,0,0,0,0,0|2,0,0]=3 1185 B10R0.4 COCCCNCC[C@@H](C)O 56b5b5408d2c15d9f4415cf06cc55dc7 [1,0,0,0,0,0|2,0,0]=3 1186 B10R0.4 COCCCNCC[C@H](C)O 9279e0fcb1c4aa02aa9d4c2b6c2e9ff3 [1,0,0,0,0,0|2,0,0]=3 1187 B10R0.4 COCCCOCCC(C)C 865d0faf2dcbbda3993a35f9cc52a096 [1,0,0,0,0,0|3,0,0]=4 1188 B10R0.4 COCCNCCCC(C)C a15672a7f9379b0aab7bd577821aab21 [1,0,0,0,0,0|3,0,0]=4 1189 B10R0.4 COCCNCCCC(C)O dbc00069a293067f4bf4bbf830236f5d [1,0,0,0,0,0|2,0,0]=3 1190 B10R0.4 COCCOCCCC(C)C 3e7429178e907c0608d22f5cf4f3163b [1,0,0,0,0,0|3,0,0]=4 1191 B10R0.4 COCCOCNCC(C)O 5d7622d02a43fa262bb145bffaba0380 [1,0,0,0,0,0|3,0,0]=4 1192 B10R0.4 COCCOCNC[C@@H](C)O 84be0a176085a37a284c0951b7343530 [1,0,0,0,0,0|3,0,0]=4 1193 B10R0.4 COCCOCNC[C@H](C)O 02ba47b6e4f6e4aee44e403a10d0b1cb [1,0,0,0,0,0|3,0,0]=4 1194 B10R0.4 COCOCCCCC(C)C 5c60f7e2698c3ed5789c783d5048dedf [1,0,0,0,0,0|3,0,0]=4 1195 B10R0.4 COCOCCNCC(C)O d4488478cd0becfb3cd3b378feecaca4 [1,0,0,0,0,0|3,0,0]=4 1196 B10R0.4 COCOCCNC[C@@H](C)O 1d38f742bd7fdc2bdeb846f98da79d76 [1,0,0,0,0,0|3,0,0]=4 1197 B10R0.4 COCOCCNC[C@H](C)O 8de6356026e52f97568b4bd663aea325 [1,0,0,0,0,0|3,0,0]=4 1198 B10R0.4 CSCCCCNCC(C)C e4759e70efa3006eba6e4bf56bce51af [1,0,0,0,0,0|3,0,0]=4 1199 B10R0.4 CSCCCCNCC(C)O 21dab1f3998b56289acf4659f5f54399 [1,0,0,0,0,0|2,0,0]=3 1200 B10R0.4 CSCCCCNC[C@@H](C)O 287f2516a96cd407b1182b6a17761c3b [1,0,0,0,0,0|2,0,0]=3 1201 B10R0.4 CSCCCCNC[C@H](C)O 002880fb4526d8803fe72a049a805455 [1,0,0,0,0,0|2,0,0]=3 1202 B10R0.4 CSCCCCOCC(C)C 2c14243237662a1853b61a37b4200032 [1,0,0,0,0,0|3,0,0]=4 1203 B10R0.4 CSCCCNCCC(C)C 9d006537826218f9107780847678384c [1,0,0,0,0,0|3,0,0]=4 1204 B10R0.4 CSCCCNCCC(C)O e3201444ee57c0b4141f28224d1732f4 [1,0,0,0,0,0|2,0,0]=3 1205 B10R0.4 CSCCCNCC[C@@H](C)O 3da49fe17e20a5dbd8b15ff6577f809c [1,0,0,0,0,0|2,0,0]=3 1206 B10R0.4 CSCCCNCC[C@H](C)O 4ed8efed7ffad1175717c16b46fba25e [1,0,0,0,0,0|2,0,0]=3 1207 B10R0.4 CSCCCOCCC(C)C 0d917d595e4921f5004e30ae85d48259 [1,0,0,0,0,0|3,0,0]=4 1208 B10R0.4 CSCCNCCCC(C)C f5f68349658f6cd20aed92671b18014a [1,0,0,0,0,0|3,0,0]=4 1209 B10R0.4 CSCCNCCCC(C)O ed0c63796a660f5427e2b8ffcf4436e9 [1,0,0,0,0,0|2,0,0]=3 1210 B10R0.4 CSCCOCCCC(C)C ae475609096bb18c03f0ff4e290fb9d9 [1,0,0,0,0,0|3,0,0]=4 1211 B10R0.4 CSCOCCCCC(C)C 0ae05e8910b5dc8ad503c7b9aaf32d2f [1,0,0,0,0,0|3,0,0]=4 1212 B10R0.4 C[C@@H](F)COCCCCCF 5b62782740e940fd707092b5f73abd66 [1,0,0,0,0,0|3,0,0]=4 1213 B10R0.4 C[C@@H](O)CCCCNCC#N b5c37042270d95e72c1b6471526c9f44 [1,0,0,0,0,0|2,0,1]=4 1214 B10R0.4 C[C@@H](O)CCCCNCCBr 981b2613b1d2a9ec8022e5fbd1ac0ac6 [1,0,0,0,0,0|2,0,0]=3 1215 B10R0.4 C[C@@H](O)CCCCNCCF 06a9119e5b24f6981568b27055f41132 [1,0,0,0,0,0|2,0,0]=3 1216 B10R0.4 C[C@@H](O)CCCCNCCI ea5db5bac35363c35ebf7704a1e4d342 [1,0,0,0,0,0|2,0,0]=3 1217 B10R0.4 C[C@@H](O)CCCCNCCO 540e5a73a85915e91ef6c8e3fa7a09a6 [1,0,0,0,0,0|2,0,0]=3 1218 B10R0.4 C[C@@H](O)CCCCNCCS a1b90adda40c9f3c04ba903565d01986 [1,0,0,0,0,0|2,0,0]=3 1219 B10R0.4 C[C@@H](O)CCNCCCC#N 556f0a9b624e61c07c06591185c5413f [1,0,0,0,0,0|2,0,1]=4 1220 B10R0.4 C[C@@H](O)CCNCCCC=O d7ec67af06a26a29d161b2e94559897b [1,0,0,0,0,0|2,0,1]=4 1221 B10R0.4 C[C@@H](O)CCNCCCCF 3caf2d840c6d57b474b164dcdda33023 [1,0,0,0,0,0|2,0,0]=3 1222 B10R0.4 C[C@@H](O)CCNCCCCO 4fca7630c61cfc16c51e05a444529134 [1,0,0,0,0,0|2,0,0]=3 1223 B10R0.4 C[C@@H](O)CNCCCCC#N f74ab483a829dd3ac65a542fd098f5f1 [1,0,0,0,0,0|2,0,1]=4 1224 B10R0.4 C[C@@H](O)CNCCCCC=O 2db3ec6bc34b57b09f883621835ea1d2 [1,0,0,0,0,0|2,0,1]=4 1225 B10R0.4 C[C@@H](O)CNCCCCCCl b866b2a61898bd18c8941edd75867d6d [1,0,0,0,0,0|2,0,0]=3 1226 B10R0.4 C[C@@H](O)CNCCCCCF 14e1b1914eded3e96ba2baf634482ca5 [1,0,0,0,0,0|2,0,0]=3 1227 B10R0.4 C[C@@H](O)CNCCCCCO f00e8cd379c6d1e2716557afd308f86c [1,0,0,0,0,0|2,0,0]=3 1228 B10R0.4 C[C@@H](O)CNCCCCON 23e34063412c48ea2f0f96924d0b24e2 [1,0,0,0,0,0|3,0,0]=4 1229 B10R0.4 C[C@@H](O)CNCCOCCO e08903df759bbbf26f2314b22996f5c5 [1,0,0,0,0,0|3,0,0]=4 1230 B10R0.4 C[C@@H](O)CNCCOCCS 717dd8c9cc86ed85fe53895ab9f3bee0 [1,0,0,0,0,0|3,0,0]=4 1231 B10R0.4 C[C@@H](O)CNCCSCCO 2ffe08c33b088af7b846f70a11bb847b [1,0,0,0,0,0|3,0,0]=4 1232 B10R0.4 C[C@H](F)COCCCCCF 1e67efe1f385db604f44c0115f658daa [1,0,0,0,0,0|3,0,0]=4 1233 B10R0.4 C[C@H](O)CCNCCCC#N c6884318fcd9808bac5e120fd334c3c7 [1,0,0,0,0,0|2,0,1]=4 1234 B10R0.4 C[C@H](O)CCNCCCC=O 96162b60d8478ae0f8040deafc04623b [1,0,0,0,0,0|2,0,1]=4 1235 B10R0.4 C[C@H](O)CCNCCCCF fe19ddf1c8881c1a1b567c54dedaff13 [1,0,0,0,0,0|2,0,0]=3 1236 B10R0.4 C[C@H](O)CCNCCCCO a9d5080b2c136f8d46ba5a35c2f2a159 [1,0,0,0,0,0|2,0,0]=3 1237 B10R0.4 C[C@H](O)CNCCCCC#N e8c066c0e16147560c2fd28ade575d2e [1,0,0,0,0,0|2,0,1]=4 1238 B10R0.4 C[C@H](O)CNCCCCC=O 70f721e8c5d7fb18eb1e8254c173e764 [1,0,0,0,0,0|2,0,1]=4 1239 B10R0.4 C[C@H](O)CNCCCCCCl ae753e896411fff5d1fe9a7a75f1edf0 [1,0,0,0,0,0|2,0,0]=3 1240 B10R0.4 C[C@H](O)CNCCCCCF c1bc8eb7156b69b5cb7c7d38b7f46148 [1,0,0,0,0,0|2,0,0]=3 1241 B10R0.4 C[C@H](O)CNCCCCCO 96311f7e134db8c0395a1fe3b30b2a18 [1,0,0,0,0,0|2,0,0]=3 1242 B10R0.4 C[C@H](O)CNCCCCON 2ceb05376676dde3e0eb8b94dcc57a90 [1,0,0,0,0,0|3,0,0]=4 1243 B10R0.4 C[C@H](O)CNCCOCCO 544a1db044cba4438f4439276763af42 [1,0,0,0,0,0|3,0,0]=4 1244 B10R0.4 C[C@H](O)CNCCOCCS 4ccb97e3ccbcd47e478323b7f92a2be5 [1,0,0,0,0,0|3,0,0]=4 1245 B10R0.4 C[C@H](O)CNCCSCCO f6c7b3b4d3d4d2e1a774f3c34a140255 [1,0,0,0,0,0|3,0,0]=4 1246 B10R0.71 C#CCCCCCCNCC 1e19a0a5664aee09e6c6b3ffa1908f78 [1,0,0,0,0,0|1,0,2]=4 1247 B10R0.71 C#CCCCCCCNCO 6ed842aecd6996ee24204f85f77ebfea [1,0,0,0,0,0|1,0,2]=4 1248 B10R0.71 C#CCCCCCCOCC f3ffc288f40af77abac880573467b1d7 [1,0,0,0,0,0|1,0,2]=4 1249 B10R0.71 C#CCCCCCNCCC f2f452bcb5375f68862be18112b09fe2 [1,0,0,0,0,0|1,0,2]=4 1250 B10R0.71 C#CCCCCCNCCO 51b3efc076e1cadbeeff73f861612116 [1,0,0,0,0,0|1,0,2]=4 1251 B10R0.71 C#CCCCCCOCCC 2ca86650ff94084696655d61570ec525 [1,0,0,0,0,0|1,0,2]=4 1252 B10R0.71 C#CCCCCNCCCC 0af8d0910ee398356821995ddc41e6bb [1,0,0,0,0,0|1,0,2]=4 1253 B10R0.71 C#CCCCCNCCCO cad8addcdd2099e0934cfc10725d1925 [1,0,0,0,0,0|1,0,2]=4 1254 B10R0.71 C#CCCCCOCCCC 155c3f8eb84354a374d6f5b6dbe37f94 [1,0,0,0,0,0|1,0,2]=4 1255 B10R0.71 C#CCCCNCCCCC 3fc4fe11920794e4bc955893ec779e02 [1,0,0,0,0,0|1,0,2]=4 1256 B10R0.71 C#CCCCNCCCCO dcf9ae0a1c5137838d7e88c238548982 [1,0,0,0,0,0|1,0,2]=4 1257 B10R0.71 C#CCCCOCCCCC cc690d207da9b887d991987e9f43900d [1,0,0,0,0,0|1,0,2]=4 1258 B10R0.71 C#CCCNCCCCCC 0f1ff853854e860e272478f5d2708f31 [1,0,0,0,0,0|1,0,2]=4 1259 B10R0.71 C#CCCNCCCCCO c38b4418e283a0f1e66ba9daaef38af2 [1,0,0,0,0,0|1,0,2]=4 1260 B10R0.71 C#CCCOCCCCCC abc6fbb8106126804619f331a30d4f48 [1,0,0,0,0,0|1,0,2]=4 1261 B10R0.71 C#CCNCCCCCCC aff9226f37cdf53f3ebb600cfdb1d4e4 [1,0,0,0,0,0|1,0,2]=4 1262 B10R0.71 C#CCNCCCCCCO c837bae575b543b476ef268bc11f13de [1,0,0,0,0,0|1,0,2]=4 1263 B10R0.71 C#CCOCCCCCCC 69fcb01c702e23b663d9a6d79c522ad8 [1,0,0,0,0,0|1,0,2]=4 1264 B10R0.71 C/C=C/CCCOCCCC 80f6cb269c0f24c47f7493f0858d135b [1,0,0,0,0,0|1,0,2]=4 1265 B10R0.71 C/C=C/CCOCCCCC b01a3aac6d31bf1181d3412f98b352d1 [1,0,0,0,0,0|1,0,2]=4 1266 B10R0.71 C/C=C/CNCCCCCC 23f0bb0d5026d859ab84031e8dc94320 [1,0,0,0,0,0|1,0,2]=4 1267 B10R0.71 C/C=C/CNCCCCCO 3b414ec002c02d5801962f69c7be7167 [1,0,0,0,0,0|1,0,2]=4 1268 B10R0.71 C/C=C/COCCCCCC 2cc86534d43c03349a69990f00a712f1 [1,0,0,0,0,0|1,0,2]=4 1269 B10R0.71 C/C=C\CCCNCCCC a73db25df80dfe021f7d70c1fcec0182 [1,0,0,0,0,0|1,0,2]=4 1270 B10R0.71 C/C=C\CCCNCCCO b4531ab51d48c8a5bc8f6e2202d71e52 [1,0,0,0,0,0|1,0,2]=4 1271 B10R0.71 C/C=C\CCCOCCCC fe2923e9d84b92616f7a73a5334d712d [1,0,0,0,0,0|1,0,2]=4 1272 B10R0.71 C/C=C\CNCCCCCC 51c50a34f77d344a6f9e8db0e46ec177 [1,0,0,0,0,0|1,0,2]=4 1273 B10R0.71 C/C=C\CNCCCCCO c6fef37b7d5f10483fd2df1e41d5d167 [1,0,0,0,0,0|1,0,2]=4 1274 B10R0.71 C/C=C\COCCCCCC c3215f168781748ebc00617e7f23375f [1,0,0,0,0,0|1,0,2]=4 1275 B10R0.71 C=CCCCCCCOCC 6dbc32c9d3b20eeb8cee0cf24e365bb6 [1,0,0,0,0,0|1,0,2]=4 1276 B10R0.71 C=CCCCCCNCCC 10e6b327fcac81e127610491b239e591 [1,0,0,0,0,0|1,0,2]=4 1277 B10R0.71 C=CCCCCCNCCO f7d0f86a115b9f08d659030c944cd614 [1,0,0,0,0,0|1,0,2]=4 1278 B10R0.71 C=CCCCCCOCCC c368b69977ea0df80586838beccded89 [1,0,0,0,0,0|1,0,2]=4 1279 B10R0.71 C=CCCCCNCCCC 70afaf74cdc590f950a8db01489534df [1,0,0,0,0,0|1,0,2]=4 1280 B10R0.71 C=CCCCCNCCCO b18ea8f54bcf0000513f0386a3bb6063 [1,0,0,0,0,0|1,0,2]=4 1281 B10R0.71 C=CCCCCOCCCC eb8efda51eb20afeb995d9abe3ad7654 [1,0,0,0,0,0|1,0,2]=4 1282 B10R0.71 C=CCCCNCCCCC 4a774e72e8691531f796e4ee77ce73c0 [1,0,0,0,0,0|1,0,2]=4 1283 B10R0.71 C=CCCCNCCCCO f895e67e13a89b3cac3415d11f625144 [1,0,0,0,0,0|1,0,2]=4 1284 B10R0.71 C=CCCCOCCCCC 63a6d257d062f7533d7c287ac671b0fd [1,0,0,0,0,0|1,0,2]=4 1285 B10R0.71 C=CCCNCCCCCC 76e5dd4d3273056eb014515e2136d33d [1,0,0,0,0,0|1,0,2]=4 1286 B10R0.71 C=CCCNCCCCCO 62f9adf3d7c33e75a7a4174782adecbf [1,0,0,0,0,0|1,0,2]=4 1287 B10R0.71 C=CCCOCCCCCC 8814dfd80f4d64b7d70e638ca2c0b882 [1,0,0,0,0,0|1,0,2]=4 1288 B10R0.71 C=CCNCCCCCCC 2a2fd85d2768fa551513c1f6e6f4458d [1,0,0,0,0,0|1,0,2]=4 1289 B10R0.71 C=CCNCCCCCCO c8d7270168b36f18582f9070243a7abc [1,0,0,0,0,0|1,0,2]=4 1290 B10R0.71 C=CCOCCCCCCC 817dc73f818a9c2b13aa69014917ad92 [1,0,0,0,0,0|1,0,2]=4 1291 B10R0.71 CC#CCCCOCCCC 0cd09975349b87add68248cd144b30c2 [1,0,0,0,0,0|1,0,2]=4 1292 B10R0.71 CC#CCCOCCCCC b5ed7155c2adc6b90ea378c870b7c568 [1,0,0,0,0,0|1,0,2]=4 1293 B10R0.71 CC#CCNCCCCCC f59c0ab09e3e7e94730db0a687976215 [1,0,0,0,0,0|1,0,2]=4 1294 B10R0.71 CC#CCNCCCCCO cdda51feffd42fd245b81182352d87a2 [1,0,0,0,0,0|1,0,2]=4 1295 B10R0.71 CC#CCOCCCCCC ca5f1de5554f737f5c88d67d2baa3847 [1,0,0,0,0,0|1,0,2]=4 1296 B10R0.71 CC/C=C/CCOCCCC c8bbe4a116e9837c5acb0bd130d88747 [1,0,0,0,0,0|1,0,2]=4 1297 B10R0.71 CC/C=C/CNCCCCC 396ae7fd2aad2d3062225091f1ed8121 [1,0,0,0,0,0|1,0,2]=4 1298 B10R0.71 CC/C=C/CNCCCCO 30e9e1d97d59f6d1e084daccf819227a [1,0,0,0,0,0|1,0,2]=4 1299 B10R0.71 CC/C=C/COCCCCC 4244476ee625bb91d4c75005fa57b26a [1,0,0,0,0,0|1,0,2]=4 1300 B10R0.71 CC/C=C\CCCCOCC 6f672bd2ab358cb454803e83d5c0e284 [1,0,0,0,0,0|1,0,2]=4 1301 B10R0.71 CC/C=C\CCCOCCC 7fa768d31f02c71335efb28537f1ed87 [1,0,0,0,0,0|1,0,2]=4 1302 B10R0.71 CC/C=C\CCNCCCC c4f059f6ebacdc59905230714b6eff68 [1,0,0,0,0,0|1,0,2]=4 1303 B10R0.71 CC/C=C\CCNCCCO 289e512a3da0d8201ff3b6a7f6c8a4e6 [1,0,0,0,0,0|1,0,2]=4 1304 B10R0.71 CC/C=C\CCOCCCC 8e83903dc8b2dc055f80be84ab4a3d9c [1,0,0,0,0,0|1,0,2]=4 1305 B10R0.71 CC/C=C\COCCCCC 273210e5829d96509e829e222979bc8b [1,0,0,0,0,0|1,0,2]=4 1306 B10R0.71 CC=CCCCOCCCC b937b4ad4c5d1a608e7129c714e871ac [1,0,0,0,0,0|1,0,2]=4 1307 B10R0.71 CC=CCNCCCCCC a2b3321184d80eccc150605d97b3fa96 [1,0,0,0,0,0|1,0,2]=4 1308 B10R0.71 CC=CCNCCCCCO f0a11ba6218259a4b6b28ec12dc6ddff [1,0,0,0,0,0|1,0,2]=4 1309 B10R0.71 CC=CCOCCCCCC a58ad78e13367fd9a0795b0d0efdc386 [1,0,0,0,0,0|1,0,2]=4 1310 B10R0.71 CCC#CCCOCCCC 164797f680cff0f6ad3f9b55f3918282 [1,0,0,0,0,0|1,0,2]=4 1311 B10R0.71 CCC#CCNCCCCC cd7c1bd32db28e29748c40d12d1a30a9 [1,0,0,0,0,0|1,0,2]=4 1312 B10R0.71 CCC#CCNCCCCO cdf25b16ea94d1e8d2163370b23d3722 [1,0,0,0,0,0|1,0,2]=4 1313 B10R0.71 CCC#CCOCCCCC 6cd027f55ffba37890269ac6de76cd41 [1,0,0,0,0,0|1,0,2]=4 1314 B10R0.71 CCC/C=C/CCCOCC 96c575cc0a2c58edec4b18e8b3051827 [1,0,0,0,0,0|1,0,2]=4 1315 B10R0.71 CCC/C=C/CNCCCC eb6f385e07ebf81c43b715a8e6898101 [1,0,0,0,0,0|1,0,2]=4 1316 B10R0.71 CCC/C=C/CNCCCO 7b5b1f32f3ba47219ba367ef60e6a076 [1,0,0,0,0,0|1,0,2]=4 1317 B10R0.71 CCC/C=C/COCCCC 5cb7fad967976b46414fd1e0981df754 [1,0,0,0,0,0|1,0,2]=4 1318 B10R0.71 CCC/C=C\CCCOCC 1c8765980afe95de3eca026e03130832 [1,0,0,0,0,0|1,0,2]=4 1319 B10R0.71 CCC/C=C\CCOCCC affe8f34b74549b94b8274cb3a319479 [1,0,0,0,0,0|1,0,2]=4 1320 B10R0.71 CCC/C=C\CNCCCC bec0667c6be34c83c909fc9cd36559c3 [1,0,0,0,0,0|1,0,2]=4 1321 B10R0.71 CCC/C=C\CNCCCO 0c1e5eb36810f8e1091abebdee101c49 [1,0,0,0,0,0|1,0,2]=4 1322 B10R0.71 CCC/C=C\COCCCC 12552b98ae2ab17ee7aaf14497e6f771 [1,0,0,0,0,0|1,0,2]=4 1323 B10R0.71 CCCC#CCCOCCC 9d371ccc704f01f8e34c17fed94acae5 [1,0,0,0,0,0|1,0,2]=4 1324 B10R0.71 CCCC#CCOCCCC 3a9b7ab043d317d55165792d5b31d2df [1,0,0,0,0,0|1,0,2]=4 1325 B10R0.71 CCCC/C=C/CNCCC b5846262769f4576898e24ec596816c8 [1,0,0,0,0,0|1,0,2]=4 1326 B10R0.71 CCCC/C=C/CNCCO 0c9c5f17e82cdfeba64c276b8f8e86b1 [1,0,0,0,0,0|1,0,2]=4 1327 B10R0.71 CCCC/C=C/COCCC 07c08b56120c97240fcfc821b0cfaf7e [1,0,0,0,0,0|1,0,2]=4 1328 B10R0.71 CCCC/C=C\CCOCC c0b86be5a318325f35923a807a0da0e5 [1,0,0,0,0,0|1,0,2]=4 1329 B10R0.71 CCCC/C=C\CNCCC 1ebafcf76c30e339500b071d8b77b007 [1,0,0,0,0,0|1,0,2]=4 1330 B10R0.71 CCCC/C=C\CNCCO 3f60531e2eaa312eafb4bf5b0403b122 [1,0,0,0,0,0|1,0,2]=4 1331 B10R0.71 CCCC/C=C\COCCC cacd342e00bdd06408172e2c8226f9fe [1,0,0,0,0,0|1,0,2]=4 1332 B10R0.71 CCCCC#CCCOCC fd6ea4ab6886d8b57ffce91597315cab [1,0,0,0,0,0|1,0,2]=4 1333 B10R0.71 CCCCC#CCOCCC b3f55348ac0050523e523ba559b53553 [1,0,0,0,0,0|1,0,2]=4 1334 B10R0.71 CCCCC/C=C/COCC d869a9967b36862cc7ff5868403bb25d [1,0,0,0,0,0|1,0,2]=4 1335 B10R0.71 CCCCCC#CCOCC caa22122c2b20cb5fe4be222e5ff2f55 [1,0,0,0,0,0|1,0,2]=4 1336 B10R0.71 CCCCCCCCNC#N 7445c948f6631b9d7692f2c79595c0b8 [1,0,0,0,0,0|2,0,1]=4 1337 B10R0.71 CCCCCCCCNC=O bc03f137b33aec3f705c81e5d5bac7bb [1,0,0,0,0,0|1,0,2]=4 1338 B10R0.71 CCCCCCCCNCC f45798325e076f51813ed9475990e935 [1,0,0,0,0,0|1,0,0]=2 1339 B10R0.71 CCCCCCCCNCF eba3784a27d0163aaddd6d4d0640d8cb [1,0,0,0,0,0|2,0,0]=3 1340 B10R0.71 CCCCCCCCNCO 62a2dae03ae16e5c5d74011b3e38bc6b [1,0,0,0,0,0|1,0,0]=2 1341 B10R0.71 CCCCCCCCOCC fdf9c57b26dc59eebf4df9f9dff7ab11 [1,0,0,0,0,0|1,0,0]=2 1342 B10R0.71 CCCCCCCCOCF 7d6ea1593b941dac758ff903c420f174 [1,0,0,0,0,0|2,0,0]=3 1343 B10R0.71 CCCCCCCNCC#N 7879b1d72cdd88fea0c9b9478bea255f [1,0,0,0,0,0|2,0,1]=4 1344 B10R0.71 CCCCCCCNCC=O bfb56bc7341eb925b4f8d6df80cbc0e0 [1,0,0,0,0,0|1,0,2]=4 1345 B10R0.71 CCCCCCCNCCBr 153a3c6e2c01a151374cf28481aa6eb9 [1,0,0,0,0,0|2,0,0]=3 1346 B10R0.71 CCCCCCCNCCC 8f428c22239379f79b42eeff6f848027 [1,0,0,0,0,0|1,0,0]=2 1347 B10R0.71 CCCCCCCNCCF 0cbe21085ad34c7f5a2177d0ffae2a78 [1,0,0,0,0,0|2,0,0]=3 1348 B10R0.71 CCCCCCCNCCI b568dedc350f2457598188b0074522f8 [1,0,0,0,0,0|2,0,0]=3 1349 B10R0.71 CCCCCCCNCCO b00594b2eda448f3d37260fcc9ae8d77 [1,0,0,0,0,0|1,0,0]=2 1350 B10R0.71 CCCCCCCNCCS 83786bb22ec9056731e6cce6fe301f14 [1,0,0,0,0,0|1,1,0]=3 1351 B10R0.71 CCCCCCCNCOC f2d51f45d743c2c6bb60d201a5c48204 [1,0,0,0,0,0|2,0,0]=3 1352 B10R0.71 CCCCCCCNCSC 2214e2f762d7beb04324a118c724f12c [1,0,0,0,0,0|2,0,0]=3 1353 B10R0.71 CCCCCCCOCC#N b53295304faef45cab9990e9f30e24dc [1,0,0,0,0,0|2,0,1]=4 1354 B10R0.71 CCCCCCCOCC=O 85a03949435365a6a1fdeda7013cb46a [1,0,0,0,0,0|1,0,2]=4 1355 B10R0.71 CCCCCCCOCCC 2dbba9d2fa88b26583f5d2ac3d741b24 [1,0,0,0,0,0|1,0,0]=2 1356 B10R0.71 CCCCCCCOCCF 2e8dd6a0af3d2b30f6f325a750e2f8e8 [1,0,0,0,0,0|2,0,0]=3 1357 B10R0.71 CCCCCCCOCCS d905d762a9b7d322c87213c7c56ba37f [1,0,0,0,0,0|1,1,0]=3 1358 B10R0.71 CCCCCCCOCOC 5ce19ed9c6e4108e173e3dc063eaeb4e [1,0,0,0,0,0|2,0,0]=3 1359 B10R0.71 CCCCCCCOCSC 08ad92cc4f51e014a7301f82e1b9552e [1,0,0,0,0,0|2,0,0]=3 1360 B10R0.71 CCCCCCNC/C=C\O 6d75b641deaa8953d1d240b2b8f20ca8 [1,0,0,0,0,0|1,0,2]=4 1361 B10R0.71 CCCCCCNCCC#N 693da38782169220ae9c8e0fb667537f [1,0,0,0,0,0|2,0,1]=4 1362 B10R0.71 CCCCCCNCCC=O 7011a6760ad05bee90b4b5fe1ddade10 [1,0,0,0,0,0|1,0,2]=4 1363 B10R0.71 CCCCCCNCCCC 20be2e0525a624157bc2fad46d2186d5 [1,0,0,0,0,0|1,0,0]=2 1364 B10R0.71 CCCCCCNCCCCl 798c3b78fda1b44bfc2a5866fd849b4a [1,0,0,0,0,0|2,0,0]=3 1365 B10R0.71 CCCCCCNCCCF ec8ad93e9495e1afdc7ceb0355e5c789 [1,0,0,0,0,0|2,0,0]=3 1366 B10R0.71 CCCCCCNCCCO 5bc4d9addd0075b9ea454b7e30b2b20c [1,0,0,0,0,0|1,0,0]=2 1367 B10R0.71 CCCCCCNCCCS 8c1aea017c53a004a3a57f13df4016f5 [1,0,0,0,0,0|1,1,0]=3 1368 B10R0.71 CCCCCCNCCOC d8a9b2ae4f4d1a2408c43a2120d332fc [1,0,0,0,0,0|2,0,0]=3 1369 B10R0.71 CCCCCCNCCON a505f41316dcdbfcd75441f02b1c8680 [1,0,0,0,0,0|3,0,0]=4 1370 B10R0.71 CCCCCCNCCSC 03f05656133e75b7ef05cf7e7a9686cd [1,0,0,0,0,0|2,0,0]=3 1371 B10R0.71 CCCCCCNCOCC 0b2dadfdd556d2bf502aa4112d950603 [1,0,0,0,0,0|2,0,0]=3 1372 B10R0.71 CCCCCCOCCC#N df918a6bf56055cc68eaa0febc6250f6 [1,0,0,0,0,0|2,0,1]=4 1373 B10R0.71 CCCCCCOCCC=O 52e11fbfda6e705332503dbf6ca57c21 [1,0,0,0,0,0|1,0,2]=4 1374 B10R0.71 CCCCCCOCCCC 938d0ec0b6adc0f1b39dbfc036e22e02 [1,0,0,0,0,0|1,0,0]=2 1375 B10R0.71 CCCCCCOCCCF 96181b976d7354be2077b197619bb942 [1,0,0,0,0,0|2,0,0]=3 1376 B10R0.71 CCCCCCOCCCS 5fa58b5367e16182182d2f61e5d955a0 [1,0,0,0,0,0|1,1,0]=3 1377 B10R0.71 CCCCCCOCCOC 498c1d974b36c5798a5345f99389e8d2 [1,0,0,0,0,0|2,0,0]=3 1378 B10R0.71 CCCCCCOCCSC a2fa5d10e923435988e5eb6eaf926cde [1,0,0,0,0,0|2,0,0]=3 1379 B10R0.71 CCCCCCOCOCC de7091207636fc19f355a981992b8eb3 [1,0,0,0,0,0|2,0,0]=3 1380 B10R0.71 CCCCCNCC#CCO 23116c6c38a6f4605bbabd713d286c57 [1,0,0,0,0,0|1,0,2]=4 1381 B10R0.71 CCCCCNCCCC#N 9aca619b0d30b921b988c4bbfa3127bd [1,0,0,0,0,0|2,0,1]=4 1382 B10R0.71 CCCCCNCCCC=O 6680464fa50f8e11fa1a82d02cb758f7 [1,0,0,0,0,0|1,0,2]=4 1383 B10R0.71 CCCCCNCCCCC fc6b1fbee2ae20e668586a93426dce7b [1,0,0,0,0,0|1,0,0]=2 1384 B10R0.71 CCCCCNCCCCCl c701e49df4eef1470e682606de3ca8f1 [1,0,0,0,0,0|2,0,0]=3 1385 B10R0.71 CCCCCNCCCCF d279fc520ee48aeaa07407924d2d74d7 [1,0,0,0,0,0|2,0,0]=3 1386 B10R0.71 CCCCCNCCCCO 379ab0235e165758d05e13f64b0667e2 [1,0,0,0,0,0|1,0,0]=2 1387 B10R0.71 CCCCCNCCCCS d84e183bdfafbaad537c0d200ed48999 [1,0,0,0,0,0|1,1,0]=3 1388 B10R0.71 CCCCCNCCCOC 59c794b1fdced6fe10e73b7eec0b61f4 [1,0,0,0,0,0|2,0,0]=3 1389 B10R0.71 CCCCCNCCCSC 1a943155b12e5db9b108db3f8ef5622d [1,0,0,0,0,0|2,0,0]=3 1390 B10R0.71 CCCCCNCCOCC b302026487b9f6fc9da1041bec3b940f [1,0,0,0,0,0|2,0,0]=3 1391 B10R0.71 CCCCCNCCSCC d4e4b88649a7d41376228d32433581ea [1,0,0,0,0,0|2,0,0]=3 1392 B10R0.71 CCCCCOCCCC#N 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17907e10bc8ae216fc19d4f50e0355d8 [1,0,0,0,0,0|2,0,0]=3 1405 B10R0.71 CCCCNCCCCCF ecb524fdab50cb363fd9220f41e81b56 [1,0,0,0,0,0|2,0,0]=3 1406 B10R0.71 CCCCNCCCCCO a568cb73440f8b5eb1a832482c6c8aa1 [1,0,0,0,0,0|1,0,0]=2 1407 B10R0.71 CCCCNCCCCOC 8a51345137a99f78ee92600b49d2fddb [1,0,0,0,0,0|2,0,0]=3 1408 B10R0.71 CCCCNCCCCON e04267b4cc174037c5dfa38636efb861 [1,0,0,0,0,0|3,0,0]=4 1409 B10R0.71 CCCCNCCCCSC 834064ffffe2ca860260d790d8b507c6 [1,0,0,0,0,0|2,0,0]=3 1410 B10R0.71 CCCCNCCCOCC 4567bf18693d1425b182776ab5d89ce7 [1,0,0,0,0,0|2,0,0]=3 1411 B10R0.71 CCCCNCCCSCC 63db814ee76aaab4513ac3ae6b0470e2 [1,0,0,0,0,0|2,0,0]=3 1412 B10R0.71 CCCCNCCOCCC 3fcdc0cfe48703f2a83af0169c62729d [1,0,0,0,0,0|2,0,0]=3 1413 B10R0.71 CCCCNCCOCCO 80115239ef9f78352b2ee441d10a1b65 [1,0,0,0,0,0|2,0,0]=3 1414 B10R0.71 CCCCNCCOCCS 57cba1cb49bedd31f203422953e08db7 [1,0,0,0,0,0|2,1,0]=4 1415 B10R0.71 CCCCNCCOCOC bd8b266c1908f8ed7d554480840547fa [1,0,0,0,0,0|3,0,0]=4 1416 B10R0.71 CCCCNCCSCCO 0347ac7aaf85116de46287a5ecc74d9a [1,0,0,0,0,0|2,0,0]=3 1417 B10R0.71 CCCCNCOCCCC 545e6748e00cac4bfa4dcccf944d1023 [1,0,0,0,0,0|2,0,0]=3 1418 B10R0.71 CCCCNCOCCOC 1dd2d7a790540a31a6570455a64e2044 [1,0,0,0,0,0|3,0,0]=4 1419 B10R0.71 CCCCOCCCCC#N 02ae7f84fca96cad6d15d62b1cbefcac [1,0,0,0,0,0|2,0,1]=4 1420 B10R0.71 CCCCOCCCCC=O 87caad785ee1de0ab8952b818b81a155 [1,0,0,0,0,0|1,0,2]=4 1421 B10R0.71 CCCCOCCCCCF aead05b2f46a954a77fb9b0d46a831a1 [1,0,0,0,0,0|2,0,0]=3 1422 B10R0.71 CCCCOCCCCOC 1c665f9a80dbcc19a2506b93b11eeab3 [1,0,0,0,0,0|2,0,0]=3 1423 B10R0.71 CCCCOCCCCSC 7e846181e45c3a440b01cd8ef8df47c8 [1,0,0,0,0,0|2,0,0]=3 1424 B10R0.71 CCCCOCCCNCC 010734c4fdc877ac094389f744441162 [1,0,0,0,0,0|2,0,0]=3 1425 B10R0.71 CCCCOCCCNCF fbaf21f03ebc1c1e24106466ca45cf49 [1,0,0,0,0,0|3,0,0]=4 1426 B10R0.71 CCCCOCCCNCO 02310b457d19aea630613cfc6ae43a82 [1,0,0,0,0,0|2,0,0]=3 1427 B10R0.71 CCCCOCCCOCC 1158a02552cfd2177bf76faa90c6df77 [1,0,0,0,0,0|2,0,0]=3 1428 B10R0.71 CCCCOCCCOCF 5e73e928453faa57e5da7ba81a05056a [1,0,0,0,0,0|3,0,0]=4 1429 B10R0.71 CCCCOCCCSCC e04cab22dc6501876d38fc7fb5563829 [1,0,0,0,0,0|2,0,0]=3 1430 B10R0.71 CCCCOCCNCCBr dc73ca26cb11908f315e59292c2a4d63 [1,0,0,0,0,0|3,0,0]=4 1431 B10R0.71 CCCCOCCNCCC c10c126aa77fae6dee2817c49229712d [1,0,0,0,0,0|2,0,0]=3 1432 B10R0.71 CCCCOCCNCCF d8e8c882b31899018a61739e3f52cc6c [1,0,0,0,0,0|3,0,0]=4 1433 B10R0.71 CCCCOCCNCCI 5a8cc801334ce93b97d6f903789fbdb6 [1,0,0,0,0,0|3,0,0]=4 1434 B10R0.71 CCCCOCCNCCO cd255df0d112d9e8c8ef0cac0591fd4e [1,0,0,0,0,0|2,0,0]=3 1435 B10R0.71 CCCCOCCNCCS 3510158d43a96868d7c62c4bece1f6ae [1,0,0,0,0,0|2,1,0]=4 1436 B10R0.71 CCCCOCCNCOC 3d46e426fe208da12e5270741d2f7758 [1,0,0,0,0,0|3,0,0]=4 1437 B10R0.71 CCCCOCCNCSC 23dca61e9f32c22306852e3b15bec4fd [1,0,0,0,0,0|3,0,0]=4 1438 B10R0.71 CCCCOCCOCCC 62aa1933f9f6285673b3ff78d496fc74 [1,0,0,0,0,0|2,0,0]=3 1439 B10R0.71 CCCCOCCOCCF 0e3907704345f6840513dbb7fe33a55b [1,0,0,0,0,0|3,0,0]=4 1440 B10R0.71 CCCCOCCOCCS e527e16f2881ce18e3da73bad0736851 [1,0,0,0,0,0|2,1,0]=4 1441 B10R0.71 CCCCOCCOCOC ac988a5aed77ca629caaf4c7819a46c6 [1,0,0,0,0,0|3,0,0]=4 1442 B10R0.71 CCCCOCCOCSC a25829e4f34115af6afb1e4b0b83c031 [1,0,0,0,0,0|3,0,0]=4 1443 B10R0.71 CCCCOCCSCCC dd7dd42c58efb56d123dfdb4ec52bdfa [1,0,0,0,0,0|2,0,0]=3 1444 B10R0.71 CCCCOCNCCCCl fcf9b7c917900b18042cb26f0b2d4362 [1,0,0,0,0,0|3,0,0]=4 1445 B10R0.71 CCCCOCNCCCO d649bca14d69eef2b8a68b32f4a61d75 [1,0,0,0,0,0|2,0,0]=3 1446 B10R0.71 CCCCOCNCCOC 9661ef8359764d8623d11afe5498e300 [1,0,0,0,0,0|3,0,0]=4 1447 B10R0.71 CCCCOCNCCSC 26fbd8ec66be974fcbd5a0526cb4b0d9 [1,0,0,0,0,0|3,0,0]=4 1448 B10R0.71 CCCCOCOCCCC cab95224f5094c3b71980434e538b501 [1,0,0,0,0,0|2,0,0]=3 1449 B10R0.71 CCCCOCOCCCF b24952fd54551c34fc7a3582b4f4b10f [1,0,0,0,0,0|3,0,0]=4 1450 B10R0.71 CCCCOCOCCCS 93f4c58804d15cdcdbc12a98bf6cbca4 [1,0,0,0,0,0|2,1,0]=4 1451 B10R0.71 CCCCOCOCCOC e1e6d52bf675f052f70a55e34a94bebd [1,0,0,0,0,0|3,0,0]=4 1452 B10R0.71 CCCCOCOCCSC d930608e2de8d8b600f7619079ad5307 [1,0,0,0,0,0|3,0,0]=4 1453 B10R0.71 CCCCSCCOCCC 042c613074bc2dcac09e3dbf40c6fdea [1,0,0,0,0,0|2,0,0]=3 1454 B10R0.71 CCCCSCCOCCF 69525a32d302cf42d8a360988f118d89 [1,0,0,0,0,0|3,0,0]=4 1455 B10R0.71 CCCCSCCOCCS 4a8371f19fa6c732bc7415f178bae3dd [1,0,0,0,0,0|2,1,0]=4 1456 B10R0.71 CCCCSCCOCOC 25abdf23fb9b1c0e8b52c413fa068913 [1,0,0,0,0,0|3,0,0]=4 1457 B10R0.71 CCCCSCCOCSC 67fb4de2d405c1ef1e2ca06ab44950a3 [1,0,0,0,0,0|3,0,0]=4 1458 B10R0.71 CCCNCCCCCC#N e5c4a75f299bf3b158afe44bcc08b22a [1,0,0,0,0,0|2,0,1]=4 1459 B10R0.71 CCCNCCCCCC=O ea13b9738fa632ac5ce864b8fef8c315 [1,0,0,0,0,0|1,0,2]=4 1460 B10R0.71 CCCNCCCCCCCl d9d02325ceabb1236feca69f9d260e06 [1,0,0,0,0,0|2,0,0]=3 1461 B10R0.71 CCCNCCCCCCF 47bd30d6c6ebb4154ccfd3d84e3dd907 [1,0,0,0,0,0|2,0,0]=3 1462 B10R0.71 CCCNCCCCCCO 957198384cd9904d687345e1f1a839fe [1,0,0,0,0,0|1,0,0]=2 1463 B10R0.71 CCCNCCCCCOC fbe0af6a29e7bb390546dc0f24f036df [1,0,0,0,0,0|2,0,0]=3 1464 B10R0.71 CCCNCCCCSCC 4fbccce5329f8a22f7d198bd04134133 [1,0,0,0,0,0|2,0,0]=3 1465 B10R0.71 CCCNCCCOCCC 7fd6aca7b9f3bc59415db067623e55ef [1,0,0,0,0,0|2,0,0]=3 1466 B10R0.71 CCCNCCCOCCO 85649ddd4b7bb8ea6cc1e32801747e8c [1,0,0,0,0,0|2,0,0]=3 1467 B10R0.71 CCCNCCOCCCO ce755d26bb38d7d0db74dd93ed4f675f [1,0,0,0,0,0|2,0,0]=3 1468 B10R0.71 CCCNCCOCCOC 2cbde89089689bf854a3b933cabe6ba2 [1,0,0,0,0,0|3,0,0]=4 1469 B10R0.71 CCCNCCSSCCO cf2351cc56cc71a3067b12d59ef535ac [1,0,0,0,0,0|3,0,0]=4 1470 B10R0.71 CCCOCCCCCC#N 80cf8a7ea89988cb83fb563eca704e39 [1,0,0,0,0,0|2,0,1]=4 1471 B10R0.71 CCCOCCCCCC=O f9a394720b00a6dd92dae6c05c91a7d4 [1,0,0,0,0,0|1,0,2]=4 1472 B10R0.71 CCCOCCCCCCF 72ffe3589386c933c936da7caa3f7256 [1,0,0,0,0,0|2,0,0]=3 1473 B10R0.71 CCCOCCCCCCS 9237106df74f11c16d22d77a5b29e426 [1,0,0,0,0,0|1,1,0]=3 1474 B10R0.71 CCCOCCCCCOC f0f1181da96b58975534715e6947023c [1,0,0,0,0,0|2,0,0]=3 1475 B10R0.71 CCCOCCCNCCBr bee87ee77ec3102d7ce6099c3a5400ee [1,0,0,0,0,0|3,0,0]=4 1476 B10R0.71 CCCOCCCNCCF 4280460a70e5ec0da532a0aef238506d [1,0,0,0,0,0|3,0,0]=4 1477 B10R0.71 CCCOCCCNCCI 5f240e521ffd9c5eda977c5ce87452ef [1,0,0,0,0,0|3,0,0]=4 1478 B10R0.71 CCCOCCCNCCO 0a8b4b1c66e483def5426f3f2c79fc1b [1,0,0,0,0,0|2,0,0]=3 1479 B10R0.71 CCCOCCCNCCS 7b5a1495544a634cb4a20606ba496232 [1,0,0,0,0,0|2,1,0]=4 1480 B10R0.71 CCCOCCCNCOC 1bea1577b514f54011229b8419bcfdb7 [1,0,0,0,0,0|3,0,0]=4 1481 B10R0.71 CCCOCCCNCSC 58701c31c8f1a07c8a8df9348f81a8e0 [1,0,0,0,0,0|3,0,0]=4 1482 B10R0.71 CCCOCCCOCCC f962260523633ca9eb2ae77ffb4aa792 [1,0,0,0,0,0|2,0,0]=3 1483 B10R0.71 CCCOCCCOCCF 3698cb40c4434046db45e1bb814e1622 [1,0,0,0,0,0|3,0,0]=4 1484 B10R0.71 CCCOCCCOCCS c412735660e2d5b16f022f520708dc55 [1,0,0,0,0,0|2,1,0]=4 1485 B10R0.71 CCCOCCCOCOC bed9246f72dff6f1dadff9d9a6e7bd82 [1,0,0,0,0,0|3,0,0]=4 1486 B10R0.71 CCCOCCNCCCCl 784632a9b2c9e6050b13054a279b5563 [1,0,0,0,0,0|3,0,0]=4 1487 B10R0.71 CCCOCCNCCCF 026f328a82fe337d42861d2ec6a5655f [1,0,0,0,0,0|3,0,0]=4 1488 B10R0.71 CCCOCCNCCCO e044842af3e92ff7eb92db45482811f4 [1,0,0,0,0,0|2,0,0]=3 1489 B10R0.71 CCCOCCNCCCS d80f2dc40273e51403b85f12b465d171 [1,0,0,0,0,0|2,1,0]=4 1490 B10R0.71 CCCOCCNCCOC b04fafbd8d2ee2c08b8f63df1798a56c [1,0,0,0,0,0|3,0,0]=4 1491 B10R0.71 CCCOCCNCCSC f57bb62307dbd266127540784f4eb500 [1,0,0,0,0,0|3,0,0]=4 1492 B10R0.71 CCCOCCNCOCC e3ae911adc1cf7303a1b72a05ebf7e83 [1,0,0,0,0,0|3,0,0]=4 1493 B10R0.71 CCCOCCOCCCF f99eaf72f24d8c38f0025bb59317ae75 [1,0,0,0,0,0|3,0,0]=4 1494 B10R0.71 CCCOCCOCCCS 29d48da73019a044d9e048470970d12c [1,0,0,0,0,0|2,1,0]=4 1495 B10R0.71 CCCOCCOCCOC 1b06cdeb8b0ec10f0136b2c501e1354c [1,0,0,0,0,0|3,0,0]=4 1496 B10R0.71 CCCOCCOCCSC dfd11617336747a54284534e611b2815 [1,0,0,0,0,0|3,0,0]=4 1497 B10R0.71 CCCOCCOCOCC 100dd6040f41719744cddfe9d7650b59 [1,0,0,0,0,0|3,0,0]=4 1498 B10R0.71 CCCSCCCCNCC 19a2007b09e5e2f3826f2c9805957fbb [1,0,0,0,0,0|2,0,0]=3 1499 B10R0.71 CCCSCCCCNCF 8cc325ea244af6b4ced7218087c95acc [1,0,0,0,0,0|3,0,0]=4 1500 B10R0.71 CCCSCCCCNCO d64656b2ed2aecb983e9bf8bbe18d3d1 [1,0,0,0,0,0|2,0,0]=3 1501 B10R0.71 CCCSCCOCCCF c2df45484e1f04796f55039c6c01149a [1,0,0,0,0,0|3,0,0]=4 1502 B10R0.71 CCCSCCOCCCS 5c85cc065b8d075793169fe91e12b9a6 [1,0,0,0,0,0|2,1,0]=4 1503 B10R0.71 CCCSCCOCCOC 6ee02793d5fe53c6051c2b73c029160a [1,0,0,0,0,0|3,0,0]=4 1504 B10R0.71 CCCSCCOCCSC 619f33b0b6b5069ab424bef912e65bf1 [1,0,0,0,0,0|3,0,0]=4 1505 B10R0.71 CCCSCCOCOCC 4185e41a27ecf720c5ad46b42494d0f9 [1,0,0,0,0,0|3,0,0]=4 1506 B10R0.71 CCNCCCCCCCO fc9b8a8b51004dd7f2bdc1e19b84756b [1,0,0,0,0,0|1,0,0]=2 1507 B10R0.71 CCNCCCCSCCO 9cc3bb61eaf41c8a4923a6db1250aa82 [1,0,0,0,0,0|2,0,0]=3 1508 B10R0.71 CCNCCCOCCCO 47d0e11f0fe7477fa63a8b913e01e66b [1,0,0,0,0,0|2,0,0]=3 1509 B10R0.71 CCNCCCOCCOC 2b72e76c302d9f2c23aaf01a3b73ab0a [1,0,0,0,0,0|3,0,0]=4 1510 B10R0.71 CCNCCCOCCSC f1f564b79311e99b3e72733e90006265 [1,0,0,0,0,0|3,0,0]=4 1511 B10R0.71 CCNCCOCCOCC 5f32edce029bc6a5247f81269ebb6cbd [1,0,0,0,0,0|3,0,0]=4 1512 B10R0.71 CCOCCCCCCOC 4054b0cb119b3fa57bc1a0eeb14de41e [1,0,0,0,0,0|2,0,0]=3 1513 B10R0.71 CCOCCCNCCCCl 07dd60015dfc25e2baad72971d66a47d [1,0,0,0,0,0|3,0,0]=4 1514 B10R0.71 CCOCCCNCCCF cd8fe7435d6e67977421865eaba08a95 [1,0,0,0,0,0|3,0,0]=4 1515 B10R0.71 CCOCCCNCCCO b075d31a0576ac4ce5af21cb018680ed [1,0,0,0,0,0|2,0,0]=3 1516 B10R0.71 CCOCCCNCCCS a007cf7186e66722e497815746a2d0ec [1,0,0,0,0,0|2,1,0]=4 1517 B10R0.71 CCOCCCNCCOC cfeea7690a41d701419acc5f0ca375bc [1,0,0,0,0,0|3,0,0]=4 1518 B10R0.71 CCOCCCNCCSC f0d3a622ea786449240bcfc9fdac1ee3 [1,0,0,0,0,0|3,0,0]=4 1519 B10R0.71 CCOCCCNCOCC 5c94f07672bba573794d7ebaaaf50bb5 [1,0,0,0,0,0|3,0,0]=4 1520 B10R0.71 CCOCCCOCCCF b35bf1ac62461dff8e8a6433d528ce47 [1,0,0,0,0,0|3,0,0]=4 1521 B10R0.71 CCOCCCOCCCS 5a3fb37aab52a4b5c1a3633304843f2d [1,0,0,0,0,0|2,1,0]=4 1522 B10R0.71 CCOCCCOCCOC 86d49f1c0e918986d65abbc263be35e3 [1,0,0,0,0,0|3,0,0]=4 1523 B10R0.71 CCOCCCOCCSC 7e6593cfd8fbe8a0366c6c086d62c695 [1,0,0,0,0,0|3,0,0]=4 1524 B10R0.71 CCOCCCOCOCC bda2c234d3de22b72b74da925ab0ea52 [1,0,0,0,0,0|3,0,0]=4 1525 B10R0.71 CCOCCNCCCCCl 934fd415aab9bef81ee58fc260d4f134 [1,0,0,0,0,0|3,0,0]=4 1526 B10R0.71 CCOCCNCCCCF 39e36c4514821dbf33e3448cb6645d4a [1,0,0,0,0,0|3,0,0]=4 1527 B10R0.71 CCOCCNCCCCO c2765a5f377f959beb3e3c80dc514c5d [1,0,0,0,0,0|2,0,0]=3 1528 B10R0.71 CCOCCNCCCCS 830680d7ab778d13a5095a4b26a0ec8f [1,0,0,0,0,0|2,1,0]=4 1529 B10R0.71 CCOCCNCCCOC abac0a126993abc0c01048088b4b9141 [1,0,0,0,0,0|3,0,0]=4 1530 B10R0.71 CCOCCNCCCSC 25582452943eb67b3b1c4af0e185992f [1,0,0,0,0,0|3,0,0]=4 1531 B10R0.71 CCOCCNCCOCC 825840a74ead14d8d4f3bbac3b2cae7c [1,0,0,0,0,0|3,0,0]=4 1532 B10R0.71 CCOCCNCCSCC 3b0f94e46e729b430af9768fec2473ea [1,0,0,0,0,0|3,0,0]=4 1533 B10R0.71 CCOCCOCCCCF 48ad7f28261a2ea0c2123b939539c9d8 [1,0,0,0,0,0|3,0,0]=4 1534 B10R0.71 CCOCCOCCCCS 518cf76116aed980c0a2180ee00dd264 [1,0,0,0,0,0|2,1,0]=4 1535 B10R0.71 CCOCCOCCCOC c7170da04bbfc7f7cb885af7e5fd026e [1,0,0,0,0,0|3,0,0]=4 1536 B10R0.71 CCOCCOCCCSC c38972a063809e2df85a883511294af3 [1,0,0,0,0,0|3,0,0]=4 1537 B10R0.71 CCOCCOCCNCO 4afd5865edd57d5fd6684959ad20dd26 [1,0,0,0,0,0|3,0,0]=4 1538 B10R0.71 CCOCCOCCOCC e371d1cb764f70557a0d4dc1d3182df8 [1,0,0,0,0,0|3,0,0]=4 1539 B10R0.71 CCOCCOCCSCC 8fb694056e2f78315508ba3070af5a7c [1,0,0,0,0,0|3,0,0]=4 1540 B10R0.71 CCOCNCCCCCCl 18d79e2470be0401d650e73e7dffed05 [1,0,0,0,0,0|3,0,0]=4 1541 B10R0.71 CCOCNCCCCCO 342967161ee32ea30677a794bea2e604 [1,0,0,0,0,0|2,0,0]=3 1542 B10R0.71 CCOCNCCCCOC c8aadc7fd0ecad94101664035b5dcb0a [1,0,0,0,0,0|3,0,0]=4 1543 B10R0.71 CCOCNCCCCSC 15a58cd7a7a391dd8f3f13a25e51856b [1,0,0,0,0,0|3,0,0]=4 1544 B10R0.71 CCOCNCCOCCO b1bf2d6fb1abe97144c8f5bbf779d3b7 [1,0,0,0,0,0|3,0,0]=4 1545 B10R0.71 CCOCNCCSCCO 0ecee3bc6db484db151fd600e0f1de2e [1,0,0,0,0,0|3,0,0]=4 1546 B10R0.71 CCOCOCCCCOC 915704c151d10769b6018e77d6159ac5 [1,0,0,0,0,0|3,0,0]=4 1547 B10R0.71 CCOCOCCCCSC 775f9873e83d33ed64cef755812a1118 [1,0,0,0,0,0|3,0,0]=4 1548 B10R0.71 CCOCOCCCSCC 0b74f7a6f67e9f31725361da5e9273b0 [1,0,0,0,0,0|3,0,0]=4 1549 B10R0.71 CCSCCCCNCCF 2af286f98954ed846fd54181a64b1ad6 [1,0,0,0,0,0|3,0,0]=4 1550 B10R0.71 CCSCCCCNCCO d49169998c95c8ac05194e3d506507c0 [1,0,0,0,0,0|2,0,0]=3 1551 B10R0.71 CCSCCCCNCCS b547ca4c95b5c668a60bbdf670735c54 [1,0,0,0,0,0|2,1,0]=4 1552 B10R0.71 CCSCCCCNCOC 4c8c83e7be762139ef57c3a28c649a5b [1,0,0,0,0,0|3,0,0]=4 1553 B10R0.71 CCSCCCCNCSC d0de013f7f1c4127d6e076919c3e14d8 [1,0,0,0,0,0|3,0,0]=4 1554 B10R0.71 CCSCCCNCCCCl fe8c48cff5e3fdba17274c3a663dedd4 [1,0,0,0,0,0|3,0,0]=4 1555 B10R0.71 CCSCCCNCCCO 47d2735b827a9b180dc3f69415f85455 [1,0,0,0,0,0|2,0,0]=3 1556 B10R0.71 CCSCCCNCCOC ce843ac43eee73906020a7978b7c2670 [1,0,0,0,0,0|3,0,0]=4 1557 B10R0.71 CCSCCCNCCSC 227a434d34946762e7141ac04f789056 [1,0,0,0,0,0|3,0,0]=4 1558 B10R0.71 CCSCCCOCCCF da8ebf8ef956a447a2622665209066ff [1,0,0,0,0,0|3,0,0]=4 1559 B10R0.71 CCSCCCOCCCS 20e48a9db1d8288875a5ef6318b27a21 [1,0,0,0,0,0|2,1,0]=4 1560 B10R0.71 CCSCCCOCCOC 184324569a695c14f2d49871f1e33d60 [1,0,0,0,0,0|3,0,0]=4 1561 B10R0.71 CCSCCCOCCSC 21daf581564f85521ee1e3a25d829227 [1,0,0,0,0,0|3,0,0]=4 1562 B10R0.71 CCSCCNCCCCCl e05a6921789090feb258ba7c527e6ea6 [1,0,0,0,0,0|3,0,0]=4 1563 B10R0.71 CCSCCNCCCCF 14212c0cd85fc42486de21afda266168 [1,0,0,0,0,0|3,0,0]=4 1564 B10R0.71 CCSCCNCCCCO 193cb6b252a8317350402e130583726e [1,0,0,0,0,0|2,0,0]=3 1565 B10R0.71 CCSCCNCCCCS 5e10e803bac61299a7a9789ce7e9e58f [1,0,0,0,0,0|2,1,0]=4 1566 B10R0.71 CCSCCNCCCOC 54b31542e202a8ad2105077f71243d91 [1,0,0,0,0,0|3,0,0]=4 1567 B10R0.71 CCSCCNCCCSC 6c5572583cb8524ef3bc363525ba21b2 [1,0,0,0,0,0|3,0,0]=4 1568 B10R0.71 CCSCCNCCSCC 766351065a3f20f33c7f8bf715afac9e [1,0,0,0,0,0|3,0,0]=4 1569 B10R0.71 CCSCCOCCCCF df2ef170c3518f5fdc16d0e596411dbd [1,0,0,0,0,0|3,0,0]=4 1570 B10R0.71 CCSCCOCCCCS 6cadcd4fc042fb5b664576424db46a66 [1,0,0,0,0,0|2,1,0]=4 1571 B10R0.71 CCSCCOCCCOC a174d929fda302181c1f8aa46f0d321b [1,0,0,0,0,0|3,0,0]=4 1572 B10R0.71 CCSCCOCCCSC 4df7d0f0fece382dbc1b5235bcdfe089 [1,0,0,0,0,0|3,0,0]=4 1573 B10R0.71 CCSCCOCCSCC aeb5bd3cb85dc8d64ed7427fa2c457ef [1,0,0,0,0,0|3,0,0]=4 1574 B10R0.71 COCCCCCCOCF 5bc07591ce5eedb6d096a50f252dd1bf [1,0,0,0,0,0|3,0,0]=4 1575 B10R0.71 COCCCCCNCCBr 7a698496282534a3fefd827a7ee7d4ad [1,0,0,0,0,0|3,0,0]=4 1576 B10R0.71 COCCCCCNCCF ae93955373c39260be83c7c074b40653 [1,0,0,0,0,0|3,0,0]=4 1577 B10R0.71 COCCCCCNCCI 88438a281dceae4357ca69b6a34a2dfc [1,0,0,0,0,0|3,0,0]=4 1578 B10R0.71 COCCCCCNCCO a4e90d1195ad0a2e045d4e3da7d08436 [1,0,0,0,0,0|2,0,0]=3 1579 B10R0.71 COCCCCCNCCS 9628634822f8e69d182a984c93b55638 [1,0,0,0,0,0|2,1,0]=4 1580 B10R0.71 COCCCCCNCOC 5768a135f57f989dec3eb0dff41b1b99 [1,0,0,0,0,0|3,0,0]=4 1581 B10R0.71 COCCCCCNCSC ac5825010475d9c558c3e1f9c38305bf [1,0,0,0,0,0|3,0,0]=4 1582 B10R0.71 COCCCCCOCCF f3a211ec0c8c52ca98e8eb9c9f8303f1 [1,0,0,0,0,0|3,0,0]=4 1583 B10R0.71 COCCCCCOCCS 3ec9d0d72d8c29a4fa761e5a2ff812c2 [1,0,0,0,0,0|2,1,0]=4 1584 B10R0.71 COCCCCCOCOC 507fdc97f92608c5104edd21704e17b0 [1,0,0,0,0,0|3,0,0]=4 1585 B10R0.71 COCCCCNCCCCl 7b0771a943f9f6d4d18c496a109e93d2 [1,0,0,0,0,0|3,0,0]=4 1586 B10R0.71 COCCCCNCCCF 9bbf1bdbca66b9b25416ddf53ec9d0d1 [1,0,0,0,0,0|3,0,0]=4 1587 B10R0.71 COCCCCNCCCO e680b9774f4f9b4a017e9897fb0e030c [1,0,0,0,0,0|2,0,0]=3 1588 B10R0.71 COCCCCNCCCS 246e4ac28937f89bdf4287a0cca1803a [1,0,0,0,0,0|2,1,0]=4 1589 B10R0.71 COCCCCNCCOC 30d1070ea571ed8d9f488497b50b58d2 [1,0,0,0,0,0|3,0,0]=4 1590 B10R0.71 COCCCCNCCSC d46023f2d925ab3f47ad6081174fe4d1 [1,0,0,0,0,0|3,0,0]=4 1591 B10R0.71 COCCCCOCCCF e6872cd38809d1806361f7ad32f2a527 [1,0,0,0,0,0|3,0,0]=4 1592 B10R0.71 COCCCCOCCCS ab904d46ca6f0f0892fbfc7c57dda8ab [1,0,0,0,0,0|2,1,0]=4 1593 B10R0.71 COCCCCOCCOC 379baa265a89cf9fa652b6f6ebaa5e6d [1,0,0,0,0,0|3,0,0]=4 1594 B10R0.71 COCCCCOCCSC b497ccff6bc26ea83e7425dcecf604f3 [1,0,0,0,0,0|3,0,0]=4 1595 B10R0.71 COCCCNCCCCCl 5999e26b65ba26b97698df8e0a0fa4b2 [1,0,0,0,0,0|3,0,0]=4 1596 B10R0.71 COCCCNCCCCF 340547664316360e0b4836fa6bb81090 [1,0,0,0,0,0|3,0,0]=4 1597 B10R0.71 COCCCNCCCCO bbb0a0cab4d8bfd8f0a4628529389dc7 [1,0,0,0,0,0|2,0,0]=3 1598 B10R0.71 COCCCNCCCCS 26ce0ea4f1e3c6901c2c094002c7f7ca [1,0,0,0,0,0|2,1,0]=4 1599 B10R0.71 COCCCNCCCOC 6b25fec743b61aaa4a592309dfa18867 [1,0,0,0,0,0|3,0,0]=4 1600 B10R0.71 COCCCNCCCSC 06fe410cf918479446c4f442702f3916 [1,0,0,0,0,0|3,0,0]=4 1601 B10R0.71 COCCCOCCCCF 1513601fe13cf3bb08e57a5826b91906 [1,0,0,0,0,0|3,0,0]=4 1602 B10R0.71 COCCCOCCCCS f81040082756c3c5657c640fd026213a [1,0,0,0,0,0|2,1,0]=4 1603 B10R0.71 COCCCOCCCOC c23b15175ba98778655d04671aa2fc22 [1,0,0,0,0,0|3,0,0]=4 1604 B10R0.71 COCCCOCCCSC 23110c14aa79d66c229987eba6774fe8 [1,0,0,0,0,0|3,0,0]=4 1605 B10R0.71 COCCNCCCCCCl 145bed3b7e22655c5ad1fc50643ef3bc [1,0,0,0,0,0|3,0,0]=4 1606 B10R0.71 COCCNCCCCCF f3d5ce09a7965b9585734f07366d1c5e [1,0,0,0,0,0|3,0,0]=4 1607 B10R0.71 COCCNCCCCCO 9c9ec868dcc297038561eacd64e4095b [1,0,0,0,0,0|2,0,0]=3 1608 B10R0.71 COCCNCCCCSC dbf5931f0162b29f8e18c3dbe4dc57f0 [1,0,0,0,0,0|3,0,0]=4 1609 B10R0.71 COCCNCCOCCO afe500b1837ad4d23f0cdca11c7f409c [1,0,0,0,0,0|3,0,0]=4 1610 B10R0.71 COCCNCCSCCO b3e51272a9e435e8fe6e5728f8c2e645 [1,0,0,0,0,0|3,0,0]=4 1611 B10R0.71 COCCOCCCCCF 4e5f4f6eedb72d35ca16a01d8e944d7b [1,0,0,0,0,0|3,0,0]=4 1612 B10R0.71 COCCOCCCCSC 9a3d705a7acc5ce3f2ef2242637c187e [1,0,0,0,0,0|3,0,0]=4 1613 B10R0.71 COCCOCCCNCO fa9eea6b2d69aee72c08770e8cbfd184 [1,0,0,0,0,0|3,0,0]=4 1614 B10R0.71 COCCOCCNCCO c7705be142ac1bec515cf30d0cf7cff5 [1,0,0,0,0,0|3,0,0]=4 1615 B10R0.71 COCCOCNCCCO 5b3227bba5977d879c6c84b2d9f85fa2 [1,0,0,0,0,0|3,0,0]=4 1616 B10R0.71 COCNCCCCCCCl 1e004d66eee27279f731283e881dc719 [1,0,0,0,0,0|3,0,0]=4 1617 B10R0.71 COCNCCCCCCO f2859e933bab15050a7e0cdf65c99b0d [1,0,0,0,0,0|2,0,0]=3 1618 B10R0.71 COCNCCCOCCO 8ac438bf074bb89f6b3bb2cefcd9b5f3 [1,0,0,0,0,0|3,0,0]=4 1619 B10R0.71 COCNCCOCCCO 68edc1abcac44a19e12d37839456e239 [1,0,0,0,0,0|3,0,0]=4 1620 B10R0.71 COCOCCCCCCF 17161ed12e555e55431c451f9ea8f8e9 [1,0,0,0,0,0|3,0,0]=4 1621 B10R0.71 COCOCCCCCCS 74af74e3e3beffe2982557911f35d8b8 [1,0,0,0,0,0|2,1,0]=4 1622 B10R0.71 COCOCCNCCCO 5e09033284e825cc2dd74b868346b42d [1,0,0,0,0,0|3,0,0]=4 1623 B10R0.71 CSCCCCNCCCF 19e281e56fa699ef9dc6c4ec47827759 [1,0,0,0,0,0|3,0,0]=4 1624 B10R0.71 CSCCCCNCCCO 536a2256947d5d7bf96225f7139cf4a5 [1,0,0,0,0,0|2,0,0]=3 1625 B10R0.71 CSCCCCNCCCS 47ae1b2524e757773a092f3a2b6c3650 [1,0,0,0,0,0|2,1,0]=4 1626 B10R0.71 CSCCCCNCCSC 4cc4e3abb962ab4da48e7401a69d2ec0 [1,0,0,0,0,0|3,0,0]=4 1627 B10R0.71 CSCCCCOCCCF 8a1b3a8e971206055dce912e15fae07c [1,0,0,0,0,0|3,0,0]=4 1628 B10R0.71 CSCCCCOCCCS 60cea5c30a0a6951485423c11433ff52 [1,0,0,0,0,0|2,1,0]=4 1629 B10R0.71 CSCCCCOCCSC 7774efcc9171d86a8214b5f2ec5d591f [1,0,0,0,0,0|3,0,0]=4 1630 B10R0.71 CSCCCNCCCCCl 06bb8845fd05ac6b00f5a6667ae22ab6 [1,0,0,0,0,0|3,0,0]=4 1631 B10R0.71 CSCCCNCCCCF e89cfd5d5723552d5ec85cfc5075731f [1,0,0,0,0,0|3,0,0]=4 1632 B10R0.71 CSCCCNCCCCO 5f679e72bf6dab4f5df47d48b627fed0 [1,0,0,0,0,0|2,0,0]=3 1633 B10R0.71 CSCCCNCCCCS 5403ec3feaec8d9cd5aec7230c370b30 [1,0,0,0,0,0|2,1,0]=4 1634 B10R0.71 CSCCCNCCCSC f48aa9472997513f4b66f2b915b3978c [1,0,0,0,0,0|3,0,0]=4 1635 B10R0.71 CSCCCOCCCCF 7b8bfdf8db8c254d9ea38777019f1908 [1,0,0,0,0,0|3,0,0]=4 1636 B10R0.71 CSCCCOCCCCS 9db249f09bc1f3b711668fde6d338014 [1,0,0,0,0,0|2,1,0]=4 1637 B10R0.71 CSCCCOCCCSC 9b04b66ba015667f3b00d24268040bff [1,0,0,0,0,0|3,0,0]=4 1638 B10R0.71 CSCCNCCCCCCl a9d8a31e397e365e5a97cb7872930679 [1,0,0,0,0,0|3,0,0]=4 1639 B10R0.71 CSCCNCCCCCF 36ad00b6c5380ae3be0693b97db10491 [1,0,0,0,0,0|3,0,0]=4 1640 B10R0.71 CSCCNCCCCCO fba793a3b8c32572b1d4ce0517f57c72 [1,0,0,0,0,0|2,0,0]=3 1641 B10R0.71 CSCCNCCOCCO 778afd7e7a2b4636ef495c9bf5cc1e05 [1,0,0,0,0,0|3,0,0]=4 1642 B10R0.71 CSCCNCCSCCO a9c46312aa4150f7131e0556c61fe608 [1,0,0,0,0,0|3,0,0]=4 1643 B10R0.71 CSCCOCCCCCF c91dfc969bda30e8e6509f126ab4281b [1,0,0,0,0,0|3,0,0]=4 1644 B10R0.71 CSCCOCCCNCO 827ef42eb298dd1f846631ac15c3909e [1,0,0,0,0,0|3,0,0]=4 1645 B10R0.71 CSCNCCCCCCCl cee7262d42f322776d0dd37eb7293230 [1,0,0,0,0,0|3,0,0]=4 1646 B10R0.71 CSCNCCCCCCO 2c18020d880691af439100daf483c0d4 [1,0,0,0,0,0|2,0,0]=3 1647 B10R0.71 CSCNCCCOCCO bd82caccabdc0500f9a187a2327fbd03 [1,0,0,0,0,0|3,0,0]=4 1648 B10R0.71 CSCNCCOCCCO db1ce9f4b74b7e6b0a1c595d9c118e65 [1,0,0,0,0,0|3,0,0]=4 1649 B10R0.71 CSCOCCCCCCF 407195bedd704b23d88aa78f6e3e9409 [1,0,0,0,0,0|3,0,0]=4 1650 B10R0.71 CSCOCCCCCCS 2b880cbb43537a4342292b63fff8bea9 [1,0,0,0,0,0|2,1,0]=4 1651 B10R0.71 FCCCCCCNCCBr 7969024167660687858cf5c771f6e95b [1,0,0,0,0,0|3,0,0]=4 1652 B10R0.71 FCCCCCCNCCF a2ff0547067d52145fbe35f8b6c40bde [1,0,0,0,0,0|3,0,0]=4 1653 B10R0.71 FCCCCCCNCCI d55529230247f05d7f49dd0ed596c0a9 [1,0,0,0,0,0|3,0,0]=4 1654 B10R0.71 FCCCCCCNCCS 5fa45f367f1766b8f0f0a56e8a663d33 [1,0,0,0,0,0|2,1,0]=4 1655 B10R0.71 FCCCCCCOCCF 00cdd59286754be6318795dcf25dcefd [1,0,0,0,0,0|3,0,0]=4 1656 B10R0.71 FCCCCCCOCCS 92d153e3bb9e1ad67b5771d0667e02fa [1,0,0,0,0,0|2,1,0]=4 1657 B10R0.71 FCCCCCNCCCCl 14475793a84dfc497e39ea94df1874f5 [1,0,0,0,0,0|3,0,0]=4 1658 B10R0.71 FCCCCCOCCCF a52d1e432f2925cef5d8939d3ad10c4a [1,0,0,0,0,0|3,0,0]=4 1659 B10R0.71 FCCCCCOCCCS 798f59dd060c2f4d944bccba177b7e14 [1,0,0,0,0,0|2,1,0]=4 1660 B10R0.71 FCCCCNCCCCCl 4563e0b21da3732636b49c0e580ba6d6 [1,0,0,0,0,0|3,0,0]=4 1661 B10R0.71 FCCCCNCCCCS c68f876d022f45b69e4f63b59add4408 [1,0,0,0,0,0|2,1,0]=4 1662 B10R0.71 FCCCCOCCCCF d3ea4d3274100b4f8e6410eaf53051fd [1,0,0,0,0,0|3,0,0]=4 1663 B10R0.71 FCCCCOCCCCS 5580d68170838e946b842c26609ce295 [1,0,0,0,0,0|2,1,0]=4 1664 B10R0.71 FCCCNCCCCCCl c0fe3292013f63f0bf9b51687de088cd [1,0,0,0,0,0|3,0,0]=4 1665 B10R0.71 FCCNCCCCCCCl bfc4bb8bed860ef5cfc0dffd980f7150 [1,0,0,0,0,0|3,0,0]=4 1666 B10R0.71 FCCOCCCCCCS 521bc1567085794b91ead8aa32f177aa [1,0,0,0,0,0|2,1,0]=4 1667 B10R0.71 N#CCCCCCNCCO 6b0b02488f80c8c88c988eb7f9ee01ab [1,0,0,0,0,0|2,0,1]=4 1668 B10R0.71 N#CCCCCNCCCO 498638d56b773d6df660a7eec6d7069f [1,0,0,0,0,0|2,0,1]=4 1669 B10R0.71 N#CCCCNCCCCO 54a6f9c7b67a4f7428d07374915a1b19 [1,0,0,0,0,0|2,0,1]=4 1670 B10R0.71 N#CCCNCCCCCO 9954609c9fff15a7d1cfe4740350aa9f [1,0,0,0,0,0|2,0,1]=4 1671 B10R0.71 N#CCNCCCCCCO 2c0b7aab41edf0ac30f256e4d15a0e6c [1,0,0,0,0,0|2,0,1]=4 1672 B10R0.71 N#CNCCCCCCCO 450b809987768541ee874e2f2eb0a965 [1,0,0,0,0,0|2,0,1]=4 1673 B10R0.71 NOCCCCNCCCO 3a9af48cd2165c222580de9ab2539d17 [1,0,0,0,0,0|3,0,0]=4 1674 B10R0.71 NOCCNCCCCCO 1e9f1faecdb8448fdab92603ae44149a [1,0,0,0,0,0|3,0,0]=4 1675 B10R0.71 O=CCCCCCNCCO 5900fdcb8d23fb631caf7cedc101f7cc [1,0,0,0,0,0|2,0,1]=4 1676 B10R0.71 O=CCCCCNCCCO 7d2ca72bf8bb26fa78069088f8a3b039 [1,0,0,0,0,0|2,0,1]=4 1677 B10R0.71 O=CCCCNCCCCO 07eb4dce5dd254d016caf3b4b0f853f3 [1,0,0,0,0,0|2,0,1]=4 1678 B10R0.71 O=CCCNCCCCCO e97db855c638d6ab4c487d701aef387d [1,0,0,0,0,0|2,0,1]=4 1679 B10R0.71 O=CCNCCCCCCO a01d155e25e8de1494aee669d2de79cd [1,0,0,0,0,0|2,0,1]=4 1680 B10R0.71 O=CNCCCCCCCO 862a670259a59d4910de7b21ab417c1e [1,0,0,0,0,0|2,0,1]=4 1681 B10R0.71 OCCCCCCCNCF 89e09816a55bae9b6b856648bab51c48 [1,0,0,0,0,0|2,0,0]=3 1682 B10R0.71 OCCCCCCCNCO 80fccc105e20af1e1af9a49c91f16cd0 [1,0,0,0,0,0|2,0,0]=3 1683 B10R0.71 OCCCCCCNCCBr 553fecb754e159e2bd5c0d5b2932c876 [1,0,0,0,0,0|2,0,0]=3 1684 B10R0.71 OCCCCCCNCCF 1b169bdfb80ba61c6714c95c8b3d6768 [1,0,0,0,0,0|2,0,0]=3 1685 B10R0.71 OCCCCCCNCCI be84ca9424a4ae6dece3ab323db6b0c1 [1,0,0,0,0,0|2,0,0]=3 1686 B10R0.71 OCCCCCCNCCO 273922bfa3fe4a4663e43f7e307f9ceb [1,0,0,0,0,0|2,0,0]=3 1687 B10R0.71 OCCCCCCNCCS 93e1cd94d9ee12dd07b8e4136f52d11f [1,0,0,0,0,0|2,0,0]=3 1688 B10R0.71 OCCCCCNCCCCl a66c64e785b6ff44ef42d7160e14c2a5 [1,0,0,0,0,0|2,0,0]=3 1689 B10R0.71 OCCCCCNCCCF 50b3a9c0d03a8801f4e3adb3a3fcccb2 [1,0,0,0,0,0|2,0,0]=3 1690 B10R0.71 OCCCCCNCCCO 072a5f4ea609bc4de4e53ba65e8ed45e [1,0,0,0,0,0|2,0,0]=3 1691 B10R0.71 OCCCCCNCCCS ac447f37d9369f6412bbe09cfcfad84a [1,0,0,0,0,0|2,0,0]=3 1692 B10R0.71 OCCCCNCCCCCl 7bd505d159c87c5f4f67443650980998 [1,0,0,0,0,0|2,0,0]=3 1693 B10R0.71 OCCCCNCCCCF f5b849efef169df539bb8cf3c5e3f705 [1,0,0,0,0,0|2,0,0]=3 1694 B10R0.71 OCCCCNCCCCO 54c7baa1496a0472a98a5aa5b31fc6d8 [1,0,0,0,0,0|2,0,0]=3 1695 B10R0.71 OCCCCNCCCCS 3aa32fca5ab0eb9e1356e36b637eed09 [1,0,0,0,0,0|2,0,0]=3 1696 B10R0.71 OCCCNCCCCCCl d945c080f090736cd2679661c70ad929 [1,0,0,0,0,0|2,0,0]=3 1697 B10R0.71 OCCCNCCCCCF 0160daefb48a996acb910c63c049dc11 [1,0,0,0,0,0|2,0,0]=3 1698 B10R0.71 OCCCNCCOCCO a4c7bde023d4bc44ce67dbade30b1f89 [1,0,0,0,0,0|3,0,0]=4 1699 B10R0.71 OCCCNCCOCCS 38e0ad8816d33bf5a4fec937a219a715 [1,0,0,0,0,0|3,0,0]=4 1700 B10R0.71 OCCCNCCSCCO e457035e3b72f737fec8d3f96a323ff5 [1,0,0,0,0,0|3,0,0]=4 1701 B10R0.71 OCCCOCCCNCF ce54b0aac20eea8acc163b80b0d3fad9 [1,0,0,0,0,0|3,0,0]=4 1702 B10R0.71 OCCCOCCCNCO faa15dc3f2149e0df94a7022b21fce7c [1,0,0,0,0,0|3,0,0]=4 1703 B10R0.71 OCCCOCCNCCF 706d515fcec25c2d9afd49a011649c9a [1,0,0,0,0,0|3,0,0]=4 1704 B10R0.71 OCCCOCCNCCO 2b24eb05430bd2aa62676d15f33651f4 [1,0,0,0,0,0|3,0,0]=4 1705 B10R0.71 OCCCOCCNCCS a9045ffc61a1b86dbf9a14b3b91ae80a [1,0,0,0,0,0|3,0,0]=4 1706 B10R0.71 OCCNCCCCCCCl 79b9a5a7709c9484ebb57666642b4ad2 [1,0,0,0,0,0|2,0,0]=3 1707 B10R0.71 OCCNCCCCCCF 2d1a46b71da8cc78f8a4b65137161bb5 [1,0,0,0,0,0|2,0,0]=3 1708 B10R0.71 OCCNCCCOCCO 8be58e92da02d1842535eb309f247e5e [1,0,0,0,0,0|3,0,0]=4 1709 B10R0.71 OCCOCCCNCCF 344bb0a56f99ecce648f66fac8f4d696 [1,0,0,0,0,0|3,0,0]=4 1710 B10R0.71 OCCOCCCNCCS 733f8b2204d41a355b5afeb7e564212c [1,0,0,0,0,0|3,0,0]=4 1711 B10R0.71 OCCOCCNCCCCl 58813dcc997ae722373a67e3a428ce7d [1,0,0,0,0,0|3,0,0]=4 1712 B10R0.71 OCCOCCNCCCF 75afb9bce14dab125c73cdb75f1f1da0 [1,0,0,0,0,0|3,0,0]=4 1713 B10R0.71 OCCOCCNCCCS 600ebd555a783318206060b5e6cb8069 [1,0,0,0,0,0|3,0,0]=4 1714 B10R0.71 OCCSCCCCNCF d52fe9aaa7378237a01563f2dd6f6b91 [1,0,0,0,0,0|3,0,0]=4 1715 B10R0.71 OCCSCCCCNCO 1e9e7ef077d6aa1ba00654dd49fda346 [1,0,0,0,0,0|3,0,0]=4 1716 B10R0.71 OCCSCCNCCCF 9c9a8ef35002faf51801dac255d43713 [1,0,0,0,0,0|3,0,0]=4 1717 B10R0.71 OCCSCCNCCCS d044e9eb6638d363def32e9cc741ed01 [1,0,0,0,0,0|3,0,0]=4 1718 B10R0.71 SCCCCCCOCCS e394aec0ef6f50093283664965a38be0 [1,0,0,0,0,0|2,1,0]=4 1719 B10R0.71 SCCCNCCCCCCl 3551ad47e9e9b302a06f463e6fd64dc6 [1,0,0,0,0,0|2,1,0]=4 1720 B10R0.71 SCCNCCCCCCCl 7c74e964d4bf705de320731c90924545 [1,0,0,0,0,0|2,1,0]=4 1721 B12R0.4 C#CCCCCCN(C)CC(C)O a04dc8606d3de9cc85af89d3215120bd [0,1,0,0,0,0|1,0,2]=4 1722 B12R0.4 C#CCCCCCN(C)C[C@H](C)O d11612906b0d12b7fb0804c3ea33575b [0,1,0,0,0,0|1,0,2]=4 1723 B12R0.4 C#CCCCCNC(C)CC(C)O 9ca3aef918219454d712f6c0cd50d444 [0,1,0,0,0,0|1,0,2]=4 1724 B12R0.4 C/C=C\CCCNC(C)CC(C)O 84e5d8cc65ebd06484ceeb7bb54ce9cd [0,1,0,0,0,0|1,0,2]=4 1725 B12R0.4 C=C(C)CN(C)CCCCCCC e2e6954fc15de1596aa00eb497b517f6 [0,1,0,0,0,0|2,0,1]=4 1726 B12R0.4 C=CCCCCCN(C)CC(C)O f126eda5d7ddfd24c80d48c8e2d03ec4 [0,1,0,0,0,0|1,0,2]=4 1727 B12R0.4 C=CCCCCCN(C)C[C@@H](C)O 1fdc158d71c9255499eec239e2744d05 [0,1,0,0,0,0|1,0,2]=4 1728 B12R0.4 C=CCCCCCN(C)C[C@H](C)O 458893d44f391a88456152536512dedd [0,1,0,0,0,0|1,0,2]=4 1729 B12R0.4 C=CCCCCNC(C)CC(C)O 8924d39b75925e122caaa0410fa5e80f [0,1,0,0,0,0|1,0,2]=4 1730 B12R0.4 CC(C)CC(C)CCCOCCF 942ed94e7442a27ff69f756662ec77fe [0,1,0,0,0,0|3,0,0]=4 1731 B12R0.4 CC(C)CC(C)CCCOCCS 820e60391b7a9b85426d2b82d139385e [0,1,0,0,0,0|3,0,0]=4 1732 B12R0.4 CC(C)CC(C)CCOCCCF 81968330b11957800425d580e2f43297 [0,1,0,0,0,0|3,0,0]=4 1733 B12R0.4 CC(C)CC(C)CCOCCCS a3b2bb702d47fa990b3663b436740678 [0,1,0,0,0,0|3,0,0]=4 1734 B12R0.4 CC(C)CC(C)COCCCCF a693193784bea674410a7ce182498c7b [0,1,0,0,0,0|3,0,0]=4 1735 B12R0.4 CC(C)CC(C)NCCCCCCl 78ce2381d777e12e0e91ccec251ba10e [0,1,0,0,0,0|3,0,0]=4 1736 B12R0.4 CC(C)CC(C)NCCCCCF 3dddbbd0d406deab65ee7b849449c748 [0,1,0,0,0,0|3,0,0]=4 1737 B12R0.4 CC(C)CC(C)NCCCCCO 5293d57fda7775c5a3355289a723b929 [0,1,0,0,0,0|3,0,0]=4 1738 B12R0.4 CC(C)CC(C)OCCCCCF 05d423bfbeda2810c028ff68a5a1d193 [0,1,0,0,0,0|3,0,0]=4 1739 B12R0.4 CC(C)CC(O)CNCCCCF 7aad4847cc10a1adcdf0d17480181fb3 [0,1,0,0,0,0|3,0,0]=4 1740 B12R0.4 CC(C)CC(O)CNCCCCO a857b3fbab3e336918a6dffc3c303715 [0,1,0,0,0,0|3,0,0]=4 1741 B12R0.4 CC(C)CN(C)CCCCCCF 4e71872d361aa1497ab37d9488435ddb [0,1,0,0,0,0|3,0,0]=4 1742 B12R0.4 CC(C)CN(C)CCCCCCO 43cc8f8263cb8df280c5bc6812a540a0 [0,1,0,0,0,0|3,0,0]=4 1743 B12R0.4 CC(C)C[C@@H](C)OCCCCCF cf7bab716e2ca0476a5a6514c624ee4a [0,1,0,0,0,0|3,0,0]=4 1744 B12R0.4 CC(C)C[C@H](C)OCCCCCF d12d6ad1f7e051f3d7f3b4efae30f943 [0,1,0,0,0,0|3,0,0]=4 1745 B12R0.4 CC(O)CC(=O)NCCCCCCl 695e2375256ee55835ab003e3691b3ad [0,1,0,0,0,0|2,0,1]=4 1746 B12R0.4 CC(O)CC(=O)NCCCCCO f1934e3d32f61937c50698f5901f099a [0,1,0,0,0,0|2,0,1]=4 1747 B12R0.4 CC(O)CC(C)NCCCCC#N fdb80ea0bca7288790c7eab15d38e825 [0,1,0,0,0,0|2,0,1]=4 1748 B12R0.4 CC(O)CC(C)NCCCCC=O ad9d6a3c6a9b7c3c439d3bd6245e957e [0,1,0,0,0,0|2,0,1]=4 1749 B12R0.4 CC(O)CC(C)NCCCCCF 587312737c2aad9b768c97b3fc141c3b [0,1,0,0,0,0|2,0,0]=3 1750 B12R0.4 CC(O)CC(C)NCCCCCO bd2603a499d085ec0091e53d052b7af5 [0,1,0,0,0,0|2,0,0]=3 1751 B12R0.4 CC(O)CC(C)NCCCCON 982318405c7a636318e105c157d55695 [0,1,0,0,0,0|3,0,0]=4 1752 B12R0.4 CC(O)CC(C)NCCOCCO 680fcd61cbf5d7dbe6be86ce24e3de14 [0,1,0,0,0,0|3,0,0]=4 1753 B12R0.4 CC(O)CN(C)CCCCCC#N b6298758f1fe110b49a5288e687b5446 [0,1,0,0,0,0|2,0,1]=4 1754 B12R0.4 CC(O)CN(C)CCCCCC=O 065cc811ce71b4210941764670ed7ac2 [0,1,0,0,0,0|2,0,1]=4 1755 B12R0.4 CC(O)CN(C)CCCCCCF 08857294edcef65d703adaf22db11911 [0,1,0,0,0,0|2,0,0]=3 1756 B12R0.4 CC(O)CN(C)CCCCCCO ab43a237669060586c957a89959b51ec [0,1,0,0,0,0|2,0,0]=3 1757 B12R0.4 CC/C=C\CCNC(C)CC(C)O 498441db2926777833734dc45ea92ba1 [0,1,0,0,0,0|1,0,2]=4 1758 B12R0.4 CCC/C=C/CNC(C)CC(C)O a2f3aa60d16536970ca048a756629e4a [0,1,0,0,0,0|1,0,2]=4 1759 B12R0.4 CCC/C=C\CNC(C)CC(C)O f78477c0ef6a7fed5a18dcc1de9d5e17 [0,1,0,0,0,0|1,0,2]=4 1760 B12R0.4 CCCC/C=C/CN(C)CC(C)O 259ce5dfa19c4c5a2b36fb5f472758a9 [0,1,0,0,0,0|1,0,2]=4 1761 B12R0.4 CCCC/C=C/CN(C)C[C@H](C)O 2e6d0e913427250530b9d2c2f11b2b51 [0,1,0,0,0,0|1,0,2]=4 1762 B12R0.4 CCCC/C=C\CN(C)CC(C)O bf5cb75f845fa3b3b59be2940e48fdcb [0,1,0,0,0,0|1,0,2]=4 1763 B12R0.4 CCCC/C=C\CN(C)C[C@H](C)O 2e9ee4645c47a4e461e2de7400b773e3 [0,1,0,0,0,0|1,0,2]=4 1764 B12R0.4 CCCCCCCC(C)OC(C)C 0b1c4c7163fdf62bb81c82fe66c2781b [0,1,0,0,0,0|2,0,0]=3 1765 B12R0.4 CCCCCCCN(C)CC(=O)O 2a8ec6178d231ca3a2022f1eba3a0975 [0,1,0,0,0,0|2,0,1]=4 1766 B12R0.4 CCCCCCCN(C)CC(C)C c5a0b4dad621f3822a9d1b21c3268cd8 [0,1,0,0,0,0|2,0,0]=3 1767 B12R0.4 CCCCCCCN(C)CC(C)O 88feca56b34c0071fa7b4a34619f34d9 [0,1,0,0,0,0|1,0,0]=2 1768 B12R0.4 CCCCCCCN(C)CC(F)F 6f6ab201877556489f39c56619afa1ac [0,1,0,0,0,0|3,0,0]=4 1769 B12R0.4 CCCCCCCN(C)CN(C)C c7854c7cef1a3d59635bb3c97f815731 [0,1,0,0,0,0|3,0,0]=4 1770 B12R0.4 CCCCCCCN(C)C[C@@H](C)O 7c172e11e79cd7e87b9a99725a3e60f1 [0,1,0,0,0,0|1,0,0]=2 1771 B12R0.4 CCCCCCCN(C)C[C@H](C)O eeba1698a8237d9658c67a8c9c38cc26 [0,1,0,0,0,0|1,0,0]=2 1772 B12R0.4 CCCCCCC[C@H](C)NC(=O)C efa629917977f4356a0c237fa7923f0f [0,1,0,0,0,0|1,0,2]=4 1773 B12R0.4 CCCCCCC[C@H](C)NC(C)C 830ed00f20ab1c2ec302b11f80111207 [0,1,0,0,0,0|2,0,0]=3 1774 B12R0.4 CCCCCCNC(=O)CC(C)C e2d134362e4b3b169a1a366090e8721d [0,1,0,0,0,0|2,0,1]=4 1775 B12R0.4 CCCCCCNC(=O)CC(C)O 32b3b559c8d90ec3b5ebd997d1c19579 [0,1,0,0,0,0|1,0,1]=3 1776 B12R0.4 CCCCCCNC(=O)C[C@@H](C)O d720b44ab195250c4b816c2522179c13 [0,1,0,0,0,0|1,0,1]=3 1777 B12R0.4 CCCCCCNC(=O)C[C@H](C)O 5de5d081808d5a3720bc88cf4dabcf1f [0,1,0,0,0,0|1,0,1]=3 1778 B12R0.4 CCCCCCNC(C)CC(=O)O 1d4cde652ab467548cd9a30d2c612ac0 [0,1,0,0,0,0|2,0,1]=4 1779 B12R0.4 CCCCCCNC(C)CC(C)C 75c4776e93142fa96d6e2bc1707a0d5e [0,1,0,0,0,0|2,0,0]=3 1780 B12R0.4 CCCCCCNC(C)CC(C)O b2a00b4b9b4f168db9a930bf770fcde1 [0,1,0,0,0,0|1,0,0]=2 1781 B12R0.4 CCCCCCNC(C)CN(C)C dc6be7d8f6296c2b7c5f000fd3e88086 [0,1,0,0,0,0|3,0,0]=4 1782 B12R0.4 CCCCCCN[C@@H](C)CC(=O)O 8deb71992734c69dcd2dee032cb8ec29 [0,1,0,0,0,0|2,0,1]=4 1783 B12R0.4 CCCCCCN[C@@H](C)CN(C)C d724397ed41e10780c3505ce002d5a4d [0,1,0,0,0,0|3,0,0]=4 1784 B12R0.4 CCCCCCN[C@H](C)CC(=O)O 911234cd7e78f2330ebe0fdd8a8635af [0,1,0,0,0,0|2,0,1]=4 1785 B12R0.4 CCCCCCN[C@H](C)CN(C)C 8c3ef2f8d4388ce427d380add1de4564 [0,1,0,0,0,0|3,0,0]=4 1786 B12R0.4 CCCCCCOC(C)CC(=O)O f4225b3e766040640b9fd17cd888aef0 [0,1,0,0,0,0|2,0,1]=4 1787 B12R0.4 CCCCCCOC(C)CC(C)C 6560c956dee98a278963955c67d66da6 [0,1,0,0,0,0|2,0,0]=3 1788 B12R0.4 CCCCCCOC(C)CN(C)C 769fa8d939ccdb2eacfd51a952b7df50 [0,1,0,0,0,0|3,0,0]=4 1789 B12R0.4 CCCCCCO[C@@H](C)CC(=O)O e05a932cee4ddf9217b161d7af5fa013 [0,1,0,0,0,0|2,0,1]=4 1790 B12R0.4 CCCCCCO[C@@H](C)CC(C)C 1fedb3350284afee43b7173c9f16b760 [0,1,0,0,0,0|2,0,0]=3 1791 B12R0.4 CCCCCCO[C@@H](C)CN(C)C 99bf97c9e51f791ec148daf4a23346b1 [0,1,0,0,0,0|3,0,0]=4 1792 B12R0.4 CCCCCCO[C@H](C)CC(=O)O e81e1d5ef086ae65fd4d151e3abf1732 [0,1,0,0,0,0|2,0,1]=4 1793 B12R0.4 CCCCCCO[C@H](C)CC(C)C cead5d22bcf79121f5c0623fc0b49e5d [0,1,0,0,0,0|2,0,0]=3 1794 B12R0.4 CCCCCCO[C@H](C)CN(C)C 27df159ba6a483cd1630c6c9b0f0d994 [0,1,0,0,0,0|3,0,0]=4 1795 B12R0.4 CCCCCNCC(=O)CC(C)C 44a613dfb5e5bef891f656e0cbe6cf01 [0,1,0,0,0,0|2,0,1]=4 1796 B12R0.4 CCCCCNCC(C)CN(C)C 890bdfbf2cc3d261eff8ef2a446b47e1 [0,1,0,0,0,0|3,0,0]=4 1797 B12R0.4 CCCCCNCC(O)CC(=O)O 642caecef057faea07b0e6f4c31f6ecd [0,1,0,0,0,0|2,0,1]=4 1798 B12R0.4 CCCCCNCC(O)CC(C)C 71335f55f9ccb14865f9b13df7956f94 [0,1,0,0,0,0|2,0,0]=3 1799 B12R0.4 CCCCCNCC(O)CN(C)C 3deb57cade785aa093e1d36d2b07db5d [0,1,0,0,0,0|3,0,0]=4 1800 B12R0.4 CCCCCNC[C@@H](O)CC(=O)O ba98d93aac74f49d69884cd63cd1d5f0 [0,1,0,0,0,0|2,0,1]=4 1801 B12R0.4 CCCCCNC[C@H](O)CC(=O)O 28bca3202b26d0b57f55175bc12bc7c7 [0,1,0,0,0,0|2,0,1]=4 1802 B12R0.4 CCCCCOCC(=O)CC(C)C c9f4e66b4bbf9b5f9530cc231f88e0a9 [0,1,0,0,0,0|2,0,1]=4 1803 B12R0.4 CCCCCOCC(C)CC(C)C c7769006f5f658a3a18768a2e3a2ffa5 [0,1,0,0,0,0|2,0,0]=3 1804 B12R0.4 CCCCCOCC(C)CN(C)C acbe92dd400b3448cbc74c7604e44732 [0,1,0,0,0,0|3,0,0]=4 1805 B12R0.4 CCCCCOC[C@@H](C)CN(C)C 1628c832d6a95f81e323bcb2a741ba48 [0,1,0,0,0,0|3,0,0]=4 1806 B12R0.4 CCCCCOC[C@H](C)CN(C)C 54cbe6b2448f245c854f9130d7f1f3ef [0,1,0,0,0,0|3,0,0]=4 1807 B12R0.4 CCCCNCCC(C)CC(=O)O 55bb5acd90b3edf10f904ac2640ffbdf [0,1,0,0,0,0|2,0,1]=4 1808 B12R0.4 CCCCOCCC(C)CC(=O)O 06fc54d24c270dc9b96451c515f7662e [0,1,0,0,0,0|2,0,1]=4 1809 B12R0.4 CCCCOCCC(C)CC(C)C 7d77cd7d28467d0485b5a87837bf7d63 [0,1,0,0,0,0|2,0,0]=3 1810 B12R0.4 CCCCOCCN(C)CC(C)C 6c228702cb2aef56faaad8c1afdc03e3 [0,1,0,0,0,0|3,0,0]=4 1811 B12R0.4 CCCCOCCN(C)CC(C)O 710f6b0138398338ac24cd1b87cfc8ce [0,1,0,0,0,0|2,0,0]=3 1812 B12R0.4 CCCCOCCN(C)C[C@H](C)O f2eb81624977965d611f95c8ee2ee026 [0,1,0,0,0,0|2,0,0]=3 1813 B12R0.4 CCCCOCNC(C)CC(C)C 4b897832543c446f364e86ab2b397708 [0,1,0,0,0,0|3,0,0]=4 1814 B12R0.4 CCCCOCNC(C)CC(C)O 6ea935660ddd6853f4a2f22c716ad38e [0,1,0,0,0,0|2,0,0]=3 1815 B12R0.4 CCCCOCOC(C)CC(C)C 7a16e811a9b77f1cd33b3666c19beb10 [0,1,0,0,0,0|3,0,0]=4 1816 B12R0.4 CCCCOCO[C@@H](C)CC(C)C 97732bbd440966772d2a8a338cb0c940 [0,1,0,0,0,0|3,0,0]=4 1817 B12R0.4 CCCCOCO[C@H](C)CC(C)C a897cddc6e857eb9730eb280f075bcd2 [0,1,0,0,0,0|3,0,0]=4 1818 B12R0.4 CCCOCCCC(C)CC(C)C 89dc6ce86f19db747f1ef998dfa973b6 [0,1,0,0,0,0|2,0,0]=3 1819 B12R0.4 CCCOCCCN(C)CC(C)C 37bbabe52c0097508ad40f55c1b19a69 [0,1,0,0,0,0|3,0,0]=4 1820 B12R0.4 CCCOCCCN(C)CC(C)O 32b215800508ff659d1a49a7da6c3cf7 [0,1,0,0,0,0|2,0,0]=3 1821 B12R0.4 CCCOCCCN(C)C[C@H](C)O 56776983863ee4e40e0663a2f44444f4 [0,1,0,0,0,0|2,0,0]=3 1822 B12R0.4 CCCOCCNC(=O)CC(C)O 23d34135ec4d4cb31bba7003e2c43dbb [0,1,0,0,0,0|2,0,1]=4 1823 B12R0.4 CCCOCCNC(=O)C[C@@H](C)O 30dc87323f04980da15514af4c3d8b32 [0,1,0,0,0,0|2,0,1]=4 1824 B12R0.4 CCCOCCNC(=O)C[C@H](C)O c26d75d5a4601257914dffef431078df [0,1,0,0,0,0|2,0,1]=4 1825 B12R0.4 CCCOCCNC(C)CC(C)C 50eef8a7f65ee7b4093e0a8a11460b45 [0,1,0,0,0,0|3,0,0]=4 1826 B12R0.4 CCCOCCNC(C)CC(C)O 5964af19329f2da797749079d11d5ce7 [0,1,0,0,0,0|2,0,0]=3 1827 B12R0.4 CCCOCCOC(C)CC(C)C 9523f427d1ee052064778419c3d5f970 [0,1,0,0,0,0|3,0,0]=4 1828 B12R0.4 CCCOCCO[C@@H](C)CC(C)C 55bc70c331cf08042661cf7b0a11ef7a [0,1,0,0,0,0|3,0,0]=4 1829 B12R0.4 CCCOCCO[C@H](C)CC(C)C 4794306ec4517a96a30bcb109153b3f7 [0,1,0,0,0,0|3,0,0]=4 1830 B12R0.4 CCCSCCOC(C)CC(C)C a3dfc87a3545e68906663c0f9d394340 [0,1,0,0,0,0|3,0,0]=4 1831 B12R0.4 CCOCCCNC(=O)CC(C)O 7e0c7d8a45075de3cf854be15f71c82e [0,1,0,0,0,0|2,0,1]=4 1832 B12R0.4 CCOCCCNC(=O)C[C@@H](C)O abf3ec743e44271d3fb671b46cc7fd3e [0,1,0,0,0,0|2,0,1]=4 1833 B12R0.4 CCOCCCNC(=O)C[C@H](C)O 0402fae037cbc8e82e87dc84f13d6757 [0,1,0,0,0,0|2,0,1]=4 1834 B12R0.4 CCOCCCNC(C)CC(C)C d0864b990e9cb47393ee977bef6cf36b [0,1,0,0,0,0|3,0,0]=4 1835 B12R0.4 CCOCCCNC(C)CC(C)O e358ccca368409aaa13c75f35cd060fa [0,1,0,0,0,0|2,0,0]=3 1836 B12R0.4 CCOCCCOC(C)CC(C)C cdafde57a4dd9d0e5079e321c2ca3f15 [0,1,0,0,0,0|3,0,0]=4 1837 B12R0.4 CCOCCCO[C@@H](C)CC(C)C 5b7269d4396defbc3e1a0be9711154bb [0,1,0,0,0,0|3,0,0]=4 1838 B12R0.4 CCOCCCO[C@H](C)CC(C)C 83c0568d1c1018a1a5250f6eae0d1c45 [0,1,0,0,0,0|3,0,0]=4 1839 B12R0.4 CCOCCNCC(O)CC(C)C 0fcbf4edd41720188e922e989b1dd2c9 [0,1,0,0,0,0|3,0,0]=4 1840 B12R0.4 CCOCCOCC(C)CC(C)C 7ca2ee5c6b521b562ddee8fe541fb073 [0,1,0,0,0,0|3,0,0]=4 1841 B12R0.4 CCOCOCCC(C)CC(C)C 601d80dc425d98b451dbadbc5d994ba1 [0,1,0,0,0,0|3,0,0]=4 1842 B12R0.4 CCSCCCNC(C)CC(C)C a81320f03bb870751296b48a083b5146 [0,1,0,0,0,0|3,0,0]=4 1843 B12R0.4 CCSCCCNC(C)CC(C)O e94a85b1dfc66862dcd1181109a3bacd [0,1,0,0,0,0|2,0,0]=3 1844 B12R0.4 CCSCCCOC(C)CC(C)C be2c6d3db1993565cb898733ae9eef6b [0,1,0,0,0,0|3,0,0]=4 1845 B12R0.4 CCSCCCO[C@@H](C)CC(C)C dc874657970cbf115eedc62da421b8b1 [0,1,0,0,0,0|3,0,0]=4 1846 B12R0.4 CCSCCCO[C@H](C)CC(C)C dbecb6184afa6428b5493649039fb012 [0,1,0,0,0,0|3,0,0]=4 1847 B12R0.4 CCSCCNCC(O)CC(C)C 804fb282ee87496f1935aa7572e9c51d [0,1,0,0,0,0|3,0,0]=4 1848 B12R0.4 CCSCCOCC(C)CC(C)C 107dc93bd871a7d26fb0d46af9a26bb3 [0,1,0,0,0,0|3,0,0]=4 1849 B12R0.4 COCCCCCN(C)CC(C)C 26f8df99b370eec0ab2c460d883d834b [0,1,0,0,0,0|3,0,0]=4 1850 B12R0.4 COCCCCCN(C)CC(C)O ab2fe107c3d48b565e7a76106c793e5e [0,1,0,0,0,0|2,0,0]=3 1851 B12R0.4 COCCCCCN(C)C[C@H](C)O 101fdb9a9a3257b494ccc84072ae80b3 [0,1,0,0,0,0|2,0,0]=3 1852 B12R0.4 COCCCCNC(=O)CC(C)O a8e04034d183a8fbdb9a58b27bf0958e [0,1,0,0,0,0|2,0,1]=4 1853 B12R0.4 COCCCCNC(=O)C[C@@H](C)O 09217f4f9fa0398c832e92ef7e2e7b15 [0,1,0,0,0,0|2,0,1]=4 1854 B12R0.4 COCCCCNC(=O)C[C@H](C)O 3b22249fb0898e5d3c810ae7f97a3a6f [0,1,0,0,0,0|2,0,1]=4 1855 B12R0.4 COCCCCNC(C)CC(C)C 93ebc0f6f141f6a0ab8f464fda75241f [0,1,0,0,0,0|3,0,0]=4 1856 B12R0.4 COCCCCNC(C)CC(C)O a818d4c22060f55e2691414878b62c1f [0,1,0,0,0,0|2,0,0]=3 1857 B12R0.4 COCCCCOC(C)CC(C)C d108d3ae0d0ca1060b11e88ce195bf11 [0,1,0,0,0,0|3,0,0]=4 1858 B12R0.4 COCCCCO[C@@H](C)CC(C)C 15c77cd4128115f7963de25c49690886 [0,1,0,0,0,0|3,0,0]=4 1859 B12R0.4 COCCCCO[C@H](C)CC(C)C 5cafd1c89a3293510e20b2ef71a0684c [0,1,0,0,0,0|3,0,0]=4 1860 B12R0.4 COCCCNCC(O)CC(C)C d8b96b0a22a439a6e44725c0ab378d90 [0,1,0,0,0,0|3,0,0]=4 1861 B12R0.4 COCCCOCC(C)CC(C)C fe0087e474310959ea6e4345ff4481f0 [0,1,0,0,0,0|3,0,0]=4 1862 B12R0.4 COCCOCCC(C)CC(C)C 3795e2fd8dcca9b4dd65ea2dd5b37140 [0,1,0,0,0,0|3,0,0]=4 1863 B12R0.4 COCCOCCN(C)CC(C)O 3a13630b8b955fe09890fbfe70fe3265 [0,1,0,0,0,0|3,0,0]=4 1864 B12R0.4 COCCOCCN(C)C[C@@H](C)O 03cdbafe4d65913aadc8828c415d0d47 [0,1,0,0,0,0|3,0,0]=4 1865 B12R0.4 COCCOCCN(C)C[C@H](C)O cb4383a0c30b2570ac7f40318736fdfa [0,1,0,0,0,0|3,0,0]=4 1866 B12R0.4 COCCOCNC(C)CC(C)O ab2d2af9db76a3baf8e36e8a1a607c8b [0,1,0,0,0,0|3,0,0]=4 1867 B12R0.4 COCOCCCC(C)CC(C)C 33c21b5f0728068b7eda20ed51b31a0e [0,1,0,0,0,0|3,0,0]=4 1868 B12R0.4 COCOCCNC(C)CC(C)O c099a4b4dbb8f2a1f4c4a25653ae0474 [0,1,0,0,0,0|3,0,0]=4 1869 B12R0.4 CSCCCCNC(=O)CC(C)O f5ce1597960c2036157c0050d2ce0cc3 [0,1,0,0,0,0|2,0,1]=4 1870 B12R0.4 CSCCCCNC(=O)C[C@@H](C)O 817110ecc76fbda156e82a71cf2e3ca3 [0,1,0,0,0,0|2,0,1]=4 1871 B12R0.4 CSCCCCNC(=O)C[C@H](C)O 22f626ffc847013cdbb7b0075af47a48 [0,1,0,0,0,0|2,0,1]=4 1872 B12R0.4 CSCCCCNC(C)CC(C)C 0486a622911d71536f0c3bbf6e9ae411 [0,1,0,0,0,0|3,0,0]=4 1873 B12R0.4 CSCCCCOC(C)CC(C)C f572b784eef207b8a77d9df36c3ad9cd [0,1,0,0,0,0|3,0,0]=4 1874 B12R0.4 CSCCCNCC(O)CC(C)C 4240cb19d7d39ec08fc0182e307547b5 [0,1,0,0,0,0|3,0,0]=4 1875 B12R0.4 CSCCCOCC(C)CC(C)C 1c48cb7cb1385a66a031a9bb738dbbe9 [0,1,0,0,0,0|3,0,0]=4 1876 B12R0.4 CSCCOCCC(C)CC(C)C 2864459a5b2fa28deb4e599357cf7b3e [0,1,0,0,0,0|3,0,0]=4 1877 B12R0.4 CSCOCCCC(C)CC(C)C b980627e7d3e3e738d6802378116da8d [0,1,0,0,0,0|3,0,0]=4 1878 B12R0.4 C[C@@H](O)CC(=O)NCCCCCCl 155d9eda2f5a89916d9ebc0a7769c227 [0,1,0,0,0,0|2,0,1]=4 1879 B12R0.4 C[C@@H](O)CC(=O)NCCCCCO 143d12efcae6b56933ae8c5b075ffc23 [0,1,0,0,0,0|2,0,1]=4 1880 B12R0.4 C[C@@H](O)CN(C)CCCCCCO c4c43551d283b2c7e6b5325459ba568c [0,1,0,0,0,0|2,0,0]=3 1881 B12R0.4 C[C@H](O)CC(=O)NCCCCCCl 83c19f62aacd3fe6c92d27bc0398ee9f [0,1,0,0,0,0|2,0,1]=4 1882 B12R0.4 C[C@H](O)CC(=O)NCCCCCO b1570d654c2096fabceff30bbe1ed60e [0,1,0,0,0,0|2,0,1]=4 1883 B12R0.4 C[C@H](O)CN(C)CCCCCC#N 58d2211bb8f3f191b954c4a982e1f690 [0,1,0,0,0,0|2,0,1]=4 1884 B12R0.4 C[C@H](O)CN(C)CCCCCC=O 913d4b5a8d694cbc76d21c52b7cc2ebc [0,1,0,0,0,0|2,0,1]=4 1885 B12R0.4 C[C@H](O)CN(C)CCCCCCF 213cdc3a3c27be1b42fe848ccb74e749 [0,1,0,0,0,0|2,0,0]=3 1886 B12R0.4 C[C@H](O)CN(C)CCCCCCO bf325a8cc14944e7042d5827495c8fd9 [0,1,0,0,0,0|2,0,0]=3 1887 B12R0.95 C#CCCN(C)CCCCC(C)O 36d47d04db26d76752386febdbeb952a [0,1,0,0,0,0|1,0,2]=4 1888 B12R0.95 C#CCCN(C)CCCC[C@@H](C)O ee882b2d0cec0c1b7185941553c11c67 [0,1,0,0,0,0|1,0,2]=4 1889 B12R0.95 C=C(C)CCCNC(C)CCCC 93d121bdce1895fc618f7c2a630b6f91 [0,1,0,0,0,0|2,0,1]=4 1890 B12R0.95 C=C(C)CCCN[C@H](C)CCCC e94b83693f88ce617a8553adfa5e5a8f [0,1,0,0,0,0|2,0,1]=4 1891 B12R0.95 C=C(C)CCCOC(C)CCCC dd43ed2da7925eeac99b471372cfa5e0 [0,1,0,0,0,0|2,0,1]=4 1892 B12R0.95 C=C(C)CCCO[C@@H](C)CCCC 018e378a6ee57063f049bf7b495df060 [0,1,0,0,0,0|2,0,1]=4 1893 B12R0.95 C=C(C)CCCO[C@H](C)CCCC 15b49b685e3d2201f2e3f2519e817f20 [0,1,0,0,0,0|2,0,1]=4 1894 B12R0.95 C=C(C)CCNCC(O)CCCC 79bd27a7d1368fd829ed56926ca70013 [0,1,0,0,0,0|2,0,1]=4 1895 B12R0.95 C=C(C)CCOCC(C)CCCC c611ab9b7373b5a046255e391e6acb5b [0,1,0,0,0,0|2,0,1]=4 1896 B12R0.95 C=C(C)COCCC(C)CCCC bdcc00922eea1e7080444d3fc241fbab [0,1,0,0,0,0|2,0,1]=4 1897 B12R0.95 C=CCCC(O)CNCCC(C)O 306f72b79dc8ba1917ec16aff24cf9a5 [0,1,0,0,0,0|1,0,2]=4 1898 B12R0.95 C=CCCN(C)CCCCC(C)O d684a01cd67edc8330ebe21e1c382795 [0,1,0,0,0,0|1,0,2]=4 1899 B12R0.95 C=CCCN(C)CCCC[C@@H](C)O 003aac7a4bf32ee9e2c59b70bcad3785 [0,1,0,0,0,0|1,0,2]=4 1900 B12R0.95 C=CCC[C@@H](O)CNCCC(C)O 18f612dab31f3e05fe0f4b3cc52a9d4f [0,1,0,0,0,0|1,0,2]=4 1901 B12R0.95 C=CCC[C@@H](O)CNCC[C@@H](C)O 2fe13ac46635c173a5aab4ad1b3ffc92 [0,1,0,0,0,0|1,0,2]=4 1902 B12R0.95 C=CCC[C@@H](O)CNCC[C@H](C)O e4a303e5933f8a73ee9992661dc1e079 [0,1,0,0,0,0|1,0,2]=4 1903 B12R0.95 CC(C)CCCCN(C)CCCO 0f3fdcd855fed2fb62fa55e03f0b455a [0,1,0,0,0,0|3,0,0]=4 1904 B12R0.95 CC(C)CCCNC(C)CCCO 1d5a861f08bd7a23d302826c039859be [0,1,0,0,0,0|3,0,0]=4 1905 B12R0.95 CC(C)CCCN[C@H](C)CCCO a8e9fc6a033ef3c4f6b51f0c92edec00 [0,1,0,0,0,0|3,0,0]=4 1906 B12R0.95 CC(C)CCNC[C@H](C)CCCO 8a045322461d41cdf3f6f15a8d769411 [0,1,0,0,0,0|3,0,0]=4 1907 B12R0.95 CC(O)CCCCN(C)CCC#N 3adcbaf8cd4a0fc698f4d759bad5bc94 [0,1,0,0,0,0|2,0,1]=4 1908 B12R0.95 CC(O)CCCCN(C)CCCO 4d0f9a1ba6734325644dc30b2bbb4f0f [0,1,0,0,0,0|2,0,0]=3 1909 B12R0.95 CC(O)CCCCN(C)CCON d9ed668358aae6b03393c8d882fd6960 [0,1,0,0,0,0|3,0,0]=4 1910 B12R0.95 CC(O)CCCNC(C)CCCO b125c924edc4e12265517ba022243be1 [0,1,0,0,0,0|2,0,0]=3 1911 B12R0.95 CC(O)CCCN[C@H](C)CCCO b83ccf342dde06ed04a7cf0f44314d34 [0,1,0,0,0,0|2,0,0]=3 1912 B12R0.95 CC(O)CCNC[C@H](C)CCCO 02896348b05b38b87d2c69e0abff50bc [0,1,0,0,0,0|2,0,0]=3 1913 B12R0.95 CCCCC(=O)NCCCC(C)C 4cfbd8cd4787b68f67725c2f6395b859 [0,1,0,0,0,0|2,0,1]=4 1914 B12R0.95 CCCCC(=O)OCNCC(C)O 44153623ecf39cc3939ac933198b5245 [0,1,0,0,0,0|2,0,1]=4 1915 B12R0.95 CCCCC(=O)OCNC[C@@H](C)O 154d85b5e31ba6f85d6cd62d8271e631 [0,1,0,0,0,0|2,0,1]=4 1916 B12R0.95 CCCCC(=O)OCNC[C@H](C)O e3492d206ed25d7c1e0ea2b05bf1e2bd [0,1,0,0,0,0|2,0,1]=4 1917 B12R0.95 CCCCC(C)CCOCC(=O)O 9ccda33f86cf11ccf4af02c94bbe2cf3 [0,1,0,0,0,0|2,0,1]=4 1918 B12R0.95 CCCCC(C)CCOCC(C)C 6e56ac07f0455e8220f5bbf0b29bf48c [0,1,0,0,0,0|2,0,0]=3 1919 B12R0.95 CCCCC(C)CCOCC(F)F b6d17bce52ed9fd622df29515c9d554c [0,1,0,0,0,0|3,0,0]=4 1920 B12R0.95 CCCCC(C)CCOCN(C)C 84a0559810918dca1391c3cb89a01ef9 [0,1,0,0,0,0|3,0,0]=4 1921 B12R0.95 CCCCC(C)COCCC(=O)C 75ae99acfb87323513244f7a07dfb8cd [0,1,0,0,0,0|1,0,2]=4 1922 B12R0.95 CCCCC(C)COCCC(=O)O fca2c5198f248b4dcaf925188fefa01b [0,1,0,0,0,0|2,0,1]=4 1923 B12R0.95 CCCCC(C)COCCC(C)C 33b9afb2e96b175222239ab0d09e270c [0,1,0,0,0,0|2,0,0]=3 1924 B12R0.95 CCCCC(C)COCCN(C)C a67ba988c68e9073163c060570797f86 [0,1,0,0,0,0|3,0,0]=4 1925 B12R0.95 CCCCC(C)COCCS(=O)C 559c8f9a8205d56ab4cc6234c4254b53 [0,1,0,0,0,0|2,0,1]=4 1926 B12R0.95 CCCCC(C)COCOC(C)C f7591d2324dba012bfd3292b0670633b [0,1,0,0,0,0|3,0,0]=4 1927 B12R0.95 CCCCC(C)NCCCC(=O)C acc59ca261b249a3b1371f42c6c89e61 [0,1,0,0,0,0|1,0,2]=4 1928 B12R0.95 CCCCC(C)NCCCC(=O)O ada8796f86ae13890572646b7e33d2f1 [0,1,0,0,0,0|2,0,1]=4 1929 B12R0.95 CCCCC(C)NCCCC(C)C fabd5d6d4a7e5f1388366db44bc4586a [0,1,0,0,0,0|2,0,0]=3 1930 B12R0.95 CCCCC(C)NCCCC(C)O 218f8320dbdac59a524a65beccf9896f [0,1,0,0,0,0|1,0,0]=2 1931 B12R0.95 CCCCC(C)NCCCN(C)C ae40eeb9cc6a74aff30c7c7f78299b74 [0,1,0,0,0,0|3,0,0]=4 1932 B12R0.95 CCCCC(C)NCCCS(=O)C c42ccf769a7146e9012bc8711f546974 [0,1,0,0,0,0|2,0,1]=4 1933 B12R0.95 CCCCC(C)NCCOC(C)C 95b23febc9d92fa064d486fbb74344a2 [0,1,0,0,0,0|3,0,0]=4 1934 B12R0.95 CCCCC(C)NCCSC(C)C d625e98c71225a4a73c8f301750912d3 [0,1,0,0,0,0|3,0,0]=4 1935 B12R0.95 CCCCC(C)OCCCC(=O)C 86a7fe92e475f05c32b98f14673e28ba [0,1,0,0,0,0|1,0,2]=4 1936 B12R0.95 CCCCC(C)OCCCC(C)C 6eb82a262fc3c9f93db19d4d8511d1fb [0,1,0,0,0,0|2,0,0]=3 1937 B12R0.95 CCCCC(C)OCCCN(C)C f535721643bdd6dcafda2cd2aed1c314 [0,1,0,0,0,0|3,0,0]=4 1938 B12R0.95 CCCCC(C)OCCOC(C)C cf4d510e580a8e97983d508e6485764d [0,1,0,0,0,0|3,0,0]=4 1939 B12R0.95 CCCCC(C)OCCSC(C)C 5c15b9c4feecda03ba35b33f4b54d80a [0,1,0,0,0,0|3,0,0]=4 1940 B12R0.95 CCCCC(O)CNCCC(=O)C 4f81b98c5cc928da74ef3e8c679ed22d [0,1,0,0,0,0|1,0,2]=4 1941 B12R0.95 CCCCC(O)CNCCC(=O)O edaa209c6cdfffef2f4ab0bacfadf900 [0,1,0,0,0,0|2,0,1]=4 1942 B12R0.95 CCCCC(O)CNCCC(C)C bb0664b2294c8d9c6c133e7710b71346 [0,1,0,0,0,0|2,0,0]=3 1943 B12R0.95 CCCCC(O)CNCCC(C)O d70dfcb7f4eb9acd043be980cca0f956 [0,1,0,0,0,0|1,0,0]=2 1944 B12R0.95 CCCCC(O)CNCCN(C)C 30cd9d33ebfd78e6d3423bdd43e897ce [0,1,0,0,0,0|3,0,0]=4 1945 B12R0.95 CCCCC(O)CNCCS(=O)C 828d22acb277f1201c4ab28ef82495df [0,1,0,0,0,0|2,0,1]=4 1946 B12R0.95 CCCCC(O)CNCOC(C)C 24d3315e79df4275d5e43f55dda87a85 [0,1,0,0,0,0|3,0,0]=4 1947 B12R0.95 CCCCN(C)CCCCC(=O)C 184a106a3a28105257e267b5fc6908da [0,1,0,0,0,0|1,0,2]=4 1948 B12R0.95 CCCCN(C)CCCCC(=O)O ae50391429c6ceafa5a2df2c6d29aea7 [0,1,0,0,0,0|2,0,1]=4 1949 B12R0.95 CCCCN(C)CCCCC(C)C e57dfe98903f825f224ac54257e3f1e7 [0,1,0,0,0,0|2,0,0]=3 1950 B12R0.95 CCCCN(C)CCCCC(C)O f2ff8725cd55843f2931a4980b5f7d49 [0,1,0,0,0,0|1,0,0]=2 1951 B12R0.95 CCCCN(C)CCCCN(C)C 621f52ca5dd0d75d611d01fbb671e0d3 [0,1,0,0,0,0|3,0,0]=4 1952 B12R0.95 CCCCN(C)CCCC[C@@H](C)O 8285aac6c97c1cd4a6833ac275f30711 [0,1,0,0,0,0|1,0,0]=2 1953 B12R0.95 CCCCN(C)CCCNC(C)C 166f72faa3dff325f3ab005643cfaf93 [0,1,0,0,0,0|3,0,0]=4 1954 B12R0.95 CCCCN(C)CCNCC(C)C 6b2b69fea0db9bcf2e9689a6a981d871 [0,1,0,0,0,0|3,0,0]=4 1955 B12R0.95 CCCCN(C)CCNCC(C)O eaf356d9e348e626997ad3cfec8904fd [0,1,0,0,0,0|2,0,0]=3 1956 B12R0.95 CCCCN(C)CCNC[C@@H](C)O f3310c684e5e15a0144cbd71c8451222 [0,1,0,0,0,0|2,0,0]=3 1957 B12R0.95 CCCCN(C)CCNC[C@H](C)O ffb8469a7d580729210553d75d38877a [0,1,0,0,0,0|2,0,0]=3 1958 B12R0.95 CCCCN(C)CCOCC(C)C 155ee08f786b073cc309f055320523ba [0,1,0,0,0,0|3,0,0]=4 1959 B12R0.95 CCCC[C@@H](C)NCCCC(=O)C 4fca5ae2263f2832aba783074b1029d0 [0,1,0,0,0,0|1,0,2]=4 1960 B12R0.95 CCCC[C@@H](C)NCCCC(C)C 115694a8d0f2bd6004b764c01837d7c1 [0,1,0,0,0,0|2,0,0]=3 1961 B12R0.95 CCCC[C@@H](C)NCCCC(C)O 2807f33233ed2ac47839b59834e91646 [0,1,0,0,0,0|1,0,0]=2 1962 B12R0.95 CCCC[C@@H](C)NCCCN(C)C 341e2ec67ef4138671a1dd8cbb93e42c [0,1,0,0,0,0|3,0,0]=4 1963 B12R0.95 CCCC[C@@H](C)NCCOC(C)C dcef3adc8a72b81e77b17cbfb9a544c5 [0,1,0,0,0,0|3,0,0]=4 1964 B12R0.95 CCCC[C@@H](C)NCCSC(C)C d0f7a67caca9c81138883fae1250011c [0,1,0,0,0,0|3,0,0]=4 1965 B12R0.95 CCCC[C@@H](C)OCCCC(=O)C f043b99ff811b24d31d5de7fe7a833d1 [0,1,0,0,0,0|1,0,2]=4 1966 B12R0.95 CCCC[C@@H](C)OCCCC(C)C 19fb73957c0527d6e0e0c50e5ddba220 [0,1,0,0,0,0|2,0,0]=3 1967 B12R0.95 CCCC[C@@H](C)OCCCN(C)C b1ef2923a34bf0e862676119315eccb7 [0,1,0,0,0,0|3,0,0]=4 1968 B12R0.95 CCCC[C@@H](C)OCCOC(C)C a75b41437129e959684839493b07aac7 [0,1,0,0,0,0|3,0,0]=4 1969 B12R0.95 CCCC[C@@H](C)OCCSC(C)C 82b270864c2a16880a983f31ff0f3cd6 [0,1,0,0,0,0|3,0,0]=4 1970 B12R0.95 CCCC[C@H](C)OCCCC(=O)C d9c3d18686eb34d706b2301b9b1d779d [0,1,0,0,0,0|1,0,2]=4 1971 B12R0.95 CCCC[C@H](C)OCCCC(C)C 8ca55e3b1a997d66401f601e823ac590 [0,1,0,0,0,0|2,0,0]=3 1972 B12R0.95 CCCC[C@H](C)OCCCN(C)C ac7f952297b5595f2c3cfc906c0d636e [0,1,0,0,0,0|3,0,0]=4 1973 B12R0.95 CCCC[C@H](C)OCCOC(C)C 1013a6830e0ce4f6310b65651de7595e [0,1,0,0,0,0|3,0,0]=4 1974 B12R0.95 CCCC[C@H](C)OCCSC(C)C e772289ad3fd81c90d7f1ba579959697 [0,1,0,0,0,0|3,0,0]=4 1975 B12R0.95 CCCNC(=O)CCCCC(C)C df71677e2f93f09f4955ba2e6046b4ae [0,1,0,0,0,0|2,0,1]=4 1976 B12R0.95 CCCNC(=O)CNCCC(C)O 7b52e17ee86d5a2c7b090ba4c1b70491 [0,1,0,0,0,0|2,0,1]=4 1977 B12R0.95 CCCNC(=O)CNCC[C@@H](C)O 6b1c7f1e8c60a4e619e4fea5e48331ae [0,1,0,0,0,0|2,0,1]=4 1978 B12R0.95 CCCNC(=O)CNCC[C@H](C)O 3f22f1a13aa7a440aef7f4569b2e26c0 [0,1,0,0,0,0|2,0,1]=4 1979 B12R0.95 CCCOC(=O)CNCCC(C)O c366f7c3e376a8b7e4758f4cbb892ff7 [0,1,0,0,0,0|2,0,1]=4 1980 B12R0.95 CCCOC(=O)CNCC[C@@H](C)O a9bcf3a7044bef31157516e087e5742d [0,1,0,0,0,0|2,0,1]=4 1981 B12R0.95 CCCOC(=O)CNCC[C@H](C)O 720e7d2cac2a4b47d1e391b4ee911556 [0,1,0,0,0,0|2,0,1]=4 1982 B12R0.95 CCOCC(C)COCCC(C)C b9f8c08d1a40dcc79884580f7c7b732f [0,1,0,0,0,0|3,0,0]=4 1983 B12R0.95 CCOCC(C)OCCCC(C)C 425f8f5eb9159a7af129b3ff253aa33d [0,1,0,0,0,0|3,0,0]=4 1984 B12R0.95 CCOCC(O)CNCCC(C)C 48daf7cdad9b957f54c6ce1df70202ba [0,1,0,0,0,0|3,0,0]=4 1985 B12R0.95 CCOCC(O)CNCCC(C)O 7d0ab982dce450f9dfef7ad4c34dc381 [0,1,0,0,0,0|2,0,0]=3 1986 B12R0.95 COCCC(C)OCCCC(C)C 0520e9be3c1f3ebc5126e872453d63ab [0,1,0,0,0,0|3,0,0]=4 1987 B12R0.95 COCCN(C)CCCCC(C)C 8d78989e29abaf8e46c04b2c02c4c5c3 [0,1,0,0,0,0|3,0,0]=4 1988 B12R0.95 COCCN(C)CCCCC(C)O bb0336e2ea98c2d4a18efc659aee52c3 [0,1,0,0,0,0|2,0,0]=3 1989 B12R0.95 COCCN(C)CCCC[C@@H](C)O 141a113a7cb83c79c9747c7d756d63e7 [0,1,0,0,0,0|2,0,0]=3 1990 B12R0.95 CSCCC(=O)CNCCC(C)O d724ab708646770f61c82f1808fff2c7 [0,1,0,0,0,0|2,0,1]=4 1991 B12R0.95 CSCCC(=O)CNCC[C@@H](C)O 534ba15a1ac9507ae5c81ac270c767ca [0,1,0,0,0,0|2,0,1]=4 1992 B12R0.95 CSCCC(=O)CNCC[C@H](C)O 92750f6f24508a0b910919aa15228561 [0,1,0,0,0,0|2,0,1]=4 1993 B12R0.95 CSCCC(C)OCCCC(C)C 7e55d32832fd215d3847550c131aad87 [0,1,0,0,0,0|3,0,0]=4 1994 B12R0.95 CSCCN(C)CCCCC(C)C 179a32e6f2f4fd0e8c62fc3a2873816b [0,1,0,0,0,0|3,0,0]=4 1995 B12R0.95 CSCCN(C)CCCCC(C)O 116b38f6deecd09bd04951b6b0989bd8 [0,1,0,0,0,0|2,0,0]=3 1996 B12R0.95 CSCCN(C)CCCC[C@@H](C)O 1f4ced58c65eda132a8509546952b388 [0,1,0,0,0,0|2,0,0]=3 1997 B12R0.95 C[C@@H](O)CCCCN(C)CCC#N 47800a8d575f37ae22e3f042e1ade185 [0,1,0,0,0,0|2,0,1]=4 1998 B12R0.95 C[C@@H](O)CCCCN(C)CCCO 3262f01a081d470085285736cc71f157 [0,1,0,0,0,0|2,0,0]=3 1999 B12R0.95 C[C@@H](O)CCCCN(C)CCON eaea92e29e23890ebd6c500564d7f628 [0,1,0,0,0,0|3,0,0]=4 2000 B12R0.119 C#CCCCCCNCC(C)(C)O 5323b4e2351a26fa7d89e92f03637c84 [0,1,0,0,0,0|1,0,2]=4 2001 B12R0.119 C#CCCCCCOCC(C)(C)O 965c2ec16dc9dd7f549cddde1fe2ab95 [0,1,0,0,0,0|1,0,2]=4 2002 B12R0.119 C#CCCCCNCCC(C)(C)O 2ba6f1ebf9dbab27ffc11cfbd8f5eb0a [0,1,0,0,0,0|1,0,2]=4 2003 B12R0.119 C#CCCCCOCCC(C)(C)O f04d8dd3bab38a74ba54626d750fee3d [0,1,0,0,0,0|1,0,2]=4 2004 B12R0.119 C#CCCCNCCCC(C)(C)O ce39a66dc8f06141e97a1e0fa91d72ea [0,1,0,0,0,0|1,0,2]=4 2005 B12R0.119 C#CCCCOCCCC(C)(C)O 52746182786ba43c1f97bab2d5bcdbb6 [0,1,0,0,0,0|1,0,2]=4 2006 B12R0.119 C#CCNCCCCCC(C)(C)O f5808265211916257286a1fbbf80ee4e [0,1,0,0,0,0|1,0,2]=4 2007 B12R0.119 C#CCOCCCCCC(C)(C)O d1fa73fecf7d68720259f35057a5d949 [0,1,0,0,0,0|1,0,2]=4 2008 B12R0.119 C/C=C/CCCOCCC(C)(C)O 9943bd5902e656a081b6335ee2c65cb3 [0,1,0,0,0,0|1,0,2]=4 2009 B12R0.119 C/C=C/CCOCCCC(C)(C)O bfb5b1a22bbe5b1360a24ddfde475c18 [0,1,0,0,0,0|1,0,2]=4 2010 B12R0.119 C/C=C\CCCNCCC(C)(C)O 70f07af3d84dc02a7d132c5faf84b6a8 [0,1,0,0,0,0|1,0,2]=4 2011 B12R0.119 C/C=C\CCCOCCC(C)(C)O 855f3c42f5b16124975fd810caee5865 [0,1,0,0,0,0|1,0,2]=4 2012 B12R0.119 C=CCCCCCNCC(C)(C)O b59c4fc5eccff1e9d91768d55a5d4dfd [0,1,0,0,0,0|1,0,2]=4 2013 B12R0.119 C=CCCCCCOCC(C)(C)O aaffd6cd5553a6a2d2003b452638d570 [0,1,0,0,0,0|1,0,2]=4 2014 B12R0.119 C=CCCCCNCCC(C)(C)O 2f30fb0fc609b7ed12baa6a67330b3c1 [0,1,0,0,0,0|1,0,2]=4 2015 B12R0.119 C=CCCCCOCCC(C)(C)O 9bc125d698850ae0fe6fff0bc31d1a8f [0,1,0,0,0,0|1,0,2]=4 2016 B12R0.119 C=CCCCNCCCC(C)(C)O ecf164ecc5f39802e2efbb29d234dc7e [0,1,0,0,0,0|1,0,2]=4 2017 B12R0.119 C=CCCCOCCCC(C)(C)O 1f26c395853c9cec590c68d731d12722 [0,1,0,0,0,0|1,0,2]=4 2018 B12R0.119 CC#CCCCNCCC(C)(C)O 80da3f6ae1b96c8a2abfadfa0f07656b [0,1,0,0,0,0|1,0,2]=4 2019 B12R0.119 CC#CCCCOCCC(C)(C)O 5fc59d34bb9bcdbfce7db0ab44702470 [0,1,0,0,0,0|1,0,2]=4 2020 B12R0.119 CC#CCCOCCCC(C)(C)O 94ad8281e45b72384ab426ef9a15c23d [0,1,0,0,0,0|1,0,2]=4 2021 B12R0.119 CC(C)(Br)COCCCCCCF 3c1583ace29660b954e749a6efc86ff3 [0,1,0,0,0,0|3,0,0]=4 2022 B12R0.119 CC(C)(C)CCCCCCOCF f739d5a9de3c3560dd94256c30db8760 [0,1,0,0,0,0|3,0,0]=4 2023 B12R0.119 CC(C)(C)CCCCOCCCF 3dc65c7a93c08349de0e927c6475470a [0,1,0,0,0,0|3,0,0]=4 2024 B12R0.119 CC(C)(C)CCCCOCCCS 8cc5b88d9d25f6d07bad456de24d4296 [0,1,0,0,0,0|3,0,0]=4 2025 B12R0.119 CC(C)(C)CCCNCCCCF d8394ff5ab2e2d4ee3606e7d26e7ecbe [0,1,0,0,0,0|3,0,0]=4 2026 B12R0.119 CC(C)(C)CCCNCCCCO cf6c64bc91bc32f145885996e51351e7 [0,1,0,0,0,0|3,0,0]=4 2027 B12R0.119 CC(C)(C)CCCOCCCCF 14ad081aa043b05da48e6696e39ac0c8 [0,1,0,0,0,0|3,0,0]=4 2028 B12R0.119 CC(C)(C)CCNCCCCCCl f62331dbe7c39ec1d3b855c511031a91 [0,1,0,0,0,0|3,0,0]=4 2029 B12R0.119 CC(C)(C)CCNCCCCCF e40918ebb597e77b8b864f84e485188c [0,1,0,0,0,0|3,0,0]=4 2030 B12R0.119 CC(C)(C)CCNCCCCCO 96f7b1b478b00522a2326e13cb1edb5a [0,1,0,0,0,0|3,0,0]=4 2031 B12R0.119 CC(C)(C)CCOCCCCCF 0b9477839789394732ccaf55c97aee37 [0,1,0,0,0,0|3,0,0]=4 2032 B12R0.119 CC(C)(C)CNCCCCCCCl 667b861c2d6606c6f9e1d97f9bfa87fb [0,1,0,0,0,0|3,0,0]=4 2033 B12R0.119 CC(C)(C)CNCCCCCCF 90a6d07678c437c60f436b03474f2700 [0,1,0,0,0,0|3,0,0]=4 2034 B12R0.119 CC(C)(C)CNCCCCCCO 05a70d8ede52a761b4a1e69413bce2e1 [0,1,0,0,0,0|3,0,0]=4 2035 B12R0.119 CC(C)(C)COCCCCCCF e8fa464c14a4ebf5e97ca820d4f25344 [0,1,0,0,0,0|3,0,0]=4 2036 B12R0.119 CC(C)(C)COCCCCCCS 633813f13e5e02b910ddcdcd1a5c297e [0,1,0,0,0,0|3,0,0]=4 2037 B12R0.119 CC(C)(C)NCCCCCCCO 6637c5a17aaa7b19cea9a03da5430abc [0,1,0,0,0,0|3,0,0]=4 2038 B12R0.119 CC(C)(F)CCNCCCCCF 284e1da192f09dfdfb3fd1fe3e2700fa [0,1,0,0,0,0|3,0,0]=4 2039 B12R0.119 CC(C)(F)CCNCCCCCO a2cdcd12248abd8c0857d528512624c3 [0,1,0,0,0,0|3,0,0]=4 2040 B12R0.119 CC(C)(F)CNCCCCCCCl 7708cc5b242a7c8c97b8bd0a3103df27 [0,1,0,0,0,0|3,0,0]=4 2041 B12R0.119 CC(C)(F)CNCCCCCCO 8b5cbcf57f5dd073fc7753608a89f044 [0,1,0,0,0,0|3,0,0]=4 2042 B12R0.119 CC(C)(F)COCCCCCCF 14bedc9cb7470f04945c0c3ca5551f4a [0,1,0,0,0,0|3,0,0]=4 2043 B12R0.119 CC(C)(F)COCCCCCCS 003adf7ffcfb5fbd663518d1dc384f27 [0,1,0,0,0,0|3,0,0]=4 2044 B12R0.119 CC(C)(O)CCCCCNCC#N 0ebb2cdbc259a0d8a19355d92bd7a8b9 [0,1,0,0,0,0|2,0,1]=4 2045 B12R0.119 CC(C)(O)CCCCCNCCBr a2ff622d7e466eb5ba73ed5c74fb9dac [0,1,0,0,0,0|2,0,0]=3 2046 B12R0.119 CC(C)(O)CCCCCNCCF b1b3f95db617fea10a80cd3b046dda2d [0,1,0,0,0,0|2,0,0]=3 2047 B12R0.119 CC(C)(O)CCCCCNCCI 2a504812e98ded71fc5a652cb6427efc [0,1,0,0,0,0|2,0,0]=3 2048 B12R0.119 CC(C)(O)CCCCCNCCO 75f8b48385491ceb7437f73df62d4d24 [0,1,0,0,0,0|2,0,0]=3 2049 B12R0.119 CC(C)(O)CCCCCNCCS ad4decc2362bae68ad43da8d586b2302 [0,1,0,0,0,0|2,0,0]=3 2050 B12R0.119 CC(C)(O)CCCCCOCC#N 25447192c815a7eb49b06f9407e1b426 [0,1,0,0,0,0|2,0,1]=4 2051 B12R0.119 CC(C)(O)CCCCCOCCF f2ad2c2405c954831aa5bcdea530c060 [0,1,0,0,0,0|2,0,0]=3 2052 B12R0.119 CC(C)(O)CCCCCOCCS 5d53dde1c57421a4c99f5d99003a23c4 [0,1,0,0,0,0|2,0,0]=3 2053 B12R0.119 CC(C)(O)CCCNCCCC#N 2c85736df6af8a59aa64c38fdf5e9ab1 [0,1,0,0,0,0|2,0,1]=4 2054 B12R0.119 CC(C)(O)CCCNCCCC=O 21517df55e75c6201d48fd12dbc1392f [0,1,0,0,0,0|2,0,1]=4 2055 B12R0.119 CC(C)(O)CCCNCCCCCl 466a10d52b70087be87163792b88d0ae [0,1,0,0,0,0|2,0,0]=3 2056 B12R0.119 CC(C)(O)CCCNCCCCF e296c9d6f8b1dc7e4cae6ad57640155e [0,1,0,0,0,0|2,0,0]=3 2057 B12R0.119 CC(C)(O)CCCNCCCCO 2d8da686fb64bd180d0f18b693f34ad4 [0,1,0,0,0,0|2,0,0]=3 2058 B12R0.119 CC(C)(O)CCCNCCCCS d919a87896f7228c424dedb6dcb22a9b [0,1,0,0,0,0|2,0,0]=3 2059 B12R0.119 CC(C)(O)CCCOCCCC#N bd1a64d6aaed908fdeb77a71f0b91fa4 [0,1,0,0,0,0|2,0,1]=4 2060 B12R0.119 CC(C)(O)CCCOCCCC=O 100d1f9d7b05561ea739f4967b6a0030 [0,1,0,0,0,0|2,0,1]=4 2061 B12R0.119 CC(C)(O)CCCOCCCCF 4057ac1d0a3cbb32a9ede968aea6258d [0,1,0,0,0,0|2,0,0]=3 2062 B12R0.119 CC(C)(O)CCCOCCCCS bfe64476680455b86644c0fde56ce2b6 [0,1,0,0,0,0|2,0,0]=3 2063 B12R0.119 CC(C)(O)CCNCCCCC#N f33b7bc8fea7193a73c93a716ac3394a [0,1,0,0,0,0|2,0,1]=4 2064 B12R0.119 CC(C)(O)CCNCCCCC=O b1e0327e6d24ffc9bec893d108f89711 [0,1,0,0,0,0|2,0,1]=4 2065 B12R0.119 CC(C)(O)CCNCCCCCCl f5c6d83788812d1746dab5392e115209 [0,1,0,0,0,0|2,0,0]=3 2066 B12R0.119 CC(C)(O)CCNCCCCCF 40cf06b9b90ffe6a083450a2735296dd [0,1,0,0,0,0|2,0,0]=3 2067 B12R0.119 CC(C)(O)CCNCCCCCO 0fbef1d961b5677a842aed87bcc3f1eb [0,1,0,0,0,0|2,0,0]=3 2068 B12R0.119 CC(C)(O)CCNCCCCON 48191c19a18db4ce2844a439c9dcb5e5 [0,1,0,0,0,0|3,0,0]=4 2069 B12R0.119 CC(C)(O)CCNCCOCCO e8d03241dd756d161754a3b95b6727f1 [0,1,0,0,0,0|3,0,0]=4 2070 B12R0.119 CC(C)(O)CCNCCOCCS d89572f90e86d13debf1d24f4ae6b86e [0,1,0,0,0,0|3,0,0]=4 2071 B12R0.119 CC(C)(O)CCNCCSCCO 609ee937683f527c231d463434d60403 [0,1,0,0,0,0|3,0,0]=4 2072 B12R0.119 CC(C)(O)CCOCCCCC#N ed5e0486c20da677ffd2d19a56dce4ae [0,1,0,0,0,0|2,0,1]=4 2073 B12R0.119 CC(C)(O)CCOCCCCC=O cc1aedc7451dab03acfa5efc8390f97f [0,1,0,0,0,0|2,0,1]=4 2074 B12R0.119 CC(C)(O)CCOCCOCCF bf5e1e436c542c7f3d0cbeb01d3f9123 [0,1,0,0,0,0|3,0,0]=4 2075 B12R0.119 CC(C)(O)CCOCCOCCS 894447f702b1f296269e896129e58e56 [0,1,0,0,0,0|3,0,0]=4 2076 B12R0.119 CC(C)(O)CNCCCCCC#N 298e3da283cf9f55d79e43891eda3324 [0,1,0,0,0,0|2,0,1]=4 2077 B12R0.119 CC(C)(O)CNCCCCCC=O 8de6ec2cda3c1a377100786ec5813ff2 [0,1,0,0,0,0|2,0,1]=4 2078 B12R0.119 CC(C)(O)CNCCCCCCCl b1ecc0e8936b6b22372e368fb647f96d [0,1,0,0,0,0|2,0,0]=3 2079 B12R0.119 CC(C)(O)CNCCCCCCF 3958b3432224f03ec428ea704a9b5412 [0,1,0,0,0,0|2,0,0]=3 2080 B12R0.119 CC(C)(O)CNCCCCCCO 8afaecab4ceb2bf39357e6503edeedfd [0,1,0,0,0,0|2,0,0]=3 2081 B12R0.119 CC(C)(O)CNCCCOCCO 6a8aeb5208d216fd5e197613daa3affe [0,1,0,0,0,0|3,0,0]=4 2082 B12R0.119 CC(C)(O)CNCCOCCCO 4faf978b7bc8505499134d69e77ba035 [0,1,0,0,0,0|3,0,0]=4 2083 B12R0.119 CC(C)(O)COCCCCCC#N bcef598a29a046b5a84116a47fede6c4 [0,1,0,0,0,0|2,0,1]=4 2084 B12R0.119 CC(C)(O)COCCCCCCF 3498f468c8c05653296d1021ca7e354b [0,1,0,0,0,0|2,0,0]=3 2085 B12R0.119 CC(C)(O)COCCCCCCS 3124f9b4497742cc0d69dd8e82816b49 [0,1,0,0,0,0|2,0,0]=3 2086 B12R0.119 CC(C)(S)CCOCCCCCF d13b31a9911d4dfc6aa36250adf0887f [0,1,0,0,0,0|2,1,0]=4 2087 B12R0.119 CC(C)(S)COCCCCCCF 8ef96fa421c11941109e1c2785981200 [0,1,0,0,0,0|2,1,0]=4 2088 B12R0.119 CC(F)(F)CCCNCCCCCl 782647096c31768416506f41cdfa222a [0,1,0,0,0,0|3,0,0]=4 2089 B12R0.119 CC(F)(F)CCCNCCCCO 072edaf5d36b0e7b259f3c37a09fa7d0 [0,1,0,0,0,0|3,0,0]=4 2090 B12R0.119 CC(F)(F)CCCNCCCCS 54cf33a0fb06261c5603b1a2363c5819 [0,1,0,0,0,0|3,0,0]=4 2091 B12R0.119 CC(F)(F)CCCOCCCCF 1ffa034460dbfda51782504358d509e7 [0,1,0,0,0,0|3,0,0]=4 2092 B12R0.119 CC(F)(F)CCCOCCCCS ffe742c51cc7caf7a76ad14d54260e43 [0,1,0,0,0,0|3,0,0]=4 2093 B12R0.119 CC(F)(F)CCNCCCCCCl 5e9cc52dae75de4bd36e54c6a66c9196 [0,1,0,0,0,0|3,0,0]=4 2094 B12R0.119 CC(F)(F)CCNCCCCCO 6bd6de2ceb9b783f51a53c7dddaba6b5 [0,1,0,0,0,0|3,0,0]=4 2095 B12R0.119 CC(F)(F)CCOCCCCCF 405327d9a819c227bda54a94f899cbc7 [0,1,0,0,0,0|3,0,0]=4 2096 B12R0.119 CC(F)(F)CNCCCCCCCl b70649798ec618789e3ba96ea50469dd [0,1,0,0,0,0|3,0,0]=4 2097 B12R0.119 CC(F)(F)CNCCCCCCO 76f9ce74143d0a6db9488049d51b9cca [0,1,0,0,0,0|3,0,0]=4 2098 B12R0.119 CC(F)(F)COCCCCCCF b6d7fbde91ea9edcdf9ad7902e3093c4 [0,1,0,0,0,0|3,0,0]=4 2099 B12R0.119 CC(F)(F)COCCCCCCS 77066c0dfc2c016fa1769a133b44471b [0,1,0,0,0,0|3,0,0]=4 2100 B12R0.119 CC/C=C/CCOCCC(C)(C)O 39216e19d1819baa326b0ad812f9d446 [0,1,0,0,0,0|1,0,2]=4 2101 B12R0.119 CC/C=C/CNCCCC(C)(C)O 62166d6040d6e002cb27df171d37a5dc [0,1,0,0,0,0|1,0,2]=4 2102 B12R0.119 CC/C=C/COCCCC(C)(C)O e06cffc84c5a57455a3b47a1700323b8 [0,1,0,0,0,0|1,0,2]=4 2103 B12R0.119 CC/C=C\CCCOCC(C)(C)O 35356aaf9d99b9bb6097d04f7f3281bb [0,1,0,0,0,0|1,0,2]=4 2104 B12R0.119 CC/C=C\CCNCCC(C)(C)O 579ff1e3b373a4f86c1be05d22cd157a [0,1,0,0,0,0|1,0,2]=4 2105 B12R0.119 CC/C=C\CCOCCC(C)(C)O 9f2282bb36b06018d08a387ba64cec6b [0,1,0,0,0,0|1,0,2]=4 2106 B12R0.119 CC/C=C\COCCCC(C)(C)O 3795865925ce112dafc234c80730a111 [0,1,0,0,0,0|1,0,2]=4 2107 B12R0.119 CC=CCCCOCCC(C)(C)O 3d167da44bc60fc67b9a2a298b3d6a80 [0,1,0,0,0,0|1,0,2]=4 2108 B12R0.119 CCC#CCCOCCC(C)(C)O 6978c4cba9fdb7de44d2edc070bd8b85 [0,1,0,0,0,0|1,0,2]=4 2109 B12R0.119 CCC#CCNCCCC(C)(C)O 2a7bdae2450637f79ee10c8f6c84b566 [0,1,0,0,0,0|1,0,2]=4 2110 B12R0.119 CCC#CCOCCCC(C)(C)O 83fe53ddac685bfe7cc3b2821eae9fb6 [0,1,0,0,0,0|1,0,2]=4 2111 B12R0.119 CCC/C=C/CNCCC(C)(C)O 27c45a4309d89e0cc59aa3ec31e90d10 [0,1,0,0,0,0|1,0,2]=4 2112 B12R0.119 CCC/C=C/COCCC(C)(C)O a2ac101dd8f507728d023cbe26a7eb1b [0,1,0,0,0,0|1,0,2]=4 2113 B12R0.119 CCC/C=C\CCOCC(C)(C)O cadc9e8dac44e8e1722a5dca0a8c046d [0,1,0,0,0,0|1,0,2]=4 2114 B12R0.119 CCC/C=C\CNCCC(C)(C)O b10ac632d0f19973d4cad73e4feb1b1c [0,1,0,0,0,0|1,0,2]=4 2115 B12R0.119 CCC/C=C\COCCC(C)(C)O 95f4bf82ebf87eb081e9409262117e1c [0,1,0,0,0,0|1,0,2]=4 2116 B12R0.119 CCCC#CCCOCC(C)(C)O 89fd75e8f2e1af2229ad5fe96fba178b [0,1,0,0,0,0|1,0,2]=4 2117 B12R0.119 CCCC#CCOCCC(C)(C)O b2f602bb73298dc8bf6d8a8b7ffe73d4 [0,1,0,0,0,0|1,0,2]=4 2118 B12R0.119 CCCC/C=C/CNCC(C)(C)O 8c5989888fd836fe0b0723046512d634 [0,1,0,0,0,0|1,0,2]=4 2119 B12R0.119 CCCC/C=C/COCC(C)(C)O b877a21ca14aacc0e88da68b092a420f [0,1,0,0,0,0|1,0,2]=4 2120 B12R0.119 CCCC/C=C\CNCC(C)(C)O 9bdcc3cb4463ca72919bb4d0748cf3a5 [0,1,0,0,0,0|1,0,2]=4 2121 B12R0.119 CCCCC#CCOCC(C)(C)O 6d0984a220a4733582579559aaa9c51f [0,1,0,0,0,0|1,0,2]=4 2122 B12R0.119 CCCCCCCCNC(C)(C)C 0de808d09045585e84e4a4ff7d11ead6 [0,1,0,0,0,0|2,0,0]=3 2123 B12R0.119 CCCCCCCNCC(C)(C)C 751b202076cd31e0f798c4e3b1a0d1c0 [0,1,0,0,0,0|2,0,0]=3 2124 B12R0.119 CCCCCCCNCC(C)(C)F 2893d7ea37ba89b6f89c4fa4b2db024a [0,1,0,0,0,0|2,0,0]=3 2125 B12R0.119 CCCCCCCNCC(C)(C)O 08f56e7c3b584bd641f3b7798b369bc4 [0,1,0,0,0,0|1,0,0]=2 2126 B12R0.119 CCCCCCCNCC(C)(F)F 6da4c8ea25ec753c3eb30beb48140323 [0,1,0,0,0,0|2,0,0]=3 2127 B12R0.119 CCCCCCCNCC(F)(F)F 45c79e828eaece3e23f152ea8dcb9bfc [0,1,0,0,0,0|3,0,0]=4 2128 B12R0.119 CCCCCCCNCS(=O)(=O)C 13d070f7b24ea7fee35ae1ac2152d259 [0,1,0,0,0,0|2,0,1]=4 2129 B12R0.119 CCCCCCCNCS(=O)(=O)O 532b2d6d8ba174a418d4bc7ae6dd3c76 [0,1,0,0,0,0|3,0,0]=4 2130 B12R0.119 CCCCCCCOCC(C)(C)Br d9cb2f0f97149db087627eb7e7428fef [0,1,0,0,0,0|2,0,0]=3 2131 B12R0.119 CCCCCCCOCC(C)(C)C 284d5c0799898c87e0e598929c448fdf [0,1,0,0,0,0|2,0,0]=3 2132 B12R0.119 CCCCCCCOCC(C)(C)F a5952b1a9662ef20284a812acadff9f4 [0,1,0,0,0,0|2,0,0]=3 2133 B12R0.119 CCCCCCCOCC(C)(C)O 54a68bd3a0c34f37f7c6a5e837777b24 [0,1,0,0,0,0|1,0,0]=2 2134 B12R0.119 CCCCCCCOCC(C)(C)S 4967d27d8aae907a1ca563a18ad992ff [0,1,0,0,0,0|1,1,0]=3 2135 B12R0.119 CCCCCCCOCC(C)(F)F 48ecf8d53a46e1cbbd8f65a3d0448f5e [0,1,0,0,0,0|2,0,0]=3 2136 B12R0.119 CCCCCCCOCC(F)(F)Br ac19281c4bf52e4956e3a683173f3254 [0,1,0,0,0,0|3,0,0]=4 2137 B12R0.119 CCCCCCCOCC(F)(F)F 80b2a384b30a472b7f237534854545c9 [0,1,0,0,0,0|3,0,0]=4 2138 B12R0.119 CCCCCCCOCS(=O)(=O)C 543b3e052485f848b4751078ca586ab9 [0,1,0,0,0,0|2,0,1]=4 2139 B12R0.119 CCCCCCNCCC(C)(C)C 63d15d750abdbaae8cc682e38be11fff [0,1,0,0,0,0|2,0,0]=3 2140 B12R0.119 CCCCCCNCCC(C)(C)F 1f2264a62e7da749c72ecf07e972804d [0,1,0,0,0,0|2,0,0]=3 2141 B12R0.119 CCCCCCNCCC(C)(C)O 2dcf02954e787498472d3ae9ee703305 [0,1,0,0,0,0|1,0,0]=2 2142 B12R0.119 CCCCCCNCCC(C)(F)F 82f41a096abd32b1718c8a50b595115d [0,1,0,0,0,0|2,0,0]=3 2143 B12R0.119 CCCCCCNCCC(F)(F)F ab7fd2f868f84805d2bb7abf810d8a89 [0,1,0,0,0,0|3,0,0]=4 2144 B12R0.119 CCCCCCNCCS(=O)(=O)C 8db9ca636d4e69b43d46e71d6a015ff1 [0,1,0,0,0,0|2,0,1]=4 2145 B12R0.119 CCCCCCNCCS(=O)(=O)O 91592e84080dc35008074696b121dca5 [0,1,0,0,0,0|3,0,0]=4 2146 B12R0.119 CCCCCCOCCC(C)(C)C 9dd6116a0cb23ce95e587e1f07900574 [0,1,0,0,0,0|2,0,0]=3 2147 B12R0.119 CCCCCCOCCC(C)(C)O 01923e29672a1afcc7d52fd43b545ac9 [0,1,0,0,0,0|1,0,0]=2 2148 B12R0.119 CCCCCCOCCC(C)(C)S 9c499b8dda98deec94d15655102d87c0 [0,1,0,0,0,0|1,1,0]=3 2149 B12R0.119 CCCCCCOCCC(C)(F)F 7d8923d85f4c89f8bd8285611e9a938c [0,1,0,0,0,0|2,0,0]=3 2150 B12R0.119 CCCCCCOCCC(F)(F)F 5489eaf42ccef6216d1e394aa1c2e56d [0,1,0,0,0,0|3,0,0]=4 2151 B12R0.119 CCCCCCOCCS(=N)(=O)C 3c9e725ae4934aa6157b0d761f555110 [0,1,0,0,0,0|2,0,1]=4 2152 B12R0.119 CCCCCCOCCS(=O)(=O)C 63547bfa6005a30a849fbce14f6389d3 [0,1,0,0,0,0|2,0,1]=4 2153 B12R0.119 CCCCCCOCCS(=O)(=O)O 3eaf4550c99c3b6777f1a2ae8170dd6d [0,1,0,0,0,0|3,0,0]=4 2154 B12R0.119 CCCCCNCCCC(C)(C)C f2d272b1fb338e60ff7cc872aa06e7ee [0,1,0,0,0,0|2,0,0]=3 2155 B12R0.119 CCCCCNCCCC(C)(C)O 91b9353353818ea264803b019fd43a33 [0,1,0,0,0,0|1,0,0]=2 2156 B12R0.119 CCCCCNCCCC(C)(F)F 6a7cd2c5303f08e41aa5d092b8c123f3 [0,1,0,0,0,0|2,0,0]=3 2157 B12R0.119 CCCCCNCCCC(F)(F)F 44a11c0743249e91075d6ea715609344 [0,1,0,0,0,0|3,0,0]=4 2158 B12R0.119 CCCCCNCCCS(=O)(=O)C 624eed163745a0d2abc606a19984eb8e [0,1,0,0,0,0|2,0,1]=4 2159 B12R0.119 CCCCCNCCCS(=O)(=O)O 7b25bf36be191c3862ae3f0ae317ddb8 [0,1,0,0,0,0|3,0,0]=4 2160 B12R0.119 CCCCCNCCOC(C)(C)C 4175e5ef6766964a4c5373e11d930aa5 [0,1,0,0,0,0|3,0,0]=4 2161 B12R0.119 CCCCCNCCSC(C)(C)C 04565f8d9e785ecd2b5bc6bf6fa3ea08 [0,1,0,0,0,0|3,0,0]=4 2162 B12R0.119 CCCCCOCCCC(C)(C)C 68c31043b597c7b92125749a5d58b63b [0,1,0,0,0,0|2,0,0]=3 2163 B12R0.119 CCCCCOCCCC(C)(C)O 712ac1c5f37206d53be274f5f39a43e3 [0,1,0,0,0,0|1,0,0]=2 2164 B12R0.119 CCCCCOCCCC(C)(F)F 1c2c24f5569eeb63abf2055370d9485d [0,1,0,0,0,0|2,0,0]=3 2165 B12R0.119 CCCCCOCCCC(F)(F)F 33960e4825185d61ad4f5a13cb950aed [0,1,0,0,0,0|3,0,0]=4 2166 B12R0.119 CCCCCOCCCS(=O)(=O)C bb0783312dbf3ee7224bec953ac5068a [0,1,0,0,0,0|2,0,1]=4 2167 B12R0.119 CCCCCOCCCS(=O)(=O)O 039b4669dbaefa4ecb5280c56b22235a [0,1,0,0,0,0|3,0,0]=4 2168 B12R0.119 CCCCCOCCOC(C)(C)C a900485033f295850530cc284dfad995 [0,1,0,0,0,0|3,0,0]=4 2169 B12R0.119 CCCCCOCCSC(C)(C)C cb942f87695bcc9fac0e2d98e5148736 [0,1,0,0,0,0|3,0,0]=4 2170 B12R0.119 CCCCNCCCCC(F)(F)F 63da7262edc9963d46a060af233cad3e [0,1,0,0,0,0|3,0,0]=4 2171 B12R0.119 CCCCNCCCCS(=O)(=O)C 063d94f2569228c55fc23202a94ca8fa [0,1,0,0,0,0|2,0,1]=4 2172 B12R0.119 CCCCNCCCCS(=O)(=O)O 0be21deaed575676d5d785dfdad0c52e [0,1,0,0,0,0|3,0,0]=4 2173 B12R0.119 CCCCNCCCOC(C)(C)C 7be91a9b2ca0ee9eba7bc6c65f41bbd8 [0,1,0,0,0,0|3,0,0]=4 2174 B12R0.119 CCCCNCCCSC(C)(C)C 9e30775e81d781524c73dd2da83a61cd [0,1,0,0,0,0|3,0,0]=4 2175 B12R0.119 CCCCOCCCCC(C)(C)C fa5e29eef2d166434c65da0731ee33ac [0,1,0,0,0,0|2,0,0]=3 2176 B12R0.119 CCCCOCCCCC(F)(F)F 5a251bdae490ebaecb92d6e3a3989472 [0,1,0,0,0,0|3,0,0]=4 2177 B12R0.119 CCCCOCCCCS(=O)(=O)C cfc63ed1f83838b0aa6985e892ecbb09 [0,1,0,0,0,0|2,0,1]=4 2178 B12R0.119 CCCCOCCCCS(=O)(=O)O 64970bf4a58f833a5cca2dd590f7dc2f [0,1,0,0,0,0|3,0,0]=4 2179 B12R0.119 CCCCOCCCSC(C)(C)C 7354f1ee7c96779c19826e5a93982013 [0,1,0,0,0,0|3,0,0]=4 2180 B12R0.119 CCCCOCCNCC(C)(C)C fa6fc7a6764069a4d1650bf9c597db24 [0,1,0,0,0,0|3,0,0]=4 2181 B12R0.119 CCCCOCCNCC(C)(C)F 4126715ec4c92cc57126987380872248 [0,1,0,0,0,0|3,0,0]=4 2182 B12R0.119 CCCCOCCNCC(C)(C)O 5b1ebbb008a292e39412cf2242576f0d [0,1,0,0,0,0|2,0,0]=3 2183 B12R0.119 CCCCOCCNCC(C)(F)F 8836888c62e1a839d2cbf192ce6443a5 [0,1,0,0,0,0|3,0,0]=4 2184 B12R0.119 CCCCOCCOCC(C)(C)Br 66c73f3697d75d4b7fa4dcf664d564cb [0,1,0,0,0,0|3,0,0]=4 2185 B12R0.119 CCCCOCCOCC(C)(C)C 0bce70069f76e2e52790afa1016efa6a [0,1,0,0,0,0|3,0,0]=4 2186 B12R0.119 CCCCOCCOCC(C)(C)F fd5fc004b62de50768f91645bc47cbef [0,1,0,0,0,0|3,0,0]=4 2187 B12R0.119 CCCCOCCOCC(C)(C)O 740f783001a7e8f10e2c06ecd7cb4ee3 [0,1,0,0,0,0|2,0,0]=3 2188 B12R0.119 CCCCOCCOCC(C)(C)S c9ee7aea7f79d721f23958e1d227a09e [0,1,0,0,0,0|2,1,0]=4 2189 B12R0.119 CCCCOCCOCC(C)(F)F d76ea4162a70b3250108accd76305717 [0,1,0,0,0,0|3,0,0]=4 2190 B12R0.119 CCCCOCNCCC(C)(C)C b4b67102c521d154fad5e0ea4830fc4e [0,1,0,0,0,0|3,0,0]=4 2191 B12R0.119 CCCCOCNCCC(C)(C)F 7bd349b51ae93199ba6bb05bd902ece3 [0,1,0,0,0,0|3,0,0]=4 2192 B12R0.119 CCCCOCNCCC(C)(C)O 7865d7acf34a5682c71eea69d5113274 [0,1,0,0,0,0|2,0,0]=3 2193 B12R0.119 CCCCOCOCCC(C)(C)C 278ea77b43430f4f6103280fc4421419 [0,1,0,0,0,0|3,0,0]=4 2194 B12R0.119 CCCCOCOCCC(C)(C)S 36060d1b306cba5f3fff21b164d82ea0 [0,1,0,0,0,0|2,1,0]=4 2195 B12R0.119 CCCCOCOCCC(C)(F)F 35a74f849d28e21494b669d571a5dabe [0,1,0,0,0,0|3,0,0]=4 2196 B12R0.119 CCCCSCCOCC(C)(C)C 3ce58d78bac0c507d77958306aef6c44 [0,1,0,0,0,0|3,0,0]=4 2197 B12R0.119 CCCCSCCOCC(C)(C)F a277ad7da75b27d38b765ff3b163f5ae [0,1,0,0,0,0|3,0,0]=4 2198 B12R0.119 CCCCSCCOCC(C)(C)O 7b19b9218127319f4ec5be2865254e0a [0,1,0,0,0,0|2,0,0]=3 2199 B12R0.119 CCCCSCCOCC(C)(F)F fc297c4b5bd8c1b93f822908a130b474 [0,1,0,0,0,0|3,0,0]=4 2200 B12R0.119 CCCNCCCCCC(C)(C)O 33c09a666d4a3fd72026a51431d8f734 [0,1,0,0,0,0|1,0,0]=2 2201 B12R0.119 CCCNCCCCCC(F)(F)F d8c92aa7e8a57c3a135b644982cd9cc1 [0,1,0,0,0,0|3,0,0]=4 2202 B12R0.119 CCCNCCCCCS(=O)(=O)O 86f75cf34591c162d760cec2187b34fc [0,1,0,0,0,0|3,0,0]=4 2203 B12R0.119 CCCOCCCCCC(C)(C)O 09787e47360e6824b84a015130bc2288 [0,1,0,0,0,0|1,0,0]=2 2204 B12R0.119 CCCOCCCCCC(F)(F)F e37d90f99a0aa365d577f6ec4e25d522 [0,1,0,0,0,0|3,0,0]=4 2205 B12R0.119 CCCOCCCNCC(C)(C)C 7b74730fb8fabf821cfb122a21e9fe27 [0,1,0,0,0,0|3,0,0]=4 2206 B12R0.119 CCCOCCCNCC(C)(C)F 291ad5cc5d3b99aa92b980910c67641c [0,1,0,0,0,0|3,0,0]=4 2207 B12R0.119 CCCOCCCNCC(C)(C)O bcbfaa979c7e260760c878266bf158a9 [0,1,0,0,0,0|2,0,0]=3 2208 B12R0.119 CCCOCCCNCC(C)(F)F ef2a15a26a3aa93345f627f8e4a6d76d [0,1,0,0,0,0|3,0,0]=4 2209 B12R0.119 CCCOCCCOCC(C)(C)Br 2b8642eb0ca7010ffcff0737bab3cf06 [0,1,0,0,0,0|3,0,0]=4 2210 B12R0.119 CCCOCCCOCC(C)(C)C 135aed2fd7dba8c5463b5f3ca52a3631 [0,1,0,0,0,0|3,0,0]=4 2211 B12R0.119 CCCOCCCOCC(C)(C)F 92f0afa0abbd46421bc4d30950c6b878 [0,1,0,0,0,0|3,0,0]=4 2212 B12R0.119 CCCOCCCOCC(C)(C)S 3ea3262c886c64ab04a0d953b35b14e9 [0,1,0,0,0,0|2,1,0]=4 2213 B12R0.119 CCCOCCCOCC(C)(F)F bd8bd31240ea8323fe9521364f3b4094 [0,1,0,0,0,0|3,0,0]=4 2214 B12R0.119 CCCOCCNCCC(C)(C)C 4cda3e3867e760ce564bf2c411bceede [0,1,0,0,0,0|3,0,0]=4 2215 B12R0.119 CCCOCCNCCC(C)(C)F f97c3e5683875673bbf58c6c7bb9ea2a [0,1,0,0,0,0|3,0,0]=4 2216 B12R0.119 CCCOCCNCCC(C)(C)O 5a4ecb3f405374e727364728dc2e3464 [0,1,0,0,0,0|2,0,0]=3 2217 B12R0.119 CCCOCCNCCC(C)(F)F 700f4e60230fbeb667cf54dae5375246 [0,1,0,0,0,0|3,0,0]=4 2218 B12R0.119 CCCOCCOCCC(C)(C)C 394a01fc5e49ecb284c625cdcb74400d [0,1,0,0,0,0|3,0,0]=4 2219 B12R0.119 CCCOCCOCCC(C)(C)O 9910229f092dd173ab8e4c492cbcc243 [0,1,0,0,0,0|2,0,0]=3 2220 B12R0.119 CCCOCCOCCC(C)(C)S 195ac8d48a62f5a59c14f9dc5a4d576f [0,1,0,0,0,0|2,1,0]=4 2221 B12R0.119 CCCOCCOCCC(C)(F)F 4c2a711527f4f34b79f3dc0c2171e68d [0,1,0,0,0,0|3,0,0]=4 2222 B12R0.119 CCCSCCOCCC(C)(C)C c19add7169e878626f6999219a8b6b2c [0,1,0,0,0,0|3,0,0]=4 2223 B12R0.119 CCCSCCOCCC(C)(C)O d9ba8b394d2b18078c2878931ab0c757 [0,1,0,0,0,0|2,0,0]=3 2224 B12R0.119 CCCSCCOCCC(C)(F)F 947d69acf3f90c30cd56ac1db62b0d52 [0,1,0,0,0,0|3,0,0]=4 2225 B12R0.119 CCNCCCCCCC(F)(F)F 4178514f08936885e1849fe4ee334cf6 [0,1,0,0,0,0|3,0,0]=4 2226 B12R0.119 CCNCCCCCCS(=O)(=O)O a945d572a1494f795f04f4dd742c5dd6 [0,1,0,0,0,0|3,0,0]=4 2227 B12R0.119 CCOCCCCCCC(C)(C)C e68b66ffd4e3e13eac1d729279e781f2 [0,1,0,0,0,0|2,0,0]=3 2228 B12R0.119 CCOCCCNCCC(C)(C)C a27d621e8a0e1a230a34ac91e31c178b [0,1,0,0,0,0|3,0,0]=4 2229 B12R0.119 CCOCCCNCCC(C)(C)F 628eaad1583f5d1d540ff24f4599047e [0,1,0,0,0,0|3,0,0]=4 2230 B12R0.119 CCOCCCNCCC(C)(C)O dab6066b18a8b36d447c0410efbe5953 [0,1,0,0,0,0|2,0,0]=3 2231 B12R0.119 CCOCCCNCCC(C)(F)F 613e00747de90515a0487acbf1c1c9a1 [0,1,0,0,0,0|3,0,0]=4 2232 B12R0.119 CCOCCCOCCC(C)(C)C 964c508272046d81e1d6532bdc629261 [0,1,0,0,0,0|3,0,0]=4 2233 B12R0.119 CCOCCCOCCC(C)(C)O 0900b98d770f27435ea4a9086df81735 [0,1,0,0,0,0|2,0,0]=3 2234 B12R0.119 CCOCCCOCCC(C)(C)S 80128089aad80cb96fa332d74052f153 [0,1,0,0,0,0|2,1,0]=4 2235 B12R0.119 CCOCCCOCCC(C)(F)F aa018a3ff165dbf10b1365a4400667bf [0,1,0,0,0,0|3,0,0]=4 2236 B12R0.119 CCOCCNCCCC(C)(C)C 33635ca71b2b7eabc83d7b2d7f0bcd55 [0,1,0,0,0,0|3,0,0]=4 2237 B12R0.119 CCOCCNCCCC(C)(C)O bf05a4f3c99fff72bad6f03872dfd75b [0,1,0,0,0,0|2,0,0]=3 2238 B12R0.119 CCOCCNCCCC(C)(F)F 786576b22f6f1e3058676d86f49624af [0,1,0,0,0,0|3,0,0]=4 2239 B12R0.119 CCOCCOCCCC(C)(C)C 44bb362f3ec70719d24f882303994eb7 [0,1,0,0,0,0|3,0,0]=4 2240 B12R0.119 CCOCCOCCCC(C)(C)O d00b9aa1c3c54cd5e2a846fd8ee787cd [0,1,0,0,0,0|2,0,0]=3 2241 B12R0.119 CCOCCOCCCC(C)(F)F 060308d1d1ff3e4d20a6a8f477d684ff [0,1,0,0,0,0|3,0,0]=4 2242 B12R0.119 CCOCOCCCCC(C)(C)C c94db836186ab20ab8ab2cacdb359103 [0,1,0,0,0,0|3,0,0]=4 2243 B12R0.119 CCSCCCCNCC(C)(C)C e3e5ac2552ecb482567af51b2440f76a [0,1,0,0,0,0|3,0,0]=4 2244 B12R0.119 CCSCCCCNCC(C)(C)F 1fb33e9c5e8233c24119810966a9f0f8 [0,1,0,0,0,0|3,0,0]=4 2245 B12R0.119 CCSCCCCNCC(C)(C)O ed9846f73c13f1025d224c6b593d3e42 [0,1,0,0,0,0|2,0,0]=3 2246 B12R0.119 CCSCCCCNCC(C)(F)F 071564499d3defcbfec7df80f86969b2 [0,1,0,0,0,0|3,0,0]=4 2247 B12R0.119 CCSCCCNCCC(C)(C)C 23b7feda0f0dfa1ccc0c91062a3926e2 [0,1,0,0,0,0|3,0,0]=4 2248 B12R0.119 CCSCCCNCCC(C)(C)F caf2ddf60f33f9e74953c3cf18127e35 [0,1,0,0,0,0|3,0,0]=4 2249 B12R0.119 CCSCCCNCCC(C)(C)O 4a581a4df2b47d2a9fbafa3b5f61b2ee [0,1,0,0,0,0|2,0,0]=3 2250 B12R0.119 CCSCCCOCCC(C)(C)C 0d4d1c8bb16ddaebabed4387dbeab62d [0,1,0,0,0,0|3,0,0]=4 2251 B12R0.119 CCSCCCOCCC(C)(C)O 967e4c5c94cf85eddc35a1631d092bab [0,1,0,0,0,0|2,0,0]=3 2252 B12R0.119 CCSCCCOCCC(C)(C)S f7d73778255f905a83ed3ced81837e6d [0,1,0,0,0,0|2,1,0]=4 2253 B12R0.119 CCSCCCOCCC(C)(F)F 85067656fb5519bd7d5ab234f1ca3ef2 [0,1,0,0,0,0|3,0,0]=4 2254 B12R0.119 CCSCCNCCCC(C)(C)C eba105b8e813900c419a421992234e73 [0,1,0,0,0,0|3,0,0]=4 2255 B12R0.119 CCSCCNCCCC(C)(C)O 9255f782cde3acff6b56d7b759c00a75 [0,1,0,0,0,0|2,0,0]=3 2256 B12R0.119 CCSCCNCCCC(C)(F)F 257a8aca946b80cb8eb814d70d2babd9 [0,1,0,0,0,0|3,0,0]=4 2257 B12R0.119 CCSCCOCCCC(C)(C)C cedd210ce50d9b8794467222e32c370d [0,1,0,0,0,0|3,0,0]=4 2258 B12R0.119 CCSCCOCCCC(C)(C)O 9bc256d09081d3f21290790f4b8889b1 [0,1,0,0,0,0|2,0,0]=3 2259 B12R0.119 CCSCCOCCCC(C)(F)F 27fad1b902d50eac2bd8f28a9640ea74 [0,1,0,0,0,0|3,0,0]=4 2260 B12R0.119 COCCCCCCNC(C)(C)C 13bdf6bf4ef90042c912a1308a2e65f6 [0,1,0,0,0,0|3,0,0]=4 2261 B12R0.119 COCCCCCNCC(C)(C)C 19fe441bd66ae0b09f27975837ef0f2c [0,1,0,0,0,0|3,0,0]=4 2262 B12R0.119 COCCCCCNCC(C)(C)F d090ce7fd078d67ad577c1f451b3ecda [0,1,0,0,0,0|3,0,0]=4 2263 B12R0.119 COCCCCCNCC(C)(C)O 0f27cf5087eb1d86f63aa2410a9bf9fc [0,1,0,0,0,0|2,0,0]=3 2264 B12R0.119 COCCCCCNCC(C)(F)F 21c210e80add910d2d121bc426d28ad8 [0,1,0,0,0,0|3,0,0]=4 2265 B12R0.119 COCCCCCOCC(C)(C)Br 26674364f62ac0b46c6244cb0c480a75 [0,1,0,0,0,0|3,0,0]=4 2266 B12R0.119 COCCCCCOCC(C)(C)C 4859ba59e1ee295999f73bc72985a39b [0,1,0,0,0,0|3,0,0]=4 2267 B12R0.119 COCCCCCOCC(C)(C)F a5776079ed7b20c08d0d1b5ac10edefa [0,1,0,0,0,0|3,0,0]=4 2268 B12R0.119 COCCCCCOCC(C)(C)S 2847ad40a0c50d37b7026c8f3655ae41 [0,1,0,0,0,0|2,1,0]=4 2269 B12R0.119 COCCCCCOCC(C)(F)F f7a5e3f5a8a01820c60d49f12cbe6daa [0,1,0,0,0,0|3,0,0]=4 2270 B12R0.119 COCCCCNCCC(C)(C)C 4ba19ba9a1663ef7811fd233bc8ec692 [0,1,0,0,0,0|3,0,0]=4 2271 B12R0.119 COCCCCNCCC(C)(C)F b96d49b6ec93c9bdb0634da6d50a15c6 [0,1,0,0,0,0|3,0,0]=4 2272 B12R0.119 COCCCCNCCC(C)(C)O 2a16e83c2702e673029f7454121f1044 [0,1,0,0,0,0|2,0,0]=3 2273 B12R0.119 COCCCCNCCC(C)(F)F 0ec56a5098ab7fe9357bc5499b2478ff [0,1,0,0,0,0|3,0,0]=4 2274 B12R0.119 COCCCCOCCC(C)(C)C f692d8e8776bde30b039cba78a220c74 [0,1,0,0,0,0|3,0,0]=4 2275 B12R0.119 COCCCCOCCC(C)(C)O a8149e05fa77009d0b969764bc0c0b5d [0,1,0,0,0,0|2,0,0]=3 2276 B12R0.119 COCCCCOCCC(C)(C)S a3a325d25ce16cee0658f2bf4d3349a0 [0,1,0,0,0,0|2,1,0]=4 2277 B12R0.119 COCCCCOCCC(C)(F)F c8016c12781bfe80f24b7d9fb5e007de [0,1,0,0,0,0|3,0,0]=4 2278 B12R0.119 COCCCNCCCC(C)(C)C 9d138ba6d0a7e299a24457d536692ecc [0,1,0,0,0,0|3,0,0]=4 2279 B12R0.119 COCCCNCCCC(C)(C)O 65aa3b4b5370dbc168c20878fbcd82cf [0,1,0,0,0,0|2,0,0]=3 2280 B12R0.119 COCCCNCCCC(C)(F)F 82e9b3cfac3b487d25df8e2f8c97323c [0,1,0,0,0,0|3,0,0]=4 2281 B12R0.119 COCCCOCCCC(C)(C)C 268fa761f1c0df89ecab484b95f1dc51 [0,1,0,0,0,0|3,0,0]=4 2282 B12R0.119 COCCCOCCCC(C)(C)O 9db696bb339adcc1166b3c531f9abc44 [0,1,0,0,0,0|2,0,0]=3 2283 B12R0.119 COCCCOCCCC(C)(F)F bc63e051a2c96c059a6683d36d93f8a9 [0,1,0,0,0,0|3,0,0]=4 2284 B12R0.119 COCCOCCCCC(C)(C)C b40dd53f25f3ff7ba3b8f195de421ef0 [0,1,0,0,0,0|3,0,0]=4 2285 B12R0.119 COCCOCCNCC(C)(C)O 916c49824b88abd60e131d01c838748b [0,1,0,0,0,0|3,0,0]=4 2286 B12R0.119 COCCOCCOCC(C)(C)O bdc46c278e75f09534932c1defba67e0 [0,1,0,0,0,0|3,0,0]=4 2287 B12R0.119 COCCOCNCCC(C)(C)O d3607891ed32ecd678dfdb0a3f1ac9c6 [0,1,0,0,0,0|3,0,0]=4 2288 B12R0.119 COCOCCCCCC(C)(C)O fe17dbc9da5465d7fb81cf509408f528 [0,1,0,0,0,0|2,0,0]=3 2289 B12R0.119 COCOCCNCCC(C)(C)O bbebe9998eaffc8002ce72337e4ab496 [0,1,0,0,0,0|3,0,0]=4 2290 B12R0.119 CSCCCCNCCC(C)(C)C 0289cbc41eb1aee57a603198a1d420c7 [0,1,0,0,0,0|3,0,0]=4 2291 B12R0.119 CSCCCCNCCC(C)(C)O 251a944bb3ad014f94dfba6d8274298e [0,1,0,0,0,0|2,0,0]=3 2292 B12R0.119 CSCCCCNCCC(C)(F)F 117fa7859529486701c66c9f58c8d194 [0,1,0,0,0,0|3,0,0]=4 2293 B12R0.119 CSCCCCOCCC(C)(C)C cc989ac79fffbab3f7c9f4f08802f319 [0,1,0,0,0,0|3,0,0]=4 2294 B12R0.119 CSCCCCOCCC(C)(C)O eea3354a520491a3e6bca6f4fc47cdb2 [0,1,0,0,0,0|2,0,0]=3 2295 B12R0.119 CSCCCCOCCC(C)(F)F 887caf2184297f00c2553861c93e6b22 [0,1,0,0,0,0|3,0,0]=4 2296 B12R0.119 CSCCCNCCCC(C)(C)C e8d39f2ea7c861636a6e5c6ffa5697c5 [0,1,0,0,0,0|3,0,0]=4 2297 B12R0.119 CSCCCNCCCC(C)(C)O 73137246ded4fa39e9c554cbaa989cbb [0,1,0,0,0,0|2,0,0]=3 2298 B12R0.119 CSCCCNCCCC(C)(F)F 95da8d7f7d78d166ebce34004ae17b6a [0,1,0,0,0,0|3,0,0]=4 2299 B12R0.119 CSCCCOCCCC(C)(C)C 20b2d48c27493db2ed687cf74079cffa [0,1,0,0,0,0|3,0,0]=4 2300 B12R0.119 CSCCCOCCCC(C)(C)O 1f8ccf16360dbf0fc12b2678c521f525 [0,1,0,0,0,0|2,0,0]=3 2301 B12R0.119 CSCCCOCCCC(C)(F)F b261317ed964b2a67ebcaba61a6d0940 [0,1,0,0,0,0|3,0,0]=4 2302 B12R0.119 CSCCOCCCCC(C)(C)C 9e8d4b39d837e410e464476115e10374 [0,1,0,0,0,0|3,0,0]=4 2303 B12R0.184 C=C(C)CCCNCCC(C)CC 501cc7e7730ad8e65b0ca88bb6f4b5e8 [0,1,0,0,0,0|2,0,1]=4 2304 B12R0.184 C=C(C)CCCOCCC(C)CC 3b10c58924f874b4c802aca5ec0203e7 [0,1,0,0,0,0|2,0,1]=4 2305 B12R0.184 C=C(C)CCCOCCC(S)CC 79a51e5fe8f797bca382a8230f97b59e [0,1,0,0,0,0|2,0,1]=4 2306 B12R0.184 C=C(C)CCCOCC[C@@H](C)CC 71a520ce7948cf89007822155e6b0e33 [0,1,0,0,0,0|2,0,1]=4 2307 B12R0.184 C=C(C)CCOCCCC(C)CC 55cf8cae43ebb962a3a0694e769c66e6 [0,1,0,0,0,0|2,0,1]=4 2308 B12R0.184 C=C(C)CCOCCC[C@@H](C)CC ea199e7bf0b728e568e0c0a857aaae45 [0,1,0,0,0,0|2,0,1]=4 2309 B12R0.184 C=C(C)COCCCCC(C)CC 488fc312212f6bae06f49869f9575a76 [0,1,0,0,0,0|2,0,1]=4 2310 B12R0.184 C=C(C)COCCCC[C@@H](C)CC 55b30adb0e38ddd3ab32c4881586f168 [0,1,0,0,0,0|2,0,1]=4 2311 B12R0.184 C=C(CC)COCCCCC(C)C 71844a66efbe591e557d068f0f44fb00 [0,1,0,0,0,0|2,0,1]=4 2312 B12R0.184 C=CC(O)CNCCCCC(C)O 8d34e95d44297c0624bcec423da6dd03 [0,1,0,0,0,0|1,0,2]=4 2313 B12R0.184 C=CC(O)CNCCCC[C@@H](C)O 5f674e76f210eb532984b85780fdc931 [0,1,0,0,0,0|1,0,2]=4 2314 B12R0.184 CC(C#N)CNCCCC[C@@H](C)O fdaf47ab6728d41abb189a3d7190efca [0,1,0,0,0,0|2,0,1]=4 2315 B12R0.184 CC(C)CCCCCNC(C)CO 4c5b3df428607c32a9f7e5fa3cf2bb6e [0,1,0,0,0,0|3,0,0]=4 2316 B12R0.184 CC(C)CCCCCN[C@@H](C)CO b425c39a33b487bd86eda5d3facf5a2e [0,1,0,0,0,0|3,0,0]=4 2317 B12R0.184 CC(C)CCCCCN[C@H](C)CO 88515ea3ee982b17a37038d89195fbb2 [0,1,0,0,0,0|3,0,0]=4 2318 B12R0.184 CC(C)CCCCCOC(C)CF 560e5869d3bfd3c31ffa6ddc07bd3d63 [0,1,0,0,0,0|3,0,0]=4 2319 B12R0.184 CC(C)CCCCCOC(C)CS 5fdb323aa2bca7ab4bf9fc82c62bc17f [0,1,0,0,0,0|3,0,0]=4 2320 B12R0.184 CC(C)CCCCCO[C@H](C)CS 8eb78688839cfde3774412df93ae7cd5 [0,1,0,0,0,0|3,0,0]=4 2321 B12R0.184 CC(C)CCCCNCC(Br)CBr c20b278c5a6d72bfbf139a637c634cab [0,1,0,0,0,0|3,0,0]=4 2322 B12R0.184 CC(C)CCCCNCC(C)CO 7eda64ef5cbc8638bc1e77c8186a9e9b [0,1,0,0,0,0|3,0,0]=4 2323 B12R0.184 CC(C)CCCCNCC(F)CO 506a375de1c48bc1ab4a56f971054cb7 [0,1,0,0,0,0|3,0,0]=4 2324 B12R0.184 CC(C)CCCCNCC(O)CO 9c1859952bd639e35a01108bcae9a01c [0,1,0,0,0,0|3,0,0]=4 2325 B12R0.184 CC(C)CCCCNC[C@@H](F)CO 4e8821141556f4a18ea4c5a2cc67a10a [0,1,0,0,0,0|3,0,0]=4 2326 B12R0.184 CC(C)CCCCNC[C@@H](O)CO 30d2f5fd6ac59f5d5c80a7752ed1d369 [0,1,0,0,0,0|3,0,0]=4 2327 B12R0.184 CC(C)CCCCNC[C@H](C)CO 001952642269fedc4fb7988a82dcf908 [0,1,0,0,0,0|3,0,0]=4 2328 B12R0.184 CC(C)CCCCNC[C@H](F)CO 4ca779e8186475e165f2bf005a6a52e6 [0,1,0,0,0,0|3,0,0]=4 2329 B12R0.184 CC(C)CCCCNC[C@H](O)CO 8f90e59afd6da9b4c9f236c673134968 [0,1,0,0,0,0|3,0,0]=4 2330 B12R0.184 CC(C)CCCCOCC(Br)CBr 027a992701c67e0c5787427e5cf5bd56 [0,1,0,0,0,0|3,0,0]=4 2331 B12R0.184 CC(C)CCCCOCC(Cl)CCl e71ff84a872020d9ddf63298385237cb [0,1,0,0,0,0|3,0,0]=4 2332 B12R0.184 CC(C)CCCCOCC(O)CO 8ca613d08a3d96d4e9d0057e5355dd96 [0,1,0,0,0,0|3,0,0]=4 2333 B12R0.184 CC(C)CCCCOCC(S)CS 2aabdf81653178e7de11e6eca94db231 [0,1,0,0,0,0|3,0,0]=4 2334 B12R0.184 CC(C)CCCCOC[C@@H](O)CO a14ac336a519cc9a5d4f0596a575d6cf [0,1,0,0,0,0|3,0,0]=4 2335 B12R0.184 CC(C)CCCCOC[C@H](O)CO 2fea5a2f46aa78c99a0b4956a022153a [0,1,0,0,0,0|3,0,0]=4 2336 B12R0.184 CC(C)CCCNCCC(C)CO e5e7405bff0353dd2e4dc3860849e328 [0,1,0,0,0,0|3,0,0]=4 2337 B12R0.184 CC(C)CCCNCCC(O)CO d325ebf819679ce278869a81e37a526d [0,1,0,0,0,0|3,0,0]=4 2338 B12R0.184 CC(C)CCCNCC[C@@H](C)CO 9b77f604455dcbe34217e7a3639aa7cf [0,1,0,0,0,0|3,0,0]=4 2339 B12R0.184 CC(C)CCNCCCC(C)CO 3315684c11d42dc5245405ed31930f76 [0,1,0,0,0,0|3,0,0]=4 2340 B12R0.184 CC(CO)CNCCCC[C@@H](C)O 90d47bb02dc266a9f058b76d149f5e7c [0,1,0,0,0,0|2,0,0]=3 2341 B12R0.184 CC(O)CCCCNCC(Br)CBr 2dc18566db5cf2904a2253f1b9ad92b5 [0,1,0,0,0,0|2,0,0]=3 2342 B12R0.184 CC(O)CCCCNCC(C)C#N 6a51ad8718ac779dea239951f1012335 [0,1,0,0,0,0|2,0,1]=4 2343 B12R0.184 CC(O)CCCCNCC(C)CO e1ba0ce61a2cddd2d52e0239f119dff4 [0,1,0,0,0,0|2,0,0]=3 2344 B12R0.184 CC(O)CCCCNCC(F)CO a228ecff690bd370e49615c93508c9e6 [0,1,0,0,0,0|2,0,0]=3 2345 B12R0.184 CC(O)CCCCNCC(O)CO 3afa0be8dec445d55a8ae61c163b9f44 [0,1,0,0,0,0|2,0,0]=3 2346 B12R0.184 CC(O)CCCCNC[C@@H](F)CO cbc44572a0158d5ff44ce29ba859855f [0,1,0,0,0,0|2,0,0]=3 2347 B12R0.184 CC(O)CCCCNC[C@@H](O)CO e02ec97ff2b97c37944ada939b386441 [0,1,0,0,0,0|2,0,0]=3 2348 B12R0.184 CC(O)CCCCNC[C@H](C)CO c30f81533d7efc4acac4af3ac58b50a4 [0,1,0,0,0,0|2,0,0]=3 2349 B12R0.184 CC(O)CCCCNC[C@H](F)CO 894152b56754129767888cf5a92936ee [0,1,0,0,0,0|2,0,0]=3 2350 B12R0.184 CC(O)CCCCNC[C@H](O)CO eba46ef8e600d9e56973c43c91f00b17 [0,1,0,0,0,0|2,0,0]=3 2351 B12R0.184 CC(O)CCCNCCC(C)CO 308b762a3b4ecdd7b58e9cee42bc70ab [0,1,0,0,0,0|2,0,0]=3 2352 B12R0.184 CC(O)CCCNCCC(O)CO f76c3962f81952920690e91c4ba3c80f [0,1,0,0,0,0|2,0,0]=3 2353 B12R0.184 CC(O)CCCNCC[C@@H](C)CO ee18e0a99fae14588af55bef81caaaa9 [0,1,0,0,0,0|2,0,0]=3 2354 B12R0.184 CC(O)CCNCCCC(C)CO 742c0bbd0a9e3612db8c18c8a50b9ba0 [0,1,0,0,0,0|2,0,0]=3 2355 B12R0.184 CCC(=O)CCCCNCC(C)C 4f3e0f5f036d7ba3bf4765d9ce856162 [0,1,0,0,0,0|2,0,1]=4 2356 B12R0.184 CCC(=O)CCCCNCC(C)O 56e60795dbd0e9c551099ca3b5ffd253 [0,1,0,0,0,0|1,0,1]=3 2357 B12R0.184 CCC(=O)CCCCNC[C@@H](C)O 981e4bf1248d19f7d6a004bb291b2ef6 [0,1,0,0,0,0|1,0,1]=3 2358 B12R0.184 CCC(=O)CCCCNC[C@H](C)O aea94d1f24ea2255f0ebc248dc7ab656 [0,1,0,0,0,0|1,0,1]=3 2359 B12R0.184 CCC(=O)CCCCOCC(C)C c9c2a017553d7fca328049e6f9bc080d [0,1,0,0,0,0|2,0,1]=4 2360 B12R0.184 CCC(=O)CCCCOCC(C)F a2ef77fa02aa842d1b7face8f2c36b53 [0,1,0,0,0,0|2,0,1]=4 2361 B12R0.184 CCC(=O)CCCCOCC(C)S 9274a2ee550d6595f88ca7864ff4c423 [0,1,0,0,0,0|1,1,1]=4 2362 B12R0.184 CCC(=O)CCCCOC[C@@H](C)F f1c51ff2bca7e6616d6babdd314b8b61 [0,1,0,0,0,0|2,0,1]=4 2363 B12R0.184 CCC(=O)CCCCOC[C@H](C)F 637c53d7273f96cb5c3ec622aceb3f89 [0,1,0,0,0,0|2,0,1]=4 2364 B12R0.184 CCC(=O)COCCCCC(C)C 6a67363bb26ad6ef7f07a3eb1b0f1840 [0,1,0,0,0,0|2,0,1]=4 2365 B12R0.184 CCC(=O)NCCCCCC(C)C 26741a41b58a1dc6614c9bbe0e7045e9 [0,1,0,0,0,0|2,0,1]=4 2366 B12R0.184 CCC(=O)NCCNCCC(C)O 676d3d1b80df23da1e8ca424bb87133e [0,1,0,0,0,0|2,0,1]=4 2367 B12R0.184 CCC(C)CCCCCOC(C)C 95460cda356fb428de00ad3554c98f24 [0,1,0,0,0,0|2,0,0]=3 2368 B12R0.184 CCC(C)CCCCOCC(=O)O 8486b0703e17c352a6fc39325cd49aec [0,1,0,0,0,0|2,0,1]=4 2369 B12R0.184 CCC(C)CCCCOCC(C)C e538a67af988dd15d79a2c47bbbb1bc0 [0,1,0,0,0,0|2,0,0]=3 2370 B12R0.184 CCC(C)CCCCOCC(F)F 6c92b8e4b1777e6cc4e59275c6e84bf0 [0,1,0,0,0,0|3,0,0]=4 2371 B12R0.184 CCC(C)CCCCOCN(C)C 6a34c2a5786a36da7261b9188091e323 [0,1,0,0,0,0|3,0,0]=4 2372 B12R0.184 CCC(C)CCCOCCC(=O)C a582b5926949e4b40de456dca4a15055 [0,1,0,0,0,0|1,0,2]=4 2373 B12R0.184 CCC(C)CCCOCCC(=O)O 4ead7a3c5cb38f9c45f5ff51fa39fe8f [0,1,0,0,0,0|2,0,1]=4 2374 B12R0.184 CCC(C)CCCOCCC(C)C eb9c18f218fdb05556138a90a749424d [0,1,0,0,0,0|2,0,0]=3 2375 B12R0.184 CCC(C)CCCOCCN(C)C f911000864c7b4c31e1cea1ef0e917cb [0,1,0,0,0,0|3,0,0]=4 2376 B12R0.184 CCC(C)CCCOCCS(=O)C a873fa62d4299a879f8aaa2cbc07565b [0,1,0,0,0,0|2,0,1]=4 2377 B12R0.184 CCC(C)CCCOCOC(C)C 71c37f27dbed2e8c044227b39e4d6324 [0,1,0,0,0,0|3,0,0]=4 2378 B12R0.184 CCC(C)CCNCCCC(=O)C 629ad7c4928409cd6bd4c6c1d6a2c4d4 [0,1,0,0,0,0|1,0,2]=4 2379 B12R0.184 CCC(C)CCNCCCC(=O)O 894c390668388908d351c2ea30e0be7b [0,1,0,0,0,0|2,0,1]=4 2380 B12R0.184 CCC(C)CCNCCCC(C)C 0fc0246e6df4eac90ba91a910d5c00a4 [0,1,0,0,0,0|2,0,0]=3 2381 B12R0.184 CCC(C)CCNCCCC(C)O 3b664d55202348afb992070db02c4b31 [0,1,0,0,0,0|1,0,0]=2 2382 B12R0.184 CCC(C)CCNCCCN(C)C c975ab08877228ef146cee0f755e3e5b [0,1,0,0,0,0|3,0,0]=4 2383 B12R0.184 CCC(C)CCNCCCS(=O)C a589136de5d61e825865392783c0cce9 [0,1,0,0,0,0|2,0,1]=4 2384 B12R0.184 CCC(C)CCNCCOC(C)C fad57a361b7e2cadee8482452f6d26e4 [0,1,0,0,0,0|3,0,0]=4 2385 B12R0.184 CCC(C)CCNCCSC(C)C 91b893abc25880bd0627eb7bb806f7fa [0,1,0,0,0,0|3,0,0]=4 2386 B12R0.184 CCC(C)CCOCCCC(=O)C 018216496fd26e99c490d31e4a9abe19 [0,1,0,0,0,0|1,0,2]=4 2387 B12R0.184 CCC(C)CCOCCCC(C)C 6303bee52d3744249dd248edfda8b629 [0,1,0,0,0,0|2,0,0]=3 2388 B12R0.184 CCC(C)CCOCCCN(C)C 544e3c2c791fbb40516edf09f9a0c26e [0,1,0,0,0,0|3,0,0]=4 2389 B12R0.184 CCC(C)CCOCCOC(C)C 993d52cdca9c06ea38f7cf4e79a2ad6e [0,1,0,0,0,0|3,0,0]=4 2390 B12R0.184 CCC(C)CCOCCSC(C)C 34c6571c0323c3302ae367a4b28c4e96 [0,1,0,0,0,0|3,0,0]=4 2391 B12R0.184 CCC(C)CNCCCCC(=O)C 11677e3c895b01788883515d414aa637 [0,1,0,0,0,0|1,0,2]=4 2392 B12R0.184 CCC(C)CNCCCCC(=O)O 32ed5e7c3b2807e91d4b1a8c7f0ef2e3 [0,1,0,0,0,0|2,0,1]=4 2393 B12R0.184 CCC(C)CNCCCCC(C)C 057542a82d2e19ca5dfa945cba9feed6 [0,1,0,0,0,0|2,0,0]=3 2394 B12R0.184 CCC(C)CNCCCCC(C)O 226ef21c51886093a0b178d08bcee67a [0,1,0,0,0,0|1,0,0]=2 2395 B12R0.184 CCC(C)CNCCCCC(F)F fd33385ec31ef213be412663c314c4a3 [0,1,0,0,0,0|3,0,0]=4 2396 B12R0.184 CCC(C)CNCCCCN(C)C c3ca9f2c7ac836b51a68cd6a2070914c [0,1,0,0,0,0|3,0,0]=4 2397 B12R0.184 CCC(C)CNCCCC[C@@H](C)O f5a4918dd22bea169c5e43c2d715be4a [0,1,0,0,0,0|1,0,0]=2 2398 B12R0.184 CCC(C)CNCCCOC(C)C 3ac37f5affddea511191de940bf7cab5 [0,1,0,0,0,0|3,0,0]=4 2399 B12R0.184 CCC(C)CNCCCSC(C)C e9111e0bf53a08d35d1f3b2baa5e8b05 [0,1,0,0,0,0|3,0,0]=4 2400 B12R0.184 CCC(C)CNCCOCC(C)C bff8047dd44388699a0048433ed252a1 [0,1,0,0,0,0|3,0,0]=4 2401 B12R0.184 CCC(C)COCCCCC(=O)C 5b568416df706d4ef941eb8804e461b9 [0,1,0,0,0,0|1,0,2]=4 2402 B12R0.184 CCC(C)COCCCCC(=O)O 5c7d7a4b76f1270176bce6e3d65dc9d3 [0,1,0,0,0,0|2,0,1]=4 2403 B12R0.184 CCC(C)COCCCCC(C)C 4ffed489963b7dd9e7e1f0786df43b5f [0,1,0,0,0,0|2,0,0]=3 2404 B12R0.184 CCC(C)COCCCCN(C)C 5ffdb14f3596305ede23ceaa6dca546d [0,1,0,0,0,0|3,0,0]=4 2405 B12R0.184 CCC(C)COCCCOC(C)C 2e138310721f6f8770de14cd4e003f19 [0,1,0,0,0,0|3,0,0]=4 2406 B12R0.184 CCC(C)COCCCSC(C)C e23ecc21c3f31130b03f6865d40eb69d [0,1,0,0,0,0|3,0,0]=4 2407 B12R0.184 CCC(C)COCCOCC(C)C 25101c6af0cadf4ddd247a74fb06a1e8 [0,1,0,0,0,0|3,0,0]=4 2408 B12R0.184 CCC(C)COCCSCC(C)C cc0a12868935e12c1a58d1f66f553b46 [0,1,0,0,0,0|3,0,0]=4 2409 B12R0.184 CCC(C)NCCCCCC(=O)C 98ba346b03e3d4e22488fe16dce7d41f [0,1,0,0,0,0|1,0,2]=4 2410 B12R0.184 CCC(C)NCCCCCC(=O)O 3d646953d5e4341bdfbed7705e0be829 [0,1,0,0,0,0|2,0,1]=4 2411 B12R0.184 CCC(C)NCCCCCC(C)C fd668a71725b8002b08937c0fa86ec3f [0,1,0,0,0,0|2,0,0]=3 2412 B12R0.184 CCC(C)NCCCCCC(F)F ca03d41c1439f0525cbf5ad0a954d516 [0,1,0,0,0,0|3,0,0]=4 2413 B12R0.184 CCC(C)NCCCCCN(C)C b60aef3c5bee08aad3d67c7fb05eb933 [0,1,0,0,0,0|3,0,0]=4 2414 B12R0.184 CCC(C)NCCCOCC(C)C c1900c8070db267bf8858c66c3be88fd [0,1,0,0,0,0|3,0,0]=4 2415 B12R0.184 CCC(C)OCCCCCC(=O)C 130798ce17cd8d8055edd1ba29ca1032 [0,1,0,0,0,0|1,0,2]=4 2416 B12R0.184 CCC(C)OCCCCCC(=O)O c9b3660802819f97ee4593234c5c009c [0,1,0,0,0,0|2,0,1]=4 2417 B12R0.184 CCC(C)OCCCCCC(C)C e3452884c9b355198f2eddfb6b3bb4aa [0,1,0,0,0,0|2,0,0]=3 2418 B12R0.184 CCC(C)OCCCCCC(F)F f0c1cba463497ace4af1a54b706c1c93 [0,1,0,0,0,0|3,0,0]=4 2419 B12R0.184 CCC(C)OCCCCCN(C)C 6220516cf6fdc20568ef9a293e9e7340 [0,1,0,0,0,0|3,0,0]=4 2420 B12R0.184 CCC(C)OCCCOCC(C)C 5866abfaf97ca789704188b08df9fcfa [0,1,0,0,0,0|3,0,0]=4 2421 B12R0.184 CCC(C)OCCCSCC(C)C c327fb96b9c341ce1386454545408290 [0,1,0,0,0,0|3,0,0]=4 2422 B12R0.184 CCC(O)CNCCCCC(=O)C d93986c1c9613c84ca151f82c6677694 [0,1,0,0,0,0|1,0,2]=4 2423 B12R0.184 CCC(O)CNCCCCC(=O)O 51e43f3330f2e782fd9c70834ff3dded [0,1,0,0,0,0|2,0,1]=4 2424 B12R0.184 CCC(O)CNCCCCC(C)C fbe86ffcbd39a609691b093345556884 [0,1,0,0,0,0|2,0,0]=3 2425 B12R0.184 CCC(O)CNCCCCC(C)O 9488d3e433c781586a5391c67b7befb0 [0,1,0,0,0,0|1,0,0]=2 2426 B12R0.184 CCC(O)CNCCCCC(F)F 8a3d94e2681aaa59c5ffe36c6bd721f5 [0,1,0,0,0,0|3,0,0]=4 2427 B12R0.184 CCC(O)CNCCCCN(C)C 90fb9990fb7ffcef9c5cfe90945e0cd0 [0,1,0,0,0,0|3,0,0]=4 2428 B12R0.184 CCC(O)CNCCCC[C@@H](C)O 2e04fbc4c83eed52fc42c32f720b7221 [0,1,0,0,0,0|1,0,0]=2 2429 B12R0.184 CCC(O)CNCCCOC(C)C 68740aed189df24321e62bc34c293a81 [0,1,0,0,0,0|3,0,0]=4 2430 B12R0.184 CCC(O)CNCCCSC(C)C edde0963f47c7e460bcb709f8598609a [0,1,0,0,0,0|3,0,0]=4 2431 B12R0.184 CCC(O)CNCCOCC(C)C 69f35b80f7b82f69058190f43aff6130 [0,1,0,0,0,0|3,0,0]=4 2432 B12R0.184 CCC(S)CCOCCCC(=O)C 83b5f2c189e41824564029b4d34fb6c0 [0,1,0,0,0,0|1,0,2]=4 2433 B12R0.184 CCC(S)CCOCCCC(=O)O 4bd4eede6c72611263f60646e7133705 [0,1,0,0,0,0|2,0,1]=4 2434 B12R0.184 CCC(S)CCOCCCC(C)C 7befa17e598fca0ac506a110da1e0003 [0,1,0,0,0,0|2,0,0]=3 2435 B12R0.184 CCC(S)CCOCCCN(C)C 91e8436ece9db9100a5c43e812b1e283 [0,1,0,0,0,0|3,0,0]=4 2436 B12R0.184 CCC(S)CCOCCOC(C)C 5722a36c8d7553a4b2dba644fe69bcc5 [0,1,0,0,0,0|3,0,0]=4 2437 B12R0.184 CCC(S)CCOCCSC(C)C c97fa4d69f9b5529e2cd418a413c7131 [0,1,0,0,0,0|3,0,0]=4 2438 B12R0.184 CCN(C)CCCCCCC(=O)O 421ac9e7456e7450633f2dd83e1c3d0a [0,1,0,0,0,0|2,0,1]=4 2439 B12R0.184 CCN(C)CCCNCCC(C)C 7ff4ffbe8a200f9d9d8f24e748372499 [0,1,0,0,0,0|3,0,0]=4 2440 B12R0.184 CCN(C)CCCNCCC(C)O b0bcb0392c688b21c924863ab870e6eb [0,1,0,0,0,0|2,0,0]=3 2441 B12R0.184 CCN(C)CCCOCCC(C)C 761f12e2c98a244d5d79217655c6b140 [0,1,0,0,0,0|3,0,0]=4 2442 B12R0.184 CCS(=O)CCNCCCC(C)C 210e70040d4a57d127045fee68f59ea0 [0,1,0,0,0,0|3,0,0]=4 2443 B12R0.184 CCS(=O)CCOCCCC(C)C 5d2aadb698b8572b8ef09736008c5d58 [0,1,0,0,0,0|3,0,0]=4 2444 B12R0.184 CC[C@@H](C)CNCCCCC(=O)O 48290853529ecd358a90466f995b4c0d [0,1,0,0,0,0|2,0,1]=4 2445 B12R0.184 CC[C@@H](C)CNCCCCC(F)F 7854fdfc3486b0dffa67ce3e5ffd1f80 [0,1,0,0,0,0|3,0,0]=4 2446 B12R0.184 CC[C@@H](C)CNCCCCN(C)C 2b742ac3acc86288ec8a934c118f3ed6 [0,1,0,0,0,0|3,0,0]=4 2447 B12R0.184 CC[C@@H](C)CNCCCOC(C)C 9193e85d237ff276442bebff83df16a7 [0,1,0,0,0,0|3,0,0]=4 2448 B12R0.184 CC[C@@H](C)CNCCCSC(C)C 29d8b918181e6077e0d1bae4d243cb8f [0,1,0,0,0,0|3,0,0]=4 2449 B12R0.184 CC[C@@H](C)COCCCCC(=O)C 24458f1001af3a5d0e247335829dc54d [0,1,0,0,0,0|1,0,2]=4 2450 B12R0.184 CC[C@@H](C)COCCCCC(=O)O b465e6e8a8d856936133e6667519a43d [0,1,0,0,0,0|2,0,1]=4 2451 B12R0.184 CC[C@@H](C)COCCCCC(C)C afe9548744e74712ad3e90b61905b248 [0,1,0,0,0,0|2,0,0]=3 2452 B12R0.184 CC[C@@H](C)COCCCCN(C)C 7ae0a68e14f09c29f17b5a83dd085a2a [0,1,0,0,0,0|3,0,0]=4 2453 B12R0.184 CC[C@@H](C)COCCCOC(C)C 904bf28d8eb8288ff6cf153d445f11d3 [0,1,0,0,0,0|3,0,0]=4 2454 B12R0.184 CC[C@@H](C)COCCCSC(C)C 46de955720aa197ca4cce63fb290e031 [0,1,0,0,0,0|3,0,0]=4 2455 B12R0.184 CC[C@@H](C)COCCOCC(C)C 13bc21e20812dda4598e74b6f2edd69d [0,1,0,0,0,0|3,0,0]=4 2456 B12R0.184 CC[C@@H](C)COCCSCC(C)C f5ce5448519744d21ef9ac3cb94a4bc1 [0,1,0,0,0,0|3,0,0]=4 2457 B12R0.184 CC[C@@H](C)NCCCCCC(=O)C 3420402e06e26b2ca844ec3293325cd4 [0,1,0,0,0,0|1,0,2]=4 2458 B12R0.184 CC[C@@H](C)NCCCCCC(C)C 275e32da666031be5356429b615b1256 [0,1,0,0,0,0|2,0,0]=3 2459 B12R0.184 CC[C@@H](C)NCCCCCC(F)F f739b561f3e197d68604eaa2ffdbdc06 [0,1,0,0,0,0|3,0,0]=4 2460 B12R0.184 CC[C@@H](C)OCCCCCC(=O)C 2d6b015db0ae5155c4f7d07b80e09826 [0,1,0,0,0,0|1,0,2]=4 2461 B12R0.184 CC[C@@H](C)OCCCCCC(C)C cd38c23679339b04c1f4bb6372d0b795 [0,1,0,0,0,0|2,0,0]=3 2462 B12R0.184 CC[C@@H](C)OCCCCCC(F)F d68d5746038732cb3427a63d86fd9d6d [0,1,0,0,0,0|3,0,0]=4 2463 B12R0.184 CC[C@@H](O)CNCCCCC(=O)C 89aed251e98fc70792cc14dc88282979 [0,1,0,0,0,0|1,0,2]=4 2464 B12R0.184 CC[C@@H](O)CNCCCCC(=O)O d8b00762f9205e8a434feb37d013892c [0,1,0,0,0,0|2,0,1]=4 2465 B12R0.184 CC[C@@H](O)CNCCCCC(C)C ddc154c080ad38d9398ac74790c26186 [0,1,0,0,0,0|2,0,0]=3 2466 B12R0.184 CC[C@@H](O)CNCCCCC(C)O 9ce4e336ca21e4539bc41a8df0c68749 [0,1,0,0,0,0|1,0,0]=2 2467 B12R0.184 CC[C@@H](O)CNCCCCN(C)C 069ff626d8aa54b35b6a79828c831433 [0,1,0,0,0,0|3,0,0]=4 2468 B12R0.184 CC[C@@H](O)CNCCCC[C@@H](C)O 1b02cc1a408983761d8e0444e7cf4780 [0,1,0,0,0,0|1,0,0]=2 2469 B12R0.184 CC[C@@H](O)CNCCOCC(C)C 61c06ca5026ec8b951b611c2afea8406 [0,1,0,0,0,0|3,0,0]=4 2470 B12R0.184 CC[C@H](C)CCCCCOC(C)C 6155ef976851da3d96dbd22fca920691 [0,1,0,0,0,0|2,0,0]=3 2471 B12R0.184 CC[C@H](C)CCCCOCC(=O)O 5e1b312d5fe71ef45c85558505a92658 [0,1,0,0,0,0|2,0,1]=4 2472 B12R0.184 CC[C@H](C)CCCCOCC(C)C c60c70607e53bc82c63a03351c417132 [0,1,0,0,0,0|2,0,0]=3 2473 B12R0.184 CC[C@H](C)CCCCOCC(F)F bda1b6972a793b1993a9f5319d9a9917 [0,1,0,0,0,0|3,0,0]=4 2474 B12R0.184 CC[C@H](C)CCCCOCN(C)C a157ec757fd0c9c6d5963b595ebe43dc [0,1,0,0,0,0|3,0,0]=4 2475 B12R0.184 CC[C@H](C)CCCOCCC(=O)C 94674b280c661c242f7b1b568bf670c0 [0,1,0,0,0,0|1,0,2]=4 2476 B12R0.184 CC[C@H](C)CCCOCCC(=O)O 0cdc399044642f5b9d5487f2f4c9d5ae [0,1,0,0,0,0|2,0,1]=4 2477 B12R0.184 CC[C@H](C)CCCOCCC(C)C 0c978eb61c90ee464ef4fbfb4075b92f [0,1,0,0,0,0|2,0,0]=3 2478 B12R0.184 CC[C@H](C)CCCOCCN(C)C 97db4ad6d7d42e7d0198f553cedfc494 [0,1,0,0,0,0|3,0,0]=4 2479 B12R0.184 CC[C@H](C)CCCOCCS(=O)C 2808354fc0940bb40b32bb5d0a638495 [0,1,0,0,0,0|2,0,1]=4 2480 B12R0.184 CC[C@H](C)CCCOCOC(C)C b76f8980a09167934092c132d4548fe3 [0,1,0,0,0,0|3,0,0]=4 2481 B12R0.184 CC[C@H](C)CCOCCCC(=O)C c8268f1305393105f5dcc10a9a11b62d [0,1,0,0,0,0|1,0,2]=4 2482 B12R0.184 CC[C@H](C)CCOCCCC(C)C 4613d56a2ad0641ef1fdf1193998e48d [0,1,0,0,0,0|2,0,0]=3 2483 B12R0.184 CC[C@H](C)CCOCCCN(C)C 246f3446b67cf406eed0ede70cd650ff [0,1,0,0,0,0|3,0,0]=4 2484 B12R0.184 CC[C@H](C)CCOCCOC(C)C 1cee98af88a9fbed7b7d78708bc0afee [0,1,0,0,0,0|3,0,0]=4 2485 B12R0.184 CC[C@H](C)CCOCCSC(C)C fd34566180d9505ead0a2a5b0df2f6d0 [0,1,0,0,0,0|3,0,0]=4 2486 B12R0.184 CC[C@H](C)CNCCCCC(=O)C 322e7524baee044ed3f660d9b4a41c12 [0,1,0,0,0,0|1,0,2]=4 2487 B12R0.184 CC[C@H](C)CNCCCCC(=O)O d8b356887b3d5a8571f15f812507a662 [0,1,0,0,0,0|2,0,1]=4 2488 B12R0.184 CC[C@H](C)CNCCCCC(C)C a02439d43f3a8b2e6d711d8a4ef5e29e [0,1,0,0,0,0|2,0,0]=3 2489 B12R0.184 CC[C@H](C)CNCCCCC(C)O c711d7934433ed14eddbfc32941af530 [0,1,0,0,0,0|1,0,0]=2 2490 B12R0.184 CC[C@H](C)CNCCCCC(F)F 8314cd5bf9ed02acd7f98c4853f1a4bb [0,1,0,0,0,0|3,0,0]=4 2491 B12R0.184 CC[C@H](C)CNCCCCN(C)C 9d14f7518fa48f3e371714bfa5b00ded [0,1,0,0,0,0|3,0,0]=4 2492 B12R0.184 CC[C@H](C)CNCCCC[C@@H](C)O 3da32315aa0ec8f3b5b5072f5cfd9bb8 [0,1,0,0,0,0|1,0,0]=2 2493 B12R0.184 CC[C@H](C)CNCCCOC(C)C ad1f35f9f37f771904964d4712bdb906 [0,1,0,0,0,0|3,0,0]=4 2494 B12R0.184 CC[C@H](C)CNCCCSC(C)C 631bb1ee87c32b60060c2dd71bc5aa7e [0,1,0,0,0,0|3,0,0]=4 2495 B12R0.184 CC[C@H](C)CNCCOCC(C)C db65c1e65a8a3945644e4245f716f197 [0,1,0,0,0,0|3,0,0]=4 2496 B12R0.184 CC[C@H](C)COCCCCC(=O)C 82ab0ab2e341467be7c2e562e2b707fc [0,1,0,0,0,0|1,0,2]=4 2497 B12R0.184 CC[C@H](C)COCCCCC(=O)O aabf08aa1b335746f76d5448c67692a0 [0,1,0,0,0,0|2,0,1]=4 2498 B12R0.184 CC[C@H](C)COCCCCC(C)C cb8e338102fcb6200738ca4e2fc8253b [0,1,0,0,0,0|2,0,0]=3 2499 B12R0.184 CC[C@H](C)COCCCCN(C)C dc94a592ba8d06d89129dc9073e22746 [0,1,0,0,0,0|3,0,0]=4 2500 B12R0.184 CC[C@H](C)COCCCOC(C)C 746b8ed2da7470ebdab0eceb86ba399e [0,1,0,0,0,0|3,0,0]=4 2501 B12R0.184 CC[C@H](C)COCCCSC(C)C 245db2f7aece9dab8d47d7c3f55a548f [0,1,0,0,0,0|3,0,0]=4 2502 B12R0.184 CC[C@H](C)COCCOCC(C)C bcbdc977f17a90c67f10b3bcbe44fe6e [0,1,0,0,0,0|3,0,0]=4 2503 B12R0.184 CC[C@H](C)COCCSCC(C)C c5b9c0d7093771a6ca9dd3144aad18b2 [0,1,0,0,0,0|3,0,0]=4 2504 B12R0.184 CC[C@H](C)NCCCCCC(=O)C a59f3b2c87bae08dfd259d38c0b205be [0,1,0,0,0,0|1,0,2]=4 2505 B12R0.184 CC[C@H](C)NCCCCCC(C)C 2da384a6f33266d1f1bac36bf540a979 [0,1,0,0,0,0|2,0,0]=3 2506 B12R0.184 CC[C@H](C)NCCCCCC(F)F 90778533526408c0cf1499a0b014e05d [0,1,0,0,0,0|3,0,0]=4 2507 B12R0.184 CC[C@H](C)OCCCCCC(=O)C 282c3e9e9793146e73f2973154dc1a55 [0,1,0,0,0,0|1,0,2]=4 2508 B12R0.184 CC[C@H](C)OCCCCCC(C)C 9610c3fb721f4d28c60e24564721504e [0,1,0,0,0,0|2,0,0]=3 2509 B12R0.184 CC[C@H](C)OCCCCCC(F)F 5588b3e5b1879395c9884c08e89f541d [0,1,0,0,0,0|3,0,0]=4 2510 B12R0.184 CNC(=O)CCCNCCC(C)O 5feca300e243cdfda8ddd3376031bb3f [0,1,0,0,0,0|2,0,1]=4 2511 B12R0.184 CNC(=O)CCCNCC[C@@H](C)O 2cd423687b53921a14e34a763f7b7e56 [0,1,0,0,0,0|2,0,1]=4 2512 B12R0.184 CNC(=O)CCCNCC[C@H](C)O efb070c1009eec5968a6b737515b7587 [0,1,0,0,0,0|2,0,1]=4 2513 B12R0.184 CNC(=O)CCNCCCC(C)O 2bcc8ea783f7a1a670b1318525500a31 [0,1,0,0,0,0|2,0,1]=4 2514 B12R0.184 CNC(=O)CNCCCCC(C)O be107ee09616c35f4ed455f30771c45b [0,1,0,0,0,0|2,0,1]=4 2515 B12R0.184 CNC(=O)CNCCCC[C@@H](C)O 29da0ca8f4942e09f48e8967731f9279 [0,1,0,0,0,0|2,0,1]=4 2516 B12R0.184 COC(=O)CCCCNCC(C)O 3a91e87a6308af785bb72a3f6d20e373 [0,1,0,0,0,0|2,0,1]=4 2517 B12R0.184 COC(=O)CCCCNC[C@@H](C)O b262084a030138f68f3c03a5e35baca9 [0,1,0,0,0,0|2,0,1]=4 2518 B12R0.184 COC(=O)CCCCNC[C@H](C)O 4205c96bfc07b0de50538ee503ea269f [0,1,0,0,0,0|2,0,1]=4 2519 B12R0.184 COC(=O)CCCNCCC(C)O 9c1493174fcfea41f6aad482f131c268 [0,1,0,0,0,0|2,0,1]=4 2520 B12R0.184 COC(=O)CCCNCC[C@@H](C)O 1d2338799f321386edeffe7197a83773 [0,1,0,0,0,0|2,0,1]=4 2521 B12R0.184 COC(=O)CCCNCC[C@H](C)O 57283e227293800b7dc98c060e880c95 [0,1,0,0,0,0|2,0,1]=4 2522 B12R0.184 COC(=O)CCNCCCC(C)O e437758d2c7709ae14b58722af30fa1c [0,1,0,0,0,0|2,0,1]=4 2523 B12R0.184 COC(=O)CNCCCCC(C)O 21351e7f9fd19ba0ebb42e56bea401ce [0,1,0,0,0,0|2,0,1]=4 2524 B12R0.184 COC(=O)CNCCCC[C@@H](C)O 44493351ac0669b1337667d7df301e63 [0,1,0,0,0,0|2,0,1]=4 2525 B12R0.184 COC(C)CCOCCCC(C)C baed9f456c5255d50eaa711049b8c36c [0,1,0,0,0,0|3,0,0]=4 2526 B12R0.184 COC(C)COCCCCC(C)C c3ff4926e2533da8f1c7da934f9d0e83 [0,1,0,0,0,0|3,0,0]=4 2527 B12R0.184 CO[C@@H](C)CNCCCCC(C)C 7cf78797053d936f3887c78da13ca7c2 [0,1,0,0,0,0|3,0,0]=4 2528 B12R0.184 CO[C@@H](C)CNCCCCC(C)O 063abd22ee20fb19c285644e4817f271 [0,1,0,0,0,0|2,0,0]=3 2529 B12R0.184 CO[C@@H](C)CNCCCC[C@@H](C)O 2e5929bd91639da4604dfd2390ad468d [0,1,0,0,0,0|2,0,0]=3 2530 B12R0.184 CO[C@@H](C)COCCCCC(C)C 0ef758628eaa1b514464b86aec0cec8b [0,1,0,0,0,0|3,0,0]=4 2531 B12R0.184 CO[C@H](C)CNCCCCC(C)C c316d647a784f1dd0e243ed71ef1f8f0 [0,1,0,0,0,0|3,0,0]=4 2532 B12R0.184 CO[C@H](C)CNCCCCC(C)O 716f003cccce18f0051415d19429babd [0,1,0,0,0,0|2,0,0]=3 2533 B12R0.184 CO[C@H](C)CNCCCC[C@@H](C)O 1851fc30bcac8f2fed43e3627700ff77 [0,1,0,0,0,0|2,0,0]=3 2534 B12R0.184 CO[C@H](C)COCCCCC(C)C 4ae203afd3fef651b901d4710609bf26 [0,1,0,0,0,0|3,0,0]=4 2535 B12R0.184 C[C@@H](O)CCCCNCC(Br)CBr 14abca62726d91b6fd3f8bac0243b5dd [0,1,0,0,0,0|2,0,0]=3 2536 B12R0.184 C[C@@H](O)CCCCNCC(F)CO 54939d0a6d34c7c2b76f942312836c8a [0,1,0,0,0,0|2,0,0]=3 2537 B12R0.184 C[C@@H](O)CCCCNCC(O)CO 4321c7bc6a2783ac5e5b1966daaec34d [0,1,0,0,0,0|2,0,0]=3 2538 B12R0.184 C[C@@H](O)CCCCNC[C@@H](F)CO 2da3ca8c86ec93a5e09ddfcdbe0fcc09 [0,1,0,0,0,0|2,0,0]=3 2539 B12R0.184 C[C@@H](O)CCCCNC[C@@H](O)CO 01b253d8d3a53a7b3d4639dfe16b4bd6 [0,1,0,0,0,0|2,0,0]=3 2540 B12R0.184 C[C@@H](O)CCCCNC[C@H](F)CO 2ed88bc8fb90c506573321dd10dcc348 [0,1,0,0,0,0|2,0,0]=3 2541 B12R0.184 C[C@@H](O)CCCCNC[C@H](O)CO fa969956cde3a17dcf9b6e5d11a1ab6e [0,1,0,0,0,0|2,0,0]=3 2542 B12R0.184 C[C@H](CO)CNCCCC[C@@H](C)O f2457ab985c9cbdd51d4d90545c82e49 [0,1,0,0,0,0|2,0,0]=3 2543 B12R0.233 C=C(C)CCCC(C)CCOCC d1733e26fe61a6ae84121b39faf18c96 [0,1,0,0,0,0|2,0,1]=4 2544 B12R0.233 C=C(C)CCCN(C)CCCCC ab4de516041800383dd3016d549a9d9e [0,1,0,0,0,0|2,0,1]=4 2545 B12R0.233 C=C(C)CCNC(C)CCCCC d949a1821d40689f1da624343f345719 [0,1,0,0,0,0|2,0,1]=4 2546 B12R0.233 C=C(C)CCN[C@@H](C)CCCCC 2e9611c319e78b6b57a9e39738165076 [0,1,0,0,0,0|2,0,1]=4 2547 B12R0.233 C=C(C)CCOC(C)CCCCC 2438f845345f1eda423c2ed340b482e5 [0,1,0,0,0,0|2,0,1]=4 2548 B12R0.233 C=C(C)CCO[C@@H](C)CCCCC c4731d5080d962ab01b0e5f9fecf5c59 [0,1,0,0,0,0|2,0,1]=4 2549 B12R0.233 C=C(C)CCO[C@H](C)CCCCC 383341a6a16f8dcf0d4ea5f6a231a77e [0,1,0,0,0,0|2,0,1]=4 2550 B12R0.233 C=C(C)COCC(C)CCCCC bcf4632d34917bdc6b9adc73ada67022 [0,1,0,0,0,0|2,0,1]=4 2551 B12R0.233 C=CCCCN(C)CCCC(C)O 1b82412d1f6a133c6fd4b8d5ad0fe698 [0,1,0,0,0,0|1,0,2]=4 2552 B12R0.233 CC(C)CCCC(C)CCNCF f0e73c28f355a1809a4d2684e0fcba70 [0,1,0,0,0,0|3,0,0]=4 2553 B12R0.233 CC(C)CCCC(C)CCNCO ecaa463845edc2ecbae704cc01d1f83e [0,1,0,0,0,0|3,0,0]=4 2554 B12R0.233 CC(C)CCCC(C)CCOCF f059e72f9c8f6997810bcae6a8f17bb9 [0,1,0,0,0,0|3,0,0]=4 2555 B12R0.233 CC(C)CCCC(C)NCCCF 7e8e649c752c7317544101098a4e3176 [0,1,0,0,0,0|3,0,0]=4 2556 B12R0.233 CC(C)CCCC(C)NCCCO 02f851a403f7c5fdf1126edfc6ecd082 [0,1,0,0,0,0|3,0,0]=4 2557 B12R0.233 CC(C)CCCC(C)NCCCS 1f0fdcd9c8966412aa59d572928f356d [0,1,0,0,0,0|3,0,0]=4 2558 B12R0.233 CC(C)CCCC(C)OCCCF ae8f610252d24c9fcb6da1be19d3f40d [0,1,0,0,0,0|3,0,0]=4 2559 B12R0.233 CC(C)CCCC(C)OCCCS 113b4d0ae80433eb3074e4b09e43542f [0,1,0,0,0,0|3,0,0]=4 2560 B12R0.233 CC(C)CCCN(C)CCCCO dc1b3894b59875ada612f6858a32bf8a [0,1,0,0,0,0|3,0,0]=4 2561 B12R0.233 CC(C)CCC[C@H](C)CCOCF 02ad29d2262b66f6b492484c249f1fb1 [0,1,0,0,0,0|3,0,0]=4 2562 B12R0.233 CC(C)CCNC(C)CCCCO 09c1c7255998d52bab2956af5669aa67 [0,1,0,0,0,0|3,0,0]=4 2563 B12R0.233 CC(CCCCO)NCC[C@@H](C)O 69594aa1b174d1c17f9410f90dba3020 [0,1,0,0,0,0|2,0,0]=3 2564 B12R0.233 CC(CCCCO)NCC[C@H](C)O b03eacbddb8430f67667efc561fdf29c [0,1,0,0,0,0|2,0,0]=3 2565 B12R0.233 CC(O)CCCN(C)CCCCO e866d7a3b3866a2cfb655dd28768d2b5 [0,1,0,0,0,0|2,0,0]=3 2566 B12R0.233 CC(O)CCNC(=O)CCCCF c6b91d36c62c0a43ee1f2a8025d44419 [0,1,0,0,0,0|2,0,1]=4 2567 B12R0.233 CC(O)CCNC(=O)CCCCO fc96ba5d1d490fb10314450eee30c14d [0,1,0,0,0,0|2,0,1]=4 2568 B12R0.233 CC(O)CCNC(=O)CCCCS 553e3ed68e6b9537662e3b1106bbd8ec [0,1,0,0,0,0|2,0,1]=4 2569 B12R0.233 CC(O)CCNC(C)CCCCO a5c82c0662b5602127d01b768afb4066 [0,1,0,0,0,0|2,0,0]=3 2570 B12R0.233 CCCCCC(=O)CNCC(C)C 2f8ffa9b1e7428d9610d9c9792423e52 [0,1,0,0,0,0|2,0,1]=4 2571 B12R0.233 CCCCCC(=O)CNCC(C)O 012939746f6c712e197753ac51a73d9d [0,1,0,0,0,0|1,0,1]=3 2572 B12R0.233 CCCCCC(=O)CNC[C@@H](C)O 11934f2fa4def43b1c8c12b6e829769d [0,1,0,0,0,0|1,0,1]=3 2573 B12R0.233 CCCCCC(=O)CNC[C@H](C)O ba9723e47ea22a6cb62220419ddd73bb [0,1,0,0,0,0|1,0,1]=3 2574 B12R0.233 CCCCCC(=O)COCC(C)C 27a79f1baef076d63996803cc7e04320 [0,1,0,0,0,0|2,0,1]=4 2575 B12R0.233 CCCCCC(=O)COCC(C)F 07c33e7926fc3f18be8b324331a95be7 [0,1,0,0,0,0|2,0,1]=4 2576 B12R0.233 CCCCCC(=O)COCC(C)S a1bdb1347817d41c37ec8c262f65572a [0,1,0,0,0,0|1,1,1]=4 2577 B12R0.233 CCCCCC(=O)COC[C@@H](C)F a11d35a37c461d9d94e44d6538df4622 [0,1,0,0,0,0|2,0,1]=4 2578 B12R0.233 CCCCCC(=O)COC[C@H](C)F 13fd6134054a0b7442b429e1b0e42b07 [0,1,0,0,0,0|2,0,1]=4 2579 B12R0.233 CCCCCC(=O)NCCC(C)C de5d4775851c3f556e0a37cd69bd6694 [0,1,0,0,0,0|2,0,1]=4 2580 B12R0.233 CCCCCC(=O)NCCC(C)O 7f60771b66ae1bec642b09c0c06b499c [0,1,0,0,0,0|1,0,1]=3 2581 B12R0.233 CCCCCC(=O)NCC[C@@H](C)O f61ba65d8dcacaf44bfbb83aa992ca7d [0,1,0,0,0,0|1,0,1]=3 2582 B12R0.233 CCCCCC(=O)NCC[C@H](C)O c876e519826877ab888e09489622daa0 [0,1,0,0,0,0|1,0,1]=3 2583 B12R0.233 CCCCCC(C)COCC(=O)O 81c74f114655b4076459ce3fa87f3974 [0,1,0,0,0,0|2,0,1]=4 2584 B12R0.233 CCCCCC(C)COCC(C)C 4213359448123f51d56b792ddcbbd57d [0,1,0,0,0,0|2,0,0]=3 2585 B12R0.233 CCCCCC(C)COCC(F)F f2755d8a14fb140bedecdfbbc70808de [0,1,0,0,0,0|3,0,0]=4 2586 B12R0.233 CCCCCC(C)COCN(C)C 33fb7b4b6b1e87f98ae7b4e8bb087228 [0,1,0,0,0,0|3,0,0]=4 2587 B12R0.233 CCCCCC(C)NCCC(=O)C ca523037baf6121595d047b8b65764c7 [0,1,0,0,0,0|1,0,2]=4 2588 B12R0.233 CCCCCC(C)NCCC(=O)O 05cad023ab20b6292f356b8740b9a6ca [0,1,0,0,0,0|2,0,1]=4 2589 B12R0.233 CCCCCC(C)NCCC(C)C 750f4c42b3a29cd4c1925fc5a4f77d78 [0,1,0,0,0,0|2,0,0]=3 2590 B12R0.233 CCCCCC(C)NCCC(C)O 2e8f135b250c8d8032391c08c421d774 [0,1,0,0,0,0|1,0,0]=2 2591 B12R0.233 CCCCCC(C)NCCC(F)F 59e640c292dae437aaeb70ead42e45b8 [0,1,0,0,0,0|3,0,0]=4 2592 B12R0.233 CCCCCC(C)NCCN(C)C ced8f58b90e191d079a3945bb078d3ac [0,1,0,0,0,0|3,0,0]=4 2593 B12R0.233 CCCCCC(C)NCCS(=O)C 8ace159d91dc2d7c8595c9c089f7589f [0,1,0,0,0,0|2,0,1]=4 2594 B12R0.233 CCCCCC(C)NCCS(=O)O e57746bc06febdafa2a17995b0432458 [0,1,0,0,0,0|3,0,0]=4 2595 B12R0.233 CCCCCC(C)NCC[C@@H](C)O 5158f540596738c6e4340c80c5703ec9 [0,1,0,0,0,0|1,0,0]=2 2596 B12R0.233 CCCCCC(C)NCC[C@H](C)O 8d4cacde00c91428fc1db84e559ed2eb [0,1,0,0,0,0|1,0,0]=2 2597 B12R0.233 CCCCCC(C)NCOC(C)C b9bf2ed2e7f21e4b8578c8f1a85e20fa [0,1,0,0,0,0|3,0,0]=4 2598 B12R0.233 CCCCCC(C)OCCC(=O)C 49212f27a69ad4babeadaa822182164c [0,1,0,0,0,0|1,0,2]=4 2599 B12R0.233 CCCCCC(C)OCCC(C)C c52701f546739edbc5422405b5075256 [0,1,0,0,0,0|2,0,0]=3 2600 B12R0.233 CCCCCC(C)OCCC(F)F 127e4701095b661fb45fe91393ea6b85 [0,1,0,0,0,0|3,0,0]=4 2601 B12R0.233 CCCCCC(C)OCCN(C)C 339bb6f086d32968db555b2a2fd922d4 [0,1,0,0,0,0|3,0,0]=4 2602 B12R0.233 CCCCCC(C)OCCS(=O)C a28f85c40aa4985b5faead7afa3ce21c [0,1,0,0,0,0|2,0,1]=4 2603 B12R0.233 CCCCCC(C)OCOC(C)C 8171ecca13377b30a6d0ab81989940ed [0,1,0,0,0,0|3,0,0]=4 2604 B12R0.233 CCCCCN(C)CCCC(=O)C da826910ffd9c9e43bc3128cc3be90cf [0,1,0,0,0,0|1,0,2]=4 2605 B12R0.233 CCCCCN(C)CCCC(=O)O 0f59389ce29ac8a9b550931c1f546c61 [0,1,0,0,0,0|2,0,1]=4 2606 B12R0.233 CCCCCN(C)CCCC(C)C af6a5e882550c1acfc13ccaa9700ce94 [0,1,0,0,0,0|2,0,0]=3 2607 B12R0.233 CCCCCN(C)CCCC(C)O 3b86c2a7a57e43106e61c7cf0aa9d471 [0,1,0,0,0,0|1,0,0]=2 2608 B12R0.233 CCCCCN(C)CCCN(C)C 35bc67c09db5c62861b06ee3b5be94de [0,1,0,0,0,0|3,0,0]=4 2609 B12R0.233 CCCCCN(C)CCOC(C)C 396ed03bc753a526e332ac872b6eda96 [0,1,0,0,0,0|3,0,0]=4 2610 B12R0.233 CCCCC[C@@H](C)OCCC(=O)C 1e961630be852b4f9db98793735eca13 [0,1,0,0,0,0|1,0,2]=4 2611 B12R0.233 CCCCC[C@@H](C)OCCC(C)C b605bfe2311a91cb1ab8ad3b09e7b3bc [0,1,0,0,0,0|2,0,0]=3 2612 B12R0.233 CCCCC[C@@H](C)OCCN(C)C 0f5b82b371ff79fce453a35f039a7867 [0,1,0,0,0,0|3,0,0]=4 2613 B12R0.233 CCCCC[C@@H](C)OCCS(=O)C 2154d947aaea8c06c10de2ff7a562b56 [0,1,0,0,0,0|2,0,1]=4 2614 B12R0.233 CCCCC[C@@H](C)OCOC(C)C 44ac6a70b56b0bf677af8794d73db56a [0,1,0,0,0,0|3,0,0]=4 2615 B12R0.233 CCCCC[C@H](C)NCCC(=O)C bb0e17d5bac070abf327b40ef4908e24 [0,1,0,0,0,0|1,0,2]=4 2616 B12R0.233 CCCCC[C@H](C)NCCC(=O)O 5b34d2ac605baf095b301b99afc4dfd4 [0,1,0,0,0,0|2,0,1]=4 2617 B12R0.233 CCCCC[C@H](C)NCCC(C)C efc4dbe7809670f31d0f38fe2cfaeb29 [0,1,0,0,0,0|2,0,0]=3 2618 B12R0.233 CCCCC[C@H](C)NCCC(C)O 88c87c0426ba48940da6e5a34b3f661f [0,1,0,0,0,0|1,0,0]=2 2619 B12R0.233 CCCCC[C@H](C)NCCC(F)F 25114fc1b1dd237c87aeffaf309b1420 [0,1,0,0,0,0|3,0,0]=4 2620 B12R0.233 CCCCC[C@H](C)NCCN(C)C 941cc4c2ff0506cf4f196bec688c35cd [0,1,0,0,0,0|3,0,0]=4 2621 B12R0.233 CCCCC[C@H](C)NCCS(=O)C 5562f52d6b9fa155203951c07be1df71 [0,1,0,0,0,0|2,0,1]=4 2622 B12R0.233 CCCCC[C@H](C)NCCS(=O)O a3faef4f61ad166631ed0099cd5f53d9 [0,1,0,0,0,0|3,0,0]=4 2623 B12R0.233 CCCCC[C@H](C)NCC[C@@H](C)O b1b3fb51506042884954e356c5a7ea41 [0,1,0,0,0,0|1,0,0]=2 2624 B12R0.233 CCCCC[C@H](C)NCC[C@H](C)O 7e31ad5a12d36049f91ba385cea5f0b0 [0,1,0,0,0,0|1,0,0]=2 2625 B12R0.233 CCCCC[C@H](C)NCOC(C)C b152072ca8a3bb9fb458692922d3851c [0,1,0,0,0,0|3,0,0]=4 2626 B12R0.233 CCCCC[C@H](C)OCCC(=O)C cf1bce5f8772a5ffce7117f2be93cad3 [0,1,0,0,0,0|1,0,2]=4 2627 B12R0.233 CCCCC[C@H](C)OCCC(C)C 1fbf45b04ff7ed87d7ca616d67fccaff [0,1,0,0,0,0|2,0,0]=3 2628 B12R0.233 CCCCC[C@H](C)OCCC(F)F d69d84a94da5d2645aa09e6ac0508ab0 [0,1,0,0,0,0|3,0,0]=4 2629 B12R0.233 CCCCC[C@H](C)OCCN(C)C ab36cd51c1aeb99ffe445a3f7b0d1e81 [0,1,0,0,0,0|3,0,0]=4 2630 B12R0.233 CCCCC[C@H](C)OCCS(=O)C d8691ff9001f6146b9bdd4c7ba86349b [0,1,0,0,0,0|2,0,1]=4 2631 B12R0.233 CCCCC[C@H](C)OCOC(C)C a49b3b416b1c04cb2b74b16070f7b832 [0,1,0,0,0,0|3,0,0]=4 2632 B12R0.233 CCCCNC(=O)CCCC(C)C 0965007a9c047a85020048af373a262d [0,1,0,0,0,0|2,0,1]=4 2633 B12R0.233 CCCCNC(=O)CNCC(C)O fedb07fd06ba48869b195512e0f97c3f [0,1,0,0,0,0|2,0,1]=4 2634 B12R0.233 CCCCNC(=O)CNC[C@@H](C)O cea4ede5db59d5d7d4192f5688f43aa9 [0,1,0,0,0,0|2,0,1]=4 2635 B12R0.233 CCCCNC(=O)CNC[C@H](C)O 447af2429a13602dc09eaa5c06e4bb6b [0,1,0,0,0,0|2,0,1]=4 2636 B12R0.233 CCCCNC(=O)NCCC(C)O 8e5661c4799481cb779586081058d0ed [0,1,0,0,0,0|2,0,1]=4 2637 B12R0.233 CCCCNC(=O)NCC[C@@H](C)O 78144d3107e1577bb145768ea57329e1 [0,1,0,0,0,0|2,0,1]=4 2638 B12R0.233 CCCCNC(=O)NCC[C@H](C)O 28ceddf3670b7e60886667a11de28c9b [0,1,0,0,0,0|2,0,1]=4 2639 B12R0.233 CCCCNC(=S)NCCC(C)O 68206097f2401976270eca715a8e8718 [0,1,0,0,0,0|2,0,1]=4 2640 B12R0.233 CCCCNC(=S)NCC[C@@H](C)O 1bf5132fd04df6cc45149547243c27eb [0,1,0,0,0,0|2,0,1]=4 2641 B12R0.233 CCCCNC(=S)NCC[C@H](C)O 4c158eedde592d396966ff16b7247694 [0,1,0,0,0,0|2,0,1]=4 2642 B12R0.233 CCCCNC(C)CCCC(C)C eb1f0ffa228decb3594aa9690902d413 [0,1,0,0,0,0|2,0,0]=3 2643 B12R0.233 CCCCOC(=O)CNCC(C)O e31095043326ff1f034c6d97b8a36176 [0,1,0,0,0,0|2,0,1]=4 2644 B12R0.233 CCCCOC(=O)CNC[C@@H](C)O a60b467e49e79ebbd8201726798bd9ed [0,1,0,0,0,0|2,0,1]=4 2645 B12R0.233 CCCCOC(=O)CNC[C@H](C)O a3e068166a55bd53eb4370905e132015 [0,1,0,0,0,0|2,0,1]=4 2646 B12R0.233 CCCCOC(C)CCCC(C)C 8330c766083d32e3e679f7fe02d88b09 [0,1,0,0,0,0|2,0,0]=3 2647 B12R0.233 CCCOCC(=O)NCCC(C)O ad3f2c49e83a2bfc5474f1a9c9282295 [0,1,0,0,0,0|2,0,1]=4 2648 B12R0.233 CCCOCC(=O)NCC[C@@H](C)O f67869fd04a7f96ae43e9cee97ae3ce9 [0,1,0,0,0,0|2,0,1]=4 2649 B12R0.233 CCCOCC(=O)NCC[C@H](C)O 3118ed4f273c513d65cbac6bef4aaaa6 [0,1,0,0,0,0|2,0,1]=4 2650 B12R0.233 CCCOCC(C)COCC(C)C 86113b1b56bf16cb31e8854df608fcdf [0,1,0,0,0,0|3,0,0]=4 2651 B12R0.233 CCCOCC(C)OCCC(C)C 21ac25f6de34fa5e59bce4dc66e00790 [0,1,0,0,0,0|3,0,0]=4 2652 B12R0.233 CCCSCC(=O)NCCC(C)O e7acda73f9a77b9ebd64703f898404d7 [0,1,0,0,0,0|2,0,1]=4 2653 B12R0.233 CCCSCC(=O)NCC[C@@H](C)O 5ee2981a70455c8b37a5188490b182d0 [0,1,0,0,0,0|2,0,1]=4 2654 B12R0.233 CCCSCC(=O)NCC[C@H](C)O 8ccdfd7fcd9776ac001fa5bd6926bec0 [0,1,0,0,0,0|2,0,1]=4 2655 B12R0.233 CCNCCC(C)CCCC(C)C 4ce1ac52ece3866747a9aed47b1a579d [0,1,0,0,0,0|2,0,0]=3 2656 B12R0.233 CCOCCC(=O)NCCC(C)O 779ea8a6c5cee2c4bcc3f75e8227c326 [0,1,0,0,0,0|2,0,1]=4 2657 B12R0.233 CCOCCC(=O)NCC[C@@H](C)O 85b3309015541d5b28d97b3336b92e63 [0,1,0,0,0,0|2,0,1]=4 2658 B12R0.233 CCOCCC(=O)NCC[C@H](C)O f8b2075d522488f08aa96a4c8ca0af72 [0,1,0,0,0,0|2,0,1]=4 2659 B12R0.233 CCOCCC(C)CCCC(C)C 47419b04183a315d7b2e4ef5c28cd216 [0,1,0,0,0,0|2,0,0]=3 2660 B12R0.233 CCOCCN(C)CCCC(C)C 46197071e23eba54ae099658cba1b1a1 [0,1,0,0,0,0|3,0,0]=4 2661 B12R0.233 CCOCCN(C)CCCC(C)O 2853164d68feb2592e1498a5566f4efc [0,1,0,0,0,0|2,0,0]=3 2662 B12R0.233 CCOCC[C@@H](C)CCCC(C)C f2bdb086e82fdc1e41cfe6ce646a5f3a [0,1,0,0,0,0|2,0,0]=3 2663 B12R0.233 CCOCNC(C)CCCC(C)C 2539e01c56fb3e9853c980fbc7afd35b [0,1,0,0,0,0|3,0,0]=4 2664 B12R0.233 CCSCCC(=O)NCCC(C)O e40ab069d458728608bb81d31c928380 [0,1,0,0,0,0|2,0,1]=4 2665 B12R0.233 CCSCCC(=O)NCC[C@@H](C)O 4768ec63e576cb2a1eb46363ab96bf4a [0,1,0,0,0,0|2,0,1]=4 2666 B12R0.233 CCSCCC(=O)NCC[C@H](C)O f4db411571c27ae32e6b108f445ccd38 [0,1,0,0,0,0|2,0,1]=4 2667 B12R0.233 COCCCC(=O)NCCC(C)O 1a8949da1b7f88ba3660bfd31df0701d [0,1,0,0,0,0|2,0,1]=4 2668 B12R0.233 COCCCC(=O)NCC[C@@H](C)O 1a0fa5cb47deb2c60cd05f6fc65bbe16 [0,1,0,0,0,0|2,0,1]=4 2669 B12R0.233 COCCCC(=O)NCC[C@H](C)O c806fc4dc7aeeb15c88bc45bbac897d3 [0,1,0,0,0,0|2,0,1]=4 2670 B12R0.233 COCCCN(C)CCCC(C)C a67bc6d81fd866a11056185d22e2a150 [0,1,0,0,0,0|3,0,0]=4 2671 B12R0.233 COCCCN(C)CCCC(C)O 3073006f818d9b367ce9004615358521 [0,1,0,0,0,0|2,0,0]=3 2672 B12R0.233 COCCNC(C)CCCC(C)C 0fe204c0402293341e56f3e23176fe53 [0,1,0,0,0,0|3,0,0]=4 2673 B12R0.233 COCCOC(C)CCCC(C)C 0d929250b6a3b88298d262b55ebd048b [0,1,0,0,0,0|3,0,0]=4 2674 B12R0.233 CSCCCC(=O)NCCC(C)O de6ff54ef59b83861bf253a1578b5980 [0,1,0,0,0,0|2,0,1]=4 2675 B12R0.233 CSCCCC(=O)NCC[C@@H](C)O 45e436cbb52e40656a978a83fb7ce47b [0,1,0,0,0,0|2,0,1]=4 2676 B12R0.233 CSCCCC(=O)NCC[C@H](C)O e16c879f2c235e4d9cf5d14b16b4ffd9 [0,1,0,0,0,0|2,0,1]=4 2677 B12R0.233 CSCCNC(C)CCCC(C)C ed7929f72766a9c1d7d16b79dd740f0c [0,1,0,0,0,0|3,0,0]=4 2678 B12R0.233 CSCCOC(C)CCCC(C)C 3b3465352ddef3e4e18da56287391d23 [0,1,0,0,0,0|3,0,0]=4 2679 B12R0.233 C[C@@H](O)CCNC(=O)CCCCF 052111f53ea44694adf27c25f96fb287 [0,1,0,0,0,0|2,0,1]=4 2680 B12R0.233 C[C@@H](O)CCNC(=O)CCCCO 57c70db0a9df69fc17d68739b1e8fc90 [0,1,0,0,0,0|2,0,1]=4 2681 B12R0.233 C[C@@H](O)CCNC(=O)CCCCS 5d49fbeb2ff588cb9bd569051128c5e5 [0,1,0,0,0,0|2,0,1]=4 2682 B12R0.233 C[C@H](O)CCNC(=O)CCCCF 137bc9fb5f9f424b50bc64cd96c2f069 [0,1,0,0,0,0|2,0,1]=4 2683 B12R0.233 C[C@H](O)CCNC(=O)CCCCO 3b9dc55dd1087997e2b6aa917b2c78d9 [0,1,0,0,0,0|2,0,1]=4 2684 B12R0.233 C[C@H](O)CCNC(=O)CCCCS 53973a03515d1da5c3a3a7a033c533d0 [0,1,0,0,0,0|2,0,1]=4 2685 B12R0.234 C#CCCCCCCCOC(C)C 08cd1b0a906e010e2dd7459eb1f053b1 [0,1,0,0,0,0|1,0,2]=4 2686 B12R0.234 C#CCCCCCCNCC(C)C 6615f64eee58e001c13ab958bbfe77ac [0,1,0,0,0,0|1,0,2]=4 2687 B12R0.234 C#CCCCCCCNCC(C)O 774d7cd65b2e7ba73145a27ccb99cc02 [0,1,0,0,0,0|0,0,2]=3 2688 B12R0.234 C#CCCCCCCNC[C@@H](C)O ca7dd726c68de55e6e69296855074ef6 [0,1,0,0,0,0|0,0,2]=3 2689 B12R0.234 C#CCCCCCCNC[C@H](C)O 7919f9c53cd6eb91fcb533c087d10bf2 [0,1,0,0,0,0|0,0,2]=3 2690 B12R0.234 C#CCCCCCCOCC(C)C 6928ba905e4bb64fff1acfc60639ce39 [0,1,0,0,0,0|1,0,2]=4 2691 B12R0.234 C#CCCCCCCOCC(C)F e030c810234167d955481c076462f35f [0,1,0,0,0,0|1,0,2]=4 2692 B12R0.234 C#CCCCCCCOCC(C)S 3b852df0e90b0c4041a2d5040b08c212 [0,1,0,0,0,0|0,1,2]=4 2693 B12R0.234 C#CCCCCCCOC[C@@H](C)F 6c3f6e67aad5f142b4f68681237bf72c [0,1,0,0,0,0|1,0,2]=4 2694 B12R0.234 C#CCCCCCCOC[C@H](C)F dcc28b70d698b34a25fa8dc81bc2edf7 [0,1,0,0,0,0|1,0,2]=4 2695 B12R0.234 C#CCCCCCNCCC(C)C 493bef5ca1c17d1af7bfc56e4898ab86 [0,1,0,0,0,0|1,0,2]=4 2696 B12R0.234 C#CCCCCCNCCC(C)O 6048f3538ea0980996021c67d5b601bb [0,1,0,0,0,0|0,0,2]=3 2697 B12R0.234 C#CCCCCCNCC[C@@H](C)O 5dc84585b0e4085df2b9b2ee60c48f20 [0,1,0,0,0,0|0,0,2]=3 2698 B12R0.234 C#CCCCCCNCC[C@H](C)O 9c68efa0929bf5d6d1cdcd69f915f8a9 [0,1,0,0,0,0|0,0,2]=3 2699 B12R0.234 C#CCCCCCOCCC(C)C 36e7ed9e513c8411e3e9b6ae6ef5ef9b [0,1,0,0,0,0|1,0,2]=4 2700 B12R0.234 C#CCCCCNCCCC(C)C e8917898299dee8f2d8521b41a7ff020 [0,1,0,0,0,0|1,0,2]=4 2701 B12R0.234 C#CCCCCNCCCC(C)O 3b936da03d49b45ea321c4ed4282f45a [0,1,0,0,0,0|0,0,2]=3 2702 B12R0.234 C#CCCCCOCCCC(C)C 7412ae4f19697129a9c5dc09d270e114 [0,1,0,0,0,0|1,0,2]=4 2703 B12R0.234 C#CCCCNCCCCC(C)C fb6638b5859a2823530724b4a77d9c4b [0,1,0,0,0,0|1,0,2]=4 2704 B12R0.234 C#CCCCNCCCCC(C)O 455fdeee1be7206ed624ef71ae7b2c7f [0,1,0,0,0,0|0,0,2]=3 2705 B12R0.234 C#CCCCNCCCC[C@@H](C)O 6e19007a97a1c052fe508e4955394c21 [0,1,0,0,0,0|0,0,2]=3 2706 B12R0.234 C#CCCCOCCCCC(C)C 59d6be9780295f89fddb850e3d8946f6 [0,1,0,0,0,0|1,0,2]=4 2707 B12R0.234 C#CCCNCCCCCC(C)C 318cab34b848c385d524e6204a0c1e1e [0,1,0,0,0,0|1,0,2]=4 2708 B12R0.234 C#CCCOCCCCCC(C)C 861dd82ba08e1ddc61181cd33e5a3d60 [0,1,0,0,0,0|1,0,2]=4 2709 B12R0.234 C#CCNCCCCCCC(C)C 82de98339e3b33204da6add59200fd40 [0,1,0,0,0,0|1,0,2]=4 2710 B12R0.234 C#CCOCCCCCCC(C)C a68d8eae2a17b616895d93c33fcb9e4e [0,1,0,0,0,0|1,0,2]=4 2711 B12R0.234 C#CCOCCNCCCC(C)O 2f564b42f74ca9a692823ad2ebf90835 [0,1,0,0,0,0|1,0,2]=4 2712 B12R0.234 C/C=C/CCCOCCCC(C)C f3cc2870b6f19858d30b1dc5e59e7d4b [0,1,0,0,0,0|1,0,2]=4 2713 B12R0.234 C/C=C/CCOCCCCC(C)C 3f9f09240548690003a9cb7d128cb9c2 [0,1,0,0,0,0|1,0,2]=4 2714 B12R0.234 C/C=C/CNCCCCCC(C)C 879b724a28abd2ecc2c1f4b91402d358 [0,1,0,0,0,0|1,0,2]=4 2715 B12R0.234 C/C=C/COCCCCCC(C)C e9f7a51132e72ca829b4f2e3ceba7738 [0,1,0,0,0,0|1,0,2]=4 2716 B12R0.234 C/C=C\CCCNCCCC(C)C fbc6aa5fcf8e6d63c41b2fced71ac677 [0,1,0,0,0,0|1,0,2]=4 2717 B12R0.234 C/C=C\CCCOCCCC(C)C c478a65b4ff9f7419d248ba810841400 [0,1,0,0,0,0|1,0,2]=4 2718 B12R0.234 C/C=C\CNCCCCCC(C)C 6d66e4a4daea9e0f3c29c18007121dbd [0,1,0,0,0,0|1,0,2]=4 2719 B12R0.234 C/C=C\COCCCCCC(C)C 2732527d202e92f09f5b8da27e0646f9 [0,1,0,0,0,0|1,0,2]=4 2720 B12R0.234 C=C(Br)CCOCCCCCCC 74d80b5c1c335a663f70e5d7320df526 [0,1,0,0,0,0|1,0,2]=4 2721 B12R0.234 C=C(Br)CNCCCCCCCC dc03bec9e0f362affb1e864ac30f7234 [0,1,0,0,0,0|1,0,2]=4 2722 B12R0.234 C=C(Br)COCCCCCCCC 6c22a447435c9f04bb6889584b6755b4 [0,1,0,0,0,0|1,0,2]=4 2723 B12R0.234 C=C(C)CCCNCCCCCC 8ae0efcd0765890e2521ed35ef58bd9d [0,1,0,0,0,0|1,0,1]=3 2724 B12R0.234 C=C(C)CCCNCCCCCCl a42711ddd0ac56fbb7f15dbf530e6926 [0,1,0,0,0,0|2,0,1]=4 2725 B12R0.234 C=C(C)CCCNCCCCCO fc575e6a1a717287924c349d8d9bf2ce [0,1,0,0,0,0|2,0,1]=4 2726 B12R0.234 C=C(C)CCCNCCCCOC 9495540fe50a0ec62c70cb496fcfd128 [0,1,0,0,0,0|2,0,1]=4 2727 B12R0.234 C=C(C)CCCNCCCCSC 2c36f635601fb88b7123317af9f134f9 [0,1,0,0,0,0|2,0,1]=4 2728 B12R0.234 C=C(C)CCCNCCCOCC 2e4ce68828dac6a69f05af8dd11bc9e0 [0,1,0,0,0,0|2,0,1]=4 2729 B12R0.234 C=C(C)CCCNCCOCCC 28ed03eefc3fc0767d56441e7a58ab15 [0,1,0,0,0,0|2,0,1]=4 2730 B12R0.234 C=C(C)CCCOCCCCCC f4d5d0352ee959cf2fa52225d2343af1 [0,1,0,0,0,0|1,0,1]=3 2731 B12R0.234 C=C(C)CCCOCCCCCF 34cf4f0a3eedf18b355cc7f5b4b0ddca [0,1,0,0,0,0|2,0,1]=4 2732 B12R0.234 C=C(C)CCCOCCCCOC 37694e40f9a2c6cd19949963d2750b85 [0,1,0,0,0,0|2,0,1]=4 2733 B12R0.234 C=C(C)CCCOCCCCSC 8ffc2f3b92d802b43644b5c02e092bec [0,1,0,0,0,0|2,0,1]=4 2734 B12R0.234 C=C(C)CCCOCCCOCC 13ca71e58d94b97bcd81b46ef2eee1e2 [0,1,0,0,0,0|2,0,1]=4 2735 B12R0.234 C=C(C)CCCOCCCSCC d682060df7062782e1b9eaa20feca870 [0,1,0,0,0,0|2,0,1]=4 2736 B12R0.234 C=C(C)CCCOCCOCCC 2032f01f1290eeb552019c23b98c9ce8 [0,1,0,0,0,0|2,0,1]=4 2737 B12R0.234 C=C(C)CCCOCCSCCC cae8a9860661983e7fb56b27b34c314b [0,1,0,0,0,0|2,0,1]=4 2738 B12R0.234 C=C(C)CCCOCOCCCC 410300b57d21c29c5638d9cd8ad55160 [0,1,0,0,0,0|2,0,1]=4 2739 B12R0.234 C=C(C)CCNCCCCCCC cb2aae2273742d24be02118e1ddadaac [0,1,0,0,0,0|1,0,1]=3 2740 B12R0.234 C=C(C)CCNCCCCCCCl d78043b91301b444b2bd3c508f299a1e [0,1,0,0,0,0|2,0,1]=4 2741 B12R0.234 C=C(C)CCNCCCCCCF a9ee80d235340921ce3e808f17fcf0fc [0,1,0,0,0,0|2,0,1]=4 2742 B12R0.234 C=C(C)CCNCCCCCCO f75ba4be69b8cecbd67b0143ccc8c9da [0,1,0,0,0,0|2,0,1]=4 2743 B12R0.234 C=C(C)CCNCCCCCOC 78b259aadad24074120a19cb5f753997 [0,1,0,0,0,0|2,0,1]=4 2744 B12R0.234 C=C(C)CCNCCCCSCC b319531c3e231daa9b4c3a610a3ff9a1 [0,1,0,0,0,0|2,0,1]=4 2745 B12R0.234 C=C(C)CCNCCCOCCC 788761da8b8467d2649b93d3fb8f5557 [0,1,0,0,0,0|2,0,1]=4 2746 B12R0.234 C=C(C)CCNCCOCCCC 0f2197d627d8a53e7d0c0224d4d7f881 [0,1,0,0,0,0|2,0,1]=4 2747 B12R0.234 C=C(C)CCOCCCCCCC b89ebde0e7cf357685280f1ca91d61e8 [0,1,0,0,0,0|1,0,1]=3 2748 B12R0.234 C=C(C)CCOCCCCCCF f81773ae0769add39552c750d3e085af [0,1,0,0,0,0|2,0,1]=4 2749 B12R0.234 C=C(C)CCOCCCCCCS 68916abd6bbb749edf31a20af6341288 [0,1,0,0,0,0|2,0,1]=4 2750 B12R0.234 C=C(C)CCOCCCCCOC f44207677c346b04edc47c50d5c4ccb5 [0,1,0,0,0,0|2,0,1]=4 2751 B12R0.234 C=C(C)CCOCCCOCCC f3368023f82d38ef8e99e9b2bd900bb3 [0,1,0,0,0,0|2,0,1]=4 2752 B12R0.234 C=C(C)CCOCCOCCCC 9377ed0242ecd26e30dfbde708611592 [0,1,0,0,0,0|2,0,1]=4 2753 B12R0.234 C=C(C)CCOCCSCCCC 5c013f87eea7e3ffb3baf987f277b5f7 [0,1,0,0,0,0|2,0,1]=4 2754 B12R0.234 C=C(C)CNCCCCCCCC 6df9dadc40f8b0eee0cffd4163032d54 [0,1,0,0,0,0|1,0,1]=3 2755 B12R0.234 C=C(C)CNCCCCCCCO 2eaa37ad2d398d6b19e200cc1172ef2c [0,1,0,0,0,0|2,0,1]=4 2756 B12R0.234 C=C(C)CNCCCCCCOC 472ad36ca7effda2f5978d30ccc62080 [0,1,0,0,0,0|2,0,1]=4 2757 B12R0.234 C=C(C)CNCCCCSCCC a69768bd80c2e748d470465b1aae34cc [0,1,0,0,0,0|2,0,1]=4 2758 B12R0.234 C=C(C)CNCCCOCCCC f2de8d0ceac7e1d62e657ef1d13cbef5 [0,1,0,0,0,0|2,0,1]=4 2759 B12R0.234 C=C(C)COCCCCCCCC e0ef7dd9e410d0fdc66f4c0d6fa8a0aa [0,1,0,0,0,0|1,0,1]=3 2760 B12R0.234 C=C(C)COCCCCCCOC a433b07c1bedb280f140447a94d46d34 [0,1,0,0,0,0|2,0,1]=4 2761 B12R0.234 C=C(C)COCCCOCCCC a1c3a3b3e22c06436716b2ced95073b7 [0,1,0,0,0,0|2,0,1]=4 2762 B12R0.234 C=C(C)COCCOCCCCC a6ec0ce2f0929de059881ce092b14a69 [0,1,0,0,0,0|2,0,1]=4 2763 B12R0.234 C=C(Cl)CNCCCCCCCC 454aa413a1b61d85320a8fde005a572c [0,1,0,0,0,0|1,0,2]=4 2764 B12R0.234 C=C(Cl)COCCCCCCCC 52895a572e60f59a2c7379bf01dc2e6c [0,1,0,0,0,0|1,0,2]=4 2765 B12R0.234 C=C(F)CNCCCCCCCC dd7b7820ed52d01ac8a5ca049ed88420 [0,1,0,0,0,0|1,0,2]=4 2766 B12R0.234 C=C(F)COCCCCCCCC cc83be2bbbb64d14a3fe8f3ce62c23af [0,1,0,0,0,0|1,0,2]=4 2767 B12R0.234 C=C(I)COCCCCCCCC 6fe868b21ddd4957edcac5eaccbe8475 [0,1,0,0,0,0|1,0,2]=4 2768 B12R0.234 C=CCCCCCCCOC(C)C 0490ca15beca8e27214d9c74ae22873b [0,1,0,0,0,0|1,0,2]=4 2769 B12R0.234 C=CCCCCCCNCC(C)C 9045791ab4a92fc64e2c98766b0e1e31 [0,1,0,0,0,0|1,0,2]=4 2770 B12R0.234 C=CCCCCCCNCC(C)O aa1c4caf32580790c67f9a7eab048798 [0,1,0,0,0,0|0,0,2]=3 2771 B12R0.234 C=CCCCCCCNC[C@@H](C)O a8e4809c664052ffd7b92fb8b950b8cd [0,1,0,0,0,0|0,0,2]=3 2772 B12R0.234 C=CCCCCCCNC[C@H](C)O 6120a16d605b2fada5423153b7404172 [0,1,0,0,0,0|0,0,2]=3 2773 B12R0.234 C=CCCCCCCOCC(C)C 7883c640712bb26932d95a2d56af1584 [0,1,0,0,0,0|1,0,2]=4 2774 B12R0.234 C=CCCCCCCOCC(C)F 64a1965401e6d4df31ed7e336ed97e94 [0,1,0,0,0,0|1,0,2]=4 2775 B12R0.234 C=CCCCCCCOCC(C)S a8cc0c6d9912d7aa36b70fdac0d51395 [0,1,0,0,0,0|0,1,2]=4 2776 B12R0.234 C=CCCCCCCOC[C@@H](C)F 0e8337d05bedef7e260f0a06bb37bc8e [0,1,0,0,0,0|1,0,2]=4 2777 B12R0.234 C=CCCCCCCOC[C@H](C)F e0fef888663a9bd106ca47846b2db5aa [0,1,0,0,0,0|1,0,2]=4 2778 B12R0.234 C=CCCCCCNCCC(C)C add6211b5c7ebdccf4770f0e33044082 [0,1,0,0,0,0|1,0,2]=4 2779 B12R0.234 C=CCCCCCNCCC(C)O e177d987d9f5bd242e7039a65e47f50a [0,1,0,0,0,0|0,0,2]=3 2780 B12R0.234 C=CCCCCCNCC[C@@H](C)O 91379c7c9bcb5468bb676af7d2aa61f6 [0,1,0,0,0,0|0,0,2]=3 2781 B12R0.234 C=CCCCCCNCC[C@H](C)O 07acf4a31ba3b23891fda7d94e6dc379 [0,1,0,0,0,0|0,0,2]=3 2782 B12R0.234 C=CCCCCCOCCC(C)C d37da8f859b0476c79f1ee1289aa66c1 [0,1,0,0,0,0|1,0,2]=4 2783 B12R0.234 C=CCCCCNCCCC(C)C 406665ea5ab01a667937351d2a34a6aa [0,1,0,0,0,0|1,0,2]=4 2784 B12R0.234 C=CCCCCNCCCC(C)O 84805df8f44b793b34c9603dfb3a4e33 [0,1,0,0,0,0|0,0,2]=3 2785 B12R0.234 C=CCCCCOCCCC(C)C 07efa0ba5b464c89d8bfcfacfecaeb9e [0,1,0,0,0,0|1,0,2]=4 2786 B12R0.234 C=CCCCNCCCCC(C)C b64fdd075790c9fad346375851fab253 [0,1,0,0,0,0|1,0,2]=4 2787 B12R0.234 C=CCCCNCCCCC(C)O d921fe1675d6e561c243932f6f967cf0 [0,1,0,0,0,0|0,0,2]=3 2788 B12R0.234 C=CCCCNCCCC[C@@H](C)O 08fac867659ebb0b6021a49193c7476c [0,1,0,0,0,0|0,0,2]=3 2789 B12R0.234 C=CCCCOCCCCC(C)C 98b6865a7501bc29e2de75d1849b948f [0,1,0,0,0,0|1,0,2]=4 2790 B12R0.234 C=CCCNCCCCCC(C)C 56332a7c12b0cf8f962ef2cdaf0c809d [0,1,0,0,0,0|1,0,2]=4 2791 B12R0.234 C=CCCOCCCCCC(C)C 1e7433b46e3d55eb11edbf54a00e732c [0,1,0,0,0,0|1,0,2]=4 2792 B12R0.234 C=CCNCCCCCCC(C)C f273f4212d378f30c58802a18b60b44e [0,1,0,0,0,0|1,0,2]=4 2793 B12R0.234 C=CCOCCCCCCC(C)C 4f222be23bbbd8f41196e1c1c7075b65 [0,1,0,0,0,0|1,0,2]=4 2794 B12R0.234 C=COCCCNCCCC(C)O b8678c7326608d76b51bb7dbbe37b9f2 [0,1,0,0,0,0|1,0,2]=4 2795 B12R0.234 C=COCCNCCCCC(C)O fddb5914d78197b492ee6976e564d567 [0,1,0,0,0,0|1,0,2]=4 2796 B12R0.234 C=COCCNCCCC[C@@H](C)O 76d68446fa09d4ec908c4a35abc5a2c8 [0,1,0,0,0,0|1,0,2]=4 2797 B12R0.234 CC#CCCCNCCCC(C)C f3c690726fca033c1f7b1c65f99fc3d6 [0,1,0,0,0,0|1,0,2]=4 2798 B12R0.234 CC#CCCCOCCCC(C)C ded930c59f211c68d25ac1546fa47694 [0,1,0,0,0,0|1,0,2]=4 2799 B12R0.234 CC#CCCOCCCCC(C)C 29e15e3015ebfa57475ea53c06f03261 [0,1,0,0,0,0|1,0,2]=4 2800 B12R0.234 CC#CCNCCCCCC(C)C 4d084c77046000f0ad08231b1f701b5f [0,1,0,0,0,0|1,0,2]=4 2801 B12R0.234 CC#CCOCCCCCC(C)C 9f5dd61c2e994f61e89f5e908f812f3f [0,1,0,0,0,0|1,0,2]=4 2802 B12R0.234 CC(=O)CCCCCCCOCF 400628823d7e12e9c1d4d620949a9c16 [0,1,0,0,0,0|1,0,2]=4 2803 B12R0.234 CC(=O)CCCCCNCCCCl 9900220f01677152aba4e3e2be184192 [0,1,0,0,0,0|1,0,2]=4 2804 B12R0.234 CC(=O)CCCCCNCCCO 0fa3e24d1a28ada7a04811b29c7c0297 [0,1,0,0,0,0|1,0,2]=4 2805 B12R0.234 CC(=O)CCCCCOCCCF aea5617ec8d11b226901e62fa772bfb5 [0,1,0,0,0,0|1,0,2]=4 2806 B12R0.234 CC(=O)CCCCCOCCCS adb0a1cbbbe885195480894115f237b3 [0,1,0,0,0,0|1,0,2]=4 2807 B12R0.234 CC(=O)CCCCNCCCCCl 6a5b6c28d5acc9a7cea35bbb482ffe5f [0,1,0,0,0,0|1,0,2]=4 2808 B12R0.234 CC(=O)CCCCNCCCCO e13aaafff6bf678a31c0d746365aac47 [0,1,0,0,0,0|1,0,2]=4 2809 B12R0.234 CC(=O)CCCCNCCCCS b7e95352f9d624897b4fceefaf09bdf1 [0,1,0,0,0,0|1,0,2]=4 2810 B12R0.234 CC(=O)CCCCOCCCCF 7abba6153d13b440bd25e9931a8a92e4 [0,1,0,0,0,0|1,0,2]=4 2811 B12R0.234 CC(=O)CCCCOCCCCS 72bd4739b616c34b3e153f9a5c4facf6 [0,1,0,0,0,0|1,0,2]=4 2812 B12R0.234 CC(=O)CCCNCCCCCCl 5c10b1a5408326b2f4b5cbe2c76de09a [0,1,0,0,0,0|1,0,2]=4 2813 B12R0.234 CC(=O)CCCNCCCCCO 6fba6a16fd8f66b73fe1f33f598e9401 [0,1,0,0,0,0|1,0,2]=4 2814 B12R0.234 CC(=O)CCCOCCCCCF 948a14f4abeb64192d4a0cafc1fa2d97 [0,1,0,0,0,0|1,0,2]=4 2815 B12R0.234 CC(=O)CCNCCCCCCCl ed7c6f69bc5ce4bdf786a074cfcd7c53 [0,1,0,0,0,0|1,0,2]=4 2816 B12R0.234 CC(=O)CCNCCCCCCO 7c130cbff3370a27029dc6e903187019 [0,1,0,0,0,0|1,0,2]=4 2817 B12R0.234 CC(=O)CCOCCCCCCF 28063f4a6422021ba2cbada32ed5cde6 [0,1,0,0,0,0|1,0,2]=4 2818 B12R0.234 CC(=O)CCOCCCCCCS 0faaaa381a23e28fc4abf5b19b60eb96 [0,1,0,0,0,0|1,0,2]=4 2819 B12R0.234 CC(=O)CNCCCCCCCO 13fac42ea1ea988c86c9b914788f7b4c [0,1,0,0,0,0|1,0,2]=4 2820 B12R0.234 CC(=O)NCCCCCCCCO 222dd7e9addab226a527d7b85d33bea7 [0,1,0,0,0,0|1,0,2]=4 2821 B12R0.234 CC(C)CCCCCCCOCF cbad12d80ee4f2f259e3bcfca768c101 [0,1,0,0,0,0|2,0,0]=3 2822 B12R0.234 CC(C)CCCCCCNCC#N 8ac8ee6409e020a9ea6cf396778ca608 [0,1,0,0,0,0|2,0,1]=4 2823 B12R0.234 CC(C)CCCCCCNCC=O 9dd33d4e8fff21717c794111e77c9a6f [0,1,0,0,0,0|2,0,1]=4 2824 B12R0.234 CC(C)CCCCCCNCCF e6f0f244541d8dda2a2f69d8690746d7 [0,1,0,0,0,0|2,0,0]=3 2825 B12R0.234 CC(C)CCCCCCNCCO 6fbc7e604c6bf59412fda4edd7b0ae09 [0,1,0,0,0,0|2,0,0]=3 2826 B12R0.234 CC(C)CCCCCCNCCS 58d0dca3c4511fc37dd5c9c1f6e16f6d [0,1,0,0,0,0|2,0,0]=3 2827 B12R0.234 CC(C)CCCCCCOCC#N 4d276b39e811a4fd5c048cc150439e6b [0,1,0,0,0,0|2,0,1]=4 2828 B12R0.234 CC(C)CCCCCCOCC=O 4ac06d6f21830f5c5e8bd2981ce5e15c [0,1,0,0,0,0|2,0,1]=4 2829 B12R0.234 CC(C)CCCCCCOCCF ae10e074d7625928e56e3a76d12262ea [0,1,0,0,0,0|2,0,0]=3 2830 B12R0.234 CC(C)CCCCCCOCCS 0ca58f100cff7d8fb9a84ed53acaf3bb [0,1,0,0,0,0|2,0,0]=3 2831 B12R0.234 CC(C)CCCCCNCCC#N 7eff4c261e5cfae6e35b215cc2ed1a51 [0,1,0,0,0,0|2,0,1]=4 2832 B12R0.234 CC(C)CCCCCNCCC=O 7668492e47044c9f3f5290499e4ddd63 [0,1,0,0,0,0|2,0,1]=4 2833 B12R0.234 CC(C)CCCCCNCCCCl ae0681dbc0b8eccb25659a4101a4eb75 [0,1,0,0,0,0|2,0,0]=3 2834 B12R0.234 CC(C)CCCCCNCCCF cb55273805d2c58d9cfa15249dd2fece [0,1,0,0,0,0|2,0,0]=3 2835 B12R0.234 CC(C)CCCCCNCCCO 794e9f38db7a13720e8e07c792297179 [0,1,0,0,0,0|2,0,0]=3 2836 B12R0.234 CC(C)CCCCCNCCCS 9be7acc2c02f4c5f221ce71bf33c6ac6 [0,1,0,0,0,0|2,0,0]=3 2837 B12R0.234 CC(C)CCCCCNCCON 3dede1100977cd7d29ed9b04bb2ac502 [0,1,0,0,0,0|3,0,0]=4 2838 B12R0.234 CC(C)CCCCCOCCC#N 79021fb32a1592dc8224026f8a068d5b [0,1,0,0,0,0|2,0,1]=4 2839 B12R0.234 CC(C)CCCCCOCCC=O 1d72f4947720180625102c67e1c368fe [0,1,0,0,0,0|2,0,1]=4 2840 B12R0.234 CC(C)CCCCCOCCCF 45c1f44e90efc7775fba6934252b0435 [0,1,0,0,0,0|2,0,0]=3 2841 B12R0.234 CC(C)CCCCCOCCCS ce3b77e746b3cb329d34c52351741bec [0,1,0,0,0,0|2,0,0]=3 2842 B12R0.234 CC(C)CCCCNCCCC#N 0dea2d6fb500bb79e6457533f9590690 [0,1,0,0,0,0|2,0,1]=4 2843 B12R0.234 CC(C)CCCCNCCCCCl 37a3ba3879581c2df454d0ccbe94d2c0 [0,1,0,0,0,0|2,0,0]=3 2844 B12R0.234 CC(C)CCCCNCCCCO 0dbe8b8548adb068264178bc3cb16e40 [0,1,0,0,0,0|2,0,0]=3 2845 B12R0.234 CC(C)CCCCNCCCCS a83d71bc9b92eee64298fb2b16a01595 [0,1,0,0,0,0|2,0,0]=3 2846 B12R0.234 CC(C)CCCCOCCCC#N 31dea31f5e910b1c3e01d21a0656d159 [0,1,0,0,0,0|2,0,1]=4 2847 B12R0.234 CC(C)CCCCOCCCC=O 194340ef5753940f90596f4b0413dc5e [0,1,0,0,0,0|2,0,1]=4 2848 B12R0.234 CC(C)CCCCOCCCCF 4188380f44d58adc62cb1c96f83f1aa5 [0,1,0,0,0,0|2,0,0]=3 2849 B12R0.234 CC(C)CCCCOCCCCS a3cac80a98759ab26871b550bec33d51 [0,1,0,0,0,0|2,0,0]=3 2850 B12R0.234 CC(C)CCCNCCCCC#N 979c7aaa9f6445f62a2e265976f7e3f6 [0,1,0,0,0,0|2,0,1]=4 2851 B12R0.234 CC(C)CCCNCCCCC=O f79181d7d9a64eb6796ea6e4f4fb96dd [0,1,0,0,0,0|2,0,1]=4 2852 B12R0.234 CC(C)CCCNCCCCCCl 535ec63c50f78362bdcd1f7c740cfc46 [0,1,0,0,0,0|2,0,0]=3 2853 B12R0.234 CC(C)CCCNCCCCCF c659cb9205299404f4ca73cfcaa30059 [0,1,0,0,0,0|2,0,0]=3 2854 B12R0.234 CC(C)CCCNCCCCCO 1200510d4fdb3666c92f4096f8e4c1e6 [0,1,0,0,0,0|2,0,0]=3 2855 B12R0.234 CC(C)CCCNCCCCON 3e51d28927180fb3cf579387929ca3fe [0,1,0,0,0,0|3,0,0]=4 2856 B12R0.234 CC(C)CCCNCCOCCO d3055097e88cefb0ede066169b617aba [0,1,0,0,0,0|3,0,0]=4 2857 B12R0.234 CC(C)CCCNCCOCCS 2d9353a702beeeb237b72448e7bc8d13 [0,1,0,0,0,0|3,0,0]=4 2858 B12R0.234 CC(C)CCCNCCSCCO d9c05cb1ee8075ee139705636a2bd8ae [0,1,0,0,0,0|3,0,0]=4 2859 B12R0.234 CC(C)CCCOCCCCC#N 88a98eeba1c199f5928d242c9be722aa [0,1,0,0,0,0|2,0,1]=4 2860 B12R0.234 CC(C)CCCOCCCCC=O 82fbf61e87b5a61d74b3a6c8b1f114d1 [0,1,0,0,0,0|2,0,1]=4 2861 B12R0.234 CC(C)CCCOCCCCCF 4456cf26f51458e6d894c3b9ba516449 [0,1,0,0,0,0|2,0,0]=3 2862 B12R0.234 CC(C)CCCOCCOCCF 1ad10b47780661fe9fbf8d5ee82dfc6e [0,1,0,0,0,0|3,0,0]=4 2863 B12R0.234 CC(C)CCCOCCOCCS 2376fcb08e478fde391a3c55df547fe1 [0,1,0,0,0,0|3,0,0]=4 2864 B12R0.234 CC(C)CCNCCCCCC#N 55b6537cbc339774a3dff10b09bbcca5 [0,1,0,0,0,0|2,0,1]=4 2865 B12R0.234 CC(C)CCNCCCCCC=O faa3adb8f56685ab6ee6db0283d13280 [0,1,0,0,0,0|2,0,1]=4 2866 B12R0.234 CC(C)CCNCCCCCCCl ab232b3272e0cca84a18fbd108afa591 [0,1,0,0,0,0|2,0,0]=3 2867 B12R0.234 CC(C)CCNCCCCCCF 44b151e901f2dc1936c488332d49927e [0,1,0,0,0,0|2,0,0]=3 2868 B12R0.234 CC(C)CCNCCCCCCO 3a0954e85cd5382a807128f8b5827436 [0,1,0,0,0,0|2,0,0]=3 2869 B12R0.234 CC(C)CCNCCCOCCO a01bec2173a2a6617c4eddfbd558faa1 [0,1,0,0,0,0|3,0,0]=4 2870 B12R0.234 CC(C)CCNCCOCCCO 1d789daf7e29d36ef9715a7d29141e91 [0,1,0,0,0,0|3,0,0]=4 2871 B12R0.234 CC(C)CCOCCCCCC#N 4c53817f0744e3e78f8d1179f82704ba [0,1,0,0,0,0|2,0,1]=4 2872 B12R0.234 CC(C)CCOCCCCCC=O adb88b2604462fc54a859e863a9fb114 [0,1,0,0,0,0|2,0,1]=4 2873 B12R0.234 CC(C)CCOCCCCCCF ea1251f7185f706c533be7084495fbc7 [0,1,0,0,0,0|2,0,0]=3 2874 B12R0.234 CC(C)CCOCCCCCCS 5ee6e3325f25868fea860901fe7be9c5 [0,1,0,0,0,0|2,0,0]=3 2875 B12R0.234 CC(C)CNCCCCCCC#N ab417936e4a03644842677e7628cb7f4 [0,1,0,0,0,0|2,0,1]=4 2876 B12R0.234 CC(C)CNCCCCCCC=O 52fa641ef1a934ad47d6903d5c67c0be [0,1,0,0,0,0|2,0,1]=4 2877 B12R0.234 CC(C)CNCCCCCCCO 17af4a06e19a9f19f4462b3a5a4692f8 [0,1,0,0,0,0|2,0,0]=3 2878 B12R0.234 CC(C)CNCCCCSCCO 6190a07e2bc49c4d51ab87b1a1b46267 [0,1,0,0,0,0|3,0,0]=4 2879 B12R0.234 CC(C)CNCCCOCCCO fcfd98c32541b1071187b381f4b3a982 [0,1,0,0,0,0|3,0,0]=4 2880 B12R0.234 CC(C)COCCCCCCC#N addc9abb93e54de878153778b54ee2a6 [0,1,0,0,0,0|2,0,1]=4 2881 B12R0.234 CC(C)COCCCCCCC=O 12f4de3759320a9474e25191bd70fbdf [0,1,0,0,0,0|2,0,1]=4 2882 B12R0.234 CC(C)COCCCNCCCF 57eeb53aeaf279c280371117533c7687 [0,1,0,0,0,0|3,0,0]=4 2883 B12R0.234 CC(C)COCCCNCCCO 7cd69c06b037f255e96a6fba349a37e3 [0,1,0,0,0,0|3,0,0]=4 2884 B12R0.234 CC(C)COCCCNCCCS e967aa3bd625912561c9d5b380d26326 [0,1,0,0,0,0|3,0,0]=4 2885 B12R0.234 CC(C)COCCCOCCCF 246f19957c73d7aeb1b408bcb1248693 [0,1,0,0,0,0|3,0,0]=4 2886 B12R0.234 CC(C)COCCCOCCCS a9f9d77e5974441a0307df06befba8cc [0,1,0,0,0,0|3,0,0]=4 2887 B12R0.234 CC(C)COCCNCCCCCl 6c9148f6b3a7c14136b4905bee7071a9 [0,1,0,0,0,0|3,0,0]=4 2888 B12R0.234 CC(C)COCCNCCCCO 897cc93df59f693602737509478375ec [0,1,0,0,0,0|3,0,0]=4 2889 B12R0.234 CC(C)COCCNCCCCS f27d99855b6adfc7757751f32e49c693 [0,1,0,0,0,0|3,0,0]=4 2890 B12R0.234 CC(C)COCCOCCCCF 5e89e57e89cd35d7fae1fa1cd856e43d [0,1,0,0,0,0|3,0,0]=4 2891 B12R0.234 CC(C)COCCOCCCCS 832f6670a275fca6ebe5aca92b7a0942 [0,1,0,0,0,0|3,0,0]=4 2892 B12R0.234 CC(C)CSCCCCNCCF 277470aca4d471aff8771b2bbeefaba1 [0,1,0,0,0,0|3,0,0]=4 2893 B12R0.234 CC(C)CSCCCCNCCO fd2461fe408a3554f742df165df988c6 [0,1,0,0,0,0|3,0,0]=4 2894 B12R0.234 CC(C)CSCCCCNCCS ab7cd8ce01370802fc7d8090b9a9af80 [0,1,0,0,0,0|3,0,0]=4 2895 B12R0.234 CC(C)CSCCCOCCCF 2bbad3ea0f9fb28b8d1ddbd37f98a485 [0,1,0,0,0,0|3,0,0]=4 2896 B12R0.234 CC(C)CSCCCOCCCS 3f5baeb2084ff269fb8e5c135e0cb4c3 [0,1,0,0,0,0|3,0,0]=4 2897 B12R0.234 CC(C)CSCCOCCCCF 5f4be9c8463a361bc12f0ec79671d5ce [0,1,0,0,0,0|3,0,0]=4 2898 B12R0.234 CC(C)NCCCCCCCCO 77e83d169886f18dbdc8364c4f71ab3f [0,1,0,0,0,0|2,0,0]=3 2899 B12R0.234 CC(C)OCCCNCCCCF c4b88a0cab375eb35ea2dc119ee20d06 [0,1,0,0,0,0|3,0,0]=4 2900 B12R0.234 CC(C)OCCCNCCCCO eca545d4c20e5ff6371dd24adc8845ee [0,1,0,0,0,0|3,0,0]=4 2901 B12R0.234 CC(C)OCCCOCCCCF f35f2eefff139adc46576b6b57a9d48e [0,1,0,0,0,0|3,0,0]=4 2902 B12R0.234 CC(C)OCCNCCCCCCl 225653eb16c1b7478b359ac3b446e7b6 [0,1,0,0,0,0|3,0,0]=4 2903 B12R0.234 CC(C)OCCNCCCCCF d9d32bfa2bcaa1a1d8b8da37ef919ada [0,1,0,0,0,0|3,0,0]=4 2904 B12R0.234 CC(C)OCCNCCCCCO b0860d3042ff259c2484caa3bcc32fd7 [0,1,0,0,0,0|3,0,0]=4 2905 B12R0.234 CC(C)OCCOCCCCCF 91cbd9f7d2236846f85ab8fa7d03d685 [0,1,0,0,0,0|3,0,0]=4 2906 B12R0.234 CC(C)OCNCCCCCCCl 1f14fe3333f8a18f28cbb02f5a89f5a8 [0,1,0,0,0,0|3,0,0]=4 2907 B12R0.234 CC(C)OCNCCCCCCO 8768380df900ae8a4ba3992e59042c66 [0,1,0,0,0,0|3,0,0]=4 2908 B12R0.234 CC(C)OCOCCCCCCF b650d085fa5306c94950ea9c9a5ad442 [0,1,0,0,0,0|3,0,0]=4 2909 B12R0.234 CC(C)OCOCCCCCCS ad1c2d1f34742a65ebc679e86fd67ed2 [0,1,0,0,0,0|3,0,0]=4 2910 B12R0.234 CC(C)SCCCNCCCCF e070c5526823363aaaee76be5fe102ab [0,1,0,0,0,0|3,0,0]=4 2911 B12R0.234 CC(C)SCCCNCCCCO 8122870fc7df068044f9ee1c4d34f6d8 [0,1,0,0,0,0|3,0,0]=4 2912 B12R0.234 CC(C)SCCCOCCCCF 0b88222bb7c3348723670db942288da7 [0,1,0,0,0,0|3,0,0]=4 2913 B12R0.234 CC(C)SCCNCCCCCCl 619ad865200933973858c9ac0df0891c [0,1,0,0,0,0|3,0,0]=4 2914 B12R0.234 CC(C)SCCNCCCCCO 31c0763f99fc52f9541af2dc91482928 [0,1,0,0,0,0|3,0,0]=4 2915 B12R0.234 CC(C)SCCOCCCCCF 89808448b7436c5c11fa314116b26202 [0,1,0,0,0,0|3,0,0]=4 2916 B12R0.234 CC(F)COCCCCCCC#N e55313c652e16bed696a6e34ccf66e67 [0,1,0,0,0,0|2,0,1]=4 2917 B12R0.234 CC(F)COCCCCCCC=O dc5badd5f804e168475868ccbcdc40d7 [0,1,0,0,0,0|2,0,1]=4 2918 B12R0.234 CC(O)CCCCNCC#CCO cbf14fd39153759da302433ed62afe79 [0,1,0,0,0,0|1,0,2]=4 2919 B12R0.234 CC(O)CCCCNCCCC#N 1b2a7fedeac4959c96dadd8e24a0c79e [0,1,0,0,0,0|1,0,1]=3 2920 B12R0.234 CC(O)CCCCNCCCCCl 964e66a2c00fd7714542c7df009673cd [0,1,0,0,0,0|1,0,0]=2 2921 B12R0.234 CC(O)CCCCNCCCCO 6f591ba8b394fe6a8130663abe33f70d [0,1,0,0,0,0|1,0,0]=2 2922 B12R0.234 CC(O)CCCCNCCCCS 65907c50c768a761610cad162ee02a9c [0,1,0,0,0,0|1,0,0]=2 2923 B12R0.234 CC(O)CCCNCCCCC#N be699a2899889f9f5a12f5060733db32 [0,1,0,0,0,0|1,0,1]=3 2924 B12R0.234 CC(O)CCCNCCCCCCl 4df170a03b9ab05609d21b4971c52552 [0,1,0,0,0,0|1,0,0]=2 2925 B12R0.234 CC(O)CCCNCCCCCO 89d286fb2c0daa27ff15e812eb4ced9f [0,1,0,0,0,0|1,0,0]=2 2926 B12R0.234 CC(O)CCCNCCOCCO 8587f910562ce98165fd27458bf4d47d [0,1,0,0,0,0|2,0,0]=3 2927 B12R0.234 CC(O)CCCNCCOCCS c99d486236ceb487b2131d67db104ba1 [0,1,0,0,0,0|2,0,0]=3 2928 B12R0.234 CC(O)CCCNCCSCCO 70c853c48170f1e9c82e6b0ad6d21308 [0,1,0,0,0,0|2,0,0]=3 2929 B12R0.234 CC(O)CCNCCCCCC#N 17126e6955c5c8a82bb2da7a8e23f916 [0,1,0,0,0,0|1,0,1]=3 2930 B12R0.234 CC(O)CCNCCCCCC=O f6ffa5a24e74baeb962851759372c299 [0,1,0,0,0,0|1,0,1]=3 2931 B12R0.234 CC(O)CCNCCCCCCCl ed4b7052b8c0181ed653f8584a3690b9 [0,1,0,0,0,0|1,0,0]=2 2932 B12R0.234 CC(O)CCNCCCCCCF 31bfdbfdaaf195274fac3c5f2d8f8019 [0,1,0,0,0,0|1,0,0]=2 2933 B12R0.234 CC(O)CCNCCCCCCO cec5839655eba3390204b94252b0162a [0,1,0,0,0,0|1,0,0]=2 2934 B12R0.234 CC(O)CCNCCCOCCO ee8e5ee6a2d66b4acaf05317bb6547d4 [0,1,0,0,0,0|2,0,0]=3 2935 B12R0.234 CC(O)CCNCCOCCCO e6387dab930dae0b739d4c0e5727c292 [0,1,0,0,0,0|2,0,0]=3 2936 B12R0.234 CC(O)CCNCCOCCON e0dc0f48e9844e5e5768b77b14b28cff [0,1,0,0,0,0|3,0,0]=4 2937 B12R0.234 CC(O)CCNCCSSCCO 4f6488fe430aff835169b9296a1cd324 [0,1,0,0,0,0|3,0,0]=4 2938 B12R0.234 CC(O)CNCCCCCCC#N bb05e3d0506daf7d523acce66720b7f7 [0,1,0,0,0,0|1,0,1]=3 2939 B12R0.234 CC(O)CNCCCCCCC=O 7c2d56d8116339d2adc17331e4a6d185 [0,1,0,0,0,0|1,0,1]=3 2940 B12R0.234 CC(O)CNCCCCCCCO 5b58b6c518af704f6a565f93bf8d0622 [0,1,0,0,0,0|1,0,0]=2 2941 B12R0.234 CC(O)CNCCCCSCCO 601fafa1d019e9d67728a0a1f2089db3 [0,1,0,0,0,0|2,0,0]=3 2942 B12R0.234 CC(O)CNCCCOCCCO 8f079fe4671ce5239c93790bd4bbe2c3 [0,1,0,0,0,0|2,0,0]=3 2943 B12R0.234 CC(S)COCCCCCCC#N b995014166e5f164aafc7f96cde311dd [0,1,0,0,0,0|1,1,1]=4 2944 B12R0.234 CC(S)COCCCCCCC=O 96dc1d76b6f2669927b77a829926abe2 [0,1,0,0,0,0|1,1,1]=4 2945 B12R0.234 CC/C=C/CCOCCCC(C)C 1eb99eb54c62da2dd92d4d02a30dd5d1 [0,1,0,0,0,0|1,0,2]=4 2946 B12R0.234 CC/C=C/COCCCCC(C)C 0dbebceb5bb3ceef69f17d38af4d39bb [0,1,0,0,0,0|1,0,2]=4 2947 B12R0.234 CC/C=C\CCCCCOC(C)C 30962e1403f8be2b24275814fee9785b [0,1,0,0,0,0|1,0,2]=4 2948 B12R0.234 CC/C=C\CCCCOCC(C)C a95610b4fb04d74a4638dc6c9520ae9f [0,1,0,0,0,0|1,0,2]=4 2949 B12R0.234 CC/C=C\CCCOCCC(C)C 373c5697820a50598e1e95195de64550 [0,1,0,0,0,0|1,0,2]=4 2950 B12R0.234 CC/C=C\CCNCCCC(C)C a2357bcd98e5361c725cecd10de4c1a7 [0,1,0,0,0,0|1,0,2]=4 2951 B12R0.234 CC/C=C\CCOCCCC(C)C de3528522f32f7a55475bcc84ceecc46 [0,1,0,0,0,0|1,0,2]=4 2952 B12R0.234 CC/C=C\COCCCCC(C)C 9dd11cb2e23f7d976ca9e4aa43272479 [0,1,0,0,0,0|1,0,2]=4 2953 B12R0.234 CC=CCCCOCCCC(C)C e523e50fb1ef2881d12053c52acaecd1 [0,1,0,0,0,0|1,0,2]=4 2954 B12R0.234 CC=CCNCCCCCC(C)C fe055b70d7f107d0fb3b70e57c674179 [0,1,0,0,0,0|1,0,2]=4 2955 B12R0.234 CC=CCOCCCCCC(C)C 9b69828cd16bc2d401925c6e06588325 [0,1,0,0,0,0|1,0,2]=4 2956 B12R0.234 CCC#CCCOCCCC(C)C d783f16b67f36ce74af503ee774dcb06 [0,1,0,0,0,0|1,0,2]=4 2957 B12R0.234 CCC#CCOCCCCC(C)C 2e7c721181134648d5efe62bbd8cc7ec [0,1,0,0,0,0|1,0,2]=4 2958 B12R0.234 CCC/C=C/CCCOCC(C)C 91f2f32b240546a7f37dd78731f403e8 [0,1,0,0,0,0|1,0,2]=4 2959 B12R0.234 CCC/C=C/CNCCCC(C)C 8029d14f57bb78a8c0ac830b28604c6e [0,1,0,0,0,0|1,0,2]=4 2960 B12R0.234 CCC/C=C/COCCCC(C)C be00091939605d696500ec3dff15fa5b [0,1,0,0,0,0|1,0,2]=4 2961 B12R0.234 CCC/C=C\CCCOCC(C)C 5a39e9b9fc8778facb10b206931063be [0,1,0,0,0,0|1,0,2]=4 2962 B12R0.234 CCC/C=C\CCOCCC(C)C 4fe0b6b8d7b85c88a7aa56f9e9ff708b [0,1,0,0,0,0|1,0,2]=4 2963 B12R0.234 CCC/C=C\CNCCCC(C)C 4c8e53a77330717f54304df957a94ac4 [0,1,0,0,0,0|1,0,2]=4 2964 B12R0.234 CCC/C=C\COCCCC(C)C 3469bdf5badbb9d71282fe886382c8ae [0,1,0,0,0,0|1,0,2]=4 2965 B12R0.234 CCC=CCCCCCOC(C)C f39379d293e7db5f348bc7d59729ada8 [0,1,0,0,0,0|1,0,2]=4 2966 B12R0.234 CCCC#CCCOCCC(C)C daacb4cc7b58dafc6d7cb20161cc0f6a [0,1,0,0,0,0|1,0,2]=4 2967 B12R0.234 CCCC#CCOCCCC(C)C d280c91a4059d0910b9e967ad07034ba [0,1,0,0,0,0|1,0,2]=4 2968 B12R0.234 CCCC/C=C/CNCCC(C)C 06287e1890b2aa517e05c1180cd41dc3 [0,1,0,0,0,0|1,0,2]=4 2969 B12R0.234 CCCC/C=C/CNCCC(C)O 06362a372b60629d8c6ddf1f3c5193e9 [0,1,0,0,0,0|0,0,2]=3 2970 B12R0.234 CCCC/C=C/CNCC[C@@H](C)O ed7af8fe5fce0f06de854387f70b960a [0,1,0,0,0,0|0,0,2]=3 2971 B12R0.234 CCCC/C=C/CNCC[C@H](C)O f77c1ba6bd7d5cd7b18dd70a4ad265bc [0,1,0,0,0,0|0,0,2]=3 2972 B12R0.234 CCCC/C=C/COCCC(C)C 47f1d0d9cf7e98555cead7d1b1a26d46 [0,1,0,0,0,0|1,0,2]=4 2973 B12R0.234 CCCC/C=C\CCOCC(C)C a0b8c7a38b55de5af0ae3aa391c0d9b6 [0,1,0,0,0,0|1,0,2]=4 2974 B12R0.234 CCCC/C=C\CNCCC(C)C b2e16dd59c66f7e4a1979024c2657373 [0,1,0,0,0,0|1,0,2]=4 2975 B12R0.234 CCCC/C=C\CNCCC(C)O eb29e4464bcfb88d8fb58836078a6946 [0,1,0,0,0,0|0,0,2]=3 2976 B12R0.234 CCCC/C=C\CNCC[C@@H](C)O 1ac984409c4ee0afffadc68f6d47aeda [0,1,0,0,0,0|0,0,2]=3 2977 B12R0.234 CCCC/C=C\CNCC[C@H](C)O 70588edc4ea2e2434a7e91e57dafb331 [0,1,0,0,0,0|0,0,2]=3 2978 B12R0.234 CCCC/C=C\COCCC(C)C d5823a6a9c10702692a20a19c1804dbf [0,1,0,0,0,0|1,0,2]=4 2979 B12R0.234 CCCCC#CCCOCC(C)C b942fc776721f15c633ded33d2bae15e [0,1,0,0,0,0|1,0,2]=4 2980 B12R0.234 CCCCC#CCOCCC(C)C d69b2a304e5258207b2bad1fcccc1c93 [0,1,0,0,0,0|1,0,2]=4 2981 B12R0.234 CCCCC/C=C/COCC(C)C dd85fdb40bbbca52817c0ae18b5d5d06 [0,1,0,0,0,0|1,0,2]=4 2982 B12R0.234 CCCCC/C=C\CCOC(C)C 9a5647d49db33bcc97a1d3d95e4cfbff [0,1,0,0,0,0|1,0,2]=4 2983 B12R0.234 CCCCCC#CCCOC(C)C c60b302de78ce81c4246a9b47d3f868b [0,1,0,0,0,0|1,0,2]=4 2984 B12R0.234 CCCCCC#CCOCC(C)C 501ca91005cdc1f415e7db82210c7b93 [0,1,0,0,0,0|1,0,2]=4 2985 B12R0.234 CCCCCC/C=C/COC(C)C 1548b27217fa9d9df5f8f296f435d410 [0,1,0,0,0,0|1,0,2]=4 2986 B12R0.234 CCCCCC/C=C\COC(C)C 8a9bbea89604515890c09bfb0db64fac [0,1,0,0,0,0|1,0,2]=4 2987 B12R0.234 CCCCCCC#CCOC(C)C 3053d5238354efc3a1d5b01f799ba51b [0,1,0,0,0,0|1,0,2]=4 2988 B12R0.234 CCCCCCCCCNC(=O)C 5fcb67754cb579f2f81659cca014b221 [0,1,0,0,0,0|0,0,2]=3 2989 B12R0.234 CCCCCCCCCNC(C)C 633b87e87241210ce29b4c891b10d156 [0,1,0,0,0,0|1,0,0]=2 2990 B12R0.234 CCCCCCCCCOC(C)C 5bfa3d51b03e273aa1342ee47e729825 [0,1,0,0,0,0|1,0,0]=2 2991 B12R0.234 CCCCCCCCNCC(=O)C 843a2cfb38179d3b3caf9d0d2340122f [0,1,0,0,0,0|0,0,2]=3 2992 B12R0.234 CCCCCCCCNCC(=O)N 93d52126533923c2f1b36be9138ca635 [0,1,0,0,0,0|1,0,2]=4 2993 B12R0.234 CCCCCCCCNCC(=O)O 83781ea853aa67014c4d40190a4bf6ba [0,1,0,0,0,0|1,0,1]=3 2994 B12R0.234 CCCCCCCCNCC(C)C edc2de24352412e89c0daea62e82a9f2 [0,1,0,0,0,0|1,0,0]=2 2995 B12R0.234 CCCCCCCCNCC(C)O 2ef8cc6de61c88a08a694653cec27f91 [0,1,0,0,0,0|0,0,0]=1 2996 B12R0.234 CCCCCCCCNCC(F)F 15e671588ddab528663a82538c54c026 [0,1,0,0,0,0|2,0,0]=3 2997 B12R0.234 CCCCCCCCNCN(C)C b34813edb2d1d53a044538aa140a0b2b [0,1,0,0,0,0|2,0,0]=3 2998 B12R0.234 CCCCCCCCNC[C@@H](C)O b95eeee27d9fa25791056fa2e6d0104a [0,1,0,0,0,0|0,0,0]=1 2999 B12R0.234 CCCCCCCCNC[C@H](C)O 259d26ce885c1415cf78f53d5926aa88 [0,1,0,0,0,0|0,0,0]=1 3000 B12R0.234 CCCCCCCCNC[N+](=O)[O-] aa26e5d3615be12f7263cfbcab98e6b5 [0,1,0,0,0,0|2,0,1]=4 3001 B12R0.234 CCCCCCCCOCC(=O)C 975d1e04c005a3736c3d966e413ed9a4 [0,1,0,0,0,0|0,0,2]=3 3002 B12R0.234 CCCCCCCCOCC(=O)N 6dd174f9955f59e7715671df2fb7d707 [0,1,0,0,0,0|1,0,2]=4 3003 B12R0.234 CCCCCCCCOCC(=O)O b83cc991500dd7f4cc1f14a947f049a9 [0,1,0,0,0,0|1,0,1]=3 3004 B12R0.234 CCCCCCCCOCC(=S)N e588413941670ff0556e32001bcf0418 [0,1,0,0,0,0|1,1,1]=4 3005 B12R0.234 CCCCCCCCOCC(C)C 86fa86f500776572e8f262245d9511e3 [0,1,0,0,0,0|1,0,0]=2 3006 B12R0.234 CCCCCCCCOCC(C)F ae1ca7e455dece962dc9262c593430ce [0,1,0,0,0,0|1,0,0]=2 3007 B12R0.234 CCCCCCCCOCC(C)S 2ade3d64af1a31c78f3b01dffc3145c2 [0,1,0,0,0,0|0,1,0]=2 3008 B12R0.234 CCCCCCCCOCC(F)F b17d4ef6b61ef484846f30a2979782b8 [0,1,0,0,0,0|2,0,0]=3 3009 B12R0.234 CCCCCCCCOCN(C)C 22d9cc71c7e8d015c42ae3d213047031 [0,1,0,0,0,0|2,0,0]=3 3010 B12R0.234 CCCCCCCCOCS(=O)O ddd48fec0524b009039de055a38d78b1 [0,1,0,0,0,0|2,0,0]=3 3011 B12R0.234 CCCCCCCCOC[C@@H](C)F 425190a999d384b9c5630093b2067c8a [0,1,0,0,0,0|1,0,0]=2 3012 B12R0.234 CCCCCCCCOC[C@H](C)F cc082e90c22cc1ff82b417a9c15691e0 [0,1,0,0,0,0|1,0,0]=2 3013 B12R0.234 CCCCCCCCOC[N+](=O)[O-] 2fe9ce4e2deb201447e51085100407d6 [0,1,0,0,0,0|2,0,1]=4 3014 B12R0.234 CCCCCCCNC/C=C(/C)\I 2d21d6595071ecb9a3033d41dfe7bdbe [0,1,0,0,0,0|1,0,2]=4 3015 B12R0.234 CCCCCCCNC/C=C(\C)/Cl 8a61d899444984ce214836fcb38b4f09 [0,1,0,0,0,0|1,0,2]=4 3016 B12R0.234 CCCCCCCNCC=C(C)C a40eedd062cc5b72102c2ae793622cf9 [0,1,0,0,0,0|1,0,2]=4 3017 B12R0.234 CCCCCCCNCC=C(C)Cl 9d63d3b43e76bd6c32d45bb4b2f40b07 [0,1,0,0,0,0|1,0,2]=4 3018 B12R0.234 CCCCCCCNCC=C(C)I 5206879ce8b7e564f5beb892aeb6a878 [0,1,0,0,0,0|1,0,2]=4 3019 B12R0.234 CCCCCCCNCCC(=O)C ab9de0fc6e0b0e78dd96f7b6d4b54397 [0,1,0,0,0,0|0,0,2]=3 3020 B12R0.234 CCCCCCCNCCC(=O)N cdfffaf067c2fbfe2769a61b7603c569 [0,1,0,0,0,0|1,0,2]=4 3021 B12R0.234 CCCCCCCNCCC(=O)O 977de1b8eb917820b2e1cca0d817c9d8 [0,1,0,0,0,0|1,0,1]=3 3022 B12R0.234 CCCCCCCNCCC(=S)N f8bfd6327d70be82b5992482b27c5936 [0,1,0,0,0,0|1,1,1]=4 3023 B12R0.234 CCCCCCCNCCC(C)C ef7cdc64c30b34e0c8305194073ddf16 [0,1,0,0,0,0|1,0,0]=2 3024 B12R0.234 CCCCCCCNCCC(C)O 46c6fa42f475c5b9fdf795a105468042 [0,1,0,0,0,0|0,0,0]=1 3025 B12R0.234 CCCCCCCNCCC(F)F 6a8780d96c5c0a843ed64f6501d9f7cd [0,1,0,0,0,0|2,0,0]=3 3026 B12R0.234 CCCCCCCNCCN(C)C 4abef3c329235d92f65d0601a165e487 [0,1,0,0,0,0|2,0,0]=3 3027 B12R0.234 CCCCCCCNCCS(=O)C d2c6971c249e50ee09f9fa0ab59349cc [0,1,0,0,0,0|1,0,1]=3 3028 B12R0.234 CCCCCCCNCCS(=O)O 565379a7d0219086578b9e959b0c956d [0,1,0,0,0,0|2,0,0]=3 3029 B12R0.234 CCCCCCCNCC[C@@H](C)O d8b7b78276e6589d71be024e1f1f86de [0,1,0,0,0,0|0,0,0]=1 3030 B12R0.234 CCCCCCCNCC[C@H](C)O 71c1a0ee238684f7ba5730029f8afc27 [0,1,0,0,0,0|0,0,0]=1 3031 B12R0.234 CCCCCCCNCOC(=O)C 4acd5ffaf13312aaf737d3ae044c33fd [0,1,0,0,0,0|1,0,2]=4 3032 B12R0.234 CCCCCCCNCOC(C)C 34e19e1e7f41450b977ee0d17598a11d [0,1,0,0,0,0|2,0,0]=3 3033 B12R0.234 CCCCCCCOC/C=C(/C)\Cl e4ea17281fcb7d7fab7bbfe8e10350b2 [0,1,0,0,0,0|1,0,2]=4 3034 B12R0.234 CCCCCCCOC/C=C(/C)\I 06e173984a9d0822bed2157e28b2f4e9 [0,1,0,0,0,0|1,0,2]=4 3035 B12R0.234 CCCCCCCOC/C=C(\C)/Cl 7740f33ee8a83280d933d2b1b9f6551f [0,1,0,0,0,0|1,0,2]=4 3036 B12R0.234 CCCCCCCOCC=C(C)C 3aba8cdd9376ab8363c8083ef428d203 [0,1,0,0,0,0|1,0,2]=4 3037 B12R0.234 CCCCCCCOCC=C(C)Cl 7f0ad0b87abbcfb3c27924dc9fffbc32 [0,1,0,0,0,0|1,0,2]=4 3038 B12R0.234 CCCCCCCOCC=C(C)I bc93e785191282d9f882a790df6e2729 [0,1,0,0,0,0|1,0,2]=4 3039 B12R0.234 CCCCCCCOCCC(=O)C e4aa55eb37e4a9deb95ffd7f03207921 [0,1,0,0,0,0|0,0,2]=3 3040 B12R0.234 CCCCCCCOCCC(=O)N f1f3ae36c8ebb21fdc4e830a47507388 [0,1,0,0,0,0|1,0,2]=4 3041 B12R0.234 CCCCCCCOCCC(=O)O 99a55f75abedf1e7f5e210f440faf80f [0,1,0,0,0,0|1,0,1]=3 3042 B12R0.234 CCCCCCCOCCC(C)C 7b4e8cf3be867280f595306a642671c2 [0,1,0,0,0,0|1,0,0]=2 3043 B12R0.234 CCCCCCCOCCC(F)F 70011af9091ea7bbf9ec569d58fc880c [0,1,0,0,0,0|2,0,0]=3 3044 B12R0.234 CCCCCCCOCCN(C)C 3d83ed7418c7b5f1512586c2a8bf6cd1 [0,1,0,0,0,0|2,0,0]=3 3045 B12R0.234 CCCCCCCOCCS(=O)C 440cf1793ac784a097c757205b2732d9 [0,1,0,0,0,0|1,0,1]=3 3046 B12R0.234 CCCCCCCOCC[N+](=O)[O-] d55a6ef7602da8f55c734e3489be5f6a [0,1,0,0,0,0|2,0,1]=4 3047 B12R0.234 CCCCCCCOCNC(=O)C 8868a63fe0ad62db02100c17a605331f [0,1,0,0,0,0|1,0,2]=4 3048 B12R0.234 CCCCCCCOCOC(=O)C 75994a86af9a170a2203559f5480833e [0,1,0,0,0,0|1,0,2]=4 3049 B12R0.234 CCCCCCCOCOC(C)C a66d0073b019d10978cd0fbf61878ed8 [0,1,0,0,0,0|2,0,0]=3 3050 B12R0.234 CCCCCCNC/C=C/C(C)C ea6abad081ec7fc782291cd6ad21f7e7 [0,1,0,0,0,0|1,0,2]=4 3051 B12R0.234 CCCCCCNCCC=C(C)C 2249bd19c46e398eacc5afc3e5fc0683 [0,1,0,0,0,0|1,0,2]=4 3052 B12R0.234 CCCCCCNCCCC(=O)C 4237140c45387a29125de17b57d911d0 [0,1,0,0,0,0|0,0,2]=3 3053 B12R0.234 CCCCCCNCCCC(=O)N e1b6b2c251765ac9edea9af982611062 [0,1,0,0,0,0|1,0,2]=4 3054 B12R0.234 CCCCCCNCCCC(=O)O 7ea79cc51006783abcbb20123d130057 [0,1,0,0,0,0|1,0,1]=3 3055 B12R0.234 CCCCCCNCCCC(C)C 0f29d09636d4ade1077cb5b342674e86 [0,1,0,0,0,0|1,0,0]=2 3056 B12R0.234 CCCCCCNCCCC(C)O 64883e7be3613ca791393331610df0c6 [0,1,0,0,0,0|0,0,0]=1 3057 B12R0.234 CCCCCCNCCCN(C)C d7f27cb8a9b0f12cc37cba3a2f2e0c9f [0,1,0,0,0,0|2,0,0]=3 3058 B12R0.234 CCCCCCNCCCS(=O)C 8f467f3e0360cbe7ec9d0c5711b27369 [0,1,0,0,0,0|1,0,1]=3 3059 B12R0.234 CCCCCCNCCC[N+](=O)[O-] 13af7f272ba497ed6fc16e40305a37e5 [0,1,0,0,0,0|2,0,1]=4 3060 B12R0.234 CCCCCCNCCNC(=O)C 8e8f681ebd2ec3710353ef5d73bad07e [0,1,0,0,0,0|1,0,2]=4 3061 B12R0.234 CCCCCCNCCOC(=O)C 5e4df66cbdad6b3a596e2cb05ff69657 [0,1,0,0,0,0|1,0,2]=4 3062 B12R0.234 CCCCCCNCCOC(C)C 19d4413db4709751cc65752cd40c00a5 [0,1,0,0,0,0|2,0,0]=3 3063 B12R0.234 CCCCCCNCCOC(F)F 936dd8a1a0e7096e76d4eaa2e1f7baa6 [0,1,0,0,0,0|3,0,0]=4 3064 B12R0.234 CCCCCCNCCSC(=O)C 29c813ca360602fc3878ad960b66fd01 [0,1,0,0,0,0|1,0,2]=4 3065 B12R0.234 CCCCCCNCCSC(C)C 128536f0808a10632243ea0b00afac7f [0,1,0,0,0,0|2,0,0]=3 3066 B12R0.234 CCCCCCOC/C=C/C(C)C 779e2bdcb188de6d6af2f476df7240be [0,1,0,0,0,0|1,0,2]=4 3067 B12R0.234 CCCCCCOCCC=C(C)C 44c9c7672119671e5f69a9791d59b173 [0,1,0,0,0,0|1,0,2]=4 3068 B12R0.234 CCCCCCOCCCC(=O)C 21a282bc9702686e7106e1ffe8f5e3e8 [0,1,0,0,0,0|0,0,2]=3 3069 B12R0.234 CCCCCCOCCCC(=O)N ed8f97a3043f9d940f4f0551572131c1 [0,1,0,0,0,0|1,0,2]=4 3070 B12R0.234 CCCCCCOCCCC(C)C 77a66c107ba53b6c1dd34c94b5f1dcae [0,1,0,0,0,0|1,0,0]=2 3071 B12R0.234 CCCCCCOCCCN(C)C 7e31b4a2494d29d3c564483431b37ecf [0,1,0,0,0,0|2,0,0]=3 3072 B12R0.234 CCCCCCOCCC[N+](=O)[O-] 5495ea670f75912a65c673b6ecadf383 [0,1,0,0,0,0|2,0,1]=4 3073 B12R0.234 CCCCCCOCCNC(=O)C 5a81c1ba5342d93ff8efab51f772c115 [0,1,0,0,0,0|1,0,2]=4 3074 B12R0.234 CCCCCCOCCOC(=O)C c976678a6b281cbeb8d86df12cc7c5bc [0,1,0,0,0,0|1,0,2]=4 3075 B12R0.234 CCCCCCOCCOC(C)C 67309bc145873b53e809aa3e700f45ab [0,1,0,0,0,0|2,0,0]=3 3076 B12R0.234 CCCCCCOCCOC(F)F 83509db779fcdcd3c8542c6b35eb91b0 [0,1,0,0,0,0|3,0,0]=4 3077 B12R0.234 CCCCCCOCCSC(=O)C 1f11bdb2561a91ddd2623515c77a997c [0,1,0,0,0,0|1,0,2]=4 3078 B12R0.234 CCCCCCOCCSC(C)C 374a60c2254b44482eceee092ddf2ed4 [0,1,0,0,0,0|2,0,0]=3 3079 B12R0.234 CCCCCNCCCCC(=O)C dc4186c3df002a1751f5b68bbd0e09e8 [0,1,0,0,0,0|0,0,2]=3 3080 B12R0.234 CCCCCNCCCCC(=O)N 792c73d83695f0c6b1c51accfc11ffb7 [0,1,0,0,0,0|1,0,2]=4 3081 B12R0.234 CCCCCNCCCCC(=O)O 2025641bcbba83afa908fa317adfc621 [0,1,0,0,0,0|1,0,1]=3 3082 B12R0.234 CCCCCNCCCCC(C)C 77619bb2a003ac28a8389daad0d73dc0 [0,1,0,0,0,0|1,0,0]=2 3083 B12R0.234 CCCCCNCCCCC(C)O 09f507821b174cb9dc8b0069b827deb5 [0,1,0,0,0,0|0,0,0]=1 3084 B12R0.234 CCCCCNCCCCC(F)F 6c8d1902b50d7d2754f35e9146232653 [0,1,0,0,0,0|2,0,0]=3 3085 B12R0.234 CCCCCNCCCCN(C)C c022429f40983350da605ae61176788d [0,1,0,0,0,0|2,0,0]=3 3086 B12R0.234 CCCCCNCCCC[C@@H](C)O f281a32fc86dc68ed462aa4cc12815ea [0,1,0,0,0,0|0,0,0]=1 3087 B12R0.234 CCCCCNCCCNC(=O)C d79126de0b63edd10f9e7c1628412f11 [0,1,0,0,0,0|1,0,2]=4 3088 B12R0.234 CCCCCNCCCOC(=O)C 423c88eb7c9ef3c2030cf82f13884d85 [0,1,0,0,0,0|1,0,2]=4 3089 B12R0.234 CCCCCNCCCOC(=S)C f6619d057ec2f7ffddccd5ab0e64ed5f [0,1,0,0,0,0|1,1,1]=4 3090 B12R0.234 CCCCCNCCCOC(C)C b37e6d9a4b55409e85bff88d8f736136 [0,1,0,0,0,0|2,0,0]=3 3091 B12R0.234 CCCCCNCCCOC(F)F c9c49984509f76263dd306e30c2776ea [0,1,0,0,0,0|3,0,0]=4 3092 B12R0.234 CCCCCNCCCSC(=O)C 42d5feecab52fd3360f8eb81b6687e0c [0,1,0,0,0,0|1,0,2]=4 3093 B12R0.234 CCCCCNCCCSC(C)C 4115a3212ea6c528e52f68be9c5c87f3 [0,1,0,0,0,0|2,0,0]=3 3094 B12R0.234 CCCCCNCCOCC(=O)O bc78ad70e8471400d9ede087f22b717f [0,1,0,0,0,0|2,0,1]=4 3095 B12R0.234 CCCCCNCCOCC(C)C ac1695bfde0259f3d09acd70e781b7ba [0,1,0,0,0,0|2,0,0]=3 3096 B12R0.234 CCCCCNCCOCC(F)F 95f21530e7de0ebf9aadb717a6968cc5 [0,1,0,0,0,0|3,0,0]=4 3097 B12R0.234 CCCCCOCCCCC(=O)C e9f945235295e2068ec066faab0e9b72 [0,1,0,0,0,0|0,0,2]=3 3098 B12R0.234 CCCCCOCCCCC(=O)N 530a460316a7be743482dd552f5a7478 [0,1,0,0,0,0|1,0,2]=4 3099 B12R0.234 CCCCCOCCCCC(=O)O c7ef8c838f309db77667febcb5863413 [0,1,0,0,0,0|1,0,1]=3 3100 B12R0.234 CCCCCOCCCCC(C)C 051429fa7b3297c644ec6896bac0dcbb [0,1,0,0,0,0|1,0,0]=2 3101 B12R0.234 CCCCCOCCCCN(C)C 3d89657b06ce8ccb79338e13346bc4fa [0,1,0,0,0,0|2,0,0]=3 3102 B12R0.234 CCCCCOCCCC[N+](=O)[O-] 44cb9280ff8dffe54c5a566f1f70931e [0,1,0,0,0,0|2,0,1]=4 3103 B12R0.234 CCCCCOCCCNC(=O)C 7c08b7feaf0f7499cc24d3b322b2e100 [0,1,0,0,0,0|1,0,2]=4 3104 B12R0.234 CCCCCOCCCOC(=O)C 34af0b0fadb315ed42fdff80d0677b37 [0,1,0,0,0,0|1,0,2]=4 3105 B12R0.234 CCCCCOCCCOC(=S)C 1f0079a3bd0a123dfa1a8bcdf2c82063 [0,1,0,0,0,0|1,1,1]=4 3106 B12R0.234 CCCCCOCCCOC(C)C 8b5fd0a550826c77432894feaa290be6 [0,1,0,0,0,0|2,0,0]=3 3107 B12R0.234 CCCCCOCCCSC(=O)C c032542397a714bf31a432f4d3a19b4c [0,1,0,0,0,0|1,0,2]=4 3108 B12R0.234 CCCCCOCCCSC(C)C 8e5238f83c3a8e7e198dc3ca9e5d279d [0,1,0,0,0,0|2,0,0]=3 3109 B12R0.234 CCCCCOCCOCC(=O)O 90f5a7a87dfe47c6baf748d44799d2a4 [0,1,0,0,0,0|2,0,1]=4 3110 B12R0.234 CCCCCOCCOCC(C)C 72ce4fe0757cfd3052c0a57ccc716337 [0,1,0,0,0,0|2,0,0]=3 3111 B12R0.234 CCCCCOCCOCC(F)F d8a39706fb53ce6f56b0c43ba9c86697 [0,1,0,0,0,0|3,0,0]=4 3112 B12R0.234 CCCCCOCCOCN(C)C b6ef6c390432fa32fdf556808c2d7503 [0,1,0,0,0,0|3,0,0]=4 3113 B12R0.234 CCCCCOCCSCC(C)C 66dfd9145ffca8bb48b3ecac682eaf8d [0,1,0,0,0,0|2,0,0]=3 3114 B12R0.234 CCCCNCCCCCC(=O)C 701c3ae3670d1ba04699f1fa3077ef26 [0,1,0,0,0,0|0,0,2]=3 3115 B12R0.234 CCCCNCCCCCC(=O)N 6d0265cb32df3084824ffb8bebfc96b6 [0,1,0,0,0,0|1,0,2]=4 3116 B12R0.234 CCCCNCCCCCC(=O)O d4c182fcc67a7ce7c55b799b06a1174d [0,1,0,0,0,0|1,0,1]=3 3117 B12R0.234 CCCCNCCCCCC(C)C de49912e4efc404aa9340aeea692cfcf [0,1,0,0,0,0|1,0,0]=2 3118 B12R0.234 CCCCNCCCCCC(F)F 009d1045925b3912f8565c8a734d99d8 [0,1,0,0,0,0|2,0,0]=3 3119 B12R0.234 CCCCNCCCCCN(C)C a37604dc9e8c167ef751e9372ad9fac1 [0,1,0,0,0,0|2,0,0]=3 3120 B12R0.234 CCCCNCCCCNC(=O)C beb884073d6a6a9697fc9296171d0dfc [0,1,0,0,0,0|1,0,2]=4 3121 B12R0.234 CCCCNCCCCOC(=O)C b3358e88a24e4565228a2198d21215eb [0,1,0,0,0,0|1,0,2]=4 3122 B12R0.234 CCCCNCCCCOC(F)F 2dd86beed7718839dbd93cc54ddb226b [0,1,0,0,0,0|3,0,0]=4 3123 B12R0.234 CCCCNCCCCSC(=O)C 955b96a5f70c81ffc05ca30332fbb700 [0,1,0,0,0,0|1,0,2]=4 3124 B12R0.234 CCCCNCCCOCC(=O)O 97bf5a6ef7431714bfb45672b98a41b3 [0,1,0,0,0,0|2,0,1]=4 3125 B12R0.234 CCCCNCCCOCC(C)C eb68c5f9417e3cc8bd0bbd6bf97abdf1 [0,1,0,0,0,0|2,0,0]=3 3126 B12R0.234 CCCCNCCOCCC(=O)O f8b5ea6e3dd209943534dbc3eb6c2cfb [0,1,0,0,0,0|2,0,1]=4 3127 B12R0.234 CCCCNCCOCCN(C)C 4db14d9cbecc5ea96bac1d6f0e3c59a6 [0,1,0,0,0,0|3,0,0]=4 3128 B12R0.234 CCCCOCCCCCC(=O)C 0f08ac5a655c29744fd7707a663f4121 [0,1,0,0,0,0|0,0,2]=3 3129 B12R0.234 CCCCOCCCCCC(=O)N e904d535cab28bd8a699671139a91112 [0,1,0,0,0,0|1,0,2]=4 3130 B12R0.234 CCCCOCCCCCC(=O)O 7292906efe2519124d1759b2ec8cb916 [0,1,0,0,0,0|1,0,1]=3 3131 B12R0.234 CCCCOCCCCCC(C)C 1b591539c3f9bcd8285c6aa6d6262aed [0,1,0,0,0,0|1,0,0]=2 3132 B12R0.234 CCCCOCCCCCC(F)F 1726d53d329160f48f1594ee93a963a4 [0,1,0,0,0,0|2,0,0]=3 3133 B12R0.234 CCCCOCCCCCN(C)C f334f41bfbb7dffa31c984a90bba1c10 [0,1,0,0,0,0|2,0,0]=3 3134 B12R0.234 CCCCOCCCCOC(=O)C c996cbcbd03482799e1eeeee731eb29b [0,1,0,0,0,0|1,0,2]=4 3135 B12R0.234 CCCCOCCCCSC(=O)C 2db3862f438f590da8645f87511262fd [0,1,0,0,0,0|1,0,2]=4 3136 B12R0.234 CCCCOCCCNCC(=O)O 27cdc24b902ba5a62df998cb9a9ce636 [0,1,0,0,0,0|2,0,1]=4 3137 B12R0.234 CCCCOCCCNCC(C)C 3bd7f5f5cbacbfcfe416d3750efd99fc [0,1,0,0,0,0|2,0,0]=3 3138 B12R0.234 CCCCOCCCNCC(C)O 5363eef4d9045be13f2dd60529241278 [0,1,0,0,0,0|1,0,0]=2 3139 B12R0.234 CCCCOCCCNCC(F)F d1ed0665c8d523c56650aa1f4a619caa [0,1,0,0,0,0|3,0,0]=4 3140 B12R0.234 CCCCOCCCNCN(C)C c8eaf53579ec0dbb57226bdae38f2d7d [0,1,0,0,0,0|3,0,0]=4 3141 B12R0.234 CCCCOCCCNC[C@@H](C)O 3bf84874cdf64dde6d0b7e62d75a98e3 [0,1,0,0,0,0|1,0,0]=2 3142 B12R0.234 CCCCOCCCNC[C@H](C)O aa6c5e73b06117453354d01ebd28d012 [0,1,0,0,0,0|1,0,0]=2 3143 B12R0.234 CCCCOCCCOCC(=O)O 74959e98b33214a3a9e064d0a7b7c49a [0,1,0,0,0,0|2,0,1]=4 3144 B12R0.234 CCCCOCCCOCC(C)C 4027b72ed6a8c576a63b6362de0bc837 [0,1,0,0,0,0|2,0,0]=3 3145 B12R0.234 CCCCOCCCOCC(F)F 27c0fc2f150aa5cbc7bb0dc92d33a4ab [0,1,0,0,0,0|3,0,0]=4 3146 B12R0.234 CCCCOCCCOCN(C)C ad864e8409b17fa0ddcd189645025936 [0,1,0,0,0,0|3,0,0]=4 3147 B12R0.234 CCCCOCCCSCC(C)C 1c64a7c39daada4a390036b113f3bc22 [0,1,0,0,0,0|2,0,0]=3 3148 B12R0.234 CCCCOCCNCCC(=O)C ea99523e2322198738f2f7f3fc58e440 [0,1,0,0,0,0|1,0,2]=4 3149 B12R0.234 CCCCOCCNCCC(=O)O e93c16e846a86354b6055df0d6025a13 [0,1,0,0,0,0|2,0,1]=4 3150 B12R0.234 CCCCOCCNCCC(C)C 712d0e5585c1add9b402bf8e8f031b5f [0,1,0,0,0,0|2,0,0]=3 3151 B12R0.234 CCCCOCCNCCC(C)O 11baf687250f60b29f8c1be528c63707 [0,1,0,0,0,0|1,0,0]=2 3152 B12R0.234 CCCCOCCNCCC(F)F 9776b133831ee891a5ae0612b61e0fbd [0,1,0,0,0,0|3,0,0]=4 3153 B12R0.234 CCCCOCCNCCN(C)C fd20ad0f479b24c4e2d669702510291a [0,1,0,0,0,0|3,0,0]=4 3154 B12R0.234 CCCCOCCNCCS(=O)C 647ec6677119474ed5f365fc1f329bb3 [0,1,0,0,0,0|2,0,1]=4 3155 B12R0.234 CCCCOCCNCCS(=O)O 8aca5a01e9de70f7056e6bf12f63490f [0,1,0,0,0,0|3,0,0]=4 3156 B12R0.234 CCCCOCCNCC[C@@H](C)O 08606b1d55914bff068edbbac9af3a9f [0,1,0,0,0,0|1,0,0]=2 3157 B12R0.234 CCCCOCCNCC[C@H](C)O 7963b48b3f9c0a75253370e650b5ba9f [0,1,0,0,0,0|1,0,0]=2 3158 B12R0.234 CCCCOCCNCOC(C)C 303fe6d617b4d8bbb361e9e7f331292a [0,1,0,0,0,0|3,0,0]=4 3159 B12R0.234 CCCCOCCOCCC(=O)C 2e987d042eb30a74e34aca0f530f532e [0,1,0,0,0,0|1,0,2]=4 3160 B12R0.234 CCCCOCCOCCC(=O)O 06651b3d6c7d50fdd63f3da56610e8bd [0,1,0,0,0,0|2,0,1]=4 3161 B12R0.234 CCCCOCCOCCC(C)C db92dbc990a9e4b084bc45527af05f99 [0,1,0,0,0,0|2,0,0]=3 3162 B12R0.234 CCCCOCCOCCC(F)F 923e368a529d1e8eeb603cfc258858a6 [0,1,0,0,0,0|3,0,0]=4 3163 B12R0.234 CCCCOCCOCCN(C)C 2cc70b8fd23b44d36fe9f859b8dfa62a [0,1,0,0,0,0|3,0,0]=4 3164 B12R0.234 CCCCOCCOCCS(=O)C c209aa889991648ab8e9e39ab89dd203 [0,1,0,0,0,0|2,0,1]=4 3165 B12R0.234 CCCCOCCOCOC(C)C 276649195da8a4649bdee18260c0651c [0,1,0,0,0,0|3,0,0]=4 3166 B12R0.234 CCCCOCNCCCC(=O)O d966949497b948766089b02bcfbfc57c [0,1,0,0,0,0|2,0,1]=4 3167 B12R0.234 CCCCOCNCCCC(C)C cf95d31f662d5d68b0ce4f6abd1d6643 [0,1,0,0,0,0|2,0,0]=3 3168 B12R0.234 CCCCOCNCCCN(C)C e30180fc23487f50a9c8517e21165f0d [0,1,0,0,0,0|3,0,0]=4 3169 B12R0.234 CCCCOCNCCCS(=O)C c9c5e3f9893b110fbc6fb67a2a291529 [0,1,0,0,0,0|2,0,1]=4 3170 B12R0.234 CCCCOCNCCOC(C)C 1acd3261cc93d447f318705cbb9b62fc [0,1,0,0,0,0|3,0,0]=4 3171 B12R0.234 CCCCOCOCCCC(=O)C 745f68690e083e17f4b8ddba1322c5d1 [0,1,0,0,0,0|1,0,2]=4 3172 B12R0.234 CCCCOCOCCCC(C)C 648ba386ae21c7e11375f431b081e4b7 [0,1,0,0,0,0|2,0,0]=3 3173 B12R0.234 CCCCOCOCCCN(C)C 68d3c5d07ff6a0b7526a6b42da7882ff [0,1,0,0,0,0|3,0,0]=4 3174 B12R0.234 CCCCOCOCCOC(C)C 22ea039fb64a530ae195f368231fd8d5 [0,1,0,0,0,0|3,0,0]=4 3175 B12R0.234 CCCCOCOCCSC(C)C af8ca0a68af6538064d235028c7db91a [0,1,0,0,0,0|3,0,0]=4 3176 B12R0.234 CCCCSCCOCCC(=O)C b2a245b991751e58aecf0db65c213523 [0,1,0,0,0,0|1,0,2]=4 3177 B12R0.234 CCCCSCCOCCC(=O)O 53cf1c591dd0a8c6a5ee5391058651db [0,1,0,0,0,0|2,0,1]=4 3178 B12R0.234 CCCCSCCOCCC(C)C 99616089174f8043002ef3d7faad3fab [0,1,0,0,0,0|2,0,0]=3 3179 B12R0.234 CCCCSCCOCCN(C)C 88422d43ba78ef4ca6568095bc60b209 [0,1,0,0,0,0|3,0,0]=4 3180 B12R0.234 CCCCSCCOCCS(=O)C 56719f3c1fa3befffbfb1d78db6fd4e6 [0,1,0,0,0,0|2,0,1]=4 3181 B12R0.234 CCCCSCCOCOC(C)C 96b0ad136836005bfb3ae2e8c69e9ba7 [0,1,0,0,0,0|3,0,0]=4 3182 B12R0.234 CCCNCCCCCCC(=O)O 1209be85d19fc9719e4624682259ccba [0,1,0,0,0,0|1,0,1]=3 3183 B12R0.234 CCCNCCCCCCC(C)C d7915ed383ba5e074a9ffc806e43e909 [0,1,0,0,0,0|1,0,0]=2 3184 B12R0.234 CCCNCCCCCCN(C)C 0ee71153936628fbfeb891505cc8f84a [0,1,0,0,0,0|2,0,0]=3 3185 B12R0.234 CCCNCCCCCNC(=O)C ab9c60e4b91e58e673834d52f662a13a [0,1,0,0,0,0|1,0,2]=4 3186 B12R0.234 CCCNCCCCCOC(=O)C 86f3cb4f3ed2e6d4645252403d41984d [0,1,0,0,0,0|1,0,2]=4 3187 B12R0.234 CCCNCCCCSCC(C)C 3deca72802a06f01569ccf448dc551f4 [0,1,0,0,0,0|2,0,0]=3 3188 B12R0.234 CCCOCCCCCCC(=O)N ef902ab8dc24827b5e068c394e3cd23d [0,1,0,0,0,0|1,0,2]=4 3189 B12R0.234 CCCOCCCCCCC(=O)O 184e565df245740558281f57f62af0c1 [0,1,0,0,0,0|1,0,1]=3 3190 B12R0.234 CCCOCCCCCCC(C)C a6616e1411b449c54de8055468b842fa [0,1,0,0,0,0|1,0,0]=2 3191 B12R0.234 CCCOCCCCCCN(C)C b73263233d01cc44c65004580738c760 [0,1,0,0,0,0|2,0,0]=3 3192 B12R0.234 CCCOCCCCCOC(=O)C c356f5294116b3c40b30bb21c8d17d81 [0,1,0,0,0,0|1,0,2]=4 3193 B12R0.234 CCCOCCCNCCC(=O)C 9c3e15a43858373c69bea829ac489ba7 [0,1,0,0,0,0|1,0,2]=4 3194 B12R0.234 CCCOCCCNCCC(=O)O bc30ee6084eb1b212083b8e6b0f24988 [0,1,0,0,0,0|2,0,1]=4 3195 B12R0.234 CCCOCCCNCCC(C)C 12840c1c30afceb4969a9f5438838cab [0,1,0,0,0,0|2,0,0]=3 3196 B12R0.234 CCCOCCCNCCC(C)O c665d7241ba38f4e58627a40b33811e9 [0,1,0,0,0,0|1,0,0]=2 3197 B12R0.234 CCCOCCCNCCC(F)F 570f1d4c1cca6610e2021fa726b8adef [0,1,0,0,0,0|3,0,0]=4 3198 B12R0.234 CCCOCCCNCCN(C)C 6a5f107a6eb5b5b5bf0bebd55bc7f3c0 [0,1,0,0,0,0|3,0,0]=4 3199 B12R0.234 CCCOCCCNCCS(=O)C 04c7b8df0fe0cd6aed18e863dd99dc5c [0,1,0,0,0,0|2,0,1]=4 3200 B12R0.234 CCCOCCCNCCS(=O)O c3e5de82c786ce0d4afad2bba2864446 [0,1,0,0,0,0|3,0,0]=4 3201 B12R0.234 CCCOCCCNCC[C@@H](C)O df617d825756d948c41cadd9d8639f83 [0,1,0,0,0,0|1,0,0]=2 3202 B12R0.234 CCCOCCCNCC[C@H](C)O 645189ec88e77e91f0e27ffac4140546 [0,1,0,0,0,0|1,0,0]=2 3203 B12R0.234 CCCOCCCNCOC(C)C c32754f99d381e850f694953c17002eb [0,1,0,0,0,0|3,0,0]=4 3204 B12R0.234 CCCOCCCOCCC(=O)C a00458fb677067a25f5df9ae1c30cc80 [0,1,0,0,0,0|1,0,2]=4 3205 B12R0.234 CCCOCCCOCCC(=O)O 87e582f681f002dac15a7b47db923ba0 [0,1,0,0,0,0|2,0,1]=4 3206 B12R0.234 CCCOCCCOCCC(C)C ddfe9da27ce0da19d48a7ef1326ff019 [0,1,0,0,0,0|2,0,0]=3 3207 B12R0.234 CCCOCCCOCCC(F)F 716eca66290669c732df280045bf594d [0,1,0,0,0,0|3,0,0]=4 3208 B12R0.234 CCCOCCCOCCN(C)C fd49c44d4996ddefa71e544a6389f6aa [0,1,0,0,0,0|3,0,0]=4 3209 B12R0.234 CCCOCCCOCCS(=O)C 3be6fd864310ec2030176a85518d7c82 [0,1,0,0,0,0|2,0,1]=4 3210 B12R0.234 CCCOCCNCCCC(=O)C 57de64e9c60c6d15db0801cec9cf0c77 [0,1,0,0,0,0|1,0,2]=4 3211 B12R0.234 CCCOCCNCCCC(=O)O 58748e67afd65f8ee33cfaf962060503 [0,1,0,0,0,0|2,0,1]=4 3212 B12R0.234 CCCOCCNCCCC(C)C f6384add3a913366f5a3f18f36260da1 [0,1,0,0,0,0|2,0,0]=3 3213 B12R0.234 CCCOCCNCCCC(C)O 2110847c5c732bc610c37e009c7ada5c [0,1,0,0,0,0|1,0,0]=2 3214 B12R0.234 CCCOCCNCCCN(C)C 32bf3d148d7546831346b24cb9b2d273 [0,1,0,0,0,0|3,0,0]=4 3215 B12R0.234 CCCOCCNCCCS(=O)C db5e5995306e5fb349a43ee61a53bede [0,1,0,0,0,0|2,0,1]=4 3216 B12R0.234 CCCOCCNCCOC(C)C 7cec70fec6f5af446c9bfc1aab0ddeac [0,1,0,0,0,0|3,0,0]=4 3217 B12R0.234 CCCOCCNCCSC(C)C f6804f7a04c45ff8e06cb1ed19a2f231 [0,1,0,0,0,0|3,0,0]=4 3218 B12R0.234 CCCOCCOCCCC(=O)C 2aceabe2371d0a983823296fde45f557 [0,1,0,0,0,0|1,0,2]=4 3219 B12R0.234 CCCOCCOCCCC(=O)O b32c954526a75429343840be31066d1b [0,1,0,0,0,0|2,0,1]=4 3220 B12R0.234 CCCOCCOCCCC(C)C b511d8958f1f3d4eee961d58fcf5d079 [0,1,0,0,0,0|2,0,0]=3 3221 B12R0.234 CCCOCCOCCCN(C)C af6923e665b505c8ef8cdb3bc5729b50 [0,1,0,0,0,0|3,0,0]=4 3222 B12R0.234 CCCOCCOCCOC(C)C 61dae7eb2ca382ebd4c34a630cd6b537 [0,1,0,0,0,0|3,0,0]=4 3223 B12R0.234 CCCOCCOCCSC(C)C a2bebc604c333c58b472a9470cf11e51 [0,1,0,0,0,0|3,0,0]=4 3224 B12R0.234 CCCSCCCCNCC(=O)O 0da3477e4390f108ab97359526f8a78b [0,1,0,0,0,0|2,0,1]=4 3225 B12R0.234 CCCSCCCCNCC(C)C a21d656371066be418c9340be3d32d0e [0,1,0,0,0,0|2,0,0]=3 3226 B12R0.234 CCCSCCCCNCC(C)O bd13b69612da07515c70ea07cc9ed749 [0,1,0,0,0,0|1,0,0]=2 3227 B12R0.234 CCCSCCCCNCC(F)F 6e2ebdae27f8c159fe6c14ccda15cbf4 [0,1,0,0,0,0|3,0,0]=4 3228 B12R0.234 CCCSCCCCNCN(C)C 9add208f9061ad0e8ce41812798fc145 [0,1,0,0,0,0|3,0,0]=4 3229 B12R0.234 CCCSCCCCNC[C@@H](C)O b6b6583078503dbc17efe78aa1e922a2 [0,1,0,0,0,0|1,0,0]=2 3230 B12R0.234 CCCSCCCCNC[C@H](C)O 4eb9e2cf78056585403cf087edab879b [0,1,0,0,0,0|1,0,0]=2 3231 B12R0.234 CCCSCCOCCCC(=O)C d85fe65ee007d3a4d2d28243a01bfe29 [0,1,0,0,0,0|1,0,2]=4 3232 B12R0.234 CCCSCCOCCCC(=O)O 0b7965f5e8a8094662e4e26f784e2bf0 [0,1,0,0,0,0|2,0,1]=4 3233 B12R0.234 CCCSCCOCCCC(C)C 68ce6fd57c00ef1b38aeef17bd3e4377 [0,1,0,0,0,0|2,0,0]=3 3234 B12R0.234 CCCSCCOCCCN(C)C 12c5b12bd7930e9663b8008b866ab724 [0,1,0,0,0,0|3,0,0]=4 3235 B12R0.234 CCCSCCOCCOC(C)C 6af8d7ff0a5f47539497834c92aac177 [0,1,0,0,0,0|3,0,0]=4 3236 B12R0.234 CCCSCCOCCSC(C)C 447daedcd7d15fe5a72ac9baf8b73ead [0,1,0,0,0,0|3,0,0]=4 3237 B12R0.234 CCNCCCCCCCC(=O)O 4129974f68a0ceef8ab0e96914078837 [0,1,0,0,0,0|1,0,1]=3 3238 B12R0.234 CCNCCCCCCCN(C)C d334c529678847991a1100d581880626 [0,1,0,0,0,0|2,0,0]=3 3239 B12R0.234 CCNCCCCCCNC(=O)C 9d04a9f9bb66debe9b608169577b565c [0,1,0,0,0,0|1,0,2]=4 3240 B12R0.234 CCNCCOCCCCC(=O)O a68d1a4ab9fdb85eaaee1e8610c4f41b [0,1,0,0,0,0|2,0,1]=4 3241 B12R0.234 CCOCCCCCCCC(=O)C 84451fa23ed3e3143a5a1d446125857e [0,1,0,0,0,0|0,0,2]=3 3242 B12R0.234 CCOCCCCCCCC(=O)O 46aa100c5035c7dc38e92b0892435701 [0,1,0,0,0,0|1,0,1]=3 3243 B12R0.234 CCOCCCCCCCC(C)C 626ed2c7256a41d21f10aff0ef8f5df5 [0,1,0,0,0,0|1,0,0]=2 3244 B12R0.234 CCOCCCNCCCC(=O)C 4c60505495c8b0fd1baf5e9404731703 [0,1,0,0,0,0|1,0,2]=4 3245 B12R0.234 CCOCCCNCCCC(=O)O aabf0aae26aed3b3b8b48b20d42125b8 [0,1,0,0,0,0|2,0,1]=4 3246 B12R0.234 CCOCCCNCCCC(C)C 3055328889148574e8d6147f250ce8d7 [0,1,0,0,0,0|2,0,0]=3 3247 B12R0.234 CCOCCCNCCCC(C)O 1a1a61e4a4aa4028c4654ddb37d5dd27 [0,1,0,0,0,0|1,0,0]=2 3248 B12R0.234 CCOCCCNCCCN(C)C 8c09b0ba0f6e69e5ed7a7ca6b76c10f8 [0,1,0,0,0,0|3,0,0]=4 3249 B12R0.234 CCOCCCNCCCS(=O)C d6ff0429175a0ee53c083fd16c16984e [0,1,0,0,0,0|2,0,1]=4 3250 B12R0.234 CCOCCCNCCOC(C)C f67be18affcbc5aedeb67d5518a5bfcb [0,1,0,0,0,0|3,0,0]=4 3251 B12R0.234 CCOCCCNCCSC(C)C 16e0f3d140673b050e87bc34d2c68640 [0,1,0,0,0,0|3,0,0]=4 3252 B12R0.234 CCOCCCOCCCC(=O)C 97e5b8446d0631529afc9074cb4aa7c6 [0,1,0,0,0,0|1,0,2]=4 3253 B12R0.234 CCOCCCOCCCC(C)C ccb4b7b291bfe9699f47d882f2839bd6 [0,1,0,0,0,0|2,0,0]=3 3254 B12R0.234 CCOCCCOCCCN(C)C 283669d1f23f0588a24cf3a757333d65 [0,1,0,0,0,0|3,0,0]=4 3255 B12R0.234 CCOCCCOCCOC(C)C 1c1fdf4e6edce8de9263d4e6fbdba8aa [0,1,0,0,0,0|3,0,0]=4 3256 B12R0.234 CCOCCCOCCSC(C)C fd1f6288fac47f143b100ac7b0312aa3 [0,1,0,0,0,0|3,0,0]=4 3257 B12R0.234 CCOCCNCCCCC(=O)C 9c2d7ce2a322d26c6550a45085cfbead [0,1,0,0,0,0|1,0,2]=4 3258 B12R0.234 CCOCCNCCCCC(=O)O e3f1921429e30bff944aeee3a1049192 [0,1,0,0,0,0|2,0,1]=4 3259 B12R0.234 CCOCCNCCCCC(C)C 55ed0e1b0111cc8d9e449116a8572088 [0,1,0,0,0,0|2,0,0]=3 3260 B12R0.234 CCOCCNCCCCC(C)O fc7186f724a4526974058140742b6e7e [0,1,0,0,0,0|1,0,0]=2 3261 B12R0.234 CCOCCNCCCCC(F)F 3257a88240aa64dc585cfb98ff89636b [0,1,0,0,0,0|3,0,0]=4 3262 B12R0.234 CCOCCNCCCCN(C)C 7958dbd5cb69ff8867ae0f7a02b219ae [0,1,0,0,0,0|3,0,0]=4 3263 B12R0.234 CCOCCNCCCC[C@@H](C)O 778954741c4d92f8a8c72336db5719b6 [0,1,0,0,0,0|1,0,0]=2 3264 B12R0.234 CCOCCNCCCOC(C)C 24020956cdeefc7c4c3e50e96595dcb0 [0,1,0,0,0,0|3,0,0]=4 3265 B12R0.234 CCOCCNCCCSC(C)C d1f25fc9b0d2d37383cfe03f6d13df17 [0,1,0,0,0,0|3,0,0]=4 3266 B12R0.234 CCOCCNCCOCC(C)C 43069dce1a77e5cd9ac0acbae8464f7d [0,1,0,0,0,0|3,0,0]=4 3267 B12R0.234 CCOCCOCCCCC(=O)C 814c6073a47153c07d099fb3579f1b9e [0,1,0,0,0,0|1,0,2]=4 3268 B12R0.234 CCOCCOCCCCC(=O)O 51a3a3dee25f63833a78d48ec8935c36 [0,1,0,0,0,0|2,0,1]=4 3269 B12R0.234 CCOCCOCCCCC(C)C 00e87799a0e225a3a7f3d3a5fbe96512 [0,1,0,0,0,0|2,0,0]=3 3270 B12R0.234 CCOCCOCCCCN(C)C 485cb2bd1f97d412c1a53a83a69ed30f [0,1,0,0,0,0|3,0,0]=4 3271 B12R0.234 CCOCCOCCCOC(C)C 451064c461f619fe08e19d81dab56a36 [0,1,0,0,0,0|3,0,0]=4 3272 B12R0.234 CCOCCOCCCSC(C)C f168066d5e88362e2f546654c79e7e26 [0,1,0,0,0,0|3,0,0]=4 3273 B12R0.234 CCOCCOCCNCC(C)C 6f31db651c60e4a7de66b10925ef2457 [0,1,0,0,0,0|3,0,0]=4 3274 B12R0.234 CCOCCOCCNCC(C)O c72c9c5b372601dc83c7d5af3aa77297 [0,1,0,0,0,0|2,0,0]=3 3275 B12R0.234 CCOCCOCCNC[C@@H](C)O 3ee0e555e4b06081b1853a7a32613c19 [0,1,0,0,0,0|2,0,0]=3 3276 B12R0.234 CCOCCOCCNC[C@H](C)O 19d07208d010157c7a4c7ae33e891c98 [0,1,0,0,0,0|2,0,0]=3 3277 B12R0.234 CCOCCOCCOCC(C)C 7c996f6d8756de02bf624936c3a5ac20 [0,1,0,0,0,0|3,0,0]=4 3278 B12R0.234 CCOCCOCCOCC(C)F abbd7658d86166bad05ec4fc7cc56f47 [0,1,0,0,0,0|3,0,0]=4 3279 B12R0.234 CCOCCOCCOCC(C)S 2c3532055aceb8dd88947895bfa48ed7 [0,1,0,0,0,0|2,1,0]=4 3280 B12R0.234 CCOCCOCCOC[C@@H](C)F cfe2d32bce2e475439eb2375b36941f4 [0,1,0,0,0,0|3,0,0]=4 3281 B12R0.234 CCOCCOCCOC[C@H](C)F f73e4d2e920e2d2ea55d090f92a4aeb8 [0,1,0,0,0,0|3,0,0]=4 3282 B12R0.234 CCOCCOCCSCC(C)C 3b66c9adeca5cfa4546d571ac904634b [0,1,0,0,0,0|3,0,0]=4 3283 B12R0.234 CCOCNCCCCCC(C)C 7ce37e8c0c2cd4051c93436eb2bf98bd [0,1,0,0,0,0|2,0,0]=3 3284 B12R0.234 CCOCNCCCCCN(C)C bf964a52ddb4efad1de59c11b59d81eb [0,1,0,0,0,0|3,0,0]=4 3285 B12R0.234 CCOCNCCCOCC(C)C aba3d66c0519c36a009420d855420b3b [0,1,0,0,0,0|3,0,0]=4 3286 B12R0.234 CCOCOCCCCCC(C)C a33f977766d418f85b50cb8d2d8123e2 [0,1,0,0,0,0|2,0,0]=3 3287 B12R0.234 CCOCOCCCCCN(C)C 8c3254cd666654a4e602eb3704776c8f [0,1,0,0,0,0|3,0,0]=4 3288 B12R0.234 CCOCOCCCOCC(C)C e4e6b5e9b363d6835322db5aa245e880 [0,1,0,0,0,0|3,0,0]=4 3289 B12R0.234 CCOCOCCCSCC(C)C 2a8f25008e3a4965b0ea356c65650cff [0,1,0,0,0,0|3,0,0]=4 3290 B12R0.234 CCSCCCCNCCC(=O)C 15a3d379ff94616ef09ab310b567ab1c [0,1,0,0,0,0|1,0,2]=4 3291 B12R0.234 CCSCCCCNCCC(=O)O 9317d4e277694d924792c143e2cee2b2 [0,1,0,0,0,0|2,0,1]=4 3292 B12R0.234 CCSCCCCNCCC(C)C 7fcbc6c123e326e1116b82b83c838b7d [0,1,0,0,0,0|2,0,0]=3 3293 B12R0.234 CCSCCCCNCCC(C)O 151b06319c8eed79ae4322500baa3cd9 [0,1,0,0,0,0|1,0,0]=2 3294 B12R0.234 CCSCCCCNCCN(C)C 1af6f4041816e0bbc89e9c39320a11d3 [0,1,0,0,0,0|3,0,0]=4 3295 B12R0.234 CCSCCCCNCCS(=O)C 963d91a6304435029ee3e4f622dad9cb [0,1,0,0,0,0|2,0,1]=4 3296 B12R0.234 CCSCCCCNCOC(C)C f17b47db28d34b76271b6d5b5bb90d2b [0,1,0,0,0,0|3,0,0]=4 3297 B12R0.234 CCSCCCNCCCC(C)C e935b3a8947ed4cdd8487e743860e112 [0,1,0,0,0,0|2,0,0]=3 3298 B12R0.234 CCSCCCNCCCN(C)C 3a328aa1e8f6a67ede5b92b92ee9316e [0,1,0,0,0,0|3,0,0]=4 3299 B12R0.234 CCSCCCNCCOC(C)C 0509ae77f67fabba5ff9cefccb6f81a1 [0,1,0,0,0,0|3,0,0]=4 3300 B12R0.234 CCSCCCOCCCC(=O)C 523dec3073a6dc56bb0753c021a3fb61 [0,1,0,0,0,0|1,0,2]=4 3301 B12R0.234 CCSCCCOCCCC(C)C e469def07fba3e8db93e1f893c7dd1c1 [0,1,0,0,0,0|2,0,0]=3 3302 B12R0.234 CCSCCCOCCCN(C)C 600d3211394bd2569eaed21980af0098 [0,1,0,0,0,0|3,0,0]=4 3303 B12R0.234 CCSCCCOCCOC(C)C 6eee6e3ca1dbd9852a78af0ac35fedd8 [0,1,0,0,0,0|3,0,0]=4 3304 B12R0.234 CCSCCCOCCSC(C)C 612b851e10e0347a70f3f970de904551 [0,1,0,0,0,0|3,0,0]=4 3305 B12R0.234 CCSCCNCCCCC(=O)C 4fd65665d0a24b40f25630b428894bb0 [0,1,0,0,0,0|1,0,2]=4 3306 B12R0.234 CCSCCNCCCCC(C)C 03da722665c1fbae4ee3d8ba04e0c3b3 [0,1,0,0,0,0|2,0,0]=3 3307 B12R0.234 CCSCCNCCCCC(C)O 038e96a1992be7f7b21328c3f7c62bee [0,1,0,0,0,0|1,0,0]=2 3308 B12R0.234 CCSCCNCCCCC(F)F 4c8b3fe248c3cd7bdc077fb4a250dce1 [0,1,0,0,0,0|3,0,0]=4 3309 B12R0.234 CCSCCNCCCCN(C)C 5559257f6db5cde0627a9cd37f7332f4 [0,1,0,0,0,0|3,0,0]=4 3310 B12R0.234 CCSCCNCCCC[C@@H](C)O cb6b5caae5f5c5e98ba0b852681e4aaf [0,1,0,0,0,0|1,0,0]=2 3311 B12R0.234 CCSCCNCCCOC(C)C ec346a5ea086de8bdf81e0bfc7cf4013 [0,1,0,0,0,0|3,0,0]=4 3312 B12R0.234 CCSCCNCCCSC(C)C bb290dc9276d237ec5a3adf91765385c [0,1,0,0,0,0|3,0,0]=4 3313 B12R0.234 CCSCCNCCOCC(C)C 3ef6bfabe00060fae455b05a93d7075c [0,1,0,0,0,0|3,0,0]=4 3314 B12R0.234 CCSCCOCCCCC(=O)C 1230254a8fd499acf755f6d9996e6254 [0,1,0,0,0,0|1,0,2]=4 3315 B12R0.234 CCSCCOCCCCC(=O)O 3cf801f8efc32fbba70f9dba41718e24 [0,1,0,0,0,0|2,0,1]=4 3316 B12R0.234 CCSCCOCCCCC(C)C ba3f169c1f91e24cbf5f3df2f159e479 [0,1,0,0,0,0|2,0,0]=3 3317 B12R0.234 CCSCCOCCCCN(C)C aef9fbb0b5ff20b26374eee7e8ff06a2 [0,1,0,0,0,0|3,0,0]=4 3318 B12R0.234 CCSCCOCCCOC(C)C 16653fa1a6f7bb9ece4ed8f9bb54bf2a [0,1,0,0,0,0|3,0,0]=4 3319 B12R0.234 CCSCCOCCCSC(C)C d7cdffbdc7b7faabab92da5d486e7b58 [0,1,0,0,0,0|3,0,0]=4 3320 B12R0.234 CCSCCOCCOCC(C)C e405f61823c2fdd705bb687c0c69381f [0,1,0,0,0,0|3,0,0]=4 3321 B12R0.234 CCSCCOCCSCC(C)C df525c4572fa65f2cd840c363f1b7abe [0,1,0,0,0,0|3,0,0]=4 3322 B12R0.234 CN(C)CCCCCCCNCF 4061f3c6b7172585a2eb4c2e0f105e89 [0,1,0,0,0,0|3,0,0]=4 3323 B12R0.234 CN(C)CCCCCCCNCO d53b551138a18ded6e3e01d17aab1548 [0,1,0,0,0,0|3,0,0]=4 3324 B12R0.234 CN(C)CCCCCCNCCF d49562dd3de6e060f5cea71238647581 [0,1,0,0,0,0|3,0,0]=4 3325 B12R0.234 CN(C)CCCCCCNCCO a9e8ff1d0eaf73b1f0e2e98694ef23e1 [0,1,0,0,0,0|3,0,0]=4 3326 B12R0.234 CN(C)CCCCCCNCCS 3027da884444b192e7fe390e87f6acc7 [0,1,0,0,0,0|3,0,0]=4 3327 B12R0.234 CN(C)CCCCCCOCCF c7711827b26555fcc95b03963e4e1014 [0,1,0,0,0,0|3,0,0]=4 3328 B12R0.234 CN(C)CCCCCCOCCS 2fb93776d3d74c78655cb816850dcec7 [0,1,0,0,0,0|3,0,0]=4 3329 B12R0.234 CN(C)CCCCCNCCCF 30c771cfd220fb335872df797e685f0c [0,1,0,0,0,0|3,0,0]=4 3330 B12R0.234 CN(C)CCCCCNCCCO 1aa69135a572f69e4e514677800f4ac0 [0,1,0,0,0,0|3,0,0]=4 3331 B12R0.234 CN(C)CCCCCNCCCS 4f487108d0baff29a2483f73fe5881ce [0,1,0,0,0,0|3,0,0]=4 3332 B12R0.234 CN(C)CCCCCOCCCF a3bf8e37cc2ec1da7959197430a0ccc6 [0,1,0,0,0,0|3,0,0]=4 3333 B12R0.234 CN(C)CCCCCOCCCS 2a23905dc002eb07818d40551ec7aab2 [0,1,0,0,0,0|3,0,0]=4 3334 B12R0.234 CN(C)CCCCNCCCCCl 81e20a60235013d79b9189fa931a737f [0,1,0,0,0,0|3,0,0]=4 3335 B12R0.234 CN(C)CCCCNCCCCF 554fb4f3de5421f48ab462503fcc1672 [0,1,0,0,0,0|3,0,0]=4 3336 B12R0.234 CN(C)CCCCNCCCCO 611d1b70bb68b1c0e22998eec3adbc43 [0,1,0,0,0,0|3,0,0]=4 3337 B12R0.234 CN(C)CCCCNCCCCS 159611eae6ccc7d0b7693266674836de [0,1,0,0,0,0|3,0,0]=4 3338 B12R0.234 CN(C)CCCCOCCCCF 5f4cbcc4ea46249c75b271913a111605 [0,1,0,0,0,0|3,0,0]=4 3339 B12R0.234 CN(C)CCCCOCCCCS b575e66b83233f4f054672f8cebf9379 [0,1,0,0,0,0|3,0,0]=4 3340 B12R0.234 CN(C)CCCNCCCCCCl e3df52a2d38889b0d9eaf8efb14c018e [0,1,0,0,0,0|3,0,0]=4 3341 B12R0.234 CN(C)CCCNCCCCCF b4609114ebc38353e6b04924a4230f6d [0,1,0,0,0,0|3,0,0]=4 3342 B12R0.234 CN(C)CCCNCCCCCO f349833d0d9aa26b8d776f27393fd1b5 [0,1,0,0,0,0|3,0,0]=4 3343 B12R0.234 CN(C)CCCOCCCCCF 940ab2b35f647f8137c197094b4a2948 [0,1,0,0,0,0|3,0,0]=4 3344 B12R0.234 CN(C)CCNCCCCCCCl 11ad4255283fa95e0060dab1a1f5de30 [0,1,0,0,0,0|3,0,0]=4 3345 B12R0.234 CN(C)CCNCCCCCCF 9da36b180f94ffe1207edd3192f8c47c [0,1,0,0,0,0|3,0,0]=4 3346 B12R0.234 CN(C)CCNCCCCCCO 1759e5dd0e4159a7821127dbb000d1c2 [0,1,0,0,0,0|3,0,0]=4 3347 B12R0.234 CN(C)CCOCCCCCCF cd881f0704cbe2ac3089217a04e0ea4d [0,1,0,0,0,0|3,0,0]=4 3348 B12R0.234 CN(C)CCOCCCCCCS f53c2e5e3be15aa3f98d9d11d4b3ccb8 [0,1,0,0,0,0|3,0,0]=4 3349 B12R0.234 CN(C)CNCCCCCCCO 87c2d498f2f217b71ebd5d91b82dd29a [0,1,0,0,0,0|3,0,0]=4 3350 B12R0.234 COCCCCCCNCC(=O)C 6ded7bbf54f621d40a66c00548f4c7a2 [0,1,0,0,0,0|1,0,2]=4 3351 B12R0.234 COCCCCCCNCC(=O)O f095c5fe8da3849c62aafe0120fdfd58 [0,1,0,0,0,0|2,0,1]=4 3352 B12R0.234 COCCCCCCNCC(C)C 64da25ac9f168903432287504a051ea3 [0,1,0,0,0,0|2,0,0]=3 3353 B12R0.234 COCCCCCCNCC(C)O 0c1a80b9848aa56fc3325b6661784652 [0,1,0,0,0,0|1,0,0]=2 3354 B12R0.234 COCCCCCCNCC(F)F dca33175a7e4eeab238a0f3b067aa7da [0,1,0,0,0,0|3,0,0]=4 3355 B12R0.234 COCCCCCCNC[C@@H](C)O 6ba8f4aab3a0a78787980b2ea9adf34e [0,1,0,0,0,0|1,0,0]=2 3356 B12R0.234 COCCCCCCNC[C@H](C)O b2a5bf398db2108a245b0be16a2afe1c [0,1,0,0,0,0|1,0,0]=2 3357 B12R0.234 COCCCCCCOCC(=O)C 11fdd94d002c4b05b7c865252b9a38b5 [0,1,0,0,0,0|1,0,2]=4 3358 B12R0.234 COCCCCCCOCC(=O)O 2fe97127b1cbad083f930a39d2eda2c6 [0,1,0,0,0,0|2,0,1]=4 3359 B12R0.234 COCCCCCCOCC(C)C 4c14385c9f1bb40f7df13106549abaf1 [0,1,0,0,0,0|2,0,0]=3 3360 B12R0.234 COCCCCCCOCC(C)F e53d780cd8100c8bdd2a91cf8ddeec29 [0,1,0,0,0,0|2,0,0]=3 3361 B12R0.234 COCCCCCCOCC(C)S 50ee3308dffea4da33af852fbc573028 [0,1,0,0,0,0|1,1,0]=3 3362 B12R0.234 COCCCCCCOCC(F)F dbf1614a88daecaee7f6d1f65efc8bc7 [0,1,0,0,0,0|3,0,0]=4 3363 B12R0.234 COCCCCCCOCN(C)C 987237e9082e466df59e2b836067a55e [0,1,0,0,0,0|3,0,0]=4 3364 B12R0.234 COCCCCCCOCS(=O)O aa255402e2de1ea43fee34ac98d4c95f [0,1,0,0,0,0|3,0,0]=4 3365 B12R0.234 COCCCCCCOC[C@@H](C)F cddb79e1d70656a31fd5889bea2ac38f [0,1,0,0,0,0|2,0,0]=3 3366 B12R0.234 COCCCCCCOC[C@H](C)F aa579eedda0d6eb4397ce51d7bff6cf1 [0,1,0,0,0,0|2,0,0]=3 3367 B12R0.234 COCCCCCNCCC(=O)C 7063402c1bde25b1794b36400454b2bf [0,1,0,0,0,0|1,0,2]=4 3368 B12R0.234 COCCCCCNCCC(=O)O 985fd6bd11dac98725eae11b9960863d [0,1,0,0,0,0|2,0,1]=4 3369 B12R0.234 COCCCCCNCCC(C)C c3a2901816a302e3decce749dd14b576 [0,1,0,0,0,0|2,0,0]=3 3370 B12R0.234 COCCCCCNCCC(C)O 26fefd78dc832e19e0142a808011a235 [0,1,0,0,0,0|1,0,0]=2 3371 B12R0.234 COCCCCCNCCC(F)F fa100880b160c6fd12935441970c3b29 [0,1,0,0,0,0|3,0,0]=4 3372 B12R0.234 COCCCCCNCCN(C)C c56051839873c63e4692d640d644ff71 [0,1,0,0,0,0|3,0,0]=4 3373 B12R0.234 COCCCCCNCCS(=O)C 3bcf37628e97bb55e716fcb5ab1ea307 [0,1,0,0,0,0|2,0,1]=4 3374 B12R0.234 COCCCCCNCCS(=O)O b6c050c48c0c99411e2f1135707a4fa7 [0,1,0,0,0,0|3,0,0]=4 3375 B12R0.234 COCCCCCNCC[C@@H](C)O a2e3c33ea81775027ac1783193e12dfe [0,1,0,0,0,0|1,0,0]=2 3376 B12R0.234 COCCCCCNCC[C@H](C)O 9f381f1c3f2ef207569f2d9fc26427a2 [0,1,0,0,0,0|1,0,0]=2 3377 B12R0.234 COCCCCCNCOC(C)C 26abee73f9716c73db7e460917d0c861 [0,1,0,0,0,0|3,0,0]=4 3378 B12R0.234 COCCCCCOCCC(=O)C 322fa71d59b27a2851173c7aeec6f538 [0,1,0,0,0,0|1,0,2]=4 3379 B12R0.234 COCCCCCOCCC(=O)O 56a45960ca3c0a931001cc460ab3f33d [0,1,0,0,0,0|2,0,1]=4 3380 B12R0.234 COCCCCCOCCC(C)C ea93c9f60dccf978d5547f51f6443280 [0,1,0,0,0,0|2,0,0]=3 3381 B12R0.234 COCCCCCOCCC(F)F ffa7198c2cb1a2b6fca2c58a0df218a8 [0,1,0,0,0,0|3,0,0]=4 3382 B12R0.234 COCCCCCOCCN(C)C 3d20d7e3756287dcbe2ce9cb45f6e4b8 [0,1,0,0,0,0|3,0,0]=4 3383 B12R0.234 COCCCCCOCCS(=O)C bea56c47307f45deaa1c64ec89834f5e [0,1,0,0,0,0|2,0,1]=4 3384 B12R0.234 COCCCCNCCCC(=O)C 05aea91648bfee314e1171d6357f8acb [0,1,0,0,0,0|1,0,2]=4 3385 B12R0.234 COCCCCNCCCC(=O)O 378ba6af10e84cb9188153cdab752d3b [0,1,0,0,0,0|2,0,1]=4 3386 B12R0.234 COCCCCNCCCC(C)C 582cacdc71dfd9158f566a75c1364e41 [0,1,0,0,0,0|2,0,0]=3 3387 B12R0.234 COCCCCNCCCC(C)O 56cb5a5d8dfeebb49d50d69b20a7b806 [0,1,0,0,0,0|1,0,0]=2 3388 B12R0.234 COCCCCNCCCN(C)C af27c412b9dc253a59fcbe50d09b80bd [0,1,0,0,0,0|3,0,0]=4 3389 B12R0.234 COCCCCNCCCS(=O)C ec0f38dd74b614dc3cbefc58b03266d4 [0,1,0,0,0,0|2,0,1]=4 3390 B12R0.234 COCCCCNCCOC(C)C 40add21f1e33abcabbfb56dbfb2edf1d [0,1,0,0,0,0|3,0,0]=4 3391 B12R0.234 COCCCCNCCSC(C)C ec94b99aeb23407a352f7a2a9a70f4da [0,1,0,0,0,0|3,0,0]=4 3392 B12R0.234 COCCCCOCCCC(=O)C 3cc17af82bef3c03d92cabe2c75cddbc [0,1,0,0,0,0|1,0,2]=4 3393 B12R0.234 COCCCCOCCCC(=O)O c5710b39c8f427a5001f16543170e263 [0,1,0,0,0,0|2,0,1]=4 3394 B12R0.234 COCCCCOCCCC(C)C 1df46b9e9f786d2fe7e2dd72d46fe7f9 [0,1,0,0,0,0|2,0,0]=3 3395 B12R0.234 COCCCCOCCCN(C)C d2a2564c4c4efc723d3dde441282f567 [0,1,0,0,0,0|3,0,0]=4 3396 B12R0.234 COCCCCOCCOC(C)C 691603afa31d210a5b445cab8f875d5a [0,1,0,0,0,0|3,0,0]=4 3397 B12R0.234 COCCCCOCCSC(C)C 17a80b145223331503fa76e242ead0cd [0,1,0,0,0,0|3,0,0]=4 3398 B12R0.234 COCCCNCCCCC(=O)C 9ece99806b2ec0f2b81b07a4d000cbdf [0,1,0,0,0,0|1,0,2]=4 3399 B12R0.234 COCCCNCCCCC(=O)O 1f3d244bfac21b8f13497cb7e6ed0fc0 [0,1,0,0,0,0|2,0,1]=4 3400 B12R0.234 COCCCNCCCCC(C)C 15fee2bbceb2e69b29fda83ff4f2489e [0,1,0,0,0,0|2,0,0]=3 3401 B12R0.234 COCCCNCCCCC(C)O 28af90339005213373aa640c6928e846 [0,1,0,0,0,0|1,0,0]=2 3402 B12R0.234 COCCCNCCCCC(F)F 71e0bab562033d64ed723e1786ea4672 [0,1,0,0,0,0|3,0,0]=4 3403 B12R0.234 COCCCNCCCCN(C)C 6edaf242cef361f1771b51a74b81424c [0,1,0,0,0,0|3,0,0]=4 3404 B12R0.234 COCCCNCCCC[C@@H](C)O 6e69f51b4cb8117e4c3b693f1cf67c80 [0,1,0,0,0,0|1,0,0]=2 3405 B12R0.234 COCCCNCCCOC(C)C 09d1a08ad849da1fefe1acd195b0354b [0,1,0,0,0,0|3,0,0]=4 3406 B12R0.234 COCCCNCCCSC(C)C 403c33ad5c3b5000f29afa270f6f6258 [0,1,0,0,0,0|3,0,0]=4 3407 B12R0.234 COCCCNCCOCC(C)C 075e0bf7e1c248b52779d191ef4051bc [0,1,0,0,0,0|3,0,0]=4 3408 B12R0.234 COCCCOCCCCC(=O)C 7ee5a36ff296efe4cbbd7037612369d4 [0,1,0,0,0,0|1,0,2]=4 3409 B12R0.234 COCCCOCCCCC(=O)O 95cee556a34fac1cb2656b23abcf66a3 [0,1,0,0,0,0|2,0,1]=4 3410 B12R0.234 COCCCOCCCCC(C)C 25f199a63197dd462e5c7e88aee0853c [0,1,0,0,0,0|2,0,0]=3 3411 B12R0.234 COCCCOCCCCN(C)C e139ee6eb6187a46ee96cf8939189cc6 [0,1,0,0,0,0|3,0,0]=4 3412 B12R0.234 COCCCOCCCOC(C)C e05b934e7c4dd8d73484db02139f4919 [0,1,0,0,0,0|3,0,0]=4 3413 B12R0.234 COCCCOCCCSC(C)C 392f66180c3b418b706848d919959f55 [0,1,0,0,0,0|3,0,0]=4 3414 B12R0.234 COCCCOCCOCC(C)C 0367b54a0919ae8d3eee03f2bf522b35 [0,1,0,0,0,0|3,0,0]=4 3415 B12R0.234 COCCCOCCSCC(C)C 465ac8ae08743e6a0314d212c8c49902 [0,1,0,0,0,0|3,0,0]=4 3416 B12R0.234 COCCNCCCCCC(=O)C 394d9d9fffd5424ec4a3cf3c23f2e1ee [0,1,0,0,0,0|1,0,2]=4 3417 B12R0.234 COCCNCCCCCC(=O)O e2d32117eebdcad6203c3cc115db91b7 [0,1,0,0,0,0|2,0,1]=4 3418 B12R0.234 COCCNCCCCCC(C)C e18b49c2d53ad3b2910659ee1cc551d5 [0,1,0,0,0,0|2,0,0]=3 3419 B12R0.234 COCCNCCCCCC(F)F c13370be605370e77f2ad6706263ce47 [0,1,0,0,0,0|3,0,0]=4 3420 B12R0.234 COCCNCCCCCN(C)C 7bd80c8262bdab72cb1c5e741965c356 [0,1,0,0,0,0|3,0,0]=4 3421 B12R0.234 COCCNCCCOCC(C)C 5f8dbe82a0c91c9d335b8b81c4a6361d [0,1,0,0,0,0|3,0,0]=4 3422 B12R0.234 COCCOCCCCCC(=O)C 32749417def69712a6da5222f141f8fa [0,1,0,0,0,0|1,0,2]=4 3423 B12R0.234 COCCOCCCCCC(=O)O 3f1f0ee6b55aa392ed0cad8e2ca529ea [0,1,0,0,0,0|2,0,1]=4 3424 B12R0.234 COCCOCCCCCC(C)C 946a6cfa6ec3235da71ff7bff24a115a [0,1,0,0,0,0|2,0,0]=3 3425 B12R0.234 COCCOCCCCCC(F)F afa7beb7d2f80c6f1af832f20cf99817 [0,1,0,0,0,0|3,0,0]=4 3426 B12R0.234 COCCOCCCCCN(C)C 03fa9cbd9cb07f066775a9c8f62dcc65 [0,1,0,0,0,0|3,0,0]=4 3427 B12R0.234 COCCOCCCCNC(C)C f3fe090e05189bac1adc9ef0631ec3ce [0,1,0,0,0,0|3,0,0]=4 3428 B12R0.234 COCCOCCCNCC(C)C bb803a5f2325aea3240715bbfe4e144f [0,1,0,0,0,0|3,0,0]=4 3429 B12R0.234 COCCOCCCNCC(C)O 51f3134115bcc2522cad6a7db508e4ab [0,1,0,0,0,0|2,0,0]=3 3430 B12R0.234 COCCOCCCNC[C@@H](C)O e53b12ac698118825a1daa60352d61bb [0,1,0,0,0,0|2,0,0]=3 3431 B12R0.234 COCCOCCCNC[C@H](C)O f17f2b7cf598fccc86afb0231516cab1 [0,1,0,0,0,0|2,0,0]=3 3432 B12R0.234 COCCOCCCOCC(C)C 3d948d770061eb0715ee126fedd8ee6d [0,1,0,0,0,0|3,0,0]=4 3433 B12R0.234 COCCOCCCOCC(C)F e61c9230f37cef5bfe898a98776e162e [0,1,0,0,0,0|3,0,0]=4 3434 B12R0.234 COCCOCCCOCC(C)S e391a10dc7d802db35ca688143e71cce [0,1,0,0,0,0|2,1,0]=4 3435 B12R0.234 COCCOCCCOC[C@@H](C)F 650f02ef715582b588eef48f03b9e718 [0,1,0,0,0,0|3,0,0]=4 3436 B12R0.234 COCCOCCCOC[C@H](C)F 5ac56c9f4cce677cdca1f1e8e0e0d97b [0,1,0,0,0,0|3,0,0]=4 3437 B12R0.234 COCCOCCCSCC(C)C c09ce985396118021f9a0d52a059ccb5 [0,1,0,0,0,0|3,0,0]=4 3438 B12R0.234 COCCOCCNCCC(C)C d3550b71053d1e806c15bbcc0a700ce3 [0,1,0,0,0,0|3,0,0]=4 3439 B12R0.234 COCCOCCNCCC(C)O 26a4658d02e96179edd78112883512ad [0,1,0,0,0,0|2,0,0]=3 3440 B12R0.234 COCCOCCNCC[C@@H](C)O ed9c2b78887e59bbcb2b3385df60cb68 [0,1,0,0,0,0|2,0,0]=3 3441 B12R0.234 COCCOCCNCC[C@H](C)O 9eb3718e6559119cd17ba2038cc5bf31 [0,1,0,0,0,0|2,0,0]=3 3442 B12R0.234 COCCOCCOCCC(C)C c74f117ae04649da64593f6888bdbcdc [0,1,0,0,0,0|3,0,0]=4 3443 B12R0.234 COCCOCNCCCC(C)C 91246852659426921d127835db30dab4 [0,1,0,0,0,0|3,0,0]=4 3444 B12R0.234 COCCOCOCCCC(C)C e22b64faafc84873c6bc604ed752e9aa [0,1,0,0,0,0|3,0,0]=4 3445 B12R0.234 COCNCCCCCCC(=O)O 940c74a48790455e40d1d357dde5f13b [0,1,0,0,0,0|2,0,1]=4 3446 B12R0.234 COCNCCCCCCC(C)C 70ac888989bd6423bd290b30c7b69f12 [0,1,0,0,0,0|2,0,0]=3 3447 B12R0.234 COCNCCCCCCN(C)C 7db1612fea3ff3742a98c51dd2a397de [0,1,0,0,0,0|3,0,0]=4 3448 B12R0.234 COCNCCCCSCC(C)C a4b8915fa9e979768b4b9ce8bfeb1535 [0,1,0,0,0,0|3,0,0]=4 3449 B12R0.234 COCOCCCCCCC(=O)O 1bce7e9006649e9f53b5afd3384b03d6 [0,1,0,0,0,0|2,0,1]=4 3450 B12R0.234 COCOCCCCCCC(C)C 7fe565ba7b201a3793b1b706a98c750f [0,1,0,0,0,0|2,0,0]=3 3451 B12R0.234 COCOCCCCCCN(C)C 1d37d62b1172900e1f7051ec735c814b [0,1,0,0,0,0|3,0,0]=4 3452 B12R0.234 COCOCCNCCCC(C)C 699b4f173e3165c62f63dc0e058bf8e9 [0,1,0,0,0,0|3,0,0]=4 3453 B12R0.234 COCOCCOCCCC(C)C b7de57ba25b9cbefa1c54990ae7b4bf2 [0,1,0,0,0,0|3,0,0]=4 3454 B12R0.234 CS(=O)CCCNCCCCCF 62670d865225512746b2e9e34752964a [0,1,0,0,0,0|2,0,1]=4 3455 B12R0.234 CS(=O)CCCNCCCCCO 05067c14475cfa637f732e40315501e3 [0,1,0,0,0,0|2,0,1]=4 3456 B12R0.234 CS(=O)CCNCCCCCCCl 6cac637bc05286fb9dccefb31b4b8fb1 [0,1,0,0,0,0|2,0,1]=4 3457 B12R0.234 CS(=O)CCNCCCCCCF 9254bdf21d8f402b03ddcb5bfc38bc6b [0,1,0,0,0,0|2,0,1]=4 3458 B12R0.234 CS(=O)CCNCCCCCCO 7896257acbdd9a4486e330b90c142f26 [0,1,0,0,0,0|2,0,1]=4 3459 B12R0.234 CS(=O)CCOCCCCCCF b351a8166a9bbffe978c7a38282c22fd [0,1,0,0,0,0|2,0,1]=4 3460 B12R0.234 CS(=O)CCOCCCCCCS 455e2c5549a7401f8679b42d354e807f [0,1,0,0,0,0|2,0,1]=4 3461 B12R0.234 CSCCCCNCCCC(=O)C 4421f7344d273170f7c936adbb182c64 [0,1,0,0,0,0|1,0,2]=4 3462 B12R0.234 CSCCCCNCCCC(C)C 27b3013b18dabfff3d05a81f87297cf9 [0,1,0,0,0,0|2,0,0]=3 3463 B12R0.234 CSCCCCNCCCC(C)O 981e5c4cc63c709e55aa7e901247d3f8 [0,1,0,0,0,0|1,0,0]=2 3464 B12R0.234 CSCCCCNCCCN(C)C 5bca9fa1d726869fef040e7b805d5592 [0,1,0,0,0,0|3,0,0]=4 3465 B12R0.234 CSCCCCNCCOC(C)C 659e2ad9724254caed7b929747c12ec6 [0,1,0,0,0,0|3,0,0]=4 3466 B12R0.234 CSCCCCNCCSC(C)C d4b7b4410071cae3d92f743ce3f2398b [0,1,0,0,0,0|3,0,0]=4 3467 B12R0.234 CSCCCCOCCCC(=O)C 99faf0434cdcdcf43f718d5e1bbd20fa [0,1,0,0,0,0|1,0,2]=4 3468 B12R0.234 CSCCCCOCCCC(C)C 271f4b641cbb889f94eef45d24439f09 [0,1,0,0,0,0|2,0,0]=3 3469 B12R0.234 CSCCCCOCCCN(C)C 2c9b6838129e164a6416c048d4c98400 [0,1,0,0,0,0|3,0,0]=4 3470 B12R0.234 CSCCCCOCCOC(C)C d59406471bf9381d6003f01e412bacdd [0,1,0,0,0,0|3,0,0]=4 3471 B12R0.234 CSCCCCOCCSC(C)C 6fd5ed19e3650d82f55b798d20c92459 [0,1,0,0,0,0|3,0,0]=4 3472 B12R0.234 CSCCCNCCCCC(=O)C 76dfda0f9870f68d15e589e55852ead0 [0,1,0,0,0,0|1,0,2]=4 3473 B12R0.234 CSCCCNCCCCC(=O)O dbe5f75bfe79e3c785f597e54058c9d4 [0,1,0,0,0,0|2,0,1]=4 3474 B12R0.234 CSCCCNCCCCC(C)C 20a7a28636b92951ec02b648933891a1 [0,1,0,0,0,0|2,0,0]=3 3475 B12R0.234 CSCCCNCCCCC(C)O f5a0cfefd9c3db7070c188b938d3a99e [0,1,0,0,0,0|1,0,0]=2 3476 B12R0.234 CSCCCNCCCCC(F)F 61d946a1efdbbff99b83d556de9ff5ca [0,1,0,0,0,0|3,0,0]=4 3477 B12R0.234 CSCCCNCCCCN(C)C aec6957e4fca332c9754213d7877a512 [0,1,0,0,0,0|3,0,0]=4 3478 B12R0.234 CSCCCNCCCC[C@@H](C)O 79f88c36702e18555f964cd87e682f32 [0,1,0,0,0,0|1,0,0]=2 3479 B12R0.234 CSCCCNCCCOC(C)C 58d3e6f8570039a7dd8a30b6f9f19cf7 [0,1,0,0,0,0|3,0,0]=4 3480 B12R0.234 CSCCCNCCCSC(C)C 8fb239ec10e4761907f20af7d3c3ac4e [0,1,0,0,0,0|3,0,0]=4 3481 B12R0.234 CSCCCNCCOCC(C)C 661325c8cce2b773426586ce9eb7ad0e [0,1,0,0,0,0|3,0,0]=4 3482 B12R0.234 CSCCCOCCCCC(=O)C e7ae99ca5fe49c94eafc004fc9c72084 [0,1,0,0,0,0|1,0,2]=4 3483 B12R0.234 CSCCCOCCCCC(=O)O dbf4ce6c0157a9a9073249229d221019 [0,1,0,0,0,0|2,0,1]=4 3484 B12R0.234 CSCCCOCCCCC(C)C 826a64c9e3488c99f795444734c57b4c [0,1,0,0,0,0|2,0,0]=3 3485 B12R0.234 CSCCCOCCCCN(C)C 147e71ad6d627a512c3314d7bb5cf6dd [0,1,0,0,0,0|3,0,0]=4 3486 B12R0.234 CSCCCOCCCOC(C)C 03e7c6e3ce8bce3220c9103761979048 [0,1,0,0,0,0|3,0,0]=4 3487 B12R0.234 CSCCCOCCCSC(C)C b27d70555176424b1c0653584c5e7ef1 [0,1,0,0,0,0|3,0,0]=4 3488 B12R0.234 CSCCCOCCOCC(C)C f4f4fadb51f8f4ca37e5d509f7d7452d [0,1,0,0,0,0|3,0,0]=4 3489 B12R0.234 CSCCCOCCSCC(C)C 7cc987456cf1744cf7d11556c7a1fb89 [0,1,0,0,0,0|3,0,0]=4 3490 B12R0.234 CSCCNCCCCCC(=O)C d8ede31baf91277de234319ef8354cdc [0,1,0,0,0,0|1,0,2]=4 3491 B12R0.234 CSCCNCCCCCC(=O)O 69b6bd0eee9dd730a8cd4eb1fd1d5d03 [0,1,0,0,0,0|2,0,1]=4 3492 B12R0.234 CSCCNCCCCCC(C)C 612b08e3a25110974d42d9d811a857f9 [0,1,0,0,0,0|2,0,0]=3 3493 B12R0.234 CSCCNCCCCCC(F)F bba530196cbe1a7795439c26fa05f172 [0,1,0,0,0,0|3,0,0]=4 3494 B12R0.234 CSCCNCCCCCN(C)C 0d63ef2413cbb3102e45927d5a46ade1 [0,1,0,0,0,0|3,0,0]=4 3495 B12R0.234 CSCCNCCCOCC(C)C e8f904feab0ca017fa92ceb9e8864712 [0,1,0,0,0,0|3,0,0]=4 3496 B12R0.234 CSCCOCCCCCC(=O)C a22b7fc34ffa94aee0a15a32700925f8 [0,1,0,0,0,0|1,0,2]=4 3497 B12R0.234 CSCCOCCCCCC(=O)O cb0796621d9ab3a0b6d44c704a69dd0c [0,1,0,0,0,0|2,0,1]=4 3498 B12R0.234 CSCCOCCCCCC(C)C ae472848186a470ec25319d4ec71aa7e [0,1,0,0,0,0|2,0,0]=3 3499 B12R0.234 CSCCOCCCCCC(F)F 71065706210074525c0878dfd7ab2e4e [0,1,0,0,0,0|3,0,0]=4 3500 B12R0.234 CSCCOCCCCCN(C)C 3d78e441da10112bf6634c294f773ea5 [0,1,0,0,0,0|3,0,0]=4 3501 B12R0.234 CSCCOCCCNCC(C)C ae6cd358c127f565a9c3b0cc5ad9b3ff [0,1,0,0,0,0|3,0,0]=4 3502 B12R0.234 CSCCOCCCNCC(C)O 17916af03b3bd020b55c7775f83c0994 [0,1,0,0,0,0|2,0,0]=3 3503 B12R0.234 CSCCOCCCNC[C@@H](C)O 07288da5e2792c0f4ace2d3bf0a16320 [0,1,0,0,0,0|2,0,0]=3 3504 B12R0.234 CSCCOCCCNC[C@H](C)O 30e79bc7e632407e7298b12c3355544a [0,1,0,0,0,0|2,0,0]=3 3505 B12R0.234 CSCCOCCCOCC(C)C 03b14d9c0195dfd1b80448171d8b0053 [0,1,0,0,0,0|3,0,0]=4 3506 B12R0.234 CSCCOCCCSCC(C)C 005bc05b272ef52d902d5c99bcfcc59f [0,1,0,0,0,0|3,0,0]=4 3507 B12R0.234 CSCNCCCCCCC(=O)O a1bc486db70065927d5b7f5b2ec9ff0e [0,1,0,0,0,0|2,0,1]=4 3508 B12R0.234 CSCNCCCCCCC(C)C 9c655c9c16f28bbf5871c5aef6a12ccb [0,1,0,0,0,0|2,0,0]=3 3509 B12R0.234 CSCNCCCCCCN(C)C f59573225fb3dfee0de71318a28c4b18 [0,1,0,0,0,0|3,0,0]=4 3510 B12R0.234 CSCNCCCCSCC(C)C 59e1f552e11da18b1873e370a4664c74 [0,1,0,0,0,0|3,0,0]=4 3511 B12R0.234 CSCOCCCCCCC(=O)O bb0fda614d47546d414cab13ce429503 [0,1,0,0,0,0|2,0,1]=4 3512 B12R0.234 CSCOCCCCCCC(C)C 72938bb0223f22577a71ca88215a267d [0,1,0,0,0,0|2,0,0]=3 3513 B12R0.234 CSCOCCCCCCN(C)C 6b60716174a9c88484610e2d58a04b2a [0,1,0,0,0,0|3,0,0]=4 3514 B12R0.234 C[C@@H](F)COCCCCCCC#N c96a7a3bca8fec331ee8f3bf93e275f8 [0,1,0,0,0,0|2,0,1]=4 3515 B12R0.234 C[C@@H](F)COCCCCCCC=O ba55aa62a8342f41fb3499efe96b5d35 [0,1,0,0,0,0|2,0,1]=4 3516 B12R0.234 C[C@@H](O)CCCCNCC#CCO 21ebb02066f3b49535ec26b1fd95ed3f [0,1,0,0,0,0|1,0,2]=4 3517 B12R0.234 C[C@@H](O)CCCCNCCCC#N 3e9773d8c0d572410ad71ff8afed8c9e [0,1,0,0,0,0|1,0,1]=3 3518 B12R0.234 C[C@@H](O)CCCCNCCCCCl e0842e2c4fa408f677d8e9aefff39610 [0,1,0,0,0,0|1,0,0]=2 3519 B12R0.234 C[C@@H](O)CCCCNCCCCO 0af8eeb1fd9cb4ed58954161a5cfcaab [0,1,0,0,0,0|1,0,0]=2 3520 B12R0.234 C[C@@H](O)CCCCNCCCCS ca53e1222040892d4b79a84b6dbdddee [0,1,0,0,0,0|1,0,0]=2 3521 B12R0.234 C[C@@H](O)CCNCCCCCC#N 43ab1d9fe74d1591cec52c977aa43e51 [0,1,0,0,0,0|1,0,1]=3 3522 B12R0.234 C[C@@H](O)CCNCCCCCC=O 80b5bcdae8ad50d9a3309d3bd7f27e41 [0,1,0,0,0,0|1,0,1]=3 3523 B12R0.234 C[C@@H](O)CCNCCCCCCF 21e699110714e61c99aad765b8666b5e [0,1,0,0,0,0|1,0,0]=2 3524 B12R0.234 C[C@@H](O)CCNCCCCCCO d463f1e255d30a705e844db06f4ce8d6 [0,1,0,0,0,0|1,0,0]=2 3525 B12R0.234 C[C@@H](O)CNCCCCCCC#N 898ff873e23e45407f9d310ea68432b6 [0,1,0,0,0,0|1,0,1]=3 3526 B12R0.234 C[C@@H](O)CNCCCCCCC=O 497c1867da55792079c8798350b7c357 [0,1,0,0,0,0|1,0,1]=3 3527 B12R0.234 C[C@@H](O)CNCCCCCCCO 173d9076ee1e4bceb0380557ae473def [0,1,0,0,0,0|1,0,0]=2 3528 B12R0.234 C[C@@H](O)CNCCCCSCCO 66325b38da731eca01893b178c98b382 [0,1,0,0,0,0|2,0,0]=3 3529 B12R0.234 C[C@@H](O)CNCCCOCCCO d2c19bdf8d3318d4726f5da9626b745d [0,1,0,0,0,0|2,0,0]=3 3530 B12R0.234 C[C@H](F)COCCCCCCC#N 64f0357974dc59ecfb6ddc283f44a049 [0,1,0,0,0,0|2,0,1]=4 3531 B12R0.234 C[C@H](F)COCCCCCCC=O 2c349480f75667298225aeb7464e1655 [0,1,0,0,0,0|2,0,1]=4 3532 B12R0.234 C[C@H](O)CCNCCCCCC#N bf5de550c20078f30c4aed5422fe898e [0,1,0,0,0,0|1,0,1]=3 3533 B12R0.234 C[C@H](O)CCNCCCCCC=O 4ce78f98a86ca4ab8ab2c490eb048d06 [0,1,0,0,0,0|1,0,1]=3 3534 B12R0.234 C[C@H](O)CCNCCCCCCF 7999a2f15352f730449c61045aa7f7e9 [0,1,0,0,0,0|1,0,0]=2 3535 B12R0.234 C[C@H](O)CCNCCCCCCO 9c556961907f2cb1f07cc2a8f1996d47 [0,1,0,0,0,0|1,0,0]=2 3536 B12R0.234 C[C@H](O)CNCCCCCCC#N b4cedc60e6078c057c2331dc23ef46fd [0,1,0,0,0,0|1,0,1]=3 3537 B12R0.234 C[C@H](O)CNCCCCCCC=O aa820cd7ec5c9c4dc85e98584a2ea50b [0,1,0,0,0,0|1,0,1]=3 3538 B12R0.234 C[C@H](O)CNCCCCCCCO 120cc2b1893fc31a2209a0ba4d17df3b [0,1,0,0,0,0|1,0,0]=2 3539 B12R0.234 C[C@H](O)CNCCCCSCCO 9dccf3211adf26a1c940e5fdace3c010 [0,1,0,0,0,0|2,0,0]=3 3540 B12R0.234 C[C@H](O)CNCCCOCCCO 0927863fc4710795896c979f1d2abb89 [0,1,0,0,0,0|2,0,0]=3 3541 B12R0.234 FC(F)CCCCCNCCCCl cca0861cebd87c0f32c7201c3df0e831 [0,1,0,0,0,0|3,0,0]=4 3542 B12R0.234 FC(F)CCCCCOCCCS 36c0aba66a07ee10888c6995f05801f4 [0,1,0,0,0,0|3,0,0]=4 3543 B12R0.234 FCCCCCCNCCC(F)F ea291ba0b199c33033fb9051287a7942 [0,1,0,0,0,0|3,0,0]=4 3544 B12R0.234 FCCCCCCOCCC(F)F 1ef06122142f57cec92c99b45c531bcc [0,1,0,0,0,0|3,0,0]=4 3545 B12R0.234 FCCCCNCCCCC(F)F 3aaf0e8d895875d8191c8ec432f37392 [0,1,0,0,0,0|3,0,0]=4 3546 B12R0.234 FCCCOCCCCCC(F)F 4c2fa595a53767db49c552b8448cf800 [0,1,0,0,0,0|3,0,0]=4 3547 B12R0.234 O=C(O)CCCCCCCNCF e8c21eba517dcbdb46dd886a12d2b83e [0,1,0,0,0,0|2,0,1]=4 3548 B12R0.234 O=C(O)CCCCCCCNCO 46ea4b8de06cdc8c9d33a0b2d6629d4f [0,1,0,0,0,0|2,0,1]=4 3549 B12R0.234 O=C(O)CCCCCCCOCF ceadc63f6c01355132f6689674f44a15 [0,1,0,0,0,0|2,0,1]=4 3550 B12R0.234 O=C(O)CCCCCCNCCF a44b095052b61095ea26d72940a8b2e2 [0,1,0,0,0,0|2,0,1]=4 3551 B12R0.234 O=C(O)CCCCCCNCCI 631aba465ea99af4cd52b2cabda44c9b [0,1,0,0,0,0|2,0,1]=4 3552 B12R0.234 O=C(O)CCCCCCNCCO e466aba34ada8f3b43cbdd78f4896f31 [0,1,0,0,0,0|2,0,1]=4 3553 B12R0.234 O=C(O)CCCCCCNCCS 460dbdbdc9f50847caf64121432cd243 [0,1,0,0,0,0|2,0,1]=4 3554 B12R0.234 O=C(O)CCCCCCOCCF 2b120b4f2aaff31eb8412cde0417e517 [0,1,0,0,0,0|2,0,1]=4 3555 B12R0.234 O=C(O)CCCCCCOCCS d5c3fcd3c1378d1cb41f2ed359404038 [0,1,0,0,0,0|2,0,1]=4 3556 B12R0.234 O=C(O)CCCCCNCCCCl b4a98b97329cfa3569049586282e17d0 [0,1,0,0,0,0|2,0,1]=4 3557 B12R0.234 O=C(O)CCCCCNCCCF 62a3ea6ff866acfa606218eab30279e1 [0,1,0,0,0,0|2,0,1]=4 3558 B12R0.234 O=C(O)CCCCCNCCCO 58a008497637fdf5b165dff5462a42c7 [0,1,0,0,0,0|2,0,1]=4 3559 B12R0.234 O=C(O)CCCCCNCCCS 3baa75d4fff40713bc096a6b36b29c5b [0,1,0,0,0,0|2,0,1]=4 3560 B12R0.234 O=C(O)CCCCCOCCCF dd2c291f12cbaed1beb5335f96bae866 [0,1,0,0,0,0|2,0,1]=4 3561 B12R0.234 O=C(O)CCCCCOCCCS 52318a2ee5f9f1576a38f1ea4d3aa604 [0,1,0,0,0,0|2,0,1]=4 3562 B12R0.234 O=C(O)CCCCNCCCCCl 0498a09ce5ca0e68dfa361371c0f7bf1 [0,1,0,0,0,0|2,0,1]=4 3563 B12R0.234 O=C(O)CCCCNCCCCF 0d479c406e4272a3b82bfcb5c540d672 [0,1,0,0,0,0|2,0,1]=4 3564 B12R0.234 O=C(O)CCCCNCCCCO 216cfec721e3042e8feb6254e3d4fa16 [0,1,0,0,0,0|2,0,1]=4 3565 B12R0.234 O=C(O)CCCCOCCCCF 1c7b4d17a80c87a331aed20c1f230907 [0,1,0,0,0,0|2,0,1]=4 3566 B12R0.234 O=C(O)CCCCOCCCCS 609d646c0f91479749b9233bcb1c490f [0,1,0,0,0,0|2,0,1]=4 3567 B12R0.234 O=C(O)CCCNCCCCCF b390e59ab52c19d76643ab5a496f8be5 [0,1,0,0,0,0|2,0,1]=4 3568 B12R0.234 O=C(O)CCCNCCCCCO ccd55d445a08a269a77912662ad20a02 [0,1,0,0,0,0|2,0,1]=4 3569 B12R0.234 O=C(O)CCNCCCCCCCl 1779a150c58a35b4b142ef0f99b87c12 [0,1,0,0,0,0|2,0,1]=4 3570 B12R0.234 O=C(O)CCNCCCCCCF 348f51d1fa1d38cd1941d93499ec59a3 [0,1,0,0,0,0|2,0,1]=4 3571 B12R0.234 O=C(O)CCNCCCCCCO adf083ed3329272cc8e274ad5ea099f3 [0,1,0,0,0,0|2,0,1]=4 3572 B12R0.234 O=C(O)CCOCCCCCCF de3389e1a62dd2e7849bbf5f014ce84d [0,1,0,0,0,0|2,0,1]=4 3573 B12R0.234 O=C(O)CCOCCCCCCS d25d14fb70c112fea0d0063058f34281 [0,1,0,0,0,0|2,0,1]=4 3574 B12R0.234 O=C(O)CNCCCCCCCO 833cd711f9fd17550098197e241d36dc [0,1,0,0,0,0|2,0,1]=4 3575 B12R0.234 O=S(O)CCNCCCCCCF 6bfa06a32294560e961c43d0bd55f79d [0,1,0,0,0,0|3,0,0]=4 3576 B12R0.234 O=S(O)CCNCCCCCCO 8c6c125e615e399140c65b078faa1e6d [0,1,0,0,0,0|3,0,0]=4 3577 B12R0.234 OCCCCCCCNCC(F)F 3cc24d055ac39523abb08a2c605e1f26 [0,1,0,0,0,0|3,0,0]=4 3578 B12R0.234 OCCCCCCNCCC(F)F 3faf9c6a1fce9e7e3c5090b3634c5715 [0,1,0,0,0,0|3,0,0]=4 3579 B12R0.234 OCCCCNCCCCC(F)F 0b91a842f72d3e3fcdad1d2cc5aa828b [0,1,0,0,0,0|3,0,0]=4 3580 B12R0.234 OCCCNCCCCCC(F)F fb6ac1c12f6005cb2d0f74d2d6bbb2fc [0,1,0,0,0,0|3,0,0]=4 3581 B12R0.248 C#CC(C)NCCCCCCCC 3c2532f1cc3e254ace81135fccde1989 [0,1,0,0,0,0|2,0,0]=3 3582 B12R0.248 C#CC(C)NCCCCCCCO 46cddbc570ae6382b29254f4e45a2410 [0,1,0,0,0,0|3,0,0]=4 3583 B12R0.248 C#CC(C)NCCCCCCOC 792aca128bd64ec81a4e04fc81e552f8 [0,1,0,0,0,0|3,0,0]=4 3584 B12R0.248 C#CC(C)NCCCCSCCC 84026c6d584f56da231f3c32b6410c1a [0,1,0,0,0,0|3,0,0]=4 3585 B12R0.248 C#CC(C)NCCCOCCCC fc1a900187571596d627827b24b358d6 [0,1,0,0,0,0|3,0,0]=4 3586 B12R0.248 C#CC(C)OCCCCCCCC 40df22ab0b8041013723952e5910b2ba [0,1,0,0,0,0|2,0,0]=3 3587 B12R0.248 C#CC(C)OCCCCCCOC e4abaa660008c28ea5623fc164b095cc [0,1,0,0,0,0|3,0,0]=4 3588 B12R0.248 C#CC(C)OCCCOCCCC d973c0e57c3309c35933de142276e172 [0,1,0,0,0,0|3,0,0]=4 3589 B12R0.248 C#CC(C)OCCOCCCCC 0248e56cf6bb3093818c3466a5ba45b5 [0,1,0,0,0,0|3,0,0]=4 3590 B12R0.248 C#CC(O)CCCCCNCCBr d9c0f55acd546bd706867f1a748b78c0 [0,1,0,0,0,0|2,0,1]=4 3591 B12R0.248 C#CC(O)CCCCCNCCC 0a10a6c898e747bcfbad27a5c288173b [0,1,0,0,0,0|1,0,1]=3 3592 B12R0.248 C#CC(O)CCCCCNCCF 841db9e3b26724d1c9cd1c178fe78a9b [0,1,0,0,0,0|2,0,1]=4 3593 B12R0.248 C#CC(O)CCCCCNCCI e0a3778dc2b1dc51b23be86460a5ae05 [0,1,0,0,0,0|2,0,1]=4 3594 B12R0.248 C#CC(O)CCCCCNCCO bb1779fbe1290da6fff6616ad3aa14d2 [0,1,0,0,0,0|2,0,1]=4 3595 B12R0.248 C#CC(O)CCCCCNCCS a178eb124d3fb09bc1db4b1d7fc9f864 [0,1,0,0,0,0|2,0,1]=4 3596 B12R0.248 C#CCCCCCCNC(C)CO 0cd746ac8d9864089e3fb49a69d90cc3 [0,1,0,0,0,0|1,0,2]=4 3597 B12R0.248 C#CCCCCCCN[C@@H](C)CO 5c4c30d67a648b8a6e8e609751398ff1 [0,1,0,0,0,0|1,0,2]=4 3598 B12R0.248 C#CCCCCCCN[C@H](C)CO d7383806584eeed7a751c0c530ce55e9 [0,1,0,0,0,0|1,0,2]=4 3599 B12R0.248 C#CCCCCCNCC(C)CO 5d3b2c467f6c5562a5e183b18bbb1c49 [0,1,0,0,0,0|1,0,2]=4 3600 B12R0.248 C#CCCCCCNCC(C)OC 69abb9b67cc75e48097919e2c76b7402 [0,1,0,0,0,0|1,0,2]=4 3601 B12R0.248 C#CCCCCCNCC(O)CC 3d41b5d953bc7a200884f7c85cfd07a4 [0,1,0,0,0,0|1,0,2]=4 3602 B12R0.248 C#CCCCCCNCC(O)CF 92c7acb1b1b6aab98acbee3e82cec332 [0,1,0,0,0,0|1,0,2]=4 3603 B12R0.248 C#CCCCCCNCC(O)CO 029cfc879725e69dd415bd79045f8d75 [0,1,0,0,0,0|1,0,2]=4 3604 B12R0.248 C#CCCCCCNC[C@@H](C)CO cff4a65cc90fcededdcc6e5312d7bbba [0,1,0,0,0,0|1,0,2]=4 3605 B12R0.248 C#CCCCCCNC[C@@H](C)OC 7374a11ee374bd06e16ff4946a5a15b2 [0,1,0,0,0,0|1,0,2]=4 3606 B12R0.248 C#CCCCCCNC[C@@H](O)CO aded2755ad0ce697ef3f837c47374444 [0,1,0,0,0,0|1,0,2]=4 3607 B12R0.248 C#CCCCCCNC[C@H](C)CO cee00ba62d1bd02f3973029c55651c0d [0,1,0,0,0,0|1,0,2]=4 3608 B12R0.248 C#CCCCCCNC[C@H](C)OC 0a7d025b8a51beabe620aa534683636c [0,1,0,0,0,0|1,0,2]=4 3609 B12R0.248 C#CCCCCCNC[C@H](O)CC 0a7e9385ff26df8c8367a3adbeb87747 [0,1,0,0,0,0|1,0,2]=4 3610 B12R0.248 C#CCCCCCNC[C@H](O)CO 1801b080d84d8375a47df97943743b45 [0,1,0,0,0,0|1,0,2]=4 3611 B12R0.248 C#CCCCCCOCC(C)OC b049b47c8407a0c6e008e2ec28a886f3 [0,1,0,0,0,0|1,0,2]=4 3612 B12R0.248 C#CCCCCCOCC(O)CO 609ea0222ab2f5535adcb491a2ae85a5 [0,1,0,0,0,0|1,0,2]=4 3613 B12R0.248 C#CCCCCCOC[C@@H](C)OC 2bec016196a6b7b1b39eaaa2a8cdc1a4 [0,1,0,0,0,0|1,0,2]=4 3614 B12R0.248 C#CCCCCCOC[C@@H](O)CO 887c49319c164b6e440fa3e1bd4488dc [0,1,0,0,0,0|1,0,2]=4 3615 B12R0.248 C#CCCCCCOC[C@H](C)OC bf3198d5dfdd7cbbc2615700d7483304 [0,1,0,0,0,0|1,0,2]=4 3616 B12R0.248 C#CCCCCCOC[C@H](O)CO a96da1898d606c0ab87f39bcb50da18f [0,1,0,0,0,0|1,0,2]=4 3617 B12R0.248 C#CCCCCNCCC(C)CO 04241e04e828196ae292652ddc1b06cf [0,1,0,0,0,0|1,0,2]=4 3618 B12R0.248 C#CCCCCNCCC(O)CO 8cf123be487b37555639841b216d07e0 [0,1,0,0,0,0|1,0,2]=4 3619 B12R0.248 C#CCCCCNCC[C@@H](C)CO fba9d7e0452e3d07839fd1aa518fcfaf [0,1,0,0,0,0|1,0,2]=4 3620 B12R0.248 C#CCCCCOCCC(C)OC 0c95ecdc668963b93c17795b4a5bbee4 [0,1,0,0,0,0|1,0,2]=4 3621 B12R0.248 C#CCCCNCCCC(C)CO 743085ff3f9706c22d50f27e85c6fe78 [0,1,0,0,0,0|1,0,2]=4 3622 B12R0.248 C#C[C@@H](C)NCCCCCCCC 2147c1cb054ba397bfe43f3cb05517ff [0,1,0,0,0,0|2,0,0]=3 3623 B12R0.248 C#C[C@@H](C)NCCCCCCCO 93508f8148ff33e08ca152ebabbcfa7a [0,1,0,0,0,0|3,0,0]=4 3624 B12R0.248 C#C[C@@H](C)NCCCCCCOC f3d9c50e710f759e095eb3d3f451014f [0,1,0,0,0,0|3,0,0]=4 3625 B12R0.248 C#C[C@@H](C)OCCCCCCCC 39dc8c5d07735af2ed36ada3276c5f86 [0,1,0,0,0,0|2,0,0]=3 3626 B12R0.248 C#C[C@@H](C)OCCCCCCOC cedd99904cd87358a67d331f6a64169e [0,1,0,0,0,0|3,0,0]=4 3627 B12R0.248 C#C[C@H](C)NCCCCCCCC b6ca25c15b912922a34822864ec78c0a [0,1,0,0,0,0|2,0,0]=3 3628 B12R0.248 C#C[C@H](C)NCCCCCCCO eb174e37a321889d8c21786864c10edc [0,1,0,0,0,0|3,0,0]=4 3629 B12R0.248 C#C[C@H](C)NCCCCCCOC 680ff5d43db42c9199a370b399de0680 [0,1,0,0,0,0|3,0,0]=4 3630 B12R0.248 C#C[C@H](C)OCCCCCCCC 3807f517230206f0d8970d63ef5dbe6c [0,1,0,0,0,0|2,0,0]=3 3631 B12R0.248 C#C[C@H](C)OCCCCCCOC 410cb068e79ae2f4c3ea6cd18931996c [0,1,0,0,0,0|3,0,0]=4 3632 B12R0.248 C/C=C\CCCNCCC(C)CO 11decade40c49818721e54558427cb16 [0,1,0,0,0,0|1,0,2]=4 3633 B12R0.248 C/C=C\CCCNCCC(O)CO 67dafde730d3f25574dacf713d661985 [0,1,0,0,0,0|1,0,2]=4 3634 B12R0.248 C/C=C\CCCNCC[C@@H](C)CO bfae42410c49109173647f1c3547a621 [0,1,0,0,0,0|1,0,2]=4 3635 B12R0.248 C/C=C\CCCOCCC(C)OC 69b0879dcf2d9dd2d13785944f9983ea [0,1,0,0,0,0|1,0,2]=4 3636 B12R0.248 C=C(CC)CNCCCCCCC 83c846a2d548154ae3dfb9b64c559fb6 [0,1,0,0,0,0|2,0,1]=4 3637 B12R0.248 C=C(CC)COCCCCCCC 2a17750a84c0fac278516bd4ea134be7 [0,1,0,0,0,0|2,0,1]=4 3638 B12R0.248 C=C(CNCCCCCCC)OC 043016b208b4d94cb43d8730512ebf8d [0,1,0,0,0,0|1,0,2]=4 3639 B12R0.248 C=C(CO)CNCCCCCCC 6f9d8fb6843df8e18f6327cbc4cf2df1 [0,1,0,0,0,0|1,0,2]=4 3640 B12R0.248 C=C(COCCCCCCC)OC 0192794a2c9e9295c9ea6e2f5364ef87 [0,1,0,0,0,0|1,0,2]=4 3641 B12R0.248 C=CC(C)COCCCCCCC ac1792a64eac7c6c9ae61326d8d4ecf3 [0,1,0,0,0,0|2,0,0]=3 3642 B12R0.248 C=CC(C)COCCCCCCF c98e2e44d93fce8b026f60637927a118 [0,1,0,0,0,0|3,0,0]=4 3643 B12R0.248 C=CC(C)COCCCCCOC 88c36c6f305929bb4519878d3efca41c [0,1,0,0,0,0|3,0,0]=4 3644 B12R0.248 C=CC(C)COCCCOCCC fb3d4cdc830f221fb35fd3e6876bb664 [0,1,0,0,0,0|3,0,0]=4 3645 B12R0.248 C=CC(C)COCCOCCCC 3ff226f1099e6b045ac297a5bd1f8217 [0,1,0,0,0,0|3,0,0]=4 3646 B12R0.248 C=CC(C)NCCCCCCCC ad304ca2e3c13338226cb83c1a83f3a7 [0,1,0,0,0,0|2,0,0]=3 3647 B12R0.248 C=CC(C)NCCCCCCCO 5a6d745e8bdd2986588ff2bb2dd35c02 [0,1,0,0,0,0|3,0,0]=4 3648 B12R0.248 C=CC(C)NCCCCCCOC 5bb6242ec7dd142b44e2c72423e03064 [0,1,0,0,0,0|3,0,0]=4 3649 B12R0.248 C=CC(C)NCCCCSCCC 6d3af88ad741260edb6c4883703040b0 [0,1,0,0,0,0|3,0,0]=4 3650 B12R0.248 C=CC(C)NCCCOCCCC cd417d91c0475dcb8c1e26486ac6ec31 [0,1,0,0,0,0|3,0,0]=4 3651 B12R0.248 C=CC(C)OCCCCCCCC 68e8ba1122e8f758e7990ccad9024d56 [0,1,0,0,0,0|2,0,0]=3 3652 B12R0.248 C=CC(C)OCCCCCCOC 6539b2dafef4e3133189fcf6d1584bdb [0,1,0,0,0,0|3,0,0]=4 3653 B12R0.248 C=CC(C)OCCCOCCCC 8718655858974ad8e85a322d4c6ff88b [0,1,0,0,0,0|3,0,0]=4 3654 B12R0.248 C=CC(C)OCCOCCCCC 68fb02c1c16c7bd611aa051ce9dffbd1 [0,1,0,0,0,0|3,0,0]=4 3655 B12R0.248 C=CC(O)CNCCCCCCC 40cfabe0dbaed3d47b4d5861f0b6ca4c [0,1,0,0,0,0|1,0,1]=3 3656 B12R0.248 C=CC(O)CNCCCCCCF 77cbb728a0cd0245fc468000050e9516 [0,1,0,0,0,0|2,0,1]=4 3657 B12R0.248 C=CC(O)CNCCCCCCO 674b667542a2590f09778e4455bab0f7 [0,1,0,0,0,0|2,0,1]=4 3658 B12R0.248 C=CC(O)CNCCCCCOC 891c3b899e0ce791ddc2ad9135f2ce92 [0,1,0,0,0,0|2,0,1]=4 3659 B12R0.248 C=CC(O)CNCCCOCCC e91342e2cfd623d7b60a77cc3cfe9e46 [0,1,0,0,0,0|2,0,1]=4 3660 B12R0.248 C=CC(O)CNCCOCCCC 205a64b20675790d246be30be692bd4b [0,1,0,0,0,0|2,0,1]=4 3661 B12R0.248 C=CCCCCCCNC(C)CO b839be17f2e5483fd158fb59a92c845d [0,1,0,0,0,0|1,0,2]=4 3662 B12R0.248 C=CCCCCCCN[C@@H](C)CO 61a8b9ef66d2201e49158c6808465292 [0,1,0,0,0,0|1,0,2]=4 3663 B12R0.248 C=CCCCCCCN[C@H](C)CO ab96304b6ea7fc0a3297febff2479174 [0,1,0,0,0,0|1,0,2]=4 3664 B12R0.248 C=CCCCCCNCC(C)CO c64537beefc36ea1451bd67e2fced084 [0,1,0,0,0,0|1,0,2]=4 3665 B12R0.248 C=CCCCCCNCC(C)OC f877252499fb5b78a7b1bfb9249ee560 [0,1,0,0,0,0|1,0,2]=4 3666 B12R0.248 C=CCCCCCNCC(O)CC c53ee322bd7cf195bd93e447af2874df [0,1,0,0,0,0|1,0,2]=4 3667 B12R0.248 C=CCCCCCNCC(O)CF bbe86cd1990df7a6d8f398a62fbf0183 [0,1,0,0,0,0|1,0,2]=4 3668 B12R0.248 C=CCCCCCNCC(O)CO a13e426ad62937f922cb9af7a1be75f3 [0,1,0,0,0,0|1,0,2]=4 3669 B12R0.248 C=CCCCCCNC[C@@H](C)CO c1d67facfb7766a53fe84ef3c4becceb [0,1,0,0,0,0|1,0,2]=4 3670 B12R0.248 C=CCCCCCNC[C@@H](C)OC 22a374f8ec2eaf3426c140d280503393 [0,1,0,0,0,0|1,0,2]=4 3671 B12R0.248 C=CCCCCCNC[C@@H](O)CO 77f3165966232bcfc36d29751b1b955f [0,1,0,0,0,0|1,0,2]=4 3672 B12R0.248 C=CCCCCCNC[C@H](C)CO 5cb2a8fab3b3050688610ee4f81094c1 [0,1,0,0,0,0|1,0,2]=4 3673 B12R0.248 C=CCCCCCNC[C@H](C)OC 43e0fd81bb3b2e8503c1bfd54905141c [0,1,0,0,0,0|1,0,2]=4 3674 B12R0.248 C=CCCCCCNC[C@H](O)CC 2050cec29203c2819748020d6a7cd558 [0,1,0,0,0,0|1,0,2]=4 3675 B12R0.248 C=CCCCCCNC[C@H](O)CO 319238f8f63f6a98ef828b2dc3ee9b02 [0,1,0,0,0,0|1,0,2]=4 3676 B12R0.248 C=CCCCCCOCC(C)OC 12dbd4856fc2b40e41b389667d48a0f5 [0,1,0,0,0,0|1,0,2]=4 3677 B12R0.248 C=CCCCCCOCC(O)CO e8b3dbb31d78c7e9bc906a75774ff540 [0,1,0,0,0,0|1,0,2]=4 3678 B12R0.248 C=CCCCCCOC[C@@H](C)OC a919abcef3684ad63bb64e5401623257 [0,1,0,0,0,0|1,0,2]=4 3679 B12R0.248 C=CCCCCCOC[C@@H](O)CO 264566accfed101a7df9edf6b2ae9f68 [0,1,0,0,0,0|1,0,2]=4 3680 B12R0.248 C=CCCCCCOC[C@H](C)OC c494bea4d4cf4fdb762d72ece5a3de95 [0,1,0,0,0,0|1,0,2]=4 3681 B12R0.248 C=CCCCCCOC[C@H](O)CO b0217f6d0cbd47de1598e7f3c4124b04 [0,1,0,0,0,0|1,0,2]=4 3682 B12R0.248 C=CCCCCNCCC(C)CO c18434d474ce890e45fb4bccd40fa525 [0,1,0,0,0,0|1,0,2]=4 3683 B12R0.248 C=CCCCCNCCC(O)CO 6a29183227c9c8777dabfdb937bf333d [0,1,0,0,0,0|1,0,2]=4 3684 B12R0.248 C=CCCCCNCC[C@@H](C)CO 7e6e4422a9e196f777429fcf809aadbf [0,1,0,0,0,0|1,0,2]=4 3685 B12R0.248 C=CCCCCOCCC(C)OC 60391427dfbf0b65d2c0f0fa5c9bb22a [0,1,0,0,0,0|1,0,2]=4 3686 B12R0.248 C=CCCCNCCCC(C)CO a410e5c7559fbc1ef7234fedde55fe23 [0,1,0,0,0,0|1,0,2]=4 3687 B12R0.248 C=C[C@H](C)OCCCCCCCC 26e94ad98739b5f204052d45774e5cf2 [0,1,0,0,0,0|2,0,0]=3 3688 B12R0.248 C=C[C@H](C)OCCCCCCOC 6fab52df4cbb33482c4e188b341c3307 [0,1,0,0,0,0|3,0,0]=4 3689 B12R0.248 CC(C#N)CNCCCCCCCl b2828210fabc21e97e6bbf2e741cf693 [0,1,0,0,0,0|3,0,0]=4 3690 B12R0.248 CC(C#N)CNCCCCCCF 0b1d91ec919888d08074fca637277086 [0,1,0,0,0,0|3,0,0]=4 3691 B12R0.248 CC(C#N)CNCCCCCCO 671400b3e2ee2a17fb686a64f94a3e15 [0,1,0,0,0,0|3,0,0]=4 3692 B12R0.248 CC(C#N)COCCCCCCF 5dfafaccc93f8e1128e0f8867b78fdf4 [0,1,0,0,0,0|3,0,0]=4 3693 B12R0.248 CC(C#N)COCCCCCCS a88e377d2cc64abc03f608d992895f31 [0,1,0,0,0,0|3,0,0]=4 3694 B12R0.248 CC(C#N)NCCCCCCCO c645821c43db4ada0660d32111bc2d32 [0,1,0,0,0,0|3,0,0]=4 3695 B12R0.248 CC(C=O)NCCCCCCCO 2e19ad0fe215c8b58f5ea50b7bf93a1e [0,1,0,0,0,0|2,0,1]=4 3696 B12R0.248 CC(CO)CCCNCCCC#N fab252c8622e24a922ca8d535c9002d1 [0,1,0,0,0,0|2,0,1]=4 3697 B12R0.248 CC(CO)CCCNCCCC=O e67a33d16da72b3dafd5667b38c2441f [0,1,0,0,0,0|2,0,1]=4 3698 B12R0.248 CC(CO)CCCNCCCCF 0ae79f0af79f8738fd53d721b740f188 [0,1,0,0,0,0|2,0,0]=3 3699 B12R0.248 CC(CO)CCCNCCCCO a71b509e1e36115cf53385e4a5e3ed0b [0,1,0,0,0,0|2,0,0]=3 3700 B12R0.248 CC(CO)CCNCCCCC#N aabcf4857d26039d3ec543f9dd5e78ce [0,1,0,0,0,0|2,0,1]=4 3701 B12R0.248 CC(CO)CCNCCCCC=O 30e8ae93ac7269d51e098b9ebc2b5b09 [0,1,0,0,0,0|2,0,1]=4 3702 B12R0.248 CC(CO)CCNCCCCCCl 71e961cad43a731d8025219044bbffb6 [0,1,0,0,0,0|2,0,0]=3 3703 B12R0.248 CC(CO)CCNCCCCCF 90936d611c40f25c269a34a7dedc4934 [0,1,0,0,0,0|2,0,0]=3 3704 B12R0.248 CC(CO)CCNCCCCCO e0d568cc47b63b406bbf04a9d1c0399b [0,1,0,0,0,0|2,0,0]=3 3705 B12R0.248 CC(CO)CCNCCCCON 22fb5a02c2eeeea33cb250e32abb54ea [0,1,0,0,0,0|3,0,0]=4 3706 B12R0.248 CC(CO)CCNCCOCCO 35418a75e0a70356d97a59450e83d8ab [0,1,0,0,0,0|3,0,0]=4 3707 B12R0.248 CC(CO)CCNCCOCCS 3ff0a907b9ccfe7dabe7af643d495d2a [0,1,0,0,0,0|3,0,0]=4 3708 B12R0.248 CC(CO)CCNCCSCCO 3194b3218bb4374b951701aed5df6e3c [0,1,0,0,0,0|3,0,0]=4 3709 B12R0.248 CC(CO)CNCCCCCC#N 247a020b32474c3c923401eaf85da4b8 [0,1,0,0,0,0|2,0,1]=4 3710 B12R0.248 CC(CO)CNCCCCCC=O b29842a1e189aad21867a55fcd89ff01 [0,1,0,0,0,0|2,0,1]=4 3711 B12R0.248 CC(CO)CNCCCCCCCl 1f36ee328d4cde7d34e2c0693f9029bf [0,1,0,0,0,0|2,0,0]=3 3712 B12R0.248 CC(CO)CNCCCCCCF 896a24c3bcf95574c20911f102db89e7 [0,1,0,0,0,0|2,0,0]=3 3713 B12R0.248 CC(CO)CNCCCCCCO 34769fca8a2b4a17c78254f242581897 [0,1,0,0,0,0|2,0,0]=3 3714 B12R0.248 CC(CO)CNCCCOCCO 763942ce50c3cc74f4165302fda6b360 [0,1,0,0,0,0|3,0,0]=4 3715 B12R0.248 CC(CO)CNCCOCCCO d0f33e9e92abb6a8a5f9a02252b01ef1 [0,1,0,0,0,0|3,0,0]=4 3716 B12R0.248 CC(CO)NCCCCCCC#N a57c1bc31ff33bfbaddba7730ccf9aa1 [0,1,0,0,0,0|2,0,1]=4 3717 B12R0.248 CC(CO)NCCCCCCC=O 71e2e40e5ddccd029ec0fb0d34c0d498 [0,1,0,0,0,0|2,0,1]=4 3718 B12R0.248 CC(CO)NCCCCCCCO 836f150704ee93e4a17dcf3f7f67bd9e [0,1,0,0,0,0|2,0,0]=3 3719 B12R0.248 CC(CO)NCCCCSCCO 29ad832ff568a2c93e1457f0401fcbdc [0,1,0,0,0,0|3,0,0]=4 3720 B12R0.248 CC(CO)NCCCOCCCO 5c25ad571e7213711d6337f844a391e0 [0,1,0,0,0,0|3,0,0]=4 3721 B12R0.248 CC/C=C/CNCCCC(C)CO 8bd5b0bca262de12bb8a376d16e9a0a8 [0,1,0,0,0,0|1,0,2]=4 3722 B12R0.248 CC/C=C\CCCOCC(C)OC 54817ad8548007e2b4fe069af440223d [0,1,0,0,0,0|1,0,2]=4 3723 B12R0.248 CC/C=C\CCCOCC(O)CO 6b76140a97f39f7e908aab6164350665 [0,1,0,0,0,0|1,0,2]=4 3724 B12R0.248 CC/C=C\CCCOC[C@@H](C)OC 8238e4621339caea60f1d68ed1cbae39 [0,1,0,0,0,0|1,0,2]=4 3725 B12R0.248 CC/C=C\CCCOC[C@@H](O)CO 7c0be6ba9916583c03b2ab6dba16cccd [0,1,0,0,0,0|1,0,2]=4 3726 B12R0.248 CC/C=C\CCCOC[C@H](C)OC 194c62395ba4300620fc201775f81129 [0,1,0,0,0,0|1,0,2]=4 3727 B12R0.248 CC/C=C\CCCOC[C@H](O)CO e2313dc018bbd6834452e658aee65cf9 [0,1,0,0,0,0|1,0,2]=4 3728 B12R0.248 CC/C=C\CCNCCC(C)CO fc526e9dcb09366eefa2f1467918ef34 [0,1,0,0,0,0|1,0,2]=4 3729 B12R0.248 CC/C=C\CCNCCC(O)CO 740d2009e92cca4f000987eda7ff6994 [0,1,0,0,0,0|1,0,2]=4 3730 B12R0.248 CC/C=C\CCNCC[C@@H](C)CO 71c275fa9a7606e966c1b5597532e648 [0,1,0,0,0,0|1,0,2]=4 3731 B12R0.248 CC/C=C\CCOCCC(C)OC 4f749b8e15c6b5d70d6ff1efb6df29e7 [0,1,0,0,0,0|1,0,2]=4 3732 B12R0.248 CCC#CCNCCCC(C)CO c790b53dd0bd23f68d66790a74f94f2e [0,1,0,0,0,0|1,0,2]=4 3733 B12R0.248 CCC(C)CCCCCOCCF 3463d37c706e71003cd033e50db2374b [0,1,0,0,0,0|3,0,0]=4 3734 B12R0.248 CCC(C)CCCCCOCCS 2506809000fd18ca1161a38c0462152b [0,1,0,0,0,0|3,0,0]=4 3735 B12R0.248 CCC(C)CCCCCOCOC 59e1593a6353a35ca5d87601940fd464 [0,1,0,0,0,0|3,0,0]=4 3736 B12R0.248 CCC(C)CCCCCOCSC efacfd7118d22a0e218a86404dddb10a [0,1,0,0,0,0|3,0,0]=4 3737 B12R0.248 CCC(C)CCCCOCCCF 11221fabf06bb795c33af9b1b523ee1e [0,1,0,0,0,0|3,0,0]=4 3738 B12R0.248 CCC(C)CCCCOCCCS 4776c3fc1bde1ff294f11af3fd876c26 [0,1,0,0,0,0|3,0,0]=4 3739 B12R0.248 CCC(C)CCCCOCCOC 6b58bb3500d79d771e0255c3b1115bd6 [0,1,0,0,0,0|3,0,0]=4 3740 B12R0.248 CCC(C)CCCCOCCSC b7436cff3a668b6fb9a5ec9869f4ddf9 [0,1,0,0,0,0|3,0,0]=4 3741 B12R0.248 CCC(C)CCCOCCCCF 65d8dc2357faf1c64ebdbb64c9d11966 [0,1,0,0,0,0|3,0,0]=4 3742 B12R0.248 CCC(C)CCCOCCCOC 07417037dfb2d966ce92791ea64e0888 [0,1,0,0,0,0|3,0,0]=4 3743 B12R0.248 CCC(C)CCCOCCCSC 16073e0e284502b440a444b9cca8dc64 [0,1,0,0,0,0|3,0,0]=4 3744 B12R0.248 CCC(C)CCNCCCCCCl 511c27d1a0aa9f5e765b11a47fbbe9e7 [0,1,0,0,0,0|3,0,0]=4 3745 B12R0.248 CCC(C)CCNCCCCCF 22aca36f22b7a795ff6aa77bffffaf8a [0,1,0,0,0,0|3,0,0]=4 3746 B12R0.248 CCC(C)CCNCCCCCO 6081e1691cff6689294c09df0145c742 [0,1,0,0,0,0|3,0,0]=4 3747 B12R0.248 CCC(C)CCNCCCCOC a03117fa80596f8aa2488e24e961e0a3 [0,1,0,0,0,0|3,0,0]=4 3748 B12R0.248 CCC(C)CCNCCCCSC 006385fad27ab85f1e93a4924e326b89 [0,1,0,0,0,0|3,0,0]=4 3749 B12R0.248 CCC(C)CCOCCCCCF fbe1c8389d314de1c9f0135fa35b5f1a [0,1,0,0,0,0|3,0,0]=4 3750 B12R0.248 CCC(C)CCOCCCCOC 9bba989ebe77f6e04298c0ddc7957424 [0,1,0,0,0,0|3,0,0]=4 3751 B12R0.248 CCC(C)CCOCCCCSC 2c7abf00ff3724f3b835d007cc8bded0 [0,1,0,0,0,0|3,0,0]=4 3752 B12R0.248 CCC(C)CNCCCCCCCl b0cf3915dc4a0439da9e4b45a3c67bf3 [0,1,0,0,0,0|3,0,0]=4 3753 B12R0.248 CCC(C)CNCCCCCCF a5ae952f2bbc459c6a4eff8a68c8ef8c [0,1,0,0,0,0|3,0,0]=4 3754 B12R0.248 CCC(C)CNCCCCCCO be0cea1760f7cb2e8f6ccdb186ff563b [0,1,0,0,0,0|3,0,0]=4 3755 B12R0.248 CCC(C)CNCCCCCOC 453bab8d6dc227b45ee217dac064e778 [0,1,0,0,0,0|3,0,0]=4 3756 B12R0.248 CCC(C)COCCCCCCF f6c8b9fb64853b51635193ee6ac66b9c [0,1,0,0,0,0|3,0,0]=4 3757 B12R0.248 CCC(C)COCCCCCCS 012f5b0742572efe572354f369267ded [0,1,0,0,0,0|3,0,0]=4 3758 B12R0.248 CCC(C)COCCCCCOC 2cb79c5ba8958767d6d5ba0d99c5575a [0,1,0,0,0,0|3,0,0]=4 3759 B12R0.248 CCC(C)NCCCCCCCO b1e64bc770d96cf8cd5d175fcbae0a1f [0,1,0,0,0,0|3,0,0]=4 3760 B12R0.248 CCC(C)NCCCCCCOC 7b5d63dc0149129b3b4a978b1e353fd8 [0,1,0,0,0,0|3,0,0]=4 3761 B12R0.248 CCC(C)OCCCCCCOC 4f0dcd674abbf6ece19e191f3c714077 [0,1,0,0,0,0|3,0,0]=4 3762 B12R0.248 CCC(O)CNCCCCCC#N 662d2edcf57b6b9859df00fd60681d64 [0,1,0,0,0,0|2,0,1]=4 3763 B12R0.248 CCC(O)CNCCCCCC=O 144d37e6a8f1ef6e797e0915fc316802 [0,1,0,0,0,0|2,0,1]=4 3764 B12R0.248 CCC(O)CNCCCCCCCl ca7493e866b53a0c7f5c756cee2b09a1 [0,1,0,0,0,0|2,0,0]=3 3765 B12R0.248 CCC(O)CNCCCCCCF d5599bbe17d99efcc2ec435df0e60f03 [0,1,0,0,0,0|2,0,0]=3 3766 B12R0.248 CCC(O)CNCCCCCCO 6994982391dd2f1efac21f59bbd849bb [0,1,0,0,0,0|2,0,0]=3 3767 B12R0.248 CCC(O)CNCCCCCOC 33a7f976a7f22076756936d84bb6a342 [0,1,0,0,0,0|2,0,0]=3 3768 B12R0.248 CCC(O)CNCCCOCCO 30594ffa95d33c330cd7030b70373dda [0,1,0,0,0,0|3,0,0]=4 3769 B12R0.248 CCC(O)CNCCOCCCO 7e13d9aa2fdf4b7378b9af2a4151a1c6 [0,1,0,0,0,0|3,0,0]=4 3770 B12R0.248 CCC(O)CNCCOCCOC 5d3ea24bb5ca9e2feae34cd254e8a557 [0,1,0,0,0,0|3,0,0]=4 3771 B12R0.248 CCC(S)CCOCCCCCF 8d9518a2b7d0480f4e0858526a499b4a [0,1,0,0,0,0|2,1,0]=4 3772 B12R0.248 CCC(S)CCOCCCCOC be9796176d626ed070b3b05dc1468dbd [0,1,0,0,0,0|2,1,0]=4 3773 B12R0.248 CCC/C=C/CNCCC(C)CO b49d3630bc55f7b2d2c9258df8677b6c [0,1,0,0,0,0|1,0,2]=4 3774 B12R0.248 CCC/C=C/CNCCC(O)CO 012b503c156746abb59470d3650a5abd [0,1,0,0,0,0|1,0,2]=4 3775 B12R0.248 CCC/C=C/CNCC[C@@H](C)CO 22f2a73a274cce2c4fa1a0dab74fe1a0 [0,1,0,0,0,0|1,0,2]=4 3776 B12R0.248 CCC/C=C/COCCC(C)OC 8f0387e0c26edf91d5ce3e76575c2e7a [0,1,0,0,0,0|1,0,2]=4 3777 B12R0.248 CCC/C=C\CCOCC(C)OC 772c8a1877015b6c3320c5406e1ddbbf [0,1,0,0,0,0|1,0,2]=4 3778 B12R0.248 CCC/C=C\CCOCC(O)CO 89e8ee6d0542f4e05e2705fd536b4e6b [0,1,0,0,0,0|1,0,2]=4 3779 B12R0.248 CCC/C=C\CCOC[C@@H](C)OC 94d74bacd581e920cbe43275f95e9b45 [0,1,0,0,0,0|1,0,2]=4 3780 B12R0.248 CCC/C=C\CCOC[C@@H](O)CO e9984c4a03243347b1dc3fc8cc504a0c [0,1,0,0,0,0|1,0,2]=4 3781 B12R0.248 CCC/C=C\CCOC[C@H](C)OC 78576a1c4837247d226b7cc84909a985 [0,1,0,0,0,0|1,0,2]=4 3782 B12R0.248 CCC/C=C\CCOC[C@H](O)CO 8903ee53dce1c0a56ce30848fa081119 [0,1,0,0,0,0|1,0,2]=4 3783 B12R0.248 CCC/C=C\CNCCC(C)CO f5be5cd9da532e67a48be3359cb35a2e [0,1,0,0,0,0|1,0,2]=4 3784 B12R0.248 CCC/C=C\CNCCC(O)CO ea34ab693ca46c9fc9ddb7b5a1cacb03 [0,1,0,0,0,0|1,0,2]=4 3785 B12R0.248 CCC/C=C\CNCC[C@@H](C)CO bd6495bff8e9e6090d96e3e607572d9e [0,1,0,0,0,0|1,0,2]=4 3786 B12R0.248 CCC/C=C\COCCC(C)OC 77e020afc06fea93d4b6fcf4d453c939 [0,1,0,0,0,0|1,0,2]=4 3787 B12R0.248 CCCC#CCCOCC(C)OC faa06f6703795f6324eb395b8651856a [0,1,0,0,0,0|1,0,2]=4 3788 B12R0.248 CCCC#CCCOCC(O)CO 6bdbb1c485a22fcf7918c9dc68354820 [0,1,0,0,0,0|1,0,2]=4 3789 B12R0.248 CCCC#CCCOC[C@@H](C)OC 1730e3a644d9b6a175e44d3338d1ecf2 [0,1,0,0,0,0|1,0,2]=4 3790 B12R0.248 CCCC#CCCOC[C@@H](O)CO 44b20d565ea1683d687890ae4d84e0dc [0,1,0,0,0,0|1,0,2]=4 3791 B12R0.248 CCCC#CCCOC[C@H](C)OC 2277ff7168f0bb140fc9625d25dd033d [0,1,0,0,0,0|1,0,2]=4 3792 B12R0.248 CCCC#CCCOC[C@H](O)CO 48a56802a0fba079c2fa8cdbab5280b7 [0,1,0,0,0,0|1,0,2]=4 3793 B12R0.248 CCCC/C=C/CNCC(C)CO 763770bb08bf55b4f7f81793d61aaa3c [0,1,0,0,0,0|1,0,2]=4 3794 B12R0.248 CCCC/C=C/CNCC(O)CC 1c07fc7186b0afaa2fc552d94f7a2ad7 [0,1,0,0,0,0|1,0,2]=4 3795 B12R0.248 CCCC/C=C/CNCC(O)CO fa100932f6c73a415e78c7228c65c397 [0,1,0,0,0,0|1,0,2]=4 3796 B12R0.248 CCCC/C=C/CNC[C@@H](C)OC 7fda65e6d7a03decafb901e79fbf6b2d [0,1,0,0,0,0|1,0,2]=4 3797 B12R0.248 CCCC/C=C/CNC[C@@H](O)CO 3d2b1161b1047c931bfade17b7e618f7 [0,1,0,0,0,0|1,0,2]=4 3798 B12R0.248 CCCC/C=C/CNC[C@H](C)CO 2018c9c711d2507b2cdaa91026b333b4 [0,1,0,0,0,0|1,0,2]=4 3799 B12R0.248 CCCC/C=C/CNC[C@H](C)OC e6a8029ba86947c19954d8e798cf7c16 [0,1,0,0,0,0|1,0,2]=4 3800 B12R0.248 CCCC/C=C/CNC[C@H](O)CC 871e10c9471ab4af0e66918d92da77af [0,1,0,0,0,0|1,0,2]=4 3801 B12R0.248 CCCC/C=C/CNC[C@H](O)CO 574ad90517b814593cb98b22e284b30e [0,1,0,0,0,0|1,0,2]=4 3802 B12R0.248 CCCC/C=C/COCC(C)OC a9c5ba0ab7260a317d141ec2af6ce87c [0,1,0,0,0,0|1,0,2]=4 3803 B12R0.248 CCCC/C=C/COCC(O)CO 318f38cbb4f41cfec1a50936caff6eb3 [0,1,0,0,0,0|1,0,2]=4 3804 B12R0.248 CCCC/C=C/COC[C@@H](C)OC edd29aaec99a693023f7f9fc022bb365 [0,1,0,0,0,0|1,0,2]=4 3805 B12R0.248 CCCC/C=C/COC[C@@H](O)CO 823f4689a5dbe24bd9cee4a49e46a0e7 [0,1,0,0,0,0|1,0,2]=4 3806 B12R0.248 CCCC/C=C/COC[C@H](C)OC 4cc6540fa356eb489452a3f1bd13bd58 [0,1,0,0,0,0|1,0,2]=4 3807 B12R0.248 CCCC/C=C/COC[C@H](O)CO 96611af0cc98f2f1dc1c17bc6fd0f353 [0,1,0,0,0,0|1,0,2]=4 3808 B12R0.248 CCCC/C=C\CNCC(C)CO ecf447bcf0cf5ccab4390cfca2c7762f [0,1,0,0,0,0|1,0,2]=4 3809 B12R0.248 CCCC/C=C\CNCC(O)CC 4f629fdec83bf62a0551ec01f578c0fa [0,1,0,0,0,0|1,0,2]=4 3810 B12R0.248 CCCC/C=C\CNCC(O)CO 16a8e46ac276f375a4131a908d5cdb95 [0,1,0,0,0,0|1,0,2]=4 3811 B12R0.248 CCCC/C=C\CNC[C@@H](C)OC a7fa2bd9ae6b7590c1e99da52ea4607e [0,1,0,0,0,0|1,0,2]=4 3812 B12R0.248 CCCC/C=C\CNC[C@@H](O)CO e2ffc88ea0ddf2a90cfd47d667df8171 [0,1,0,0,0,0|1,0,2]=4 3813 B12R0.248 CCCC/C=C\CNC[C@H](C)CO bd63824f9385f7b993a36a3defa1bdc6 [0,1,0,0,0,0|1,0,2]=4 3814 B12R0.248 CCCC/C=C\CNC[C@H](C)OC 589d3874f367561fda0d27270d63e1ac [0,1,0,0,0,0|1,0,2]=4 3815 B12R0.248 CCCC/C=C\CNC[C@H](O)CC fc1ba347ac656a462f32a0e2b26750c5 [0,1,0,0,0,0|1,0,2]=4 3816 B12R0.248 CCCC/C=C\CNC[C@H](O)CO 163a8da09cf90a8878bf5022b9b9b487 [0,1,0,0,0,0|1,0,2]=4 3817 B12R0.248 CCCC/C=C\COCC(C)OC daf180d11e52c1b04bc80e45a1898ece [0,1,0,0,0,0|1,0,2]=4 3818 B12R0.248 CCCC/C=C\COC[C@@H](C)OC ba3bb230837b3ce14a86e1af9ed35354 [0,1,0,0,0,0|1,0,2]=4 3819 B12R0.248 CCCC/C=C\COC[C@H](C)OC edc4b2c281705796e88a2cfc8414cb6c [0,1,0,0,0,0|1,0,2]=4 3820 B12R0.248 CCCCC#CCOCC(C)OC 0e03ee9ae1854eca090c44b7d98eb4cc [0,1,0,0,0,0|1,0,2]=4 3821 B12R0.248 CCCCC#CCOCC(O)CO d354d08f7421891d1dcb92e73445ca02 [0,1,0,0,0,0|1,0,2]=4 3822 B12R0.248 CCCCC#CCOC[C@@H](C)OC 1872873369944fd1a6facc84273cf00e [0,1,0,0,0,0|1,0,2]=4 3823 B12R0.248 CCCCC#CCOC[C@@H](O)CO 1d6fb70293902d923524095f21b2d70c [0,1,0,0,0,0|1,0,2]=4 3824 B12R0.248 CCCCC#CCOC[C@H](C)OC 0d35db0aa897c17b0a167897d27183fd [0,1,0,0,0,0|1,0,2]=4 3825 B12R0.248 CCCCC#CCOC[C@H](O)CO 14aec85b9852478ac546e61cbcaadbd0 [0,1,0,0,0,0|1,0,2]=4 3826 B12R0.248 CCCCCCCCCN(C)C=O 99247f383e132de9ebd00d705ff46dca [0,1,0,0,0,0|1,0,1]=3 3827 B12R0.248 CCCCCCCCCN(C)CC a5d0856f18c569967bb7ff2510b586f9 [0,1,0,0,0,0|2,0,0]=3 3828 B12R0.248 CCCCCCCCCN(C)CF 915e80195ba3d30f9ab7e62941628a87 [0,1,0,0,0,0|2,0,0]=3 3829 B12R0.248 CCCCCCCCCN(C)CO f2b28438a5f9acff1bec3fbec3b1ae3a [0,1,0,0,0,0|1,0,0]=2 3830 B12R0.248 CCCCCCCCNC(=O)CC 8d5ca65c7bc055f65ae9b9c0d4864e57 [0,1,0,0,0,0|1,0,2]=4 3831 B12R0.248 CCCCCCCCNC(=O)CF c4db3ee1a17357dbe65197ea56878593 [0,1,0,0,0,0|1,0,2]=4 3832 B12R0.248 CCCCCCCCNC(=O)CO 1b2314c0db76d0a277cf2f0f4d94503d [0,1,0,0,0,0|1,0,2]=4 3833 B12R0.248 CCCCCCCCNC(=O)CS c3e84d69a8fd363779f35405d911eb5a [0,1,0,0,0,0|1,0,2]=4 3834 B12R0.248 CCCCCCCCNC(C)C#N 80055ed08f26104307ab6bc2ea0195f1 [0,1,0,0,0,0|2,0,0]=3 3835 B12R0.248 CCCCCCCCNC(C)C=O 4d909a5c4f6c0c87bc35f2882c2f189f [0,1,0,0,0,0|1,0,1]=3 3836 B12R0.248 CCCCCCCCNC(C)CC 0d706d06af56069e47d71da4590659ec [0,1,0,0,0,0|2,0,0]=3 3837 B12R0.248 CCCCCCCCNC(C)CO 691930e7ee9f2252c33826e262a83a7b [0,1,0,0,0,0|1,0,0]=2 3838 B12R0.248 CCCCCCCCN[C@@H](C)CC 07f8472e1844311e4454a6d46efe94c0 [0,1,0,0,0,0|2,0,0]=3 3839 B12R0.248 CCCCCCCCN[C@@H](C)CO 07df57f5908b145777f7ba5962e16cae [0,1,0,0,0,0|1,0,0]=2 3840 B12R0.248 CCCCCCCCN[C@H](C)C=O 18ae31881e02a9f5e7c5bc7565961aa2 [0,1,0,0,0,0|1,0,1]=3 3841 B12R0.248 CCCCCCCCN[C@H](C)CC de5d6acf612c0009ee7dcd674b57b2c5 [0,1,0,0,0,0|2,0,0]=3 3842 B12R0.248 CCCCCCCCN[C@H](C)CO 367e68bc9cb86406686317ae8915801d [0,1,0,0,0,0|1,0,0]=2 3843 B12R0.248 CCCCCCCCOC(C)C#N 805e19f4d475d1b4cc3b4fa4215f8a43 [0,1,0,0,0,0|2,0,0]=3 3844 B12R0.248 CCCCCCCCOC(C)C=O 48ea74792949b20106746f4281a651f0 [0,1,0,0,0,0|1,0,1]=3 3845 B12R0.248 CCCCCCCCOC(C)CC 47d72e45fc059a4b8f3035c8a9eef5c9 [0,1,0,0,0,0|2,0,0]=3 3846 B12R0.248 CCCCCCCCOC(C)CF fad66b895baa5853b1da99f3824e0977 [0,1,0,0,0,0|2,0,0]=3 3847 B12R0.248 CCCCCCCCOC(C)CS 3a5f57ec72fb2da9c1599e967afb9eff [0,1,0,0,0,0|1,1,0]=3 3848 B12R0.248 CCCCCCCCO[C@@H](C)CC e5751f18e914c751e22df72fbf0bee36 [0,1,0,0,0,0|2,0,0]=3 3849 B12R0.248 CCCCCCCCO[C@H](C)C=O e7c5b7781b1097ba11b88c78ab429552 [0,1,0,0,0,0|1,0,1]=3 3850 B12R0.248 CCCCCCCCO[C@H](C)CC 5c6cafaf0679c51f7281abb351105278 [0,1,0,0,0,0|2,0,0]=3 3851 B12R0.248 CCCCCCCCO[C@H](C)CS 267d356702ec0c74da9c86d739d831f4 [0,1,0,0,0,0|1,1,0]=3 3852 B12R0.248 CCCCCCCNCC(=O)CC 89ed05db9bec07e2e6db05ecef7a0fca [0,1,0,0,0,0|1,0,2]=4 3853 B12R0.248 CCCCCCCNCC(=O)CO 78260d7bffbe5c9bc7eb28ddafc55fae [0,1,0,0,0,0|1,0,2]=4 3854 B12R0.248 CCCCCCCNCC(=O)NC 6d9648dacdcc37bc39a5a62812b40b4f [0,1,0,0,0,0|1,0,2]=4 3855 B12R0.248 CCCCCCCNCC(=O)NO 466eb679593197d7932fa512c2129bdc [0,1,0,0,0,0|2,0,1]=4 3856 B12R0.248 CCCCCCCNCC(=O)OC 2a593dbd0b5d06f61843f359317cdf86 [0,1,0,0,0,0|1,0,2]=4 3857 B12R0.248 CCCCCCCNCC(Br)CBr 7b1cdadffbf3352779561aa01b7836df [0,1,0,0,0,0|2,0,0]=3 3858 B12R0.248 CCCCCCCNCC(C)C#N dafc09458a14835f97b2f04eac7ea9f0 [0,1,0,0,0,0|2,0,0]=3 3859 B12R0.248 CCCCCCCNCC(C)CC 4a8e54a874369243e17d5d4030cd5092 [0,1,0,0,0,0|2,0,0]=3 3860 B12R0.248 CCCCCCCNCC(C)CO c66e525eafcba3acd5a64eb7c7de82b2 [0,1,0,0,0,0|1,0,0]=2 3861 B12R0.248 CCCCCCCNCC(C)OC 12427664f58653b270952775996b1b60 [0,1,0,0,0,0|1,0,0]=2 3862 B12R0.248 CCCCCCCNCC(F)CO ca02ce3cdd2d4e4b7ea15fdf29b8f59f [0,1,0,0,0,0|2,0,0]=3 3863 B12R0.248 CCCCCCCNCC(O)CC 6bfffbeb1344eb76a9abeaee0db5163b [0,1,0,0,0,0|1,0,0]=2 3864 B12R0.248 CCCCCCCNCC(O)CF 0f8f6cd7b4465f2d0b594f8204f908d2 [0,1,0,0,0,0|1,0,0]=2 3865 B12R0.248 CCCCCCCNCC(O)CO 9afea52ca8722ada70c2f09e63e788cd [0,1,0,0,0,0|1,0,0]=2 3866 B12R0.248 CCCCCCCNC[C@@H](C)CC 4787adca798df27521fb20310d8814fc [0,1,0,0,0,0|2,0,0]=3 3867 B12R0.248 CCCCCCCNC[C@@H](C)CO 6da6ce4cf2711418c5cb665f9953dc70 [0,1,0,0,0,0|1,0,0]=2 3868 B12R0.248 CCCCCCCNC[C@@H](C)OC 69689cab1ba2528997a5fd9ba7582780 [0,1,0,0,0,0|1,0,0]=2 3869 B12R0.248 CCCCCCCNC[C@@H](F)CO 57393e78caa9829fe88f26e0b54941dd [0,1,0,0,0,0|2,0,0]=3 3870 B12R0.248 CCCCCCCNC[C@@H](O)CO 5f1ca85a80ea13607b6b264d64a6ba8f [0,1,0,0,0,0|1,0,0]=2 3871 B12R0.248 CCCCCCCNC[C@H](C)CC 89c8ad7176bf7058d9a0e019c78741e1 [0,1,0,0,0,0|2,0,0]=3 3872 B12R0.248 CCCCCCCNC[C@H](C)CO 512d941bf12e52d1f452076e2dd98123 [0,1,0,0,0,0|1,0,0]=2 3873 B12R0.248 CCCCCCCNC[C@H](C)OC 9ff56a0c318e23ca54280026ef7717bc [0,1,0,0,0,0|1,0,0]=2 3874 B12R0.248 CCCCCCCNC[C@H](F)CO eb7388c10575ec742adb18bf8921cc18 [0,1,0,0,0,0|2,0,0]=3 3875 B12R0.248 CCCCCCCNC[C@H](O)CC 012a92f8cbf2c944047eade9e2501a07 [0,1,0,0,0,0|1,0,0]=2 3876 B12R0.248 CCCCCCCNC[C@H](O)CO 858579fb9b2ee7593835f5359cac34e0 [0,1,0,0,0,0|1,0,0]=2 3877 B12R0.248 CCCCCCCOC/C(=C/I)/C ef3152235bc71aa9ee07a292c3aa0860 [0,1,0,0,0,0|2,0,1]=4 3878 B12R0.248 CCCCCCCOCC(=CI)C 8fcf1b75b1d1113104218bdb2cb469cb [0,1,0,0,0,0|2,0,1]=4 3879 B12R0.248 CCCCCCCOCC(=O)CC a8acc97960556a375783be8199237dca [0,1,0,0,0,0|1,0,2]=4 3880 B12R0.248 CCCCCCCOCC(=O)NC f6472919275e3b150f6c0e20fb6ced2d [0,1,0,0,0,0|1,0,2]=4 3881 B12R0.248 CCCCCCCOCC(=O)OC 04031205afbe774e5f21f17cc5098880 [0,1,0,0,0,0|1,0,2]=4 3882 B12R0.248 CCCCCCCOCC(Br)CBr 45e23c718f6951be45f42f7f84e7a24e [0,1,0,0,0,0|2,0,0]=3 3883 B12R0.248 CCCCCCCOCC(C)C#N c836bad23a85c47b96b9b4d40edd2e96 [0,1,0,0,0,0|2,0,0]=3 3884 B12R0.248 CCCCCCCOCC(C)CC 502970761dde1be56e0458579701b7be [0,1,0,0,0,0|2,0,0]=3 3885 B12R0.248 CCCCCCCOCC(C)OC ede828090ce1b3f5d1f6ead52428d66b [0,1,0,0,0,0|1,0,0]=2 3886 B12R0.248 CCCCCCCOCC(Cl)CCl 7891f5936b6fbd91d3b2ee8f14a62f62 [0,1,0,0,0,0|2,0,0]=3 3887 B12R0.248 CCCCCCCOCC(O)CO b7968decdf391a6e1f275ba687c17c80 [0,1,0,0,0,0|1,0,0]=2 3888 B12R0.248 CCCCCCCOCC(S)CS 9b13720c723da5ea80e06407725bb32c [0,1,0,0,0,0|1,1,0]=3 3889 B12R0.248 CCCCCCCOC[C@@H](C)CC c0b4d3a856cdc84802f9c4930bc792f2 [0,1,0,0,0,0|2,0,0]=3 3890 B12R0.248 CCCCCCCOC[C@@H](C)OC ba29b8bd3770fffbb38508f11c9cdded [0,1,0,0,0,0|1,0,0]=2 3891 B12R0.248 CCCCCCCOC[C@@H](O)CO 578ae06ebfc921f009c88093d935a3fa [0,1,0,0,0,0|1,0,0]=2 3892 B12R0.248 CCCCCCCOC[C@H](C)CC d4094f553b7794f4d8e0c258b7a59be2 [0,1,0,0,0,0|2,0,0]=3 3893 B12R0.248 CCCCCCCOC[C@H](C)OC 5e5d407c76b62f4d6065605fd32997c5 [0,1,0,0,0,0|1,0,0]=2 3894 B12R0.248 CCCCCCCOC[C@H](O)CO 4e16fd13f50d197d72e3c151b9b5054a [0,1,0,0,0,0|1,0,0]=2 3895 B12R0.248 CCCCCCNCCC(=O)NC f03ff6a74684820323d170d68c8c9cc7 [0,1,0,0,0,0|1,0,2]=4 3896 B12R0.248 CCCCCCNCCC(=O)NO a8c78afb268cd1328fe70b732051854a [0,1,0,0,0,0|2,0,1]=4 3897 B12R0.248 CCCCCCNCCC(=O)OC 88018f823e6b9b368e308c072245caf2 [0,1,0,0,0,0|1,0,2]=4 3898 B12R0.248 CCCCCCNCCC(C)CC d746abf1cdf2bc5ccb95ab1221c838d0 [0,1,0,0,0,0|2,0,0]=3 3899 B12R0.248 CCCCCCNCCC(C)CO 504977974d38fdea0e356fcbb30e426e [0,1,0,0,0,0|1,0,0]=2 3900 B12R0.248 CCCCCCNCCC(O)CO ce8edc3ac7dd8b7ceb3a76bc9758ba22 [0,1,0,0,0,0|1,0,0]=2 3901 B12R0.248 CCCCCCNCCS(=O)CC e964d1c90a957a19479bf0a95bb8a4ec [0,1,0,0,0,0|2,0,1]=4 3902 B12R0.248 CCCCCCNCC[C@@H](C)CO 74511eb67258178be77544d52e2594e6 [0,1,0,0,0,0|1,0,0]=2 3903 B12R0.248 CCCCCCOCCC(=O)NC dc8f3be555a715028c848fc47355aefa [0,1,0,0,0,0|1,0,2]=4 3904 B12R0.248 CCCCCCOCCC(=O)OC fcfca6f4a105eb36c6bdf010574fee04 [0,1,0,0,0,0|1,0,2]=4 3905 B12R0.248 CCCCCCOCCC(C)CC 0bf22f4f31b54d481b3dc28178050982 [0,1,0,0,0,0|2,0,0]=3 3906 B12R0.248 CCCCCCOCCC(C)OC 8baa815023902eeec2134340266a7918 [0,1,0,0,0,0|1,0,0]=2 3907 B12R0.248 CCCCCCOCCC(S)CC 0f7663dcaffff5af72f4b664cdadf80e [0,1,0,0,0,0|1,1,0]=3 3908 B12R0.248 CCCCCCOCCN(C)C#N 204b2dae48c5b1464e4e49f74b13d664 [0,1,0,0,0,0|3,0,0]=4 3909 B12R0.248 CCCCCCOCCN(C)C=O 7fb26b9c90aa644da7a0173310926453 [0,1,0,0,0,0|2,0,1]=4 3910 B12R0.248 CCCCCCOCC[C@@H](C)CC ab96e7d06a7b2bfdf02b55cc867a35fb [0,1,0,0,0,0|2,0,0]=3 3911 B12R0.248 CCCCCNCCCC(=O)NC 9e3cd31bd5bd22bd1e57817a487c3f2c [0,1,0,0,0,0|1,0,2]=4 3912 B12R0.248 CCCCCNCCCC(=O)OC df636db288139b82b44ccdc35fadd3aa [0,1,0,0,0,0|1,0,2]=4 3913 B12R0.248 CCCCCNCCCC(C)CO 75f4715a7fdd4014f169ec0d56ead1f2 [0,1,0,0,0,0|1,0,0]=2 3914 B12R0.248 CCCCCNCCCN(C)CC c3d422e211f8c0174fa1023c3c5d6758 [0,1,0,0,0,0|3,0,0]=4 3915 B12R0.248 CCCCCNCCOC(C)C#N d701563f9029b07553c8889ae28bd517 [0,1,0,0,0,0|3,0,0]=4 3916 B12R0.248 CCCCCOCCCC(=O)NC 26adbe93f4240f6151d8eb03ba68d821 [0,1,0,0,0,0|1,0,2]=4 3917 B12R0.248 CCCCCOCCCC(=O)OC 6d595d79d4a782dba780cd78bb66a9c8 [0,1,0,0,0,0|1,0,2]=4 3918 B12R0.248 CCCCCOCCCC(C)CC 12724e519e83b2c2a2b4c09a8676b5e6 [0,1,0,0,0,0|2,0,0]=3 3919 B12R0.248 CCCCCOCCCN(C)CC d2bb07644b6195bb7ca060bda926a678 [0,1,0,0,0,0|3,0,0]=4 3920 B12R0.248 CCCCCOCCC[C@@H](C)CC 6d6653804edd39adb7dde8b908a3fe18 [0,1,0,0,0,0|2,0,0]=3 3921 B12R0.248 CCCCCOCCOC(C)C#N 864bbbe3ff1e52d1a5148ff4176724b9 [0,1,0,0,0,0|3,0,0]=4 3922 B12R0.248 CCCCCOCCOC(C)C=O 3d4aafecfd5a096c4b85138d5a5ca69a [0,1,0,0,0,0|2,0,1]=4 3923 B12R0.248 CCCCCOCCOC(C)CC 50841120c627819ffb2c792316cbc975 [0,1,0,0,0,0|3,0,0]=4 3924 B12R0.248 CCCCCOCCO[C@H](C)C=O 2ce59c2adaa6e3aa0099fece6ec73159 [0,1,0,0,0,0|2,0,1]=4 3925 B12R0.248 CCCCNCCCCC(=O)CC 75ca588ca1aaa2c811fe1088d3346fe6 [0,1,0,0,0,0|1,0,2]=4 3926 B12R0.248 CCCCNCCCCC(=O)OC 581f41ce8229ec98b014f7c6df60648e [0,1,0,0,0,0|1,0,2]=4 3927 B12R0.248 CCCCOCCCCC(=O)CC e302404d6275421b52ba8d82a0a0ca19 [0,1,0,0,0,0|1,0,2]=4 3928 B12R0.248 CCCCOCCCCC(=O)OC dd999d0123fc4f5efca686b1cd68edc5 [0,1,0,0,0,0|1,0,2]=4 3929 B12R0.248 CCCCOCCCCC(C)CC 227b1c30a46e97406211f2f02b041331 [0,1,0,0,0,0|2,0,0]=3 3930 B12R0.248 CCCCOCCCC[C@@H](C)CC 12328991f83c7bebf418037048ff50f7 [0,1,0,0,0,0|2,0,0]=3 3931 B12R0.248 CCCCOCCCNC(C)C#N 614c73492739c0c0e92d348c64bc7bdb [0,1,0,0,0,0|3,0,0]=4 3932 B12R0.248 CCCCOCCCNC(C)C=O 81cd40665d4fc3a05208353d6983a899 [0,1,0,0,0,0|2,0,1]=4 3933 B12R0.248 CCCCOCCCNC(C)CC 3cf0a7dc9f1e8d2193201aab09db13a3 [0,1,0,0,0,0|3,0,0]=4 3934 B12R0.248 CCCCOCCCNC(C)CO 248fe2ae548c5f280afabcbc876b3264 [0,1,0,0,0,0|2,0,0]=3 3935 B12R0.248 CCCCOCCCN[C@@H](C)CO 92d00ecc268b4fe78257e3de62352876 [0,1,0,0,0,0|2,0,0]=3 3936 B12R0.248 CCCCOCCCN[C@H](C)C=O c2fc12059f05d1ee8edad228573904a1 [0,1,0,0,0,0|2,0,1]=4 3937 B12R0.248 CCCCOCCCN[C@H](C)CO 0b202a885f208c21cc4b7a2e01cb8bce [0,1,0,0,0,0|2,0,0]=3 3938 B12R0.248 CCCCOCCCOC(C)C#N b8d366c5647dbc34ae841ca747d140b1 [0,1,0,0,0,0|3,0,0]=4 3939 B12R0.248 CCCCOCCCOC(C)C=O 1447193e7723a59658178a2b912cfc8c [0,1,0,0,0,0|2,0,1]=4 3940 B12R0.248 CCCCOCCCOC(C)CC cc63a68eae9053a199f8864cbe392476 [0,1,0,0,0,0|3,0,0]=4 3941 B12R0.248 CCCCOCCCO[C@H](C)C=O 78cf0da59a9193c85b6c0d6d3622c2c6 [0,1,0,0,0,0|2,0,1]=4 3942 B12R0.248 CCCCOCCNCC(Br)CBr cd1a668918bdb7103a717181a9f772b1 [0,1,0,0,0,0|3,0,0]=4 3943 B12R0.248 CCCCOCCNCC(C)C#N 8869d4172d390a7f510581a84026ca16 [0,1,0,0,0,0|3,0,0]=4 3944 B12R0.248 CCCCOCCNCC(C)CC 70a7fa563fbf32286a5201fe5cd084c7 [0,1,0,0,0,0|3,0,0]=4 3945 B12R0.248 CCCCOCCNCC(C)CO 2edc97ea835b2a6b74eb77ffe9fda0d0 [0,1,0,0,0,0|2,0,0]=3 3946 B12R0.248 CCCCOCCNCC(C)OC 7c46d66abd9299efcdadc8f1d0e8d1ad [0,1,0,0,0,0|2,0,0]=3 3947 B12R0.248 CCCCOCCNCC(F)CO 0f3161755ece91597b03e6fc85e7d7db [0,1,0,0,0,0|3,0,0]=4 3948 B12R0.248 CCCCOCCNCC(O)CC 5357718e3a9dec554e41e10db71f2df6 [0,1,0,0,0,0|2,0,0]=3 3949 B12R0.248 CCCCOCCNCC(O)CF 89b022672c024af95361e7877b2e8333 [0,1,0,0,0,0|2,0,0]=3 3950 B12R0.248 CCCCOCCNCC(O)CO 9f45b352c00f22aaa61061cdcae2be90 [0,1,0,0,0,0|2,0,0]=3 3951 B12R0.248 CCCCOCCNC[C@@H](C)CC db67e89a9726777a0f55ed6e47940565 [0,1,0,0,0,0|3,0,0]=4 3952 B12R0.248 CCCCOCCNC[C@@H](C)CO 9575751df8d6e57fae1513abc171a77e [0,1,0,0,0,0|2,0,0]=3 3953 B12R0.248 CCCCOCCNC[C@@H](C)OC 1ff1b1381e6329b854316dccb36578cd [0,1,0,0,0,0|2,0,0]=3 3954 B12R0.248 CCCCOCCNC[C@@H](F)CO d29a9d42ce94536d1d52f579059d4f6e [0,1,0,0,0,0|3,0,0]=4 3955 B12R0.248 CCCCOCCNC[C@@H](O)CO 6a072c7cd2bcd8880f452d70f31d000f [0,1,0,0,0,0|2,0,0]=3 3956 B12R0.248 CCCCOCCNC[C@H](C)CC 545feaf667fec6bb51edfbe9221aeb74 [0,1,0,0,0,0|3,0,0]=4 3957 B12R0.248 CCCCOCCNC[C@H](C)CO 05aae4b7e194ff24d64a47946a8095c2 [0,1,0,0,0,0|2,0,0]=3 3958 B12R0.248 CCCCOCCNC[C@H](C)OC bebc8d64cc844e62412c6f90c443dfd3 [0,1,0,0,0,0|2,0,0]=3 3959 B12R0.248 CCCCOCCNC[C@H](F)CO 9cef36ab2695e3747efa4afe234de182 [0,1,0,0,0,0|3,0,0]=4 3960 B12R0.248 CCCCOCCNC[C@H](O)CC 58e0dc53f1a4bfe039fce964f8077646 [0,1,0,0,0,0|2,0,0]=3 3961 B12R0.248 CCCCOCCNC[C@H](O)CO fa8c00c2bb2dd7d1271c254b22224a9b [0,1,0,0,0,0|2,0,0]=3 3962 B12R0.248 CCCCOCCOCC(Br)CBr 4350ddd3e727685d3d3a557ad6ad0f99 [0,1,0,0,0,0|3,0,0]=4 3963 B12R0.248 CCCCOCCOCC(C)C#N 472d9066c6f2915768808a966be7721f [0,1,0,0,0,0|3,0,0]=4 3964 B12R0.248 CCCCOCCOCC(C)CC 3a88cc16b4a9bea1f88526335116b74f [0,1,0,0,0,0|3,0,0]=4 3965 B12R0.248 CCCCOCCOCC(C)OC e44ca1f66b3621147d06dace7aa4ea2b [0,1,0,0,0,0|2,0,0]=3 3966 B12R0.248 CCCCOCCOCC(Cl)CCl 0116892b6f8c4ee30ee1f8a85ae8a4ab [0,1,0,0,0,0|3,0,0]=4 3967 B12R0.248 CCCCOCCOCC(O)CO 673eebf2c29f973b7ef4e902dcd6dfc1 [0,1,0,0,0,0|2,0,0]=3 3968 B12R0.248 CCCCOCCOCC(S)CS e7594342bf876103a5f3412b0d230062 [0,1,0,0,0,0|2,1,0]=4 3969 B12R0.248 CCCCOCCOC[C@@H](C)CC e6d387e6307802aab4f3ea88654cb740 [0,1,0,0,0,0|3,0,0]=4 3970 B12R0.248 CCCCOCCOC[C@@H](C)OC f0bc0fd4a62d4ff19ae9c20644a5f5bf [0,1,0,0,0,0|2,0,0]=3 3971 B12R0.248 CCCCOCCOC[C@@H](O)CO b2a0ef2d0ce8c5d06f1b5d4ba16c46f5 [0,1,0,0,0,0|2,0,0]=3 3972 B12R0.248 CCCCOCCOC[C@H](C)CC d866cfaf6e4c604b7eb1906e1a2084eb [0,1,0,0,0,0|3,0,0]=4 3973 B12R0.248 CCCCOCCOC[C@H](C)OC 8a6f187f71ea5a7a43e9f07b64b2a33e [0,1,0,0,0,0|2,0,0]=3 3974 B12R0.248 CCCCOCCOC[C@H](O)CO c55eedb0c3e73a800286062cb06e3568 [0,1,0,0,0,0|2,0,0]=3 3975 B12R0.248 CCCCOCNCCC(C)CC 40bc60e36af2e273bea33945f2ea3729 [0,1,0,0,0,0|3,0,0]=4 3976 B12R0.248 CCCCOCNCCC(C)CO cd4768c6b9ef76db08c0f44666135907 [0,1,0,0,0,0|2,0,0]=3 3977 B12R0.248 CCCCOCNCCC(O)CO 6820127802730b6c84ac7e44954d4e94 [0,1,0,0,0,0|2,0,0]=3 3978 B12R0.248 CCCCOCNCC[C@@H](C)CO 7d1b6404c3375968ea345a91b1ef594a [0,1,0,0,0,0|2,0,0]=3 3979 B12R0.248 CCCCOCOCCC(C)CC 6d79e4320b267207fbf4e12157eb0589 [0,1,0,0,0,0|3,0,0]=4 3980 B12R0.248 CCCCOCOCCC(C)OC bba2269055232cac32725fd530ab4c20 [0,1,0,0,0,0|2,0,0]=3 3981 B12R0.248 CCCCOCOCCC(S)CC 848e97bca5aceb5cc1f1215457e493ff [0,1,0,0,0,0|2,1,0]=4 3982 B12R0.248 CCCCOCOCC[C@@H](C)CC 9bc70de5169650db08b6e7a4a103c040 [0,1,0,0,0,0|3,0,0]=4 3983 B12R0.248 CCCCSCCOCC(C)C#N 68e743974fea42ce84234d45cb4d6bbd [0,1,0,0,0,0|3,0,0]=4 3984 B12R0.248 CCCCSCCOCC(C)CC 8af86fc991a22d2870634bd5b792aa2a [0,1,0,0,0,0|3,0,0]=4 3985 B12R0.248 CCCCSCCOCC(C)OC 32fd22f2ca04816dfbe5aaae33af241e [0,1,0,0,0,0|2,0,0]=3 3986 B12R0.248 CCCCSCCOCC(O)CO 810010df9793b9103060e23065ca2cbc [0,1,0,0,0,0|2,0,0]=3 3987 B12R0.248 CCCCSCCOC[C@@H](C)CC 08cc68b1e76966dbe20f907500b41362 [0,1,0,0,0,0|3,0,0]=4 3988 B12R0.248 CCCCSCCOC[C@@H](C)OC bb728725e7885f18ebac1811acbf0871 [0,1,0,0,0,0|2,0,0]=3 3989 B12R0.248 CCCCSCCOC[C@@H](O)CO 66f4915b93a0f15cf1ab0de7b320e16c [0,1,0,0,0,0|2,0,0]=3 3990 B12R0.248 CCCCSCCOC[C@H](C)CC eeddb91c836136be6c1ad0d2ce51be37 [0,1,0,0,0,0|3,0,0]=4 3991 B12R0.248 CCCCSCCOC[C@H](C)OC 1d55a94561ce01d10cb56b10d16e58ab [0,1,0,0,0,0|2,0,0]=3 3992 B12R0.248 CCCCSCCOC[C@H](O)CO 269b7dc9a9be539973844e2cbc5ee6c0 [0,1,0,0,0,0|2,0,0]=3 3993 B12R0.248 CCCNCCCCCC(=O)OC 50a153133ff67a283d48c3f51024f3bc [0,1,0,0,0,0|1,0,2]=4 3994 B12R0.248 CCCOCCCCCC(=O)OC 852d725e6d7eda057314915a42d96742 [0,1,0,0,0,0|1,0,2]=4 3995 B12R0.248 CCCOCCCCCC(C)CC 9f77c79cbbc99ad412360db274ad6c6a [0,1,0,0,0,0|2,0,0]=3 3996 B12R0.248 CCCOCCCCC[C@@H](C)CC aab92d9063ab272fd6336daab6308ca7 [0,1,0,0,0,0|2,0,0]=3 3997 B12R0.248 CCCOCCCNCC(Br)CBr e09710b2a5c2612afd8ea15986823096 [0,1,0,0,0,0|3,0,0]=4 3998 B12R0.248 CCCOCCCNCC(C)C#N f8f839ceb83b9293b380738aa52c48ab [0,1,0,0,0,0|3,0,0]=4 3999 B12R0.248 CCCOCCCNCC(C)CC 34f2256af422c18ed028eba23a0f9fa3 [0,1,0,0,0,0|3,0,0]=4 4000 B12R0.248 CCCOCCCNCC(C)CO b97c0c8178573e85005a57b4ccdb0c61 [0,1,0,0,0,0|2,0,0]=3 4001 B12R0.248 CCCOCCCNCC(C)OC f6ab28d948e1820c3f7b0d4691cbb31f [0,1,0,0,0,0|2,0,0]=3 4002 B12R0.248 CCCOCCCNCC(F)CO 6f4ab4979f2ca490c1d9c46df7b1c4ba [0,1,0,0,0,0|3,0,0]=4 4003 B12R0.248 CCCOCCCNCC(O)CC e1f11e4c84f2c698b98b4521c6fa7188 [0,1,0,0,0,0|2,0,0]=3 4004 B12R0.248 CCCOCCCNCC(O)CF 4d32f295408232ecdbaa9a5900050d34 [0,1,0,0,0,0|2,0,0]=3 4005 B12R0.248 CCCOCCCNCC(O)CO bcbb190bbcd78f141512f7f3f0919612 [0,1,0,0,0,0|2,0,0]=3 4006 B12R0.248 CCCOCCCNC[C@@H](C)CC 60f99dcb8808bb877a1a47eeb1778eec [0,1,0,0,0,0|3,0,0]=4 4007 B12R0.248 CCCOCCCNC[C@@H](C)CO c0ce60393794a2722e2c73dc53744136 [0,1,0,0,0,0|2,0,0]=3 4008 B12R0.248 CCCOCCCNC[C@@H](C)OC 09142fc183b43e592f5c37fa2b7d7408 [0,1,0,0,0,0|2,0,0]=3 4009 B12R0.248 CCCOCCCNC[C@@H](F)CO 3e6503ad115fc8b3869a0785a0d700a4 [0,1,0,0,0,0|3,0,0]=4 4010 B12R0.248 CCCOCCCNC[C@@H](O)CO 0b3f5f47affcaa99de2b1343b6fea702 [0,1,0,0,0,0|2,0,0]=3 4011 B12R0.248 CCCOCCCNC[C@H](C)CC 842af79e4aace16b01219ca375db892d [0,1,0,0,0,0|3,0,0]=4 4012 B12R0.248 CCCOCCCNC[C@H](C)CO 43570f800671642d47bd17970e9709fd [0,1,0,0,0,0|2,0,0]=3 4013 B12R0.248 CCCOCCCNC[C@H](C)OC 1d2ff26c0271969786a1b8ece3719e42 [0,1,0,0,0,0|2,0,0]=3 4014 B12R0.248 CCCOCCCNC[C@H](F)CO 6ad75fa41c51724e39c7a566f0803839 [0,1,0,0,0,0|3,0,0]=4 4015 B12R0.248 CCCOCCCNC[C@H](O)CC fa52f29ddb6af9621d115120f129c2ac [0,1,0,0,0,0|2,0,0]=3 4016 B12R0.248 CCCOCCCNC[C@H](O)CO 2a6b5942e02e19a11719044421a337e2 [0,1,0,0,0,0|2,0,0]=3 4017 B12R0.248 CCCOCCCOCC(Br)CBr e07e3ae71eecb5df247f9c54afbb6dc0 [0,1,0,0,0,0|3,0,0]=4 4018 B12R0.248 CCCOCCCOCC(C)C#N faab4c30e46346b3dac11763f2245c69 [0,1,0,0,0,0|3,0,0]=4 4019 B12R0.248 CCCOCCCOCC(C)CC 0c0fcd53fa44f62f50c1acfbd1f398a8 [0,1,0,0,0,0|3,0,0]=4 4020 B12R0.248 CCCOCCCOCC(C)OC f756b683068810b1185cc0f4201dcf31 [0,1,0,0,0,0|2,0,0]=3 4021 B12R0.248 CCCOCCCOCC(Cl)CCl 077edd1fcef266846114b04ae43bfa43 [0,1,0,0,0,0|3,0,0]=4 4022 B12R0.248 CCCOCCCOCC(S)CS 4e5863f42095ca0b73a9d84cf0ac5e4c [0,1,0,0,0,0|2,1,0]=4 4023 B12R0.248 CCCOCCCOC[C@@H](C)CC 65979b658d11640c32bb3fe6d9886bb6 [0,1,0,0,0,0|3,0,0]=4 4024 B12R0.248 CCCOCCCOC[C@@H](C)OC f76149b83056ef0c044ed9f34d75d1d8 [0,1,0,0,0,0|2,0,0]=3 4025 B12R0.248 CCCOCCCOC[C@H](C)CC 48ff71dcbc2caebd49b2a280a73eb7cb [0,1,0,0,0,0|3,0,0]=4 4026 B12R0.248 CCCOCCCOC[C@H](C)OC 7abb2e9df558dfa3bfad336da9daa200 [0,1,0,0,0,0|2,0,0]=3 4027 B12R0.248 CCCOCCNCCC(C)CC 0ef22e9f538dc35f5d86e4e06222ab87 [0,1,0,0,0,0|3,0,0]=4 4028 B12R0.248 CCCOCCNCCC(C)CO 8e95d2bf043d6ccfb0489f91ba98ed09 [0,1,0,0,0,0|2,0,0]=3 4029 B12R0.248 CCCOCCNCCC(O)CO 6ff8eb963d655442aaa3290fec028a6e [0,1,0,0,0,0|2,0,0]=3 4030 B12R0.248 CCCOCCNCC[C@@H](C)CO 2f3bd698394190b9c5eca0c9970324fa [0,1,0,0,0,0|2,0,0]=3 4031 B12R0.248 CCCOCCOCCC(C)CC cc68d5d828a2ea6fae74364fcdb11f6a [0,1,0,0,0,0|3,0,0]=4 4032 B12R0.248 CCCOCCOCCC(C)OC 75438806c65eee856a6ab9b861023591 [0,1,0,0,0,0|2,0,0]=3 4033 B12R0.248 CCCOCCOCCC(S)CC 0682f5351b746cd6cdaaab810f94634a [0,1,0,0,0,0|2,1,0]=4 4034 B12R0.248 CCCOCCOCC[C@@H](C)CC cc50f0531eea8f980afd3b971ba289ad [0,1,0,0,0,0|3,0,0]=4 4035 B12R0.248 CCCSCCCCNC(C)C#N 0f3bc97f906d701500532512f39d5b54 [0,1,0,0,0,0|3,0,0]=4 4036 B12R0.248 CCCSCCCCNC(C)C=O ce5d6a774015baec7704e5efad017b73 [0,1,0,0,0,0|2,0,1]=4 4037 B12R0.248 CCCSCCCCNC(C)CC c7d636649f800424f3211b728444020c [0,1,0,0,0,0|3,0,0]=4 4038 B12R0.248 CCCSCCCCNC(C)CO 6317146df2f20c2e26f54799d89814d7 [0,1,0,0,0,0|2,0,0]=3 4039 B12R0.248 CCCSCCCCN[C@@H](C)CO 720932c7d147a76024954a9fe6b5d029 [0,1,0,0,0,0|2,0,0]=3 4040 B12R0.248 CCCSCCCCN[C@H](C)C=O d62f31d80d7f37f32ba7634066b3f4b3 [0,1,0,0,0,0|2,0,1]=4 4041 B12R0.248 CCCSCCCCN[C@H](C)CO 61188cea6c4c27d43130459a0705c9d1 [0,1,0,0,0,0|2,0,0]=3 4042 B12R0.248 CCCSCCOCCC(C)CC 1a05855fc6c01cbe1a10742189391fb4 [0,1,0,0,0,0|3,0,0]=4 4043 B12R0.248 CCN(C)CCCCCCCCO 247c7e02e3da17aa0d7359733b690928 [0,1,0,0,0,0|3,0,0]=4 4044 B12R0.248 CCNCCCCCCC(=O)OC 1cc47f298a3d094fe024703851966ff0 [0,1,0,0,0,0|1,0,2]=4 4045 B12R0.248 CCOCCCCCCC(=O)OC 86e68201f215ac95030704e4770cdead [0,1,0,0,0,0|1,0,2]=4 4046 B12R0.248 CCOCCCNCCC(C)CC 2528e8f017c711ad6c27fe097b40469f [0,1,0,0,0,0|3,0,0]=4 4047 B12R0.248 CCOCCCNCCC(C)CO bf433b5d6af821a5f56a1e50d6f2577a [0,1,0,0,0,0|2,0,0]=3 4048 B12R0.248 CCOCCCNCCC(O)CO f7167d72b65126a6cdf0ae8c5d00f622 [0,1,0,0,0,0|2,0,0]=3 4049 B12R0.248 CCOCCCNCC[C@@H](C)CO 81bbb47c1958039fd78b7f811704fcb1 [0,1,0,0,0,0|2,0,0]=3 4050 B12R0.248 CCOCCCOCCC(C)CC 85a735d024d73d78debcbb6f26ee0f5d [0,1,0,0,0,0|3,0,0]=4 4051 B12R0.248 CCOCCCOCCC(C)OC 67df87c544f03ab0a5e4c2ef5f954e7f [0,1,0,0,0,0|2,0,0]=3 4052 B12R0.248 CCOCCCOCCC(S)CC e238d579406f2377b70c40a8d7f875a4 [0,1,0,0,0,0|2,1,0]=4 4053 B12R0.248 CCOCCCOCC[C@@H](C)CC a42322fb796a01cf312c7ada71e4105e [0,1,0,0,0,0|3,0,0]=4 4054 B12R0.248 CCOCCNCCCC(C)CO 90414bbb3a46490967372eed67fda904 [0,1,0,0,0,0|2,0,0]=3 4055 B12R0.248 CCOCCOCCCC(C)CC dbb3b98d3cafc56f029c4a46f412cb45 [0,1,0,0,0,0|3,0,0]=4 4056 B12R0.248 CCOCCOCCC[C@@H](C)CC 2e6a10585102004cac17d3f3281a237d [0,1,0,0,0,0|3,0,0]=4 4057 B12R0.248 CCOCCOCCNC(C)CO 5deb6920b2491866ce950c3ac43effd1 [0,1,0,0,0,0|3,0,0]=4 4058 B12R0.248 CCOCCOCCN[C@@H](C)CO 00e9ddd87a38ffd2310e07e7e8f6845d [0,1,0,0,0,0|3,0,0]=4 4059 B12R0.248 CCOCCOCCN[C@H](C)CO 45f7dfaca037d77c2bb46a22a440e34b [0,1,0,0,0,0|3,0,0]=4 4060 B12R0.248 CCOCOCCCCC(C)CC 6e8f7f8af62b0679500cc5271acb09bb [0,1,0,0,0,0|3,0,0]=4 4061 B12R0.248 CCOCOCCCC[C@@H](C)CC 3a2d27457b36184226a2b3ff203ee3fb [0,1,0,0,0,0|3,0,0]=4 4062 B12R0.248 CCSCCCCNCC(C)C#N 6c856a7740fbf4e7ef2c0bf44f340df7 [0,1,0,0,0,0|3,0,0]=4 4063 B12R0.248 CCSCCCCNCC(C)CC fb047431176b3a2bff4910c0d9cff557 [0,1,0,0,0,0|3,0,0]=4 4064 B12R0.248 CCSCCCCNCC(C)CO 3f9c2e19d0491d1a2c992864cbfd8e5e [0,1,0,0,0,0|2,0,0]=3 4065 B12R0.248 CCSCCCCNCC(C)OC dd7017409c1c58f8743e3583682f3836 [0,1,0,0,0,0|2,0,0]=3 4066 B12R0.248 CCSCCCCNCC(O)CC cf7cebd9def79a580f84865726cd4a22 [0,1,0,0,0,0|2,0,0]=3 4067 B12R0.248 CCSCCCCNCC(O)CF b6535b1abc1c0be2b1f786028c08f685 [0,1,0,0,0,0|2,0,0]=3 4068 B12R0.248 CCSCCCCNCC(O)CO 81aa06dc3d676b6f5d6880ed0b4d90a6 [0,1,0,0,0,0|2,0,0]=3 4069 B12R0.248 CCSCCCCNC[C@@H](C)CC f5cae3226ba7313ab600564a54f5a7e1 [0,1,0,0,0,0|3,0,0]=4 4070 B12R0.248 CCSCCCCNC[C@@H](C)CO b19249c49545d5068f544d9f116ae113 [0,1,0,0,0,0|2,0,0]=3 4071 B12R0.248 CCSCCCCNC[C@@H](C)OC 6a09e93d504cb00df6183acf09f1c304 [0,1,0,0,0,0|2,0,0]=3 4072 B12R0.248 CCSCCCCNC[C@@H](O)CO b8ebafcc0f2ced03407a994e7bb59858 [0,1,0,0,0,0|2,0,0]=3 4073 B12R0.248 CCSCCCCNC[C@H](C)CC 5338b0ce3e070adfdb0720420b81e4fc [0,1,0,0,0,0|3,0,0]=4 4074 B12R0.248 CCSCCCCNC[C@H](C)CO 24aeee4d860c43ab9a2a9de88f9943a8 [0,1,0,0,0,0|2,0,0]=3 4075 B12R0.248 CCSCCCCNC[C@H](C)OC 8e9d22391254281785b252d4ddbe2ee9 [0,1,0,0,0,0|2,0,0]=3 4076 B12R0.248 CCSCCCCNC[C@H](O)CO 0092f52e7f9203b4bb244dcd160fe722 [0,1,0,0,0,0|2,0,0]=3 4077 B12R0.248 CCSCCCNCCC(C)CC 598b596f00733da3eb1f36a28f7b835c [0,1,0,0,0,0|3,0,0]=4 4078 B12R0.248 CCSCCCNCCC(C)CO 27c4ca07c448fca06aa036a399d3ef2b [0,1,0,0,0,0|2,0,0]=3 4079 B12R0.248 CCSCCCNCCC(O)CO 338606dbacbc62ba93d1a33a425ea986 [0,1,0,0,0,0|2,0,0]=3 4080 B12R0.248 CCSCCCNCC[C@@H](C)CO 2ac489f0ae5394bee3d6ee6932a97b87 [0,1,0,0,0,0|2,0,0]=3 4081 B12R0.248 CCSCCCOCCC(C)CC 0bc55e141023f1116d152725bf367cda [0,1,0,0,0,0|3,0,0]=4 4082 B12R0.248 CCSCCCOCCC(C)OC d786254f8209ae06167b4db369f878d1 [0,1,0,0,0,0|2,0,0]=3 4083 B12R0.248 CCSCCCOCCC(S)CC 8bdef410db42c0f55a6ba421b7afe589 [0,1,0,0,0,0|2,1,0]=4 4084 B12R0.248 CCSCCCOCC[C@@H](C)CC 099a0b71fac36ef03869b4ecec44f611 [0,1,0,0,0,0|3,0,0]=4 4085 B12R0.248 CCSCCNCCCC(C)CO a7e02863a88f5089b72b10e543477d18 [0,1,0,0,0,0|2,0,0]=3 4086 B12R0.248 CCSCCOCCCC(C)CC 2c6f01e8ceaf5ae0898ac18de94aa931 [0,1,0,0,0,0|3,0,0]=4 4087 B12R0.248 CCSCCOCCC[C@@H](C)CC 0c508bff772dbdf3e039c250555f714c [0,1,0,0,0,0|3,0,0]=4 4088 B12R0.248 CC[C@@H](C)CNCCCCCCCl a396692bb99b039b20edb5b1e684c9ac [0,1,0,0,0,0|3,0,0]=4 4089 B12R0.248 CC[C@@H](C)CNCCCCCCO 35a0b9210c12f687c8031112bea4842a [0,1,0,0,0,0|3,0,0]=4 4090 B12R0.248 CC[C@@H](C)CNCCCCCOC 059d00c001afea645fb57580eb3fb22d [0,1,0,0,0,0|3,0,0]=4 4091 B12R0.248 CC[C@@H](C)COCCCCCCF ed306dc96dbc250597d0fb47014ee6f3 [0,1,0,0,0,0|3,0,0]=4 4092 B12R0.248 CC[C@@H](C)COCCCCCCS b1a511746b65cc96b8d53ea8afa48f8e [0,1,0,0,0,0|3,0,0]=4 4093 B12R0.248 CC[C@@H](C)COCCCCCOC ae8f66d4b2e382ab31d36c595c499b7d [0,1,0,0,0,0|3,0,0]=4 4094 B12R0.248 CC[C@@H](C)NCCCCCCCO 3070068b7cbaa931273c71e741a07715 [0,1,0,0,0,0|3,0,0]=4 4095 B12R0.248 CC[C@@H](C)NCCCCCCOC 4d0661f50849e695f7061df14feb8d57 [0,1,0,0,0,0|3,0,0]=4 4096 B12R0.248 CC[C@@H](C)OCCCCCCOC 81e83abacabc0b8f1756dd39b7d35ea0 [0,1,0,0,0,0|3,0,0]=4 4097 B12R0.248 CC[C@@H](O)CNCCCCCC#N aef2e39d228d2413db2a0f9eb25b5d37 [0,1,0,0,0,0|2,0,1]=4 4098 B12R0.248 CC[C@@H](O)CNCCCCCC=O 0930980ab15dd5c90634b2420a141834 [0,1,0,0,0,0|2,0,1]=4 4099 B12R0.248 CC[C@@H](O)CNCCCCCCF f374f5b724fd32a237adb23a81d6abf0 [0,1,0,0,0,0|2,0,0]=3 4100 B12R0.248 CC[C@@H](O)CNCCCCCCO 2c7d46f7d769af87c612f1133919cd1b [0,1,0,0,0,0|2,0,0]=3 4101 B12R0.248 CC[C@@H](O)CNCCCCCOC 6fe57ffd32e1e6588df06345482e21cb [0,1,0,0,0,0|2,0,0]=3 4102 B12R0.248 CC[C@@H](O)CNCCOCCOC 902da24df767762aae43759238bf3bd2 [0,1,0,0,0,0|3,0,0]=4 4103 B12R0.248 CC[C@H](C)CCCCCOCCF 9861d94717ee5a0c1fd0e8be350d2f3f [0,1,0,0,0,0|3,0,0]=4 4104 B12R0.248 CC[C@H](C)CCCCCOCCS 243793892c51337a2b88c1aebffd36d1 [0,1,0,0,0,0|3,0,0]=4 4105 B12R0.248 CC[C@H](C)CCCCCOCOC 8a26ec64ca20272eb1509efbe68cd05b [0,1,0,0,0,0|3,0,0]=4 4106 B12R0.248 CC[C@H](C)CCCCCOCSC 287b5b4c691fcfa022e7b39d8d2ad483 [0,1,0,0,0,0|3,0,0]=4 4107 B12R0.248 CC[C@H](C)CCCCOCCCF 0092621e2b8b8b021740b096ce7ea4de [0,1,0,0,0,0|3,0,0]=4 4108 B12R0.248 CC[C@H](C)CCCCOCCCS 3a29ae78e356e3613df7c625a6e59e28 [0,1,0,0,0,0|3,0,0]=4 4109 B12R0.248 CC[C@H](C)CCCCOCCOC f5b62c4dd03e33acc9cec5b4feb26fc2 [0,1,0,0,0,0|3,0,0]=4 4110 B12R0.248 CC[C@H](C)CCCCOCCSC 011d7de30ae8c1e5eb602be10bf94468 [0,1,0,0,0,0|3,0,0]=4 4111 B12R0.248 CC[C@H](C)CCCOCCCCF d99020cde694d2965cd068276cba25ac [0,1,0,0,0,0|3,0,0]=4 4112 B12R0.248 CC[C@H](C)CCCOCCCOC 6fee221a7cad46383b5e75c8f34c3d39 [0,1,0,0,0,0|3,0,0]=4 4113 B12R0.248 CC[C@H](C)CCCOCCCSC 02e9c226cca4cb95a81c0e4b2f27c86e [0,1,0,0,0,0|3,0,0]=4 4114 B12R0.248 CC[C@H](C)CCOCCCCCF 786cea65300e7bad4eb1b80c7f06995f [0,1,0,0,0,0|3,0,0]=4 4115 B12R0.248 CC[C@H](C)CCOCCCCOC 57db59fe9ae55201b25da65d3ef52f64 [0,1,0,0,0,0|3,0,0]=4 4116 B12R0.248 CC[C@H](C)CNCCCCCCCl 6336856b68dbc8a4c729bff2181c0127 [0,1,0,0,0,0|3,0,0]=4 4117 B12R0.248 CC[C@H](C)CNCCCCCCF e3b5dfda13ee4fdecdb4c853b16569a0 [0,1,0,0,0,0|3,0,0]=4 4118 B12R0.248 CC[C@H](C)CNCCCCCCO 8228c83ddeab969996b8321b6e4059d6 [0,1,0,0,0,0|3,0,0]=4 4119 B12R0.248 CC[C@H](C)CNCCCCCOC 711a1f7db074baec88b2a9be48c0c303 [0,1,0,0,0,0|3,0,0]=4 4120 B12R0.248 CC[C@H](C)COCCCCCCF 145f2a35d39437c483b3fc491f3ec11c [0,1,0,0,0,0|3,0,0]=4 4121 B12R0.248 CC[C@H](C)COCCCCCCS 6a8add636da0c2f4b4e7d56e9053207b [0,1,0,0,0,0|3,0,0]=4 4122 B12R0.248 CC[C@H](C)COCCCCCOC a371e387955ad01b617c63013c4c95db [0,1,0,0,0,0|3,0,0]=4 4123 B12R0.248 CC[C@H](C)NCCCCCCCO b3d4185050783c944d238126e2c7b238 [0,1,0,0,0,0|3,0,0]=4 4124 B12R0.248 CC[C@H](C)NCCCCCCOC 6d1295c460dcadbfeaf5b6ab7f2ee7a2 [0,1,0,0,0,0|3,0,0]=4 4125 B12R0.248 CC[C@H](C)OCCCCCCOC b60e4c5c1c153ccab0e5c314894b66d0 [0,1,0,0,0,0|3,0,0]=4 4126 B12R0.248 COC(C)CCOCCCCC#N 315dfc710dfa556661def62a2e007073 [0,1,0,0,0,0|2,0,1]=4 4127 B12R0.248 COC(C)CCOCCCCC=O fe81ea975be2633510e758639da4979a [0,1,0,0,0,0|2,0,1]=4 4128 B12R0.248 COC(C)CCOCCCCCF 46a6ede89e094cc799c6ef0fd7004656 [0,1,0,0,0,0|2,0,0]=3 4129 B12R0.248 COC(C)CNCCCCCC#N 0c7df94b34c48a9706b29f01fc3dce69 [0,1,0,0,0,0|2,0,1]=4 4130 B12R0.248 COC(C)CNCCCCCCCl 50eefb6ceaf726c7cbda212cacd798f9 [0,1,0,0,0,0|2,0,0]=3 4131 B12R0.248 COC(C)CNCCCCCCO 54077320513ea138f6476b91833a52b4 [0,1,0,0,0,0|2,0,0]=3 4132 B12R0.248 COC(C)CNCCCOCCO 94084957ca62f97088d691c30556a7b2 [0,1,0,0,0,0|3,0,0]=4 4133 B12R0.248 COC(C)CNCCOCCCO d3951366893cf70952572e6fa893336f [0,1,0,0,0,0|3,0,0]=4 4134 B12R0.248 COC(C)COCCCCCC#N e78c291c0b48bec9d9b06f1e5cc57512 [0,1,0,0,0,0|2,0,1]=4 4135 B12R0.248 COC(C)COCCCCCC=O de77badb257ba494ad1f0256f59329fa [0,1,0,0,0,0|2,0,1]=4 4136 B12R0.248 COC(C)COCCCCCCF 44cc9a23fe27d61e75fe4d712da65ac3 [0,1,0,0,0,0|2,0,0]=3 4137 B12R0.248 COC(C)COCCCCCCS 506c3ae86924bad9a3b18012c0228cd7 [0,1,0,0,0,0|2,0,0]=3 4138 B12R0.248 COCCCCCCNC(C)C#N 4f2c69ccdae965b8b33996818d007908 [0,1,0,0,0,0|3,0,0]=4 4139 B12R0.248 COCCCCCCNC(C)CO c359e5d4b35810d8f94ff097c5dba394 [0,1,0,0,0,0|2,0,0]=3 4140 B12R0.248 COCCCCCCN[C@@H](C)CO 97d54bacb85f461973ceb7383f1e0ceb [0,1,0,0,0,0|2,0,0]=3 4141 B12R0.248 COCCCCCCN[C@H](C)CO 71f928a77adaea43e4b9fd9b70b0b806 [0,1,0,0,0,0|2,0,0]=3 4142 B12R0.248 COCCCCCCOC(C)C#N e7164e585059b00608ebd3fbfa23a611 [0,1,0,0,0,0|3,0,0]=4 4143 B12R0.248 COCCCCCCOC(C)C=O f48d988e9052a044fcb303f88c41f948 [0,1,0,0,0,0|2,0,1]=4 4144 B12R0.248 COCCCCCCOC(C)CF f16af05894e9a3528972ec18994f17af [0,1,0,0,0,0|3,0,0]=4 4145 B12R0.248 COCCCCCCOC(C)CS d7859c63b6c32e67359f4be36a1812ab [0,1,0,0,0,0|2,1,0]=4 4146 B12R0.248 COCCCCCCO[C@H](C)C=O 1193a88ea910d99ed2116bf93e9bb1fc [0,1,0,0,0,0|2,0,1]=4 4147 B12R0.248 COCCCCCCO[C@H](C)CS f263a71d7640f91a207a73913023bd06 [0,1,0,0,0,0|2,1,0]=4 4148 B12R0.248 COCCCCCNCC(Br)CBr 24968f070b1d04e5e58d62da71a85bb5 [0,1,0,0,0,0|3,0,0]=4 4149 B12R0.248 COCCCCCNCC(C)C#N 12c730a6615219544dab76c508b5e0f1 [0,1,0,0,0,0|3,0,0]=4 4150 B12R0.248 COCCCCCNCC(C)CO 550fe7cb7cd78e8b00d16654419f48e0 [0,1,0,0,0,0|2,0,0]=3 4151 B12R0.248 COCCCCCNCC(C)OC 1916176b10ef6e4f6019758444f25499 [0,1,0,0,0,0|2,0,0]=3 4152 B12R0.248 COCCCCCNCC(F)CO a94b0cc2aa4705d29ce2132df82c6ff1 [0,1,0,0,0,0|3,0,0]=4 4153 B12R0.248 COCCCCCNCC(O)CF 91ac3e3486ffd39a26b7bd80a2a05778 [0,1,0,0,0,0|2,0,0]=3 4154 B12R0.248 COCCCCCNCC(O)CO 804c784ab54181ee7bbbc282c50d21fc [0,1,0,0,0,0|2,0,0]=3 4155 B12R0.248 COCCCCCNC[C@@H](C)CO 7e27ac85d610007738ff78f268daa9c7 [0,1,0,0,0,0|2,0,0]=3 4156 B12R0.248 COCCCCCNC[C@@H](C)OC cefcd2b3570ad6c22e7ad13e1d93bb8d [0,1,0,0,0,0|2,0,0]=3 4157 B12R0.248 COCCCCCNC[C@@H](F)CO 64e725c0b22c20a06a303a8719d2dd60 [0,1,0,0,0,0|3,0,0]=4 4158 B12R0.248 COCCCCCNC[C@@H](O)CO c79a80151568a965068209f050040728 [0,1,0,0,0,0|2,0,0]=3 4159 B12R0.248 COCCCCCNC[C@H](C)CO b1f5316e6ddb88addd8094baa7936733 [0,1,0,0,0,0|2,0,0]=3 4160 B12R0.248 COCCCCCNC[C@H](C)OC 62c5550ccfe57bee3126113f8077fe18 [0,1,0,0,0,0|2,0,0]=3 4161 B12R0.248 COCCCCCNC[C@H](F)CO 809eab8572c9166319fd332889836841 [0,1,0,0,0,0|3,0,0]=4 4162 B12R0.248 COCCCCCNC[C@H](O)CO 2d0d886be852c56f0a189648ad6932e3 [0,1,0,0,0,0|2,0,0]=3 4163 B12R0.248 COCCCCCOCC(Br)CBr b84ba3c29c5254f0b4c8ca6bcd8123e5 [0,1,0,0,0,0|3,0,0]=4 4164 B12R0.248 COCCCCCOCC(C)C#N 2febf1d49af7262a53a75cd6e7e9211f [0,1,0,0,0,0|3,0,0]=4 4165 B12R0.248 COCCCCCOCC(C)OC c9259aeb04d7d4affa96750271b4419e [0,1,0,0,0,0|2,0,0]=3 4166 B12R0.248 COCCCCCOCC(Cl)CCl d7083271af967a7447dc07dd612c8378 [0,1,0,0,0,0|3,0,0]=4 4167 B12R0.248 COCCCCCOCC(S)CS 2f3231684fac1d30b6e370922092ee4e [0,1,0,0,0,0|2,1,0]=4 4168 B12R0.248 COCCCCCOC[C@@H](C)OC 7f8e4d5790d9f5bfb79eb0e4838174bc [0,1,0,0,0,0|2,0,0]=3 4169 B12R0.248 COCCCCCOC[C@H](C)OC ba90dbba43b7edeea628930fb14d4122 [0,1,0,0,0,0|2,0,0]=3 4170 B12R0.248 COCCCCNCCC(C)CO d66fcc4382e40e15c8e08535866742eb [0,1,0,0,0,0|2,0,0]=3 4171 B12R0.248 COCCCCNCCC(O)CO 835572c7a218db0ddc17c154db069042 [0,1,0,0,0,0|2,0,0]=3 4172 B12R0.248 COCCCCNCC[C@@H](C)CO 3d6f20a8d97901ec4f4fd90ce2f986bc [0,1,0,0,0,0|2,0,0]=3 4173 B12R0.248 COCCCCOCCC(C)OC 9e8e73688f13d84cab081cc03f75a132 [0,1,0,0,0,0|2,0,0]=3 4174 B12R0.248 COCCCNCCCC(C)CO de1054b17a61f31d03fed39ea618c165 [0,1,0,0,0,0|2,0,0]=3 4175 B12R0.248 COCCOCCCNC(C)CO 97515660e9b214bb6a20a3dcb85dd8cd [0,1,0,0,0,0|3,0,0]=4 4176 B12R0.248 COCCOCCCN[C@@H](C)CO 0e39f84fc0d09cc4fe2e010935ed3b27 [0,1,0,0,0,0|3,0,0]=4 4177 B12R0.248 COCCOCCCN[C@H](C)CO 08328a93ac63b7fd289986f0f382aced [0,1,0,0,0,0|3,0,0]=4 4178 B12R0.248 COCCOCCNCC(C)CO 5d9583db4283fb854a6b9b1e443e637d [0,1,0,0,0,0|3,0,0]=4 4179 B12R0.248 COCCOCCNCC(C)OC fe2e7c3231b514fc75ad40db4854f1fa [0,1,0,0,0,0|3,0,0]=4 4180 B12R0.248 COCCOCCNCC(O)CF c78ea7e2696f7806a5b0d048927dc2fd [0,1,0,0,0,0|3,0,0]=4 4181 B12R0.248 COCCOCCNCC(O)CO c0dce0e33db4c8cdd1bef1f519ab44b7 [0,1,0,0,0,0|3,0,0]=4 4182 B12R0.248 COCCOCCNC[C@@H](C)CO 834c7cf4153d5ee334f1de2b807805a0 [0,1,0,0,0,0|3,0,0]=4 4183 B12R0.248 COCCOCCNC[C@@H](C)OC faa49f773d2a05390781701ff938fc39 [0,1,0,0,0,0|3,0,0]=4 4184 B12R0.248 COCCOCCNC[C@@H](O)CO a0093a8091a8dabde4a0e281ba1e9864 [0,1,0,0,0,0|3,0,0]=4 4185 B12R0.248 COCCOCCNC[C@H](C)CO 655562662ad6e8ed7ba341eaf432f201 [0,1,0,0,0,0|3,0,0]=4 4186 B12R0.248 COCCOCCNC[C@H](C)OC 169a4f4c314bf879ec72fed7fed33321 [0,1,0,0,0,0|3,0,0]=4 4187 B12R0.248 COCCOCCNC[C@H](O)CO 94f08241b9f787565413a853b28a962f [0,1,0,0,0,0|3,0,0]=4 4188 B12R0.248 COCCOCCOCC(C)OC d340f95e9d28ace250610326988bec6c [0,1,0,0,0,0|3,0,0]=4 4189 B12R0.248 COCCOCCOCC(O)CO 8e86670cf226b7fb8ff456e44190dd86 [0,1,0,0,0,0|3,0,0]=4 4190 B12R0.248 COCCOCCOC[C@@H](C)OC 4f7a601e97d5b3f870175608de9be20f [0,1,0,0,0,0|3,0,0]=4 4191 B12R0.248 COCCOCCOC[C@@H](O)CO 3d2ae4b330ffe2de83067e8fada6ac7c [0,1,0,0,0,0|3,0,0]=4 4192 B12R0.248 COCCOCCOC[C@H](C)OC a555e04589dae39f12f8b95ac18dde2d [0,1,0,0,0,0|3,0,0]=4 4193 B12R0.248 COCCOCCOC[C@H](O)CO 332e51fe01272c243306c68292a47e42 [0,1,0,0,0,0|3,0,0]=4 4194 B12R0.248 COCCOCNCCC(C)CO 38a72c2b5c19deb3fb8736187d03d54a [0,1,0,0,0,0|3,0,0]=4 4195 B12R0.248 COCCOCNCCC(O)CO fd6f4a6b754e049cf078b23f31eb0dc1 [0,1,0,0,0,0|3,0,0]=4 4196 B12R0.248 COCCOCNCC[C@@H](C)CO 1e1c91d17bac9eb130f46447bef368cd [0,1,0,0,0,0|3,0,0]=4 4197 B12R0.248 COCCOCOCCC(C)OC 5495c0cd451bd0f7d54dcbf96f360590 [0,1,0,0,0,0|3,0,0]=4 4198 B12R0.248 COCOCCNCCC(C)CO e5223be041ae880915a9b937dafe3ab0 [0,1,0,0,0,0|3,0,0]=4 4199 B12R0.248 COCOCCNCCC(O)CO baac1204644f9ce9eccd773a2c4bdc3c [0,1,0,0,0,0|3,0,0]=4 4200 B12R0.248 COCOCCNCC[C@@H](C)CO 88d481b42bbf66d1eec6cdaabfbc2d4e [0,1,0,0,0,0|3,0,0]=4 4201 B12R0.248 COCOCCOCCC(C)OC d8623de6ee89d8d8fcc0071ca7e44d23 [0,1,0,0,0,0|3,0,0]=4 4202 B12R0.248 CO[C@@H](C)CNCCCCCC#N ff692203866e324d583f98e8729dd5fc [0,1,0,0,0,0|2,0,1]=4 4203 B12R0.248 CO[C@@H](C)CNCCCCCC=O 09d810a6506b9c5e4c155f168210881d [0,1,0,0,0,0|2,0,1]=4 4204 B12R0.248 CO[C@@H](C)CNCCCCCCCl 276694b96f3b7baf661696d1cfde3651 [0,1,0,0,0,0|2,0,0]=3 4205 B12R0.248 CO[C@@H](C)CNCCCCCCF d4e33f34787b0c9a5a15876e55adf9c1 [0,1,0,0,0,0|2,0,0]=3 4206 B12R0.248 CO[C@@H](C)CNCCCCCCO fadc8c60c2bd7267f4f543ef0587ebea [0,1,0,0,0,0|2,0,0]=3 4207 B12R0.248 CO[C@@H](C)CNCCCOCCO 18b7962920aa06279e9d0e2f33a15373 [0,1,0,0,0,0|3,0,0]=4 4208 B12R0.248 CO[C@@H](C)CNCCOCCCO 67e14240ef48e04feeaafcb33fc64058 [0,1,0,0,0,0|3,0,0]=4 4209 B12R0.248 CO[C@@H](C)COCCCCCC#N 2877f951cbac51dfcf37da3f3430b5b5 [0,1,0,0,0,0|2,0,1]=4 4210 B12R0.248 CO[C@@H](C)COCCCCCC=O ed15e6ca0a5e74c1621b70be7e88e9c8 [0,1,0,0,0,0|2,0,1]=4 4211 B12R0.248 CO[C@@H](C)COCCCCCCF 82bafbd3ff9eb8d695d7c2fd3de52ecb [0,1,0,0,0,0|2,0,0]=3 4212 B12R0.248 CO[C@@H](C)COCCCCCCS 382470c64b33277bfaaa7833baf52f58 [0,1,0,0,0,0|2,0,0]=3 4213 B12R0.248 CO[C@H](C)CNCCCCCC#N bca0dec2c7f399d9a0c4bce449b12916 [0,1,0,0,0,0|2,0,1]=4 4214 B12R0.248 CO[C@H](C)CNCCCCCC=O 6efd6611770c834db4fe9785c399e3eb [0,1,0,0,0,0|2,0,1]=4 4215 B12R0.248 CO[C@H](C)CNCCCCCCCl 97b2fbe31813db3e11975fd480eba328 [0,1,0,0,0,0|2,0,0]=3 4216 B12R0.248 CO[C@H](C)CNCCCCCCF b48451f1bf36d7e8ae869dc6e41e45d0 [0,1,0,0,0,0|2,0,0]=3 4217 B12R0.248 CO[C@H](C)CNCCCCCCO 19e6da3749fbda78c29f9389d1dde019 [0,1,0,0,0,0|2,0,0]=3 4218 B12R0.248 CO[C@H](C)CNCCCOCCO c7fc2c27f9bd54f2bfc30d18ed687d6b [0,1,0,0,0,0|3,0,0]=4 4219 B12R0.248 CO[C@H](C)CNCCOCCCO d6c3cba37980276a71eb2833ee5f15b1 [0,1,0,0,0,0|3,0,0]=4 4220 B12R0.248 CO[C@H](C)COCCCCCC#N ba1bd031f2d9096ebb22d123fc10a34e [0,1,0,0,0,0|2,0,1]=4 4221 B12R0.248 CO[C@H](C)COCCCCCC=O 1fb0b3d7f5d684e56ff14242f82e52e4 [0,1,0,0,0,0|2,0,1]=4 4222 B12R0.248 CO[C@H](C)COCCCCCCF 90dca1017627af19c17232da26073f28 [0,1,0,0,0,0|2,0,0]=3 4223 B12R0.248 CO[C@H](C)COCCCCCCS e214db6a12acc017758197574ae82141 [0,1,0,0,0,0|2,0,0]=3 4224 B12R0.248 CSCCCCNCCC(C)CO 1e9af43c75570d49d2a9f7e9c271a6f5 [0,1,0,0,0,0|2,0,0]=3 4225 B12R0.248 CSCCCNCCCC(C)CO d43c7e73f8fea53ab589098f7b69cfb7 [0,1,0,0,0,0|2,0,0]=3 4226 B12R0.248 CSCCOCCCNC(C)CO cd1e3a326aa360916892a224c59835b1 [0,1,0,0,0,0|3,0,0]=4 4227 B12R0.248 CSCCOCCCN[C@@H](C)CO 735f6dd97124dec52945464518866c8e [0,1,0,0,0,0|3,0,0]=4 4228 B12R0.248 CSCCOCCCN[C@H](C)CO d0eb395fd5f6c394db8a2c78cbe650d7 [0,1,0,0,0,0|3,0,0]=4 4229 B12R0.248 C[C@@H](CO)CCNCCCCC#N a62ff5963d19bdc943f8a9a16bd41d70 [0,1,0,0,0,0|2,0,1]=4 4230 B12R0.248 C[C@@H](CO)CCNCCCCC=O 2738a32b8203cf3b592621d79959a0f0 [0,1,0,0,0,0|2,0,1]=4 4231 B12R0.248 C[C@@H](CO)CCNCCCCCF 302e70a7805805e9aa4f1e7985401e6b [0,1,0,0,0,0|2,0,0]=3 4232 B12R0.248 C[C@@H](CO)CCNCCCCCO 73592a4dd52abad573aa02e4d665bfa9 [0,1,0,0,0,0|2,0,0]=3 4233 B12R0.248 C[C@@H](CO)CCNCCCCON 98fa85e1af85318697601429fefc549e [0,1,0,0,0,0|3,0,0]=4 4234 B12R0.248 C[C@@H](CO)CCNCCOCCO 5dd114600caa1082d4c5dff453f70ea2 [0,1,0,0,0,0|3,0,0]=4 4235 B12R0.248 C[C@@H](CO)CNCCCCCC#N 54e278b07da2cbb1eb032726cec29595 [0,1,0,0,0,0|2,0,1]=4 4236 B12R0.248 C[C@@H](CO)CNCCCCCCCl 98d48821d3f97b61bc94316c6d744bb1 [0,1,0,0,0,0|2,0,0]=3 4237 B12R0.248 C[C@@H](CO)CNCCCCCCO 8c9d333fba7c250de1b8c34c0a4022e6 [0,1,0,0,0,0|2,0,0]=3 4238 B12R0.248 C[C@@H](CO)CNCCCOCCO 802c367326811fb1e4153f80de9e25ea [0,1,0,0,0,0|3,0,0]=4 4239 B12R0.248 C[C@@H](CO)CNCCOCCCO 778fa508f4268cab022b139935f75ca1 [0,1,0,0,0,0|3,0,0]=4 4240 B12R0.248 C[C@@H](CO)NCCCCCCC#N 8a1f4d5ad850987bde169eb5db744afe [0,1,0,0,0,0|2,0,1]=4 4241 B12R0.248 C[C@@H](CO)NCCCCCCC=O ca97a199b16fa2f929e6fc89e5a8f31c [0,1,0,0,0,0|2,0,1]=4 4242 B12R0.248 C[C@@H](CO)NCCCCCCCO fb0e32d826a68555e54e7cfc1e6ffc30 [0,1,0,0,0,0|2,0,0]=3 4243 B12R0.248 C[C@@H](CO)NCCCCSCCO 01a03ff3fc6df7b03831bc49b84d6673 [0,1,0,0,0,0|3,0,0]=4 4244 B12R0.248 C[C@@H](CO)NCCCOCCCO a526684f8a1e6b3efc5cc72753c24bdf [0,1,0,0,0,0|3,0,0]=4 4245 B12R0.248 C[C@H](C=O)NCCCCCCCO 1791571e3680fb4efb3912579a9c94ef [0,1,0,0,0,0|2,0,1]=4 4246 B12R0.248 C[C@H](CO)CNCCCCCC#N d8fdeb4eba392531ea737efc91df8954 [0,1,0,0,0,0|2,0,1]=4 4247 B12R0.248 C[C@H](CO)CNCCCCCC=O b2aa0480626f22d92b6d4d8e76b0c8f8 [0,1,0,0,0,0|2,0,1]=4 4248 B12R0.248 C[C@H](CO)CNCCCCCCCl bf0e8ba070bd36e5fdddd1234bf957ca [0,1,0,0,0,0|2,0,0]=3 4249 B12R0.248 C[C@H](CO)CNCCCCCCF 2cbc6fffbbc3a0ef29f9eb5d7a305e20 [0,1,0,0,0,0|2,0,0]=3 4250 B12R0.248 C[C@H](CO)CNCCCCCCO 889984c414ef0d9d7660148dfd84d8f4 [0,1,0,0,0,0|2,0,0]=3 4251 B12R0.248 C[C@H](CO)CNCCCOCCO fa7ba2d7b2ffa1383f0a03402baddc66 [0,1,0,0,0,0|3,0,0]=4 4252 B12R0.248 C[C@H](CO)CNCCOCCCO 560a5f5381370a946033ddbc31b366e9 [0,1,0,0,0,0|3,0,0]=4 4253 B12R0.248 C[C@H](CO)NCCCCCCC#N 526767f78bb75d6883c89c76762f1895 [0,1,0,0,0,0|2,0,1]=4 4254 B12R0.248 C[C@H](CO)NCCCCCCC=O 87dc462d964961096299b66a19a8a69e [0,1,0,0,0,0|2,0,1]=4 4255 B12R0.248 C[C@H](CO)NCCCCCCCO 6c5b2b311ac6902bc2e8fa57fd5f82d5 [0,1,0,0,0,0|2,0,0]=3 4256 B12R0.248 C[C@H](CO)NCCCCSCCO 9fe34c6ecc29585028972479edbf3b1d [0,1,0,0,0,0|3,0,0]=4 4257 B12R0.248 C[C@H](CO)NCCCOCCCO cb2cea0b0cc7419cc80b17f22b511ef9 [0,1,0,0,0,0|3,0,0]=4 4258 B12R0.248 FCCCCCCNCC(Br)CBr bd1f9f512b8b3c3ce1ac3bb86f56de56 [0,1,0,0,0,0|3,0,0]=4 4259 B12R0.248 FCCCCCCOCC(Br)CBr 0dcb026a9507f12b2930047cd23e65aa [0,1,0,0,0,0|3,0,0]=4 4260 B12R0.248 FCCCCCCOCC(Cl)CCl 833a503ee678ccc838aeee6254a359b7 [0,1,0,0,0,0|3,0,0]=4 4261 B12R0.248 FCCCCCCOCC(S)CS 94253922632c56feadd22513093b73d7 [0,1,0,0,0,0|2,1,0]=4 4262 B12R0.248 N#CCCCCCNCC(O)CF 962ae98e896e695ba8510a0dc2c4a73b [0,1,0,0,0,0|2,0,1]=4 4263 B12R0.248 N#CCCCCCNCC(O)CO afa2e13c9cb4665072dfa42f45bbe05a [0,1,0,0,0,0|2,0,1]=4 4264 B12R0.248 N#CCCCCCNC[C@@H](O)CO 643407e006e2ef37eed908edad036609 [0,1,0,0,0,0|2,0,1]=4 4265 B12R0.248 N#CCCCCCNC[C@H](O)CO a569f748752019c251db440eae47dee1 [0,1,0,0,0,0|2,0,1]=4 4266 B12R0.248 N#CCCCCCOCC(O)CO d22a393ab13796b059e4269a0108dc62 [0,1,0,0,0,0|2,0,1]=4 4267 B12R0.248 N#CCCCCCOC[C@@H](O)CO aa513a0cdd8a494287241df5795f3f6d [0,1,0,0,0,0|2,0,1]=4 4268 B12R0.248 N#CCCCCCOC[C@H](O)CO 99c7833f1bd774f988e47f53cccd6fbb [0,1,0,0,0,0|2,0,1]=4 4269 B12R0.248 N#CCCCCNCCC(O)CO 6fd0c68a41192bc011bf46149e228494 [0,1,0,0,0,0|2,0,1]=4 4270 B12R0.248 NOCCCCNCCC(O)CO 0540ab46676702576ac14506830403c9 [0,1,0,0,0,0|3,0,0]=4 4271 B12R0.248 O=CCCCCCNCC(O)CO c8998ae63a869ec19d4ff301ced2ca2c [0,1,0,0,0,0|2,0,1]=4 4272 B12R0.248 O=CCCCCCNC[C@@H](O)CO 6990eb7d2d22f409bcc43eb73e27fb6d [0,1,0,0,0,0|2,0,1]=4 4273 B12R0.248 O=CCCCCCNC[C@H](O)CO 27da0fb898694a662cb5eca36ec1c8a6 [0,1,0,0,0,0|2,0,1]=4 4274 B12R0.248 O=CCCCCNCCC(O)CO dce130c8b7a45f8498349077d69c991b [0,1,0,0,0,0|2,0,1]=4 4275 B12R0.248 OC(CF)CNCCCCCCCl 46bdf28baea015c52016c7f095fabc8d [0,1,0,0,0,0|2,0,0]=3 4276 B12R0.248 OCC(F)CNCCCCCCF ab58749c899ccd300670e7119666d622 [0,1,0,0,0,0|3,0,0]=4 4277 B12R0.248 OCC(O)CCNCCCCCF ee5689f45171ef652a7d68d839c00d3a [0,1,0,0,0,0|2,0,0]=3 4278 B12R0.248 OCC(O)CNCCCCCCCl c32937377c116adab829f89da9e202ce [0,1,0,0,0,0|2,0,0]=3 4279 B12R0.248 OCC(O)CNCCCCCCF da7fe409baf33950a01d31c6e3bbee4b [0,1,0,0,0,0|2,0,0]=3 4280 B12R0.248 OCC(O)COCCCCCCF 6d15f7a58ecd68e7ca948e7725353622 [0,1,0,0,0,0|2,0,0]=3 4281 B12R0.248 OCC(O)COCCCCCCS d0699ffd5c3656f2414854e21deba53d [0,1,0,0,0,0|2,0,0]=3 4282 B12R0.248 OCCCCCCNCC(Br)CBr b161fd7caada67bea3c58c62a1bf20cc [0,1,0,0,0,0|3,0,0]=4 4283 B12R0.248 OCCCCCCNCC(F)CO c092c05e51c988b837b27557ec56c078 [0,1,0,0,0,0|3,0,0]=4 4284 B12R0.248 OCCCCCCNCC(O)CF 9a393e6da4086800d24709afb599bbba [0,1,0,0,0,0|2,0,0]=3 4285 B12R0.248 OCCCCCCNCC(O)CO 6765eeb94fa40b40850d3abcd7448a7a [0,1,0,0,0,0|2,0,0]=3 4286 B12R0.248 OCCCCCCNC[C@@H](F)CO 7e0e37a9f74218bfd46952a75b83eb40 [0,1,0,0,0,0|3,0,0]=4 4287 B12R0.248 OCCCCCCNC[C@@H](O)CO a069d87df3ff8daf7fcd40dd04aa062a [0,1,0,0,0,0|2,0,0]=3 4288 B12R0.248 OCCCCCCNC[C@H](F)CO 7a74a4192f6c9c9e5e98ae9203953814 [0,1,0,0,0,0|3,0,0]=4 4289 B12R0.248 OCCCCCCNC[C@H](O)CO 55b6a046c8815e31ed482fd7f10e67f5 [0,1,0,0,0,0|2,0,0]=3 4290 B12R0.248 OCCCCCNCCC(O)CO 36fc0410f51ee1d6c4c9e0f5287ecd4b [0,1,0,0,0,0|2,0,0]=3 4291 B12R0.248 OCCCOCCNCC(O)CF b476d41a38be7fd246a9e1346421a387 [0,1,0,0,0,0|3,0,0]=4 4292 B12R0.248 OCCCOCCNCC(O)CO 13485e4d00bd79cecaf3063e653cd582 [0,1,0,0,0,0|3,0,0]=4 4293 B12R0.248 OCCCOCCNC[C@@H](O)CO aab30ee0d90d8618969e0e2e0f776f2b [0,1,0,0,0,0|3,0,0]=4 4294 B12R0.248 OCCCOCCNC[C@H](O)CO ac8662c05abee524163b2058a58facbe [0,1,0,0,0,0|3,0,0]=4 4295 B12R0.248 OCCOCCCNCC(O)CF a91f227b763d43be58c9e5cb352e0784 [0,1,0,0,0,0|3,0,0]=4 4296 B12R0.248 OCCOCCCNCC(O)CO 227c1fca7b933304e8b8556eb2cedc3a [0,1,0,0,0,0|3,0,0]=4 4297 B12R0.248 OCCOCCCNC[C@@H](O)CO 177348f61566a36f2a79f0dca09c6cf1 [0,1,0,0,0,0|3,0,0]=4 4298 B12R0.248 OCCOCCCNC[C@H](O)CO e21c775f51d8b69002bc35efa6f1fb3f [0,1,0,0,0,0|3,0,0]=4 4299 B12R0.248 OCCOCCNCCC(O)CO 10ae137f09ba45e9fb34b26739d977a5 [0,1,0,0,0,0|3,0,0]=4 4300 B12R0.248 OC[C@@H](F)CNCCCCCCF 12521d565c44231a3b057fe107d94864 [0,1,0,0,0,0|3,0,0]=4 4301 B12R0.248 OC[C@@H](O)CNCCCCCCCl 2c669e666a0ab4cd7319012446c413a1 [0,1,0,0,0,0|2,0,0]=3 4302 B12R0.248 OC[C@@H](O)CNCCCCCCF 07ecf6190faf15c12ab33e1b0d9df47d [0,1,0,0,0,0|2,0,0]=3 4303 B12R0.248 OC[C@@H](O)COCCCCCCF 57d37a4c2846980dd2576da18b7a327d [0,1,0,0,0,0|2,0,0]=3 4304 B12R0.248 OC[C@@H](O)COCCCCCCS 9bd8d564ae0b4c4072967dca1e8266f3 [0,1,0,0,0,0|2,0,0]=3 4305 B12R0.248 OC[C@H](F)CNCCCCCCF 32eb2efe8fa57e432c308d26a25537b7 [0,1,0,0,0,0|3,0,0]=4 4306 B12R0.248 OC[C@H](O)CNCCCCCCCl bd8ef5ac75679d7d2ad60584c656ab6b [0,1,0,0,0,0|2,0,0]=3 4307 B12R0.248 OC[C@H](O)CNCCCCCCF 9e012314ba8f45a08dd3c289a78aafe8 [0,1,0,0,0,0|2,0,0]=3 4308 B12R0.248 OC[C@H](O)COCCCCCCF 99a4a76a43702198d067e0756ba3545b [0,1,0,0,0,0|2,0,0]=3 4309 B12R0.248 OC[C@H](O)COCCCCCCS a5c5e1d9fceedd4b0cdbc87aeff1f727 [0,1,0,0,0,0|2,0,0]=3 4310 B12R0.251 C#CCCCCCNC(C)C(C)O 120f90b0dd0fb642abe967d1c26d87dd [0,1,0,0,0,0|1,0,2]=4 4311 B12R0.251 C=CCCCCCNC(C)C(C)O 5a96ad27763610100a4c65ba49abba27 [0,1,0,0,0,0|1,0,2]=4 4312 B12R0.251 CC(C)C(C)CCOCCCCF d75a4093b941f2d3bd65bb8e7f8ed5b8 [0,1,0,0,0,0|3,0,0]=4 4313 B12R0.251 CC(C)C(C)CNCCCCCCl c0c6a4c9f3d6939c5713e16ed5979ae8 [0,1,0,0,0,0|3,0,0]=4 4314 B12R0.251 CC(C)C(C)CNCCCCCO fd8d1214bae8582a8026ba797a505f4b [0,1,0,0,0,0|3,0,0]=4 4315 B12R0.251 CC(C)C(C)COCCCCCF 27bff9b5a0debc86a7b093cef5243961 [0,1,0,0,0,0|3,0,0]=4 4316 B12R0.251 CC(C)C(C)NCCCCCCCl b9037721f1763a1644a82d35e51862b8 [0,1,0,0,0,0|3,0,0]=4 4317 B12R0.251 CC(C)C(C)NCCCCCCF 6d8fc06ed511c079a2426664fd4a52fd [0,1,0,0,0,0|3,0,0]=4 4318 B12R0.251 CC(C)C(C)NCCCCCCO 3f1bff99225c07f7acaa310d9947aa2d [0,1,0,0,0,0|3,0,0]=4 4319 B12R0.251 CC(C)C(C)OCCCCCCF 3d664b122a4b1856278562002978a14f [0,1,0,0,0,0|3,0,0]=4 4320 B12R0.251 CC(C)C(C)OCCCCCCS f39e0677d08c1b99a2b72c51c27c1ea8 [0,1,0,0,0,0|3,0,0]=4 4321 B12R0.251 CC(C)C(O)CNCCCCCF 93cfe30a7c57594466f42b31cce5526d [0,1,0,0,0,0|3,0,0]=4 4322 B12R0.251 CC(C)C(O)CNCCCCCO 06148a8173d86b051da0f702a521c742 [0,1,0,0,0,0|3,0,0]=4 4323 B12R0.251 CC(C)N(C)CCCCCCCO ac015d150d72e42fdc3142a0811741b9 [0,1,0,0,0,0|3,0,0]=4 4324 B12R0.251 CC(C)[C@@H](C)NCCCCCCF 812b7ea1b9c1320104396730f4058145 [0,1,0,0,0,0|3,0,0]=4 4325 B12R0.251 CC(C)[C@@H](C)NCCCCCCO 0d5c4a54bb26e33c1d161f156fd35ba4 [0,1,0,0,0,0|3,0,0]=4 4326 B12R0.251 CC(C)[C@@H](C)OCCCCCCF 292bfddd08c83f7a4fe2e51d0a001561 [0,1,0,0,0,0|3,0,0]=4 4327 B12R0.251 CC(C)[C@H](C)NCCCCCCF f3d11acb7b43ef9923d0897924f5c172 [0,1,0,0,0,0|3,0,0]=4 4328 B12R0.251 CC(C)[C@H](C)NCCCCCCO d5581cea90ec97434d44a7913f0df25f [0,1,0,0,0,0|3,0,0]=4 4329 B12R0.251 CC(C)[C@H](C)OCCCCCCF 69a37935826578a5ba57f70290d0c657 [0,1,0,0,0,0|3,0,0]=4 4330 B12R0.251 CC(O)C(=O)NCCCCCCCl 24568692d7c1d310cd88750e24accb9a [0,1,0,0,0,0|2,0,1]=4 4331 B12R0.251 CC(O)C(=O)NCCCCCCO 08c6e013b555fd9f6f534be8e4aeedb1 [0,1,0,0,0,0|2,0,1]=4 4332 B12R0.251 CC(O)C(C)NCCCCCC#N 3b6d569fa3e3ff1e8e112929086181b1 [0,1,0,0,0,0|2,0,1]=4 4333 B12R0.251 CC(O)C(C)NCCCCCC=O 0dc609ad092183f76619969d6e2d5521 [0,1,0,0,0,0|2,0,1]=4 4334 B12R0.251 CC(O)C(C)NCCCCCCF 641dcc4dfa2b07a3aeec22954b9b6245 [0,1,0,0,0,0|2,0,0]=3 4335 B12R0.251 CC(O)C(C)NCCCCCCO c8bdeaab789ad8160bbd2854b3ac3284 [0,1,0,0,0,0|2,0,0]=3 4336 B12R0.251 CC(S)C(C)OCCCCCCF 5cf7d355f931660b6a582712f6bc604a [0,1,0,0,0,0|2,1,0]=4 4337 B12R0.251 CCCC/C=C/CNC(C)C(C)O 5a91738ec4ac1fb4e4bce3fb7ef913a5 [0,1,0,0,0,0|1,0,2]=4 4338 B12R0.251 CCCC/C=C\CNC(C)C(C)O 4888ecc7743c9d801b31aae4520740f1 [0,1,0,0,0,0|1,0,2]=4 4339 B12R0.251 CCCCCCCCN(C)C(=O)C 8d709d5226149bbe12dde031673cd44c [0,1,0,0,0,0|1,0,2]=4 4340 B12R0.251 CCCCCCCCN(C)C(C)C d8440348b6c16d98ead35cb09dc500d4 [0,1,0,0,0,0|2,0,0]=3 4341 B12R0.251 CCCCCCCNC(=O)C(C)F 57a519b04a5e09b346474d9901a0a13a [0,1,0,0,0,0|2,0,1]=4 4342 B12R0.251 CCCCCCCNC(=O)C(C)O d1e7cf65f0c85036bb4ceff5266af976 [0,1,0,0,0,0|1,0,1]=3 4343 B12R0.251 CCCCCCCNC(=O)C(C)S 21ef221c9222809f89cabe342c7f61ec [0,1,0,0,0,0|1,1,1]=4 4344 B12R0.251 CCCCCCCNC(=O)C(O)O 4f1bdeeab45332fe82dc1006b6d123c1 [0,1,0,0,0,0|2,0,1]=4 4345 B12R0.251 CCCCCCCNC(=O)[C@@H](C)F fe184b2df527f454614f88b19faae6e9 [0,1,0,0,0,0|2,0,1]=4 4346 B12R0.251 CCCCCCCNC(=O)[C@@H](C)O 1726a45d18305ca5241e027bbc53a146 [0,1,0,0,0,0|1,0,1]=3 4347 B12R0.251 CCCCCCCNC(=O)[C@H](C)F 9032b192eba6fe0c7a2ff79ce7a378e0 [0,1,0,0,0,0|2,0,1]=4 4348 B12R0.251 CCCCCCCNC(=O)[C@H](C)O 5f75904c211c95844ff40e06201a21df [0,1,0,0,0,0|1,0,1]=3 4349 B12R0.251 CCCCCCCNC(C)C(=O)C 88d907782986c69dac214d54818d2184 [0,1,0,0,0,0|1,0,2]=4 4350 B12R0.251 CCCCCCCNC(C)C(=O)O 0bf6764328836a014db9a3a355c88d18 [0,1,0,0,0,0|2,0,1]=4 4351 B12R0.251 CCCCCCCNC(C)C(C)C 4c495bf769af9c3ffa486ed9eeeff284 [0,1,0,0,0,0|2,0,0]=3 4352 B12R0.251 CCCCCCCNC(C)C(C)O 064a8d272b8c435de1a1b82a1be5422f [0,1,0,0,0,0|1,0,0]=2 4353 B12R0.251 CCCCCCCNC(O)C(=O)O f51509c28799bcd70e26502ab647742f [0,1,0,0,0,0|2,0,1]=4 4354 B12R0.251 CCCCCCCN[C@@H](C)C(=O)O f1e125e94fbc3c206396172f15edc259 [0,1,0,0,0,0|2,0,1]=4 4355 B12R0.251 CCCCCCCN[C@@H](C)C(C)C f2cc94dfd0f61d78e03ef678ba2923e1 [0,1,0,0,0,0|2,0,0]=3 4356 B12R0.251 CCCCCCCN[C@@H](C)C(F)F a565787cd896f5a08153bc8239781265 [0,1,0,0,0,0|3,0,0]=4 4357 B12R0.251 CCCCCCCN[C@H](C)C(=O)O 65aaa795baa16cbae1d560736acb069b [0,1,0,0,0,0|2,0,1]=4 4358 B12R0.251 CCCCCCCN[C@H](C)C(C)C 3a0645234faac2b27e1f0baa46bd9c35 [0,1,0,0,0,0|2,0,0]=3 4359 B12R0.251 CCCCCCCN[C@H](C)C(F)F 8d5ebb1f35ea47e7b4797016953476a7 [0,1,0,0,0,0|3,0,0]=4 4360 B12R0.251 CCCCCCCOC(C)C(=O)C fc3e86ca8fc247cce46decdd16015c06 [0,1,0,0,0,0|1,0,2]=4 4361 B12R0.251 CCCCCCCOC(C)C(=O)O a6783dbeebb3278a49c34700326a63c1 [0,1,0,0,0,0|2,0,1]=4 4362 B12R0.251 CCCCCCCOC(C)C(C)C f56093260fe2082792350d5b526fedbd [0,1,0,0,0,0|2,0,0]=3 4363 B12R0.251 CCCCCCCOC(C)C(C)S 5a6cd081d3492eae231dd35433bd9f68 [0,1,0,0,0,0|1,1,0]=3 4364 B12R0.251 CCCCCCCOC(C)C(F)F 182b16cf70fa83db06263f8a21bcf801 [0,1,0,0,0,0|3,0,0]=4 4365 B12R0.251 CCCCCCCOC(F)C(=O)O df20dd3791b4bd55c4cc46f047d66b6d [0,1,0,0,0,0|2,0,1]=4 4366 B12R0.251 CCCCCCCO[C@@H](C)C(=O)O 9ade8d39d0b7827b0d2bbc0c4dc21f74 [0,1,0,0,0,0|2,0,1]=4 4367 B12R0.251 CCCCCCCO[C@@H](C)C(C)C 0eaa67cb3e422ac392fabdca9b303242 [0,1,0,0,0,0|2,0,0]=3 4368 B12R0.251 CCCCCCCO[C@@H](F)C(=O)O b475846ec3fd1c66fe40d49a75618abc [0,1,0,0,0,0|2,0,1]=4 4369 B12R0.251 CCCCCCCO[C@H](C)C(=O)O 004ba158e34fa871db9ef4e062488bc0 [0,1,0,0,0,0|2,0,1]=4 4370 B12R0.251 CCCCCCCO[C@H](C)C(C)C 1e216ee3475a01a3b38e7015e38bc257 [0,1,0,0,0,0|2,0,0]=3 4371 B12R0.251 CCCCCCNCC(=O)C(C)C 9520cdb569f32e1eff04ef5e1cbcad32 [0,1,0,0,0,0|2,0,1]=4 4372 B12R0.251 CCCCCCNCC(C)C(=O)O 68cbeab6031df552724e5d040ea8d8b9 [0,1,0,0,0,0|2,0,1]=4 4373 B12R0.251 CCCCCCNCC(C)C(C)C aee92e2a9ba99526dc033bfad661f0a1 [0,1,0,0,0,0|2,0,0]=3 4374 B12R0.251 CCCCCCNCC(C)N(C)C dd17202a3b5a8a9f2748f94230047a9c [0,1,0,0,0,0|3,0,0]=4 4375 B12R0.251 CCCCCCNCC(F)C(=O)O 3a1d9907f0a5d79cb4260215bd6501cd [0,1,0,0,0,0|2,0,1]=4 4376 B12R0.251 CCCCCCNCC(O)C(=O)O 197e92ff6dce457e8910ad871ee7d4c4 [0,1,0,0,0,0|2,0,1]=4 4377 B12R0.251 CCCCCCNCC(O)C(C)C 546d3115f49e463503107a5e63232481 [0,1,0,0,0,0|2,0,0]=3 4378 B12R0.251 CCCCCCNCC(O)C(F)F 7f922915441e63a791cc222195e6b544 [0,1,0,0,0,0|3,0,0]=4 4379 B12R0.251 CCCCCCNC[C@@H](C)C(=O)O 7dc356d9c9c6f90966da67bb84009883 [0,1,0,0,0,0|2,0,1]=4 4380 B12R0.251 CCCCCCNC[C@@H](O)C(=O)O 571f2d6e8ed05e05b2d07a57a18169e5 [0,1,0,0,0,0|2,0,1]=4 4381 B12R0.251 CCCCCCNC[C@H](C)C(=O)O b4b3074fdd0263159af7e473fcc19db3 [0,1,0,0,0,0|2,0,1]=4 4382 B12R0.251 CCCCCCNC[C@H](O)C(=O)O 5585dfd695fc74247eb810ae0d23a2d6 [0,1,0,0,0,0|2,0,1]=4 4383 B12R0.251 CCCCCCOCC(=O)C(C)C 97073a309b33a8ba572416aeaf543c56 [0,1,0,0,0,0|2,0,1]=4 4384 B12R0.251 CCCCCCOCC(C)C(=O)C d67c2e4c5e2f810ce2b6051bcc118d4e [0,1,0,0,0,0|1,0,2]=4 4385 B12R0.251 CCCCCCOCC(C)C(=O)O 7bd97dee6812a484e02647b0d199144a [0,1,0,0,0,0|2,0,1]=4 4386 B12R0.251 CCCCCCOCC(C)C(C)C 046d370afaef8cf0188c4ba52df8d69a [0,1,0,0,0,0|2,0,0]=3 4387 B12R0.251 CCCCCCOCC(C)N(C)C fae5aab87915ed0bc252e2fa0d9417ca [0,1,0,0,0,0|3,0,0]=4 4388 B12R0.251 CCCCCCOC[C@@H](C)C(=O)O 8aa4480b40581d4ce42fad9dafad2cb3 [0,1,0,0,0,0|2,0,1]=4 4389 B12R0.251 CCCCCCOC[C@@H](C)N(C)C 0389db3680091172b82e64f2dd27e4d2 [0,1,0,0,0,0|3,0,0]=4 4390 B12R0.251 CCCCCCOC[C@H](C)C(=O)O 4a21028a6ddb0d14a389367d8a007c68 [0,1,0,0,0,0|2,0,1]=4 4391 B12R0.251 CCCCCCOC[C@H](C)N(C)C 7083e06b1b3ed4d29dd4e3e21fa7f148 [0,1,0,0,0,0|3,0,0]=4 4392 B12R0.251 CCCCCNCCC(C)N(C)C 06ddb964f37d681a6601fc26a6190b6a [0,1,0,0,0,0|3,0,0]=4 4393 B12R0.251 CCCCCNCCC(F)C(=O)O 3f0e914ae2f258d054a2682830ee4e2d [0,1,0,0,0,0|2,0,1]=4 4394 B12R0.251 CCCCCNCCC(O)C(=O)O f089e6fabeb0bdad3d1e28e1dad0ed9c [0,1,0,0,0,0|2,0,1]=4 4395 B12R0.251 CCCCCNCCN(C)C(C)C 7b53964cc5c4e5a5b798b32455d937f1 [0,1,0,0,0,0|3,0,0]=4 4396 B12R0.251 CCCCCNCC[C@@H](C)N(C)C d434adde9bb0392c51dd41a95c969f1d [0,1,0,0,0,0|3,0,0]=4 4397 B12R0.251 CCCCCNCC[C@H](C)N(C)C 10a43ac7c7948b4233d4ca5ba1723f9c [0,1,0,0,0,0|3,0,0]=4 4398 B12R0.251 CCCCCNCC[C@H](O)C(=O)O c77ddabb8687fe061d7b77f13e027bb8 [0,1,0,0,0,0|2,0,1]=4 4399 B12R0.251 CCCCCOCCC(C)C(C)C 00431e72c75a0d8876e2d3f3cdb1326d [0,1,0,0,0,0|2,0,0]=3 4400 B12R0.251 CCCCCOCCC(C)N(C)C 235df2af1be6015c35ff9f98465cad1a [0,1,0,0,0,0|3,0,0]=4 4401 B12R0.251 CCCCNCCCC(C)C(=O)O eac345f993a3ba654bf1d71fa4b1b602 [0,1,0,0,0,0|2,0,1]=4 4402 B12R0.251 CCCCOCCCC(C)C(=O)O 7eceac3dec75b314e685f395f8f104b7 [0,1,0,0,0,0|2,0,1]=4 4403 B12R0.251 CCCCOCCNC(=O)C(C)O d95de97de7294770124c86bf4fc83f38 [0,1,0,0,0,0|2,0,1]=4 4404 B12R0.251 CCCCOCCNC(=O)[C@@H](C)O 063fec4da88544ce5417136659715313 [0,1,0,0,0,0|2,0,1]=4 4405 B12R0.251 CCCCOCCNC(=O)[C@H](C)O 4a617f6cef5c9ccbb0d901402733f592 [0,1,0,0,0,0|2,0,1]=4 4406 B12R0.251 CCCCOCCNC(C)C(C)C 543b1d0875dac9be774cb126b4b7dca2 [0,1,0,0,0,0|3,0,0]=4 4407 B12R0.251 CCCCOCCNC(C)C(C)O 5a1d39cf65c7cb563edf343ed4671173 [0,1,0,0,0,0|2,0,0]=3 4408 B12R0.251 CCCCOCCN[C@@H](C)C(C)C 06dd917b173c5eb59424e71701ebe8f4 [0,1,0,0,0,0|3,0,0]=4 4409 B12R0.251 CCCCOCCN[C@H](C)C(C)C 26967182ba73d627605c997300566b00 [0,1,0,0,0,0|3,0,0]=4 4410 B12R0.251 CCCCOCCOC(C)C(C)C e5e90bae8a9bf240c334de764612a33f [0,1,0,0,0,0|3,0,0]=4 4411 B12R0.251 CCCCOCCOC(C)C(C)S 183d5efc1808cc442a285cc85f2c628b [0,1,0,0,0,0|2,1,0]=4 4412 B12R0.251 CCCCOCCO[C@@H](C)C(C)C ef8a07ff6fbf8c3b5b2b16457464a7fa [0,1,0,0,0,0|3,0,0]=4 4413 B12R0.251 CCCCOCCO[C@H](C)C(C)C d16006a6460161a9f8bcd21738f9cdd7 [0,1,0,0,0,0|3,0,0]=4 4414 B12R0.251 CCCCOCNCC(O)C(C)C 0e00abfda77931d4c184794c09302bb3 [0,1,0,0,0,0|3,0,0]=4 4415 B12R0.251 CCCCOCOCC(C)C(C)C 394d4916fbe3223eb1389f24570e9607 [0,1,0,0,0,0|3,0,0]=4 4416 B12R0.251 CCCCSCCOC(C)C(C)C 68ab9c49f65ffa3468a2462f22451358 [0,1,0,0,0,0|3,0,0]=4 4417 B12R0.251 CCCOCCCNC(=O)C(C)O 5e9c986f542b4b13a23d62bf449e8cc3 [0,1,0,0,0,0|2,0,1]=4 4418 B12R0.251 CCCOCCCNC(=O)[C@@H](C)O 965aac27266e12fc1a8d17c17f658ff0 [0,1,0,0,0,0|2,0,1]=4 4419 B12R0.251 CCCOCCCNC(=O)[C@H](C)O a1687dc4e873682a2d47d338c81ab31b [0,1,0,0,0,0|2,0,1]=4 4420 B12R0.251 CCCOCCCNC(C)C(C)C ebc9565544bd5e2d39fcb099058ddb93 [0,1,0,0,0,0|3,0,0]=4 4421 B12R0.251 CCCOCCCNC(C)C(C)O 6be9abc810081abd7555e130b98ce6cc [0,1,0,0,0,0|2,0,0]=3 4422 B12R0.251 CCCOCCCN[C@@H](C)C(C)C 5c5911ccce121d7e56ea952e9f8ec07c [0,1,0,0,0,0|3,0,0]=4 4423 B12R0.251 CCCOCCCN[C@H](C)C(C)C 52c9589e6e11b40cfe1506046bcc16ad [0,1,0,0,0,0|3,0,0]=4 4424 B12R0.251 CCCOCCCOC(C)C(C)C abba771f1c84350db0055aff1d18cc65 [0,1,0,0,0,0|3,0,0]=4 4425 B12R0.251 CCCOCCCOC(C)C(C)S 01316babbf123f289710bda6d793a9a8 [0,1,0,0,0,0|2,1,0]=4 4426 B12R0.251 CCCOCCCO[C@@H](C)C(C)C 61242f9c3a54889f861ae6cafb2ec443 [0,1,0,0,0,0|3,0,0]=4 4427 B12R0.251 CCCOCCCO[C@H](C)C(C)C 14b44de1fe0c55b6f61dbb8bea5670a8 [0,1,0,0,0,0|3,0,0]=4 4428 B12R0.251 CCCOCCNCC(C)C(C)C 409293033c7d8c79df79ee8ba4220bf7 [0,1,0,0,0,0|3,0,0]=4 4429 B12R0.251 CCCOCCNCC(O)C(C)C b262ea2e49e27edf627f091997f1c229 [0,1,0,0,0,0|3,0,0]=4 4430 B12R0.251 CCCOCCOCC(C)C(C)C 6587b66a0d928a691736ba0647e7b305 [0,1,0,0,0,0|3,0,0]=4 4431 B12R0.251 CCCSCCOCC(C)C(C)C 51ffaf22e8b0cf08d3652202a3b8194a [0,1,0,0,0,0|3,0,0]=4 4432 B12R0.251 CCOCCCNCC(C)C(C)C fc018f608c1476ef18d04d2414f4ec56 [0,1,0,0,0,0|3,0,0]=4 4433 B12R0.251 CCOCCCNCC(O)C(C)C 591a30d945879db9beb7825b4fdeb7e4 [0,1,0,0,0,0|3,0,0]=4 4434 B12R0.251 CCOCCCOCC(C)C(C)C c0f55580a50886d89fac6343093dcc27 [0,1,0,0,0,0|3,0,0]=4 4435 B12R0.251 CCOCCOCCC(C)C(C)C 45383071777f3b523b26a38e3a0a5c1f [0,1,0,0,0,0|3,0,0]=4 4436 B12R0.251 CCSCCCCNC(=O)C(C)O b4a5d726b9217123e63c0c40c392a249 [0,1,0,0,0,0|2,0,1]=4 4437 B12R0.251 CCSCCCCNC(=O)[C@@H](C)O 060d78ad355077f584faf9dd9734c805 [0,1,0,0,0,0|2,0,1]=4 4438 B12R0.251 CCSCCCCNC(=O)[C@H](C)O 1fe46e7ca0e1e761c03ae78055ce7602 [0,1,0,0,0,0|2,0,1]=4 4439 B12R0.251 CCSCCCCNC(C)C(C)C 7e1644219361414cdcbe9929e61a5f5d [0,1,0,0,0,0|3,0,0]=4 4440 B12R0.251 CCSCCCNCC(O)C(C)C 06c6692e28229dc18899c17f3182fffa [0,1,0,0,0,0|3,0,0]=4 4441 B12R0.251 CCSCCCOCC(C)C(C)C 8da4d41d274fbaf8a85153b00fe7f454 [0,1,0,0,0,0|3,0,0]=4 4442 B12R0.251 CCSCCOCCC(C)C(C)C 027223d8b24b6947446d2f1625792c7f [0,1,0,0,0,0|3,0,0]=4 4443 B12R0.251 COCCCCCCN(C)C(C)C f73eb45864393c1968950ac9231e7612 [0,1,0,0,0,0|3,0,0]=4 4444 B12R0.251 COCCCCCNC(=O)C(C)O 6e1dcb1f04f4400e995a5f2cd81b1b38 [0,1,0,0,0,0|2,0,1]=4 4445 B12R0.251 COCCCCCNC(=O)[C@@H](C)O f87423f1c2f27205e1048f919c0d022d [0,1,0,0,0,0|2,0,1]=4 4446 B12R0.251 COCCCCCNC(=O)[C@H](C)O 0baaa9bf55de21b566f172e4f7268c37 [0,1,0,0,0,0|2,0,1]=4 4447 B12R0.251 COCCCCCNC(C)C(C)C 1dc8f234e9c3b74f38e09508540fa0c2 [0,1,0,0,0,0|3,0,0]=4 4448 B12R0.251 COCCCCCNC(C)C(C)O 61aab428c1e3e78fa29e1625124210fd [0,1,0,0,0,0|2,0,0]=3 4449 B12R0.251 COCCCCCN[C@@H](C)C(C)C d14ed4a76826367365bd01a377bcbc37 [0,1,0,0,0,0|3,0,0]=4 4450 B12R0.251 COCCCCCN[C@H](C)C(C)C 5b6e6fc59daf2ffaab14764ccf716929 [0,1,0,0,0,0|3,0,0]=4 4451 B12R0.251 COCCCCCOC(C)C(C)C a2ad7d81d3bedfe34cafe62fc3cb449c [0,1,0,0,0,0|3,0,0]=4 4452 B12R0.251 COCCCCCOC(C)C(C)S 4c315ca8bf0c781dac6aa01937f8a505 [0,1,0,0,0,0|2,1,0]=4 4453 B12R0.251 COCCCCCO[C@@H](C)C(C)C 8f185e0533d01138b644db4869ab546c [0,1,0,0,0,0|3,0,0]=4 4454 B12R0.251 COCCCCCO[C@H](C)C(C)C 6163b557fbed946c2f41febbbba5a7a0 [0,1,0,0,0,0|3,0,0]=4 4455 B12R0.251 COCCCCNCC(C)C(C)C 564bc7176157095da058a5dce7b7ce32 [0,1,0,0,0,0|3,0,0]=4 4456 B12R0.251 COCCCCNCC(O)C(C)C a3fe3089c2d419d7f9ce1958aefd5236 [0,1,0,0,0,0|3,0,0]=4 4457 B12R0.251 COCCCCOCC(C)C(C)C 9c7d79a70dec573bf0b2332126eca920 [0,1,0,0,0,0|3,0,0]=4 4458 B12R0.251 COCCCOCCC(C)C(C)C 27023ae1c9a392ac4bc6b662881a91d0 [0,1,0,0,0,0|3,0,0]=4 4459 B12R0.251 COCCOCCNC(C)C(C)O a12a99eae00fbb0901d51882bbe73582 [0,1,0,0,0,0|3,0,0]=4 4460 B12R0.251 CSCCCCNCC(C)C(C)C fdda3a3c6da7a5cf623fc6dda4e5e6c7 [0,1,0,0,0,0|3,0,0]=4 4461 B12R0.251 CSCCCCOCC(C)C(C)C 3f9ffe23e4884476ae37fac1b3a6d617 [0,1,0,0,0,0|3,0,0]=4 4462 B12R0.251 CSCCCOCCC(C)C(C)C a530268b31c97e774bf5ed6a18df6373 [0,1,0,0,0,0|3,0,0]=4 4463 B12R0.251 C[C@@H](O)C(=O)NCCCCCCCl 0b4113855926f37b14b8871597b75647 [0,1,0,0,0,0|2,0,1]=4 4464 B12R0.251 C[C@@H](O)C(=O)NCCCCCCO 65956720889f04936d33c0247a9c40f2 [0,1,0,0,0,0|2,0,1]=4 4465 B12R0.251 C[C@H](O)C(=O)NCCCCCCCl a283dde7713fe3cf654f08505a814651 [0,1,0,0,0,0|2,0,1]=4 4466 B12R0.251 C[C@H](O)C(=O)NCCCCCCO 8a9a5559a677f62c60292b57f5779a34 [0,1,0,0,0,0|2,0,1]=4 4467 B12R0.255 C#CCCCCN(C)CCC(C)O 3352ac64e7cb5b6e2f544861ab4ec798 [0,1,0,0,0,0|1,0,2]=4 4468 B12R0.255 C/C=C\CCCN(C)CCC(C)O 2abeaceb4791e4325f517633d841b3f2 [0,1,0,0,0,0|1,0,2]=4 4469 B12R0.255 C=C(C)CCN(C)CCCCCC e7077ec24efed7a93623be4650fbd15d [0,1,0,0,0,0|2,0,1]=4 4470 B12R0.255 C=C(C)CNC(C)CCCCCC cc90a95ca839a3702152d9c91e722c58 [0,1,0,0,0,0|2,0,1]=4 4471 B12R0.255 C=C(C)CN[C@@H](C)CCCCCC c524b75adeb25043c038a5ab6ad8e9e1 [0,1,0,0,0,0|2,0,1]=4 4472 B12R0.255 C=C(C)CN[C@H](C)CCCCCC d7682a4a2c698d757c1c08092754f0c7 [0,1,0,0,0,0|2,0,1]=4 4473 B12R0.255 C=C(C)COC(C)CCCCCC f49b5aab41ed12e6fac188243b062752 [0,1,0,0,0,0|2,0,1]=4 4474 B12R0.255 C=C(C)CO[C@@H](C)CCCCCC 2f07db065620fd9e5bd37cfdefb71ba6 [0,1,0,0,0,0|2,0,1]=4 4475 B12R0.255 C=C(C)CO[C@H](C)CCCCCC 9746dba1c428b1a09cc664529ec898b9 [0,1,0,0,0,0|2,0,1]=4 4476 B12R0.255 C=CCCCCN(C)CCC(C)O 7bb83031afc8a6882761f7912d26b245 [0,1,0,0,0,0|1,0,2]=4 4477 B12R0.255 CC(C)CCC(C)CNCCCCl 07688ee0494c20741d4a0218eebbfc87 [0,1,0,0,0,0|3,0,0]=4 4478 B12R0.255 CC(C)CCC(C)CNCCCO 3e3e2944508e8d5fc938f18f9732436d [0,1,0,0,0,0|3,0,0]=4 4479 B12R0.255 CC(C)CCC(C)COCCCF 5b8376e0784c0ebb9605fa52a7ef1330 [0,1,0,0,0,0|3,0,0]=4 4480 B12R0.255 CC(C)CCC(C)COCCCS e41c68f68229b5508e1398c3a010121d [0,1,0,0,0,0|3,0,0]=4 4481 B12R0.255 CC(C)CCC(C)NCCCCCl 3d8b7b83905cdbd1f34ede2932e979d8 [0,1,0,0,0,0|3,0,0]=4 4482 B12R0.255 CC(C)CCC(C)NCCCCF bf3c22fd7f9cd5eccafce7048d68c34d [0,1,0,0,0,0|3,0,0]=4 4483 B12R0.255 CC(C)CCC(C)NCCCCO 8fdfc809974c5f67fa849e55d6ada581 [0,1,0,0,0,0|3,0,0]=4 4484 B12R0.255 CC(C)CCC(C)NCCCCS dfedc58908cfb234621c8b53ec57c8df [0,1,0,0,0,0|3,0,0]=4 4485 B12R0.255 CC(C)CCC(C)OCCCCF aa4ca4f9e0df178817e86b853f00978d [0,1,0,0,0,0|3,0,0]=4 4486 B12R0.255 CC(C)CCC(C)OCCCCS 8e5ea39ebfd7a22aeb21f7bf3fd39d8e [0,1,0,0,0,0|3,0,0]=4 4487 B12R0.255 CC(C)CCN(C)CCCCCF 90ee67c511180808a276f58ea9e8b31e [0,1,0,0,0,0|3,0,0]=4 4488 B12R0.255 CC(C)CCN(C)CCCCCO 43404cf0ed4ac15d1e7aa30cef56806e [0,1,0,0,0,0|3,0,0]=4 4489 B12R0.255 CC(O)CCC(=O)NCCCCCl e020d36936433fff6a900587aae22e8a [0,1,0,0,0,0|2,0,1]=4 4490 B12R0.255 CC(O)CCC(=O)NCCCCO 7a3c343d68de114d2db2414cc1aa3619 [0,1,0,0,0,0|2,0,1]=4 4491 B12R0.255 CC(O)CCC(=O)NCCCCS 554b766283302868c5371f68379e9d06 [0,1,0,0,0,0|2,0,1]=4 4492 B12R0.255 CC(O)CCN(C)CCCCC#N 8f25e464657ead40d1fb3f45342cd373 [0,1,0,0,0,0|2,0,1]=4 4493 B12R0.255 CC(O)CCN(C)CCCCC=O c6c3067188ca88efd82eca1e39faa6e6 [0,1,0,0,0,0|2,0,1]=4 4494 B12R0.255 CC(O)CCN(C)CCCCCF 4099a451260f55897df17f442373f516 [0,1,0,0,0,0|2,0,0]=3 4495 B12R0.255 CC(O)CCN(C)CCCCCO 611d46693b8fc2ce7373f4cf6870033f [0,1,0,0,0,0|2,0,0]=3 4496 B12R0.255 CC(O)CCN(C)CCCCON cea787e1ec5ac15a5028453a3a8efddc [0,1,0,0,0,0|3,0,0]=4 4497 B12R0.255 CC(O)CCN(C)CCOCCO 202f0b2eb465e81b4201aeaee412a4f8 [0,1,0,0,0,0|3,0,0]=4 4498 B12R0.255 CC(O)CNC(=O)CCCCCF aad3a1aa167270a752a7d15c513c0bc0 [0,1,0,0,0,0|2,0,1]=4 4499 B12R0.255 CC(O)CNC(=O)CCCCCO 247b82f9e45bd3ddf30cd75e3ff5abec [0,1,0,0,0,0|2,0,1]=4 4500 B12R0.255 CC(O)CNC(=O)CCCCCS deb7e73b9e43ba2fdcf2f35b11b1bfb6 [0,1,0,0,0,0|2,0,1]=4 4501 B12R0.255 CC/C=C\CCN(C)CCC(C)O b7c2210f1c408a015a067169e8b90b61 [0,1,0,0,0,0|1,0,2]=4 4502 B12R0.255 CCC/C=C/CN(C)CCC(C)O 11be0d75cb58df1a9ee8b1e1f5054b08 [0,1,0,0,0,0|1,0,2]=4 4503 B12R0.255 CCC/C=C\CN(C)CCC(C)O 9df5849e3bd0ea517abb28501ef934d2 [0,1,0,0,0,0|1,0,2]=4 4504 B12R0.255 CCCCCCC(=O)NCC(C)C 0c5152eb0e826684d1d413b677c75710 [0,1,0,0,0,0|2,0,1]=4 4505 B12R0.255 CCCCCCC(=O)NCC(C)O c1979e8648c94a347dab72d9885f0875 [0,1,0,0,0,0|1,0,1]=3 4506 B12R0.255 CCCCCCC(=O)NC[C@@H](C)O 4e14730ab63dec4b35220e51bd599649 [0,1,0,0,0,0|1,0,1]=3 4507 B12R0.255 CCCCCCC(=O)NC[C@H](C)O b6fabc3eb769298d953797ac157bdffe [0,1,0,0,0,0|1,0,1]=3 4508 B12R0.255 CCCCCCC(C)COC(C)C 55952ff2228551087ed8539a221cc10d [0,1,0,0,0,0|2,0,0]=3 4509 B12R0.255 CCCCCCC(C)NCC(=O)C 8373bc57eb888e934ff1a4770be2f031 [0,1,0,0,0,0|1,0,2]=4 4510 B12R0.255 CCCCCCC(C)NCC(=O)O 5b4ef846d71e5227a255848f84ef3adb [0,1,0,0,0,0|2,0,1]=4 4511 B12R0.255 CCCCCCC(C)NCC(C)C 3609e67bdd27f48165d0cefe437ea9fd [0,1,0,0,0,0|2,0,0]=3 4512 B12R0.255 CCCCCCC(C)NCC(C)O 347a56c31b7437f5b3e3dea7c4723f43 [0,1,0,0,0,0|1,0,0]=2 4513 B12R0.255 CCCCCCC(C)NCC(F)F 1854162d0122570b5261f1ed72180682 [0,1,0,0,0,0|3,0,0]=4 4514 B12R0.255 CCCCCCC(C)NCN(C)C eec95d787c6ecf4c3cd03c558f117d31 [0,1,0,0,0,0|3,0,0]=4 4515 B12R0.255 CCCCCCC(C)NC[C@@H](C)O 867d126176d13fce29b806aa2e8abdc5 [0,1,0,0,0,0|1,0,0]=2 4516 B12R0.255 CCCCCCC(C)NC[C@H](C)O 1847295b6f7a678418149b280061eb72 [0,1,0,0,0,0|1,0,0]=2 4517 B12R0.255 CCCCCCC(C)OCC(=O)C b3baaea0fb3783bcad6572d0d40ddc26 [0,1,0,0,0,0|1,0,2]=4 4518 B12R0.255 CCCCCCC(C)OCC(=O)O bf6da62cb517a7400bc7e361626de98d [0,1,0,0,0,0|2,0,1]=4 4519 B12R0.255 CCCCCCC(C)OCC(C)C 062e8906e37f4fc31be1bc88d316b827 [0,1,0,0,0,0|2,0,0]=3 4520 B12R0.255 CCCCCCC(C)OCC(C)F d391120109c2367f3ceec481707f15df [0,1,0,0,0,0|2,0,0]=3 4521 B12R0.255 CCCCCCC(C)OCC(C)S 6c97fc2cc44484748451ede52a2c28d0 [0,1,0,0,0,0|1,1,0]=3 4522 B12R0.255 CCCCCCC(C)OCC(F)F f4c43131b00f57cb38d72e632a070560 [0,1,0,0,0,0|3,0,0]=4 4523 B12R0.255 CCCCCCC(C)OCN(C)C f7ca2e23ad57f3532c248ea25896c5b7 [0,1,0,0,0,0|3,0,0]=4 4524 B12R0.255 CCCCCCC(C)OC[C@@H](C)F 3b1450489f5f658ea00d4702aa7628d3 [0,1,0,0,0,0|2,0,0]=3 4525 B12R0.255 CCCCCCC(C)OC[C@H](C)F 1a1e8cfd451f44837514f29cba434253 [0,1,0,0,0,0|2,0,0]=3 4526 B12R0.255 CCCCCCN(C)CCC(=O)C 77c0a1221183fa40cb1ace6a9be6ca61 [0,1,0,0,0,0|1,0,2]=4 4527 B12R0.255 CCCCCCN(C)CCC(=O)O 3ee6fb03f9f9bf3501eecfc92744a975 [0,1,0,0,0,0|2,0,1]=4 4528 B12R0.255 CCCCCCN(C)CCC(C)C 271d0ff72082fb8d7ba2ffc61fb44a48 [0,1,0,0,0,0|2,0,0]=3 4529 B12R0.255 CCCCCCN(C)CCC(C)O 0d9933581c2a7ffc5c33050c61f3a297 [0,1,0,0,0,0|1,0,0]=2 4530 B12R0.255 CCCCCCN(C)CCC(F)F 55cc102df5d10eab377d4c31d59168c7 [0,1,0,0,0,0|3,0,0]=4 4531 B12R0.255 CCCCCCN(C)CCN(C)C e2c4022ee46d84ae5c82638ef73ba7a2 [0,1,0,0,0,0|3,0,0]=4 4532 B12R0.255 CCCCCCN(C)CCS(=O)C 528aaaaca54fd5d1c70a0ed646ccb6df [0,1,0,0,0,0|2,0,1]=4 4533 B12R0.255 CCCCCCN(C)COC(C)C f3c795f15daef5656cdbdf2741163f5a [0,1,0,0,0,0|3,0,0]=4 4534 B12R0.255 CCCCCC[C@@H](C)NCC(=O)O b4d3a1ddcb935fb82355d0e55f57b6c5 [0,1,0,0,0,0|2,0,1]=4 4535 B12R0.255 CCCCCC[C@@H](C)NCC(C)C bbca764bbedfe97cde188b6be3861486 [0,1,0,0,0,0|2,0,0]=3 4536 B12R0.255 CCCCCC[C@@H](C)NCC(C)O 8257cca5945f28715814c07712bb7a60 [0,1,0,0,0,0|1,0,0]=2 4537 B12R0.255 CCCCCC[C@@H](C)NCC(F)F 3f2952aae86ee9bfaedf50cb86c90ab1 [0,1,0,0,0,0|3,0,0]=4 4538 B12R0.255 CCCCCC[C@@H](C)NCN(C)C d96c0e16d9d111ce63f7ab3a4a654fa0 [0,1,0,0,0,0|3,0,0]=4 4539 B12R0.255 CCCCCC[C@@H](C)NC[C@@H](C)O efb919a1e9cf05edefbc65a84f410a09 [0,1,0,0,0,0|1,0,0]=2 4540 B12R0.255 CCCCCC[C@@H](C)NC[C@H](C)O 4b471bf22338ae86de450474855b7a7f [0,1,0,0,0,0|1,0,0]=2 4541 B12R0.255 CCCCCC[C@@H](C)OCC(=O)O 6a2cc292694e77902215affab05046db [0,1,0,0,0,0|2,0,1]=4 4542 B12R0.255 CCCCCC[C@@H](C)OCC(C)C c161a01d216343b11cd2c57ee40f2d8b [0,1,0,0,0,0|2,0,0]=3 4543 B12R0.255 CCCCCC[C@@H](C)OCC(F)F dc243b3b89f1a4fd022f66b8a61206e0 [0,1,0,0,0,0|3,0,0]=4 4544 B12R0.255 CCCCCC[C@@H](C)OCN(C)C 72edd03ef36552eb2ce8d67833b0f228 [0,1,0,0,0,0|3,0,0]=4 4545 B12R0.255 CCCCCC[C@H](C)NCC(=O)O 2edf41aded485414f03bcf3127daaac2 [0,1,0,0,0,0|2,0,1]=4 4546 B12R0.255 CCCCCC[C@H](C)NCC(C)C 953d9c59acb6fc7e1012883ad6550b6d [0,1,0,0,0,0|2,0,0]=3 4547 B12R0.255 CCCCCC[C@H](C)NCC(C)O d6a6009f69d44dbc296587ae911a3cd3 [0,1,0,0,0,0|1,0,0]=2 4548 B12R0.255 CCCCCC[C@H](C)NCC(F)F 6e51b21bcbd77b476adbc1cff98c1b38 [0,1,0,0,0,0|3,0,0]=4 4549 B12R0.255 CCCCCC[C@H](C)NCN(C)C ac0764978f96726875f373795be25d07 [0,1,0,0,0,0|3,0,0]=4 4550 B12R0.255 CCCCCC[C@H](C)NC[C@@H](C)O 19167f9af1dc89d804c356a4292943f2 [0,1,0,0,0,0|1,0,0]=2 4551 B12R0.255 CCCCCC[C@H](C)NC[C@H](C)O 86348e1d874cecd59980df94092878ef [0,1,0,0,0,0|1,0,0]=2 4552 B12R0.255 CCCCCC[C@H](C)OCC(=O)O a23bbfbc06cec00fc6872e21388755e1 [0,1,0,0,0,0|2,0,1]=4 4553 B12R0.255 CCCCCC[C@H](C)OCC(C)C 873412fe9c3683d71d9163071cdfaa3c [0,1,0,0,0,0|2,0,0]=3 4554 B12R0.255 CCCCCC[C@H](C)OCC(F)F a67b7d1703411c504b8a9da7c63a01c5 [0,1,0,0,0,0|3,0,0]=4 4555 B12R0.255 CCCCCC[C@H](C)OCN(C)C 77f4652e7453226bba4bf76df20675b8 [0,1,0,0,0,0|3,0,0]=4 4556 B12R0.255 CCCCCNC(=O)CCC(C)C 4509dfaa9996ad412b21022ad1197a9e [0,1,0,0,0,0|2,0,1]=4 4557 B12R0.255 CCCCCNC(=O)CCC(C)O 9ae4d2e8fa18dd30b74dc56d421339a8 [0,1,0,0,0,0|1,0,1]=3 4558 B12R0.255 CCCCCNC(=O)CCC(C)S 8fcca9b47bf869f2b2b12ba6d6ba9a1a [0,1,0,0,0,0|1,1,1]=4 4559 B12R0.255 CCCCCNC(=O)CC[C@H](C)S 32f20faa1501cb075be47f0761d88337 [0,1,0,0,0,0|1,1,1]=4 4560 B12R0.255 CCCCCNC(=O)NCC(C)O 5ec8930cc3f2ba2beae2843a0139b8e2 [0,1,0,0,0,0|2,0,1]=4 4561 B12R0.255 CCCCCNC(=O)NC[C@@H](C)O 595779b34a71cf136763fd5118013fde [0,1,0,0,0,0|2,0,1]=4 4562 B12R0.255 CCCCCNC(=O)NC[C@H](C)O 561f576252e9d6732de03a0f3ded132b [0,1,0,0,0,0|2,0,1]=4 4563 B12R0.255 CCCCCNC(=S)NCC(C)O 85d9ffd4ccae8d88bfa2588dafefbfbb [0,1,0,0,0,0|2,0,1]=4 4564 B12R0.255 CCCCCNC(=S)NC[C@@H](C)O 6bac4fcfcfb93c2af6007831165c4147 [0,1,0,0,0,0|2,0,1]=4 4565 B12R0.255 CCCCCNC(=S)NC[C@H](C)O bf3f7c92f9626828e2c5c65218e2efbe [0,1,0,0,0,0|2,0,1]=4 4566 B12R0.255 CCCCCNC(C)CCC(=O)O 730b0df9d7fa73e87407a0302aed1146 [0,1,0,0,0,0|2,0,1]=4 4567 B12R0.255 CCCCCNC(C)CCC(C)C abb6188abf30fc4f0af96c8addc33d3c [0,1,0,0,0,0|2,0,0]=3 4568 B12R0.255 CCCCCNC(C)CCN(C)C 41dd1d3913b4f98baa692cb6d994e3b7 [0,1,0,0,0,0|3,0,0]=4 4569 B12R0.255 CCCCCN[C@@H](C)CCC(=O)O 4387733a443a9a8b950031c87b714308 [0,1,0,0,0,0|2,0,1]=4 4570 B12R0.255 CCCCCN[C@@H](C)CCN(C)C 5455d98c556e961eacf28ee09ccd7f5d [0,1,0,0,0,0|3,0,0]=4 4571 B12R0.255 CCCCCN[C@H](C)CCN(C)C 0ea6ebeb50ca2e088b7174e9a1b3bead [0,1,0,0,0,0|3,0,0]=4 4572 B12R0.255 CCCCCOC(C)CCC(=O)O 77363f5fe2bc3f8f43385acd048d6314 [0,1,0,0,0,0|2,0,1]=4 4573 B12R0.255 CCCCCOC(C)CCC(C)C f3083416dbfd4c775573ce6ee5eba6d4 [0,1,0,0,0,0|2,0,0]=3 4574 B12R0.255 CCCCCOC(C)CCN(C)C 9bff8374c42b4ab864945a82b348d51b [0,1,0,0,0,0|3,0,0]=4 4575 B12R0.255 CCCCCOC(C)COC(C)C b6e991577221aef15bb5c63a08cdd279 [0,1,0,0,0,0|3,0,0]=4 4576 B12R0.255 CCCCCO[C@@H](C)COC(C)C ae1e1540c460ed255a67891ea2702383 [0,1,0,0,0,0|3,0,0]=4 4577 B12R0.255 CCCCNCC(C)CCC(C)C 144c51f40fddd0241ede0a58a41e34bf [0,1,0,0,0,0|2,0,0]=3 4578 B12R0.255 CCCCNCC(O)COC(C)C accb91b10415fa6c8bce6520b12f0030 [0,1,0,0,0,0|3,0,0]=4 4579 B12R0.255 CCCCOCC(=O)NCC(C)O 10db8463f7dda08f13f3bf23d0fd905c [0,1,0,0,0,0|2,0,1]=4 4580 B12R0.255 CCCCOCC(=O)NC[C@@H](C)O 6da09ed3f23f277cddc4dcabb43e1550 [0,1,0,0,0,0|2,0,1]=4 4581 B12R0.255 CCCCOCC(=O)NC[C@H](C)O 4b5f37c86f3d617dbe0c1476a1a6b487 [0,1,0,0,0,0|2,0,1]=4 4582 B12R0.255 CCCCOCC(C)CCC(C)C 7a8054f5a2143741e0d0be0fa3d6b059 [0,1,0,0,0,0|2,0,0]=3 4583 B12R0.255 CCCCOCC(C)OCC(C)C bd0091eb0f15fcbd99f46cfd5802584e [0,1,0,0,0,0|3,0,0]=4 4584 B12R0.255 CCCCOCN(C)CCC(C)C 4f89dcbda247bbd0a9524bca663e7ca5 [0,1,0,0,0,0|3,0,0]=4 4585 B12R0.255 CCCCOCN(C)CCC(C)O 8c3132ade59e4b324a4d287a73a41f66 [0,1,0,0,0,0|2,0,0]=3 4586 B12R0.255 CCCCSCC(=O)NCC(C)O 133f8c5dd6f6a5fa8092e2b958671201 [0,1,0,0,0,0|2,0,1]=4 4587 B12R0.255 CCCCSCC(=O)NC[C@@H](C)O 9c3ebb36766a809ac7cb8973c6c2458f [0,1,0,0,0,0|2,0,1]=4 4588 B12R0.255 CCCCSCC(=O)NC[C@H](C)O 3a03dcbb269a34e26ed2a3838e89b9f2 [0,1,0,0,0,0|2,0,1]=4 4589 B12R0.255 CCCOCCC(=O)NCC(C)O 017d96992e314732f7d78d4b99d7019a [0,1,0,0,0,0|2,0,1]=4 4590 B12R0.255 CCCOCCC(=O)NC[C@@H](C)O 4aa45b06aecef650d0dca86f505ca263 [0,1,0,0,0,0|2,0,1]=4 4591 B12R0.255 CCCOCCC(=O)NC[C@H](C)O 05acf0f5bbcbea6e781d8a4377f94c34 [0,1,0,0,0,0|2,0,1]=4 4592 B12R0.255 CCCOCCN(C)CCC(C)C e4341f1fa39d890cf03a0e2777b2ab16 [0,1,0,0,0,0|3,0,0]=4 4593 B12R0.255 CCCOCCN(C)CCC(C)O cabeab4bcacf3fddbe78747573f5a02a [0,1,0,0,0,0|2,0,0]=3 4594 B12R0.255 CCOCCCN(C)CCC(C)C 1d5a604004d90531e7d64caf0574292f [0,1,0,0,0,0|3,0,0]=4 4595 B12R0.255 CCOCCCN(C)CCC(C)O 8e406aae461649c431eea658a7158a69 [0,1,0,0,0,0|2,0,0]=3 4596 B12R0.255 CCOCCNC(=O)CCC(C)O 7a25dc3ee917c3693b505f95f6452db7 [0,1,0,0,0,0|2,0,1]=4 4597 B12R0.255 CCOCCNC(C)CCC(C)C e0d5afa03fffb62a50e4be3dd27ddb3f [0,1,0,0,0,0|3,0,0]=4 4598 B12R0.255 CCOCCOC(C)CCC(C)C 98d4adb87db1ecec036a39099baaa346 [0,1,0,0,0,0|3,0,0]=4 4599 B12R0.255 CCOCOCC(C)CCC(C)C e66e450788b7d7e8720c0f4c3b0d6dd5 [0,1,0,0,0,0|3,0,0]=4 4600 B12R0.255 CCSCCCN(C)CCC(C)C 3aecefcdc83f96e38193df6c1ed1a718 [0,1,0,0,0,0|3,0,0]=4 4601 B12R0.255 CCSCCCN(C)CCC(C)O c0349080157df550b4f1694bdbc2298b [0,1,0,0,0,0|2,0,0]=3 4602 B12R0.255 CCSCCNC(=O)CCC(C)O de8ae67b27ff4b882ec4cdd27e2285df [0,1,0,0,0,0|2,0,1]=4 4603 B12R0.255 CCSCCNC(C)CCC(C)C 295a31a75028a79861458db50673c7bc [0,1,0,0,0,0|3,0,0]=4 4604 B12R0.255 CCSCCOC(C)CCC(C)C d3bd18056b86ab043397d862b5758c5c [0,1,0,0,0,0|3,0,0]=4 4605 B12R0.255 COCCCCN(C)CCC(C)C 11c1e8656fb7a09533333650139da2a9 [0,1,0,0,0,0|3,0,0]=4 4606 B12R0.255 COCCCCN(C)CCC(C)O 15d3b185e975b7ba6738e39114bbd77c [0,1,0,0,0,0|2,0,0]=3 4607 B12R0.255 COCCCNC(=O)CCC(C)O b8996dc3a09a721c81bb6b41c4181816 [0,1,0,0,0,0|2,0,1]=4 4608 B12R0.255 COCCCNC(C)CCC(C)C ddd80e6c3cd763cf39566b6143120b3c [0,1,0,0,0,0|3,0,0]=4 4609 B12R0.255 COCCCOC(C)CCC(C)C e2456bdd5554185ddabc3603a665bc8a [0,1,0,0,0,0|3,0,0]=4 4610 B12R0.255 COCCNCC(C)CCC(C)C 7e5a1c8ad301823589dc18f0a619bc09 [0,1,0,0,0,0|3,0,0]=4 4611 B12R0.255 COCCOCC(C)CCC(C)C 480888ca56e9ac133aa4aebf4a6bff58 [0,1,0,0,0,0|3,0,0]=4 4612 B12R0.255 COCCOCN(C)CCC(C)O e5c3cfa30b67ca1ec6c5ed9fb06f2e24 [0,1,0,0,0,0|3,0,0]=4 4613 B12R0.255 COCOCCN(C)CCC(C)O 20f6450a1a4179e59ed85ba0d91941da [0,1,0,0,0,0|3,0,0]=4 4614 B12R0.255 CSCCCNC(=O)CCC(C)O 3cb826010195a30173aedbcb7cb69ead [0,1,0,0,0,0|2,0,1]=4 4615 B12R0.255 CSCCCNC(C)CCC(C)C c2796fee2118c9340bb9493a3dfa322d [0,1,0,0,0,0|3,0,0]=4 4616 B12R0.255 CSCCCOC(C)CCC(C)C 5f6c44a1fffdba904319019367d784ff [0,1,0,0,0,0|3,0,0]=4 4617 B12R0.255 CSCCNCC(C)CCC(C)C 5fed4b62979dd18123e7ed1dca2a3d53 [0,1,0,0,0,0|3,0,0]=4 4618 B12R0.255 CSCCOCC(C)CCC(C)C 9f258359b508f246ca70a35fcb855786 [0,1,0,0,0,0|3,0,0]=4 4619 B12R0.255 C[C@@H](O)CNC(=O)CCCCCF 1b4b7e32bd4af3eaa854f38575cd58cf [0,1,0,0,0,0|2,0,1]=4 4620 B12R0.255 C[C@@H](O)CNC(=O)CCCCCO 459efdbb64cdfa9eb9b34d612f8dd01b [0,1,0,0,0,0|2,0,1]=4 4621 B12R0.255 C[C@@H](O)CNC(=O)CCCCCS aa41a283462a3516c6c6c25829f4363c [0,1,0,0,0,0|2,0,1]=4 4622 B12R0.255 C[C@H](O)CNC(=O)CCCCCF 48a802559132d81a4a423a08efa684af [0,1,0,0,0,0|2,0,1]=4 4623 B12R0.255 C[C@H](O)CNC(=O)CCCCCO e62869498fe2d44ae6b256232d96f8b3 [0,1,0,0,0,0|2,0,1]=4 4624 B12R0.255 C[C@H](O)CNC(=O)CCCCCS b815bd50b32f50d5c16c26777ea61ba6 [0,1,0,0,0,0|2,0,1]=4 4625 B12R0.268 C=C(C)CCCNCCCC(C)C 7205c3eec3ac6669aa8e936057ad058a [0,1,0,0,0,0|2,0,1]=4 4626 B12R0.268 C=C(C)CCCOCCCC(C)C e1f5e4ccfd5037c45bc6da56e89c26a6 [0,1,0,0,0,0|2,0,1]=4 4627 B12R0.268 C=C(C)CCNCCCCC(C)C 89fdfde8f9e4135f25dcc5df74262a03 [0,1,0,0,0,0|2,0,1]=4 4628 B12R0.268 C=C(C)CCNCCCCC(C)O 531e7b52746a3942d918f35b54324792 [0,1,0,0,0,0|1,0,1]=3 4629 B12R0.268 C=C(C)CCNCCCC[C@@H](C)O 0f2a127206a37e34a5aa866065108ee5 [0,1,0,0,0,0|1,0,1]=3 4630 B12R0.268 C=C(C)CCOCCCCC(C)C c4303f7491f0acd639e37ea6f5102ffe [0,1,0,0,0,0|2,0,1]=4 4631 B12R0.268 C=C(C)CNCCCCCC(C)C c712a2403ae28e028ffb29681ac896b4 [0,1,0,0,0,0|2,0,1]=4 4632 B12R0.268 C=C(C)COCCCCCC(C)C 2cfcce33d485c4231a3a2c67fe84fb47 [0,1,0,0,0,0|2,0,1]=4 4633 B12R0.268 CC(=CCNCCCCC(C)O)C b74e47fa60bf7742aa195c2390a30563 [0,1,0,0,0,0|1,0,2]=4 4634 B12R0.268 CC(=CCNCCCC[C@@H](C)O)C 28d55cdc179c26a57b8128866e6435a8 [0,1,0,0,0,0|1,0,2]=4 4635 B12R0.268 CC(=O)CCCCCNCC(C)C b3d3e3fd1d8fd027f6c6c8a468bb6421 [0,1,0,0,0,0|1,0,2]=4 4636 B12R0.268 CC(=O)CCCCCNCC(C)O 51c09229f7d57d24a24952c0933c8bcb [0,1,0,0,0,0|1,0,1]=3 4637 B12R0.268 CC(=O)CCCCCNC[C@@H](C)O 975488390d3ba6ee961bc652b36ce35c [0,1,0,0,0,0|1,0,1]=3 4638 B12R0.268 CC(=O)CCCCCNC[C@H](C)O cc55bcd80a13d5b36fad8ce8f47a4694 [0,1,0,0,0,0|1,0,1]=3 4639 B12R0.268 CC(=O)CCCCCOCC(C)C fd01073020830e855e3fa8713a6489cb [0,1,0,0,0,0|1,0,2]=4 4640 B12R0.268 CC(=O)CCCCCOCC(C)F 9516cb1a86b2391df719fdeabc9bebad [0,1,0,0,0,0|1,0,2]=4 4641 B12R0.268 CC(=O)CCCCCOCC(C)S d93845de3d4512445ec3c1c86a0098dd [0,1,0,0,0,0|1,0,2]=4 4642 B12R0.268 CC(=O)CCCCCOC[C@@H](C)F dfe831dd075ef35fb238b09d24944518 [0,1,0,0,0,0|1,0,2]=4 4643 B12R0.268 CC(=O)CCCCCOC[C@H](C)F f48758efd7e77081c6cae4273062d2e1 [0,1,0,0,0,0|1,0,2]=4 4644 B12R0.268 CC(=O)CCCCNCCC(C)C 79db3092d6102a59e6a4729bee230e1f [0,1,0,0,0,0|1,0,2]=4 4645 B12R0.268 CC(=O)CCCCNCCC(C)O 0a79b3008577d0999b6f6e062f397ebc [0,1,0,0,0,0|1,0,1]=3 4646 B12R0.268 CC(=O)CCCCNCC[C@@H](C)O e5f4e5452e1975ea0e77eeb5c3654c14 [0,1,0,0,0,0|1,0,1]=3 4647 B12R0.268 CC(=O)CCCCNCC[C@H](C)O cc290693299e5d865b9c9a6a3efa6aec [0,1,0,0,0,0|1,0,1]=3 4648 B12R0.268 CC(=O)CCCCOCCC(C)C 541dc39bd2527116e2568a911c050439 [0,1,0,0,0,0|1,0,2]=4 4649 B12R0.268 CC(=O)CCCNCCCC(C)C be90f6bb1d7b250c8650cae70348773a [0,1,0,0,0,0|1,0,2]=4 4650 B12R0.268 CC(=O)CCCOCCCC(C)C c52f2cbfa9af5ce02a2b488d27d53b63 [0,1,0,0,0,0|1,0,2]=4 4651 B12R0.268 CC(=O)CCOCCCCC(C)C c175f11c6de35fc87bc817dcccaa1a16 [0,1,0,0,0,0|1,0,2]=4 4652 B12R0.268 CC(=O)CNCCCCCC(C)C 24770649e88fdd3d6391d8c54485a92a [0,1,0,0,0,0|1,0,2]=4 4653 B12R0.268 CC(=O)COCCCCCC(C)C 72c559fde0b6b586b1394d174a8941ac [0,1,0,0,0,0|1,0,2]=4 4654 B12R0.268 CC(=O)NCCCCCCC(C)C 34bfb37edb48c7a4b8a967a4aea9afad [0,1,0,0,0,0|1,0,2]=4 4655 B12R0.268 CC(=O)NCCCCNCC(C)O 1151a7d210ca7bd4989b1a86a5b76b4c [0,1,0,0,0,0|2,0,1]=4 4656 B12R0.268 CC(=O)NCCCCNC[C@@H](C)O 0b0037c5d4a31acbccc3f5d858e90f8a [0,1,0,0,0,0|2,0,1]=4 4657 B12R0.268 CC(=O)NCCCCNC[C@H](C)O 63267fe5d281b8a29857fa0434d16172 [0,1,0,0,0,0|2,0,1]=4 4658 B12R0.268 CC(=O)NCCCNCCC(C)O dab25dac90341e6ca1e3f53d50a12755 [0,1,0,0,0,0|2,0,1]=4 4659 B12R0.268 CC(=O)NCCCNCC[C@@H](C)O df3d51a1a700f6e6223a57795629bc27 [0,1,0,0,0,0|2,0,1]=4 4660 B12R0.268 CC(=O)NCCCNCC[C@H](C)O 343b0cb09b966a4a294fba6c68e5984b [0,1,0,0,0,0|2,0,1]=4 4661 B12R0.268 CC(=O)NCCNCCCC(C)O b3f84dda5a9e90a3a38f9f22150427fa [0,1,0,0,0,0|2,0,1]=4 4662 B12R0.268 CC(=O)OCCCCNCC(C)O c3d4d9310acd7e4d537e1960f26f96eb [0,1,0,0,0,0|2,0,1]=4 4663 B12R0.268 CC(=O)OCCCCNC[C@@H](C)O 78a3999634f0b893993c022ab63fa4e1 [0,1,0,0,0,0|2,0,1]=4 4664 B12R0.268 CC(=O)OCCCCNC[C@H](C)O 8821d4d913f049294f35b758d3650ed6 [0,1,0,0,0,0|2,0,1]=4 4665 B12R0.268 CC(=O)OCCCNCCC(C)O 39ede755fb77a6275479c6f1297578f7 [0,1,0,0,0,0|2,0,1]=4 4666 B12R0.268 CC(=O)OCCCNCC[C@@H](C)O b648cd8fe99829a3abbd2601438f5159 [0,1,0,0,0,0|2,0,1]=4 4667 B12R0.268 CC(=O)OCCCNCC[C@H](C)O de17a96e228173828b648644d5ff67fd [0,1,0,0,0,0|2,0,1]=4 4668 B12R0.268 CC(=O)SCCCCNCC(C)O eb1cd9c703d3fe8715ab5e13535e4457 [0,1,0,0,0,0|2,0,1]=4 4669 B12R0.268 CC(=O)SCCCCNC[C@@H](C)O 9ce184814bdfc6a143ddaf6a1af3cd88 [0,1,0,0,0,0|2,0,1]=4 4670 B12R0.268 CC(=O)SCCCCNC[C@H](C)O 0ddb5172e6ecf33159f75ef7cdf46913 [0,1,0,0,0,0|2,0,1]=4 4671 B12R0.268 CC(=O)SCCCNCCC(C)O 69fd866b39009ecdd93ec4381a8ec704 [0,1,0,0,0,0|2,0,1]=4 4672 B12R0.268 CC(=O)SCCCNCC[C@@H](C)O 270f18d38a43167fbdd5b971833a87aa [0,1,0,0,0,0|2,0,1]=4 4673 B12R0.268 CC(=O)SCCCNCC[C@H](C)O 5ae1e20d2be411714df38424134e1bca [0,1,0,0,0,0|2,0,1]=4 4674 B12R0.268 CC(=S)OCCCNCCC(C)O 267738ab3967d762b76b797b9a2a834a [0,1,0,0,0,0|2,0,1]=4 4675 B12R0.268 CC(=S)OCCCNCC[C@@H](C)O 8344c84239c64669028033653b93437c [0,1,0,0,0,0|2,0,1]=4 4676 B12R0.268 CC(=S)OCCCNCC[C@H](C)O ed7378d5d2a0ba1a4d0c2081e333995f [0,1,0,0,0,0|2,0,1]=4 4677 B12R0.268 CC(C)CCCCCCNC(C)C 40118e1ef272125c43de6c5fd616b9bc [0,1,0,0,0,0|2,0,0]=3 4678 B12R0.268 CC(C)CCCCCCOC(C)C 063dfa1f2b749213fc23dda9d43c7cc6 [0,1,0,0,0,0|2,0,0]=3 4679 B12R0.268 CC(C)CCCCCNCC(=O)O bc1e72eb6cd8a0a88440d6aab5dfc8c4 [0,1,0,0,0,0|2,0,1]=4 4680 B12R0.268 CC(C)CCCCCNCC(C)C fc6e2eb85a4ce251550fdb590f5e2344 [0,1,0,0,0,0|2,0,0]=3 4681 B12R0.268 CC(C)CCCCCNCC(C)O 8c296eeb310e4254cde3c8dbff584dad [0,1,0,0,0,0|1,0,0]=2 4682 B12R0.268 CC(C)CCCCCNCC(F)F ff7444624de488f85295616617c0ee5f [0,1,0,0,0,0|3,0,0]=4 4683 B12R0.268 CC(C)CCCCCNCN(C)C d09c231f3e46dcfc006534e592dc4a94 [0,1,0,0,0,0|3,0,0]=4 4684 B12R0.268 CC(C)CCCCCNC[C@@H](C)O 7b6f280296c9380a9fd6a2e191b5a127 [0,1,0,0,0,0|1,0,0]=2 4685 B12R0.268 CC(C)CCCCCNC[C@H](C)O df8cdece7f64ae92248923ce6f24ecf8 [0,1,0,0,0,0|1,0,0]=2 4686 B12R0.268 CC(C)CCCCCOCC(=O)O ad5b528a5f39e66824c6882877801d6d [0,1,0,0,0,0|2,0,1]=4 4687 B12R0.268 CC(C)CCCCCOCC(C)C b950c703059738ef752c6408d7457cb7 [0,1,0,0,0,0|2,0,0]=3 4688 B12R0.268 CC(C)CCCCCOCC(C)F cf9faf48c255816493fe94a01d412a4a [0,1,0,0,0,0|2,0,0]=3 4689 B12R0.268 CC(C)CCCCCOCC(C)S 7d7374cd967872d9da8386b6f779082f [0,1,0,0,0,0|1,1,0]=3 4690 B12R0.268 CC(C)CCCCCOCC(F)F 7e0ac6ed2dca5fd95581aaa6a570c139 [0,1,0,0,0,0|3,0,0]=4 4691 B12R0.268 CC(C)CCCCCOCN(C)C 9613b394259ecdf4521f82b1a5cd1b7d [0,1,0,0,0,0|3,0,0]=4 4692 B12R0.268 CC(C)CCCCCOCS(=O)O 7392b27b75370fe124595f77c19ef7c2 [0,1,0,0,0,0|3,0,0]=4 4693 B12R0.268 CC(C)CCCCCOC[C@@H](C)F 7e770bd8812278ab36500fbf8a69ade3 [0,1,0,0,0,0|2,0,0]=3 4694 B12R0.268 CC(C)CCCCCOC[C@H](C)F 5f85fb05e60f352dc1f5d3ce38752f98 [0,1,0,0,0,0|2,0,0]=3 4695 B12R0.268 CC(C)CCCCNCCC(=O)O 6f9b0e5dbba9eb2b66a4135799fd5727 [0,1,0,0,0,0|2,0,1]=4 4696 B12R0.268 CC(C)CCCCNCCC(C)C f3b5a1fc70689a4cf3f529b59a14f5da [0,1,0,0,0,0|2,0,0]=3 4697 B12R0.268 CC(C)CCCCNCCC(C)O de66ca1cca76c20acc226e3de8ab7f9f [0,1,0,0,0,0|1,0,0]=2 4698 B12R0.268 CC(C)CCCCNCCC(F)F caefd8ae39ceccec10cb9155891960d4 [0,1,0,0,0,0|3,0,0]=4 4699 B12R0.268 CC(C)CCCCNCCN(C)C 61fd9d0fd447cce7c9fbf0831b22c9eb [0,1,0,0,0,0|3,0,0]=4 4700 B12R0.268 CC(C)CCCCNCCS(=O)C 2de351369cba15b80f969469fea41940 [0,1,0,0,0,0|2,0,1]=4 4701 B12R0.268 CC(C)CCCCNCCS(=O)O 2e316773e063740a9861d6dff6e1ca59 [0,1,0,0,0,0|3,0,0]=4 4702 B12R0.268 CC(C)CCCCNCC[C@@H](C)O 41f5e7f60a163149c646010ca6aaf7c5 [0,1,0,0,0,0|1,0,0]=2 4703 B12R0.268 CC(C)CCCCNCC[C@H](C)O e71ea23502c1fb79161d4d81d21f17df [0,1,0,0,0,0|1,0,0]=2 4704 B12R0.268 CC(C)CCCCOCCC(=O)O eb4b6a5d6c58fa91464161fa5217a654 [0,1,0,0,0,0|2,0,1]=4 4705 B12R0.268 CC(C)CCCCOCCC(C)C 8ff1682f199de350b595fced74c96623 [0,1,0,0,0,0|2,0,0]=3 4706 B12R0.268 CC(C)CCCCOCCC(F)F b2f8cf7568c8384d69ce00088a1a7d09 [0,1,0,0,0,0|3,0,0]=4 4707 B12R0.268 CC(C)CCCCOCCN(C)C 2dbca1930cc7cee60da45698eb3334df [0,1,0,0,0,0|3,0,0]=4 4708 B12R0.268 CC(C)CCCCOCCS(=O)C e4e59eaa27d9214ae25384c8a1b93c5d [0,1,0,0,0,0|2,0,1]=4 4709 B12R0.268 CC(C)CCCCOCOC(C)C fb5f177bfa98c233c9b70f2c7e02d811 [0,1,0,0,0,0|3,0,0]=4 4710 B12R0.268 CC(C)CCCNCCCC(=O)O d53bbc48af8962d41c40e02914ec4a3c [0,1,0,0,0,0|2,0,1]=4 4711 B12R0.268 CC(C)CCCNCCCC(C)C 30e552f04bd07c9fbc8ed00654cba6e4 [0,1,0,0,0,0|2,0,0]=3 4712 B12R0.268 CC(C)CCCNCCCC(C)O b9864289dab92da14ba03113245ce737 [0,1,0,0,0,0|1,0,0]=2 4713 B12R0.268 CC(C)CCCNCCCN(C)C 660f273386962722b46b33aeb7e6ba6e [0,1,0,0,0,0|3,0,0]=4 4714 B12R0.268 CC(C)CCCNCCCS(=O)C 69ce10f65bd882802139ebd3d9e04172 [0,1,0,0,0,0|2,0,1]=4 4715 B12R0.268 CC(C)CCCNCCOC(C)C cb7a8e8b5c05b9abaa2457eecc162baf [0,1,0,0,0,0|3,0,0]=4 4716 B12R0.268 CC(C)CCCNCCSC(C)C 665b9fc765f64a3f1eb782954e8c3be0 [0,1,0,0,0,0|3,0,0]=4 4717 B12R0.268 CC(C)CCCOCCCC(C)C 17797f044cad227bc4f06d511f11800c [0,1,0,0,0,0|2,0,0]=3 4718 B12R0.268 CC(C)CCCOCCCN(C)C 4a273e9222e22f54a580ad7a38c45cba [0,1,0,0,0,0|3,0,0]=4 4719 B12R0.268 CC(C)CCCOCCOC(C)C 246a00107cf533fd8d2e6f170faa6dd8 [0,1,0,0,0,0|3,0,0]=4 4720 B12R0.268 CC(C)CCCOCCSC(C)C 80ddfe24c14a6708157a39b9c31cf370 [0,1,0,0,0,0|3,0,0]=4 4721 B12R0.268 CC(C)CCNCCCCC(=O)O b00c47ec3791b0904d76bf6e85ff2c88 [0,1,0,0,0,0|2,0,1]=4 4722 B12R0.268 CC(C)CCNCCCCC(C)O 3a1fbe0d96e6e3cd3eec55341036bb65 [0,1,0,0,0,0|1,0,0]=2 4723 B12R0.268 CC(C)CCNCCCCC(F)F bb30f60d3b12a41de7cadc0978eaa449 [0,1,0,0,0,0|3,0,0]=4 4724 B12R0.268 CC(C)CCNCCCCN(C)C f1f44b695770b22119255b1534dbf50c [0,1,0,0,0,0|3,0,0]=4 4725 B12R0.268 CC(C)CCNCCCC[C@@H](C)O 73a59c355a71249c2c704ea4cef776e2 [0,1,0,0,0,0|1,0,0]=2 4726 B12R0.268 CC(C)CCNCCCOC(C)C 769f28573fb263445e245b225a023d6e [0,1,0,0,0,0|3,0,0]=4 4727 B12R0.268 CC(C)CCNCCCSC(C)C 737eb21f358b82b2886f9bceddcac83a [0,1,0,0,0,0|3,0,0]=4 4728 B12R0.268 CC(C)CCNCCOCC(C)C d92d35aa193c0d8e6b34adcadf088bb1 [0,1,0,0,0,0|3,0,0]=4 4729 B12R0.268 CC(C)CCOCCCCC(=O)O 3ae9c5d31d01bc421d73e55604a98e93 [0,1,0,0,0,0|2,0,1]=4 4730 B12R0.268 CC(C)CCOCCCCN(C)C b23acdbc51d011b1cb7ab1a0a33dabf3 [0,1,0,0,0,0|3,0,0]=4 4731 B12R0.268 CC(C)CCOCCCOC(C)C 782fa64b8330af62fe01f785ecc7198f [0,1,0,0,0,0|3,0,0]=4 4732 B12R0.268 CC(C)CCOCCCSC(C)C c431a8075ab1de0122f55c977e47e7f1 [0,1,0,0,0,0|3,0,0]=4 4733 B12R0.268 CC(C)CCOCCOCC(C)C 4359e0b64c26c7325456f8b8cd61df34 [0,1,0,0,0,0|3,0,0]=4 4734 B12R0.268 CC(C)CCOCCSCC(C)C b2a290539a50873e5eb5df6a21a4cc64 [0,1,0,0,0,0|3,0,0]=4 4735 B12R0.268 CC(C)CNCCCCCC(=O)O 82ae2bb3033420f8e0fe10ffbe7afe0a [0,1,0,0,0,0|2,0,1]=4 4736 B12R0.268 CC(C)CNCCCCCC(F)F d583d7eb408b17095bfa629d59c6b969 [0,1,0,0,0,0|3,0,0]=4 4737 B12R0.268 CC(C)CNCCCCCN(C)C b2d1fbf183573abab308f67c24b2e281 [0,1,0,0,0,0|3,0,0]=4 4738 B12R0.268 CC(C)CNCCCOCC(C)C 1b95580ec315b5e7f6dbeb263dac5cdb [0,1,0,0,0,0|3,0,0]=4 4739 B12R0.268 CC(C)COCCCCCC(=O)O a9671be5780033acdb72d3d5fb13d61d [0,1,0,0,0,0|2,0,1]=4 4740 B12R0.268 CC(C)COCCCCCC(F)F ba48789302245eadee29e3c0f2336cad [0,1,0,0,0,0|3,0,0]=4 4741 B12R0.268 CC(C)COCCCCCN(C)C 4f549acfa436c7eda661969d681100b7 [0,1,0,0,0,0|3,0,0]=4 4742 B12R0.268 CC(C)COCCCNCC(C)O 44ed522e77feb666c1110eeb2f2f9d6d [0,1,0,0,0,0|2,0,0]=3 4743 B12R0.268 CC(C)COCCCNC[C@@H](C)O ec28ca553a961b6e84b7e1115bb93c1b [0,1,0,0,0,0|2,0,0]=3 4744 B12R0.268 CC(C)COCCCNC[C@H](C)O aba5c6365b3cf4e5eedc233339bed7c5 [0,1,0,0,0,0|2,0,0]=3 4745 B12R0.268 CC(C)COCCCOCC(C)C 58bfb2a897c7651f0ab4db52dcb54e2b [0,1,0,0,0,0|3,0,0]=4 4746 B12R0.268 CC(C)COCCCSCC(C)C 4380cc59f68781b6a00fc264d9941291 [0,1,0,0,0,0|3,0,0]=4 4747 B12R0.268 CC(C)COCCNCCC(C)O 939ae26808b75b7441476bb3c33e424f [0,1,0,0,0,0|2,0,0]=3 4748 B12R0.268 CC(C)COCCNCC[C@@H](C)O 4e7d22c749751adda653074fcea34121 [0,1,0,0,0,0|2,0,0]=3 4749 B12R0.268 CC(C)COCCNCC[C@H](C)O b2546b5a81e69e4bb598f672ad03436c [0,1,0,0,0,0|2,0,0]=3 4750 B12R0.268 CC(C)CSCCCCNC(C)C a3218f5f5d7cfea41652150b71143002 [0,1,0,0,0,0|3,0,0]=4 4751 B12R0.268 CC(C)NCCCCCCC(=O)O 23aae92806f6b4ef29fa0844f7b2d02b [0,1,0,0,0,0|2,0,1]=4 4752 B12R0.268 CC(C)NCCCCCCN(C)C 143665257b83daba0ced28dc1e5bddf1 [0,1,0,0,0,0|3,0,0]=4 4753 B12R0.268 CC(C)OCCCCCCC(=O)O 97d8bafef78d17118fcd21444e2b7046 [0,1,0,0,0,0|2,0,1]=4 4754 B12R0.268 CC(C)OCCCCCCN(C)C aaa41ef990d31498881addf06710db91 [0,1,0,0,0,0|3,0,0]=4 4755 B12R0.268 CC(F)COCCCCCC(F)F f516fba7963dbfb6585b4a7e6d9c813f [0,1,0,0,0,0|3,0,0]=4 4756 B12R0.268 CC(O)CCCCNCCC(=O)N b4b8b8680aee9170e5b67401e1860296 [0,1,0,0,0,0|2,0,1]=4 4757 B12R0.268 CC(O)CCCCNCCC(=O)O 5c2365ddb948ecd957dd41a6dda4cd9f [0,1,0,0,0,0|2,0,1]=4 4758 B12R0.268 CC(O)CCCCNCCC(=S)N 8fd167df704ce93c5edf6b11c06073b2 [0,1,0,0,0,0|2,0,1]=4 4759 B12R0.268 CC(O)CCCCNCCC(C)O b9cb2d117925f56e14e2a4322aed3bee [0,1,0,0,0,0|1,0,0]=2 4760 B12R0.268 CC(O)CCCCNCCC(F)F 44c1cd57224f7480b5a024a86933ceab [0,1,0,0,0,0|2,0,0]=3 4761 B12R0.268 CC(O)CCCCNCCN(C)C 2b62f168d92254be4ab74b9dfc6e015e [0,1,0,0,0,0|2,0,0]=3 4762 B12R0.268 CC(O)CCCCNCCS(=O)C 1018b526ed8cd13800a19487aa2c9cf5 [0,1,0,0,0,0|2,0,0]=3 4763 B12R0.268 CC(O)CCCCNCCS(=O)O 3801ba2fa5b410e88e4087a87ccd3a7f [0,1,0,0,0,0|3,0,0]=4 4764 B12R0.268 CC(O)CCCCNCC[C@@H](C)O 8e0b317e099d3ee1f5f75cca8ab864ca [0,1,0,0,0,0|1,0,0]=2 4765 B12R0.268 CC(O)CCCCNCC[C@H](C)O 9f5179d9b2a6f43698bfeb1d5b3500e6 [0,1,0,0,0,0|1,0,0]=2 4766 B12R0.268 CC(O)CCCNCCCC(=O)N b39079b8ea4cca36a3cdc5707447e642 [0,1,0,0,0,0|2,0,1]=4 4767 B12R0.268 CC(O)CCCNCCCC(=O)O c3136a8e1c16bef3b091a09bf5614109 [0,1,0,0,0,0|2,0,1]=4 4768 B12R0.268 CC(O)CCCNCCCN(C)C 85fe037d0b1602932b3d8561f80b520e [0,1,0,0,0,0|2,0,0]=3 4769 B12R0.268 CC(O)CCCNCCCS(=O)C 0d5fb88893e927a6b0e6fa8c6de7e2ef [0,1,0,0,0,0|2,0,0]=3 4770 B12R0.268 CC(O)CCCNCCOC(C)C c05104662bfd459f22e9b48c5db4ad2d [0,1,0,0,0,0|2,0,0]=3 4771 B12R0.268 CC(O)CCCNCCOC(F)F 214d6f57864e259843e67a68cfa4e4f7 [0,1,0,0,0,0|3,0,0]=4 4772 B12R0.268 CC(O)CCNCCCCC(=O)N 7ca1be026d10e193417a370269df9722 [0,1,0,0,0,0|2,0,1]=4 4773 B12R0.268 CC(O)CCNCCCCC(=O)O aaa0af2603bb1890250e5799e0fc3d68 [0,1,0,0,0,0|2,0,1]=4 4774 B12R0.268 CC(O)CCNCCCCC(F)F b76ea08b2fd123b4c9f2fcb392eff156 [0,1,0,0,0,0|2,0,0]=3 4775 B12R0.268 CC(O)CCNCCCCN(C)C a7a84fc5bc053613d2b26398ad04b128 [0,1,0,0,0,0|2,0,0]=3 4776 B12R0.268 CC(O)CCNCCCC[C@@H](C)O 64c50aa10e0b6519e1e37e471341bab3 [0,1,0,0,0,0|1,0,0]=2 4777 B12R0.268 CC(O)CCNCCCOC(C)C dfbadcb88bef26d6985a65dd3ddfb6e1 [0,1,0,0,0,0|2,0,0]=3 4778 B12R0.268 CC(O)CCNCCCOC(F)F a235688451edb53b6d2c52a055885ef3 [0,1,0,0,0,0|3,0,0]=4 4779 B12R0.268 CC(O)CCNCCCSC(C)C 9732c8c517138e6b458044fd3ff74cf2 [0,1,0,0,0,0|2,0,0]=3 4780 B12R0.268 CC(O)CCNCCOCC(F)F 8d5ce458877be8a14fde5356ff1e7a97 [0,1,0,0,0,0|3,0,0]=4 4781 B12R0.268 CC(O)CNCCCCCC(=O)N 64c2e15a913b4d182399b7dfc853ae53 [0,1,0,0,0,0|2,0,1]=4 4782 B12R0.268 CC(O)CNCCCCCC(=O)O fea82d849942b8001a98607fcfdf8592 [0,1,0,0,0,0|2,0,1]=4 4783 B12R0.268 CC(O)CNCCCCCC(F)F 6031e7bcc06b2868c2a1243a863136ee [0,1,0,0,0,0|2,0,0]=3 4784 B12R0.268 CC(O)CNCCCCCN(C)C f342f18e0178555d4bd03eeebd0dd6be [0,1,0,0,0,0|2,0,0]=3 4785 B12R0.268 CC(O)CNCCCCOC(F)F 483badb7276a2408cc3a651f6f38ed5b [0,1,0,0,0,0|3,0,0]=4 4786 B12R0.268 CC(O)CNCCOCCN(C)C 589a8e55cb4dcc1baaf9ffac168ac5cd [0,1,0,0,0,0|3,0,0]=4 4787 B12R0.268 CC(S)COCCCCCC(F)F 9ad23e03c95b70c5904e93e1697b22cb [0,1,0,0,0,0|2,1,0]=4 4788 B12R0.268 C[C@@H](F)COCCCCCC(F)F 176e38c7099121734e3ccd4b3fde547a [0,1,0,0,0,0|3,0,0]=4 4789 B12R0.268 C[C@@H](O)CCCCNCCC(=O)N 649a97074fe6642c80fc36f7d55f91d5 [0,1,0,0,0,0|2,0,1]=4 4790 B12R0.268 C[C@@H](O)CCCCNCCC(=O)O e56590d53223ed224c1150eed53028bb [0,1,0,0,0,0|2,0,1]=4 4791 B12R0.268 C[C@@H](O)CCCCNCCC(=S)N 36b3c3742582460a89faa218a4be2489 [0,1,0,0,0,0|2,0,1]=4 4792 B12R0.268 C[C@@H](O)CCCCNCCC(F)F f91f1124824e291d776743d770dc00dc [0,1,0,0,0,0|2,0,0]=3 4793 B12R0.268 C[C@@H](O)CCCCNCCN(C)C a31532e4746aecae3a118560361450a1 [0,1,0,0,0,0|2,0,0]=3 4794 B12R0.268 C[C@@H](O)CCCCNCCS(=O)C 3458696ceefc0d2f7e92be9b41febcf5 [0,1,0,0,0,0|2,0,0]=3 4795 B12R0.268 C[C@@H](O)CCCCNCCS(=O)O af7db9b763c1d9229c7552c392adcffd [0,1,0,0,0,0|3,0,0]=4 4796 B12R0.268 C[C@@H](O)CCCCNCC[C@@H](C)O 5f35290ceae325998105f691c4a500b2 [0,1,0,0,0,0|1,0,0]=2 4797 B12R0.268 C[C@@H](O)CCNCCCCC(=O)N ffef567f0cb78402672059867e1ea0da [0,1,0,0,0,0|2,0,1]=4 4798 B12R0.268 C[C@@H](O)CCNCCCCC(=O)O 630d478bfcd24b7e330127ab6b0b7b00 [0,1,0,0,0,0|2,0,1]=4 4799 B12R0.268 C[C@@H](O)CCNCCCCN(C)C d2331233156da99e72c9bf72879c0cb0 [0,1,0,0,0,0|2,0,0]=3 4800 B12R0.268 C[C@@H](O)CCNCCOCC(F)F 8cca8c139af7e39cf261ab4370879ac8 [0,1,0,0,0,0|3,0,0]=4 4801 B12R0.268 C[C@@H](O)CNCCCCCC(=O)N 4f04483a050623718de53e0c53123f7d [0,1,0,0,0,0|2,0,1]=4 4802 B12R0.268 C[C@@H](O)CNCCCCCC(=O)O b3b17421345c7969104039a219a6f0c2 [0,1,0,0,0,0|2,0,1]=4 4803 B12R0.268 C[C@@H](O)CNCCCCCC(F)F c1c89d3a8ede47620aad67e896655343 [0,1,0,0,0,0|2,0,0]=3 4804 B12R0.268 C[C@@H](O)CNCCCCCN(C)C 430b0f6a6cee5b2d0ac5536b7c22770a [0,1,0,0,0,0|2,0,0]=3 4805 B12R0.268 C[C@@H](O)CNCCCCOC(F)F 9a6dcbc42d57da1e6adcb9053ac2e9a7 [0,1,0,0,0,0|3,0,0]=4 4806 B12R0.268 C[C@@H](O)CNCCOCCN(C)C 677f479ba9549705c249e6e9d0b9e5f6 [0,1,0,0,0,0|3,0,0]=4 4807 B12R0.268 C[C@H](F)COCCCCCC(F)F 9b11c3d83c21595e836ac01098e8d659 [0,1,0,0,0,0|3,0,0]=4 4808 B12R0.268 C[C@H](O)CCNCCCCC(=O)N fcc9f44e9ed460e6587a0a5df6afc3bc [0,1,0,0,0,0|2,0,1]=4 4809 B12R0.268 C[C@H](O)CCNCCCCC(=O)O 95f01436583f248ee59b7b0dd120c8f6 [0,1,0,0,0,0|2,0,1]=4 4810 B12R0.268 C[C@H](O)CCNCCCCN(C)C e65bebc5307e648190da039b87e115e3 [0,1,0,0,0,0|2,0,0]=3 4811 B12R0.268 C[C@H](O)CCNCCCC[C@@H](C)O 1d676069494bdc8e1c586b37627192b4 [0,1,0,0,0,0|1,0,0]=2 4812 B12R0.268 C[C@H](O)CCNCCOCC(F)F d3ad90a1ae453cf19e982c6f0d36e5d3 [0,1,0,0,0,0|3,0,0]=4 4813 B12R0.268 C[C@H](O)CNCCCCCC(=O)N 83f9297bca31b7a0aa42d6fb02f0b0e1 [0,1,0,0,0,0|2,0,1]=4 4814 B12R0.268 C[C@H](O)CNCCCCCC(=O)O 09705aaad427fbb5507a5d3bd5d06959 [0,1,0,0,0,0|2,0,1]=4 4815 B12R0.268 C[C@H](O)CNCCCCCC(F)F a3709d83de0e509a73d6957938d22e1a [0,1,0,0,0,0|2,0,0]=3 4816 B12R0.268 C[C@H](O)CNCCCCCN(C)C c6ebcbd4e5a086255a02032c356da88e [0,1,0,0,0,0|2,0,0]=3 4817 B12R0.268 C[C@H](O)CNCCCCOC(F)F 24d96cc94d4e8c65d9a1604305b2eb67 [0,1,0,0,0,0|3,0,0]=4 4818 B12R0.268 C[C@H](O)CNCCOCCN(C)C c27e8e8aa3b6cf9d62b14d1d120719fa [0,1,0,0,0,0|3,0,0]=4 4819 B12R0.277 C=C(C)CCCNCC(O)CCC b17f6643af84fd68e5b3fbf7be5adfd3 [0,1,0,0,0,0|2,0,1]=4 4820 B12R0.277 C=C(C)CCCOCC(C)CCC 8e37ef9ce91179190fa4dc72e320f8b3 [0,1,0,0,0,0|2,0,1]=4 4821 B12R0.277 C=C(C)CCOCCC(C)CCC a43ba91bd7f219e650932002f68e836f [0,1,0,0,0,0|2,0,1]=4 4822 B12R0.277 C=C(C)CCOCCC(S)CCC a457be04a65f63d4c4fec94e57d696af [0,1,0,0,0,0|2,0,1]=4 4823 B12R0.277 C=C(C)COCCCC(C)CCC 5067b16603d4c4dbe1cae8eccf4e1917 [0,1,0,0,0,0|2,0,1]=4 4824 B12R0.277 C=CCC(O)CNCCCC(C)O deb7ba19249972ab40a5d36b4693455f [0,1,0,0,0,0|1,0,2]=4 4825 B12R0.277 CC(C)CCCCCN(C)CCF eac703b1b59aa879f3530632beb203f1 [0,1,0,0,0,0|3,0,0]=4 4826 B12R0.277 CC(C)CCCCCN(C)CCO 26605efc5eb013d123b55bef89a376db [0,1,0,0,0,0|3,0,0]=4 4827 B12R0.277 CC(C)CCCCNC(C)CCO 2e25e3233b536fec9d6c0b4f1d7f51ac [0,1,0,0,0,0|3,0,0]=4 4828 B12R0.277 CC(C)CCCCN[C@@H](C)CCO 79dfac6ef71993c7d53ced22a3b41798 [0,1,0,0,0,0|3,0,0]=4 4829 B12R0.277 CC(C)CCCCN[C@H](C)CCO fd68304275a4fe94646b2eced3d5aaf3 [0,1,0,0,0,0|3,0,0]=4 4830 B12R0.277 CC(C)CCCNCC(C)CCO 430ac6872cb9bd157e5968245bb31965 [0,1,0,0,0,0|3,0,0]=4 4831 B12R0.277 CC(C)CCCNC[C@@H](O)CCO 669cce0c70c91873cd43826bca03b14e [0,1,0,0,0,0|3,0,0]=4 4832 B12R0.277 CC(C)CCCOC[C@@H](O)CCO 590846ae57f23dca5e377da78209b8b1 [0,1,0,0,0,0|3,0,0]=4 4833 B12R0.277 CC(CC#N)NCCCC[C@@H](C)O 962d49a6b897c092460a0869fc2dce83 [0,1,0,0,0,0|2,0,1]=4 4834 B12R0.277 CC(CCO)NCCCC[C@@H](C)O ca5891b2a323c8a431fe48ed0e2af916 [0,1,0,0,0,0|2,0,0]=3 4835 B12R0.277 CC(O)CCCCNC(C)CC#N 626cc609f6d20653f5a48510d1af2a9e [0,1,0,0,0,0|2,0,1]=4 4836 B12R0.277 CC(O)CCCCNC(C)CCO fed8ad38686945d8ec59cf7e4f2d8e60 [0,1,0,0,0,0|2,0,0]=3 4837 B12R0.277 CC(O)CCCCN[C@@H](C)CCO 5b6a6e96e86b6f9a0a221bbfdec05be7 [0,1,0,0,0,0|2,0,0]=3 4838 B12R0.277 CC(O)CCCCN[C@H](C)CCO d670e31779e18a193c7cb39c38b3b7a6 [0,1,0,0,0,0|2,0,0]=3 4839 B12R0.277 CC(O)CCCNCC(C)CCO 13efefa9fdaff4b351f86ebcbe2298d7 [0,1,0,0,0,0|2,0,0]=3 4840 B12R0.277 CC(O)CCNCCN(C)CCO a2c9d335a33076adf9861f98ea460107 [0,1,0,0,0,0|3,0,0]=4 4841 B12R0.277 CC(O)CNCCCN(C)CCO 4098dab76657e1e67c8baf23a9e5305c [0,1,0,0,0,0|3,0,0]=4 4842 B12R0.277 CCCC(=O)CNCCCC(C)C 0cdf7a83896c98113f3d6ee9b4f8b347 [0,1,0,0,0,0|2,0,1]=4 4843 B12R0.277 CCCC(=O)COCCCC(C)C 88358ad6a6c24db94213aaeac694703b [0,1,0,0,0,0|2,0,1]=4 4844 B12R0.277 CCCC(=O)OCNCCC(C)O 850e8804b12e9cd489ab622800f4ee35 [0,1,0,0,0,0|2,0,1]=4 4845 B12R0.277 CCCC(=O)OCNCC[C@@H](C)O cb4e9dadadc81a8e9356bc9ea2288ae0 [0,1,0,0,0,0|2,0,1]=4 4846 B12R0.277 CCCC(=O)OCNCC[C@H](C)O 23dd082ae5f991062ed03dac0cee15c4 [0,1,0,0,0,0|2,0,1]=4 4847 B12R0.277 CCCC(=S)OCCCCC(C)C f4a18bc73988d6655c431a725b3b188c [0,1,0,0,0,0|2,0,1]=4 4848 B12R0.277 CCCC(C)CCCOCC(=O)O ab89c819830bc48302db4f341b81fd16 [0,1,0,0,0,0|2,0,1]=4 4849 B12R0.277 CCCC(C)CCCOCC(C)C a2eddc07b802b6a334dd804b7fd4e2d1 [0,1,0,0,0,0|2,0,0]=3 4850 B12R0.277 CCCC(C)CCCOCC(F)F 8b62b86d2124e57b42f87362723b5f55 [0,1,0,0,0,0|3,0,0]=4 4851 B12R0.277 CCCC(C)CCCOCN(C)C a22676451f4027ed8d42f76e7764efaf [0,1,0,0,0,0|3,0,0]=4 4852 B12R0.277 CCCC(C)CCOCCC(=O)C 7d337d668c0bb083f9e55599785c65b5 [0,1,0,0,0,0|1,0,2]=4 4853 B12R0.277 CCCC(C)CCOCCC(=O)O 03b76b41578e9acaf1e42df292f050c3 [0,1,0,0,0,0|2,0,1]=4 4854 B12R0.277 CCCC(C)CCOCCC(C)C 645613536b1399784860682f3ec4f793 [0,1,0,0,0,0|2,0,0]=3 4855 B12R0.277 CCCC(C)CCOCCN(C)C 009750432d96334ac772377393ee74d3 [0,1,0,0,0,0|3,0,0]=4 4856 B12R0.277 CCCC(C)CCOCCS(=O)C 1b568bc17bbd0fada45bfe51e033df9f [0,1,0,0,0,0|2,0,1]=4 4857 B12R0.277 CCCC(C)CCOCOC(C)C f4c20b1b38f0d64d1bf7aaa9f88b71a4 [0,1,0,0,0,0|3,0,0]=4 4858 B12R0.277 CCCC(C)CNCCCC(=O)O d9878a804d5cedea5970c063205c383b [0,1,0,0,0,0|2,0,1]=4 4859 B12R0.277 CCCC(C)CNCCCC(C)C e48f09cec2c5aecce151ba002390b711 [0,1,0,0,0,0|2,0,0]=3 4860 B12R0.277 CCCC(C)CNCCCN(C)C 446597dbbc97b18b24b5c6c2dd3861e9 [0,1,0,0,0,0|3,0,0]=4 4861 B12R0.277 CCCC(C)CNCCCS(=O)C a2c90ebd17442f4b7fe2d7dcd63f4b87 [0,1,0,0,0,0|2,0,1]=4 4862 B12R0.277 CCCC(C)CNCCOC(C)C c59071d53802cf7e67074cb510761766 [0,1,0,0,0,0|3,0,0]=4 4863 B12R0.277 CCCC(C)COCCCC(=O)C 307bf8bfbeafaa85c4668533f056e5af [0,1,0,0,0,0|1,0,2]=4 4864 B12R0.277 CCCC(C)COCCCC(C)C 0f0b1d43da07d56128e45b7efa4e1227 [0,1,0,0,0,0|2,0,0]=3 4865 B12R0.277 CCCC(C)COCCCN(C)C e9863c1d3570139d1654ccc42f548fa0 [0,1,0,0,0,0|3,0,0]=4 4866 B12R0.277 CCCC(C)COCCOC(C)C bddce8dc2e428b13ebf8d09476cfaa1a [0,1,0,0,0,0|3,0,0]=4 4867 B12R0.277 CCCC(C)COCCSC(C)C 78b8ab236697ea696a85038b7991ba17 [0,1,0,0,0,0|3,0,0]=4 4868 B12R0.277 CCCC(C)NCCCCC(=O)C 07fcc618de7add6af85de05eb8b8d96a [0,1,0,0,0,0|1,0,2]=4 4869 B12R0.277 CCCC(C)NCCCCC(=O)O 48d5592d94a45933afd15061689b4048 [0,1,0,0,0,0|2,0,1]=4 4870 B12R0.277 CCCC(C)NCCCCC(C)C 6ce220d7c48a3f67fbf5c6324e6a048c [0,1,0,0,0,0|2,0,0]=3 4871 B12R0.277 CCCC(C)NCCCCC(C)O 499a1caec8002a613b9d527e927365b7 [0,1,0,0,0,0|1,0,0]=2 4872 B12R0.277 CCCC(C)NCCCCC(F)F 33fecc894ba3c208c32ab119f0f14f54 [0,1,0,0,0,0|3,0,0]=4 4873 B12R0.277 CCCC(C)NCCCCN(C)C 41a7507daa030a66e674dd8a331a741e [0,1,0,0,0,0|3,0,0]=4 4874 B12R0.277 CCCC(C)NCCCC[C@@H](C)O 223e61083955024fa1b57fd6a35cffe0 [0,1,0,0,0,0|1,0,0]=2 4875 B12R0.277 CCCC(C)NCCCOC(C)C fecf08201f66ce2cedb01a07350a6e53 [0,1,0,0,0,0|3,0,0]=4 4876 B12R0.277 CCCC(C)NCCCSC(C)C acc6b3816a86103dc2e2109c963586c7 [0,1,0,0,0,0|3,0,0]=4 4877 B12R0.277 CCCC(C)NCCOCC(C)C 576732ab85b24bfcb47f184a1be961a0 [0,1,0,0,0,0|3,0,0]=4 4878 B12R0.277 CCCC(C)OCCCCC(=O)C 9dbd5df0d94253a9bce24f8736363f9a [0,1,0,0,0,0|1,0,2]=4 4879 B12R0.277 CCCC(C)OCCCCC(=O)O 64b544d5e46b90bfc2cfab82f84f620c [0,1,0,0,0,0|2,0,1]=4 4880 B12R0.277 CCCC(C)OCCCCC(C)C 78d3712ca26412aee34799bb98d1f532 [0,1,0,0,0,0|2,0,0]=3 4881 B12R0.277 CCCC(C)OCCCCN(C)C b27d10c4307554b0b76c04d7e64c02ce [0,1,0,0,0,0|3,0,0]=4 4882 B12R0.277 CCCC(C)OCCCOC(C)C 3bce41277ad645dd6168acaaf2bf49bc [0,1,0,0,0,0|3,0,0]=4 4883 B12R0.277 CCCC(C)OCCCSC(C)C 1576a083c1e7ae9d52b6ffe0042f0108 [0,1,0,0,0,0|3,0,0]=4 4884 B12R0.277 CCCC(C)OCCOCC(C)C 710b673b99e4a963f4cb00348a264b6d [0,1,0,0,0,0|3,0,0]=4 4885 B12R0.277 CCCC(C)OCCSCC(C)C c60b57ab36ea118e35c55f6ba44bbfda [0,1,0,0,0,0|3,0,0]=4 4886 B12R0.277 CCCC(O)CNCCCC(=O)C 51a4db601bf4021bb9ff9661e3601078 [0,1,0,0,0,0|1,0,2]=4 4887 B12R0.277 CCCC(O)CNCCCC(C)C d3a95a23ac051dd993eff885f608b19d [0,1,0,0,0,0|2,0,0]=3 4888 B12R0.277 CCCC(O)CNCCCC(C)O b19245cb20af4074f82f1927a980006b [0,1,0,0,0,0|1,0,0]=2 4889 B12R0.277 CCCC(O)CNCCCN(C)C 2af0309b9c6eba1780b6852a7abb93d4 [0,1,0,0,0,0|3,0,0]=4 4890 B12R0.277 CCCC(O)CNCCOC(C)C a62d182440813a7f0ee0588498fce059 [0,1,0,0,0,0|3,0,0]=4 4891 B12R0.277 CCCC(O)CNCCSC(C)C 66f240f15e8d96dcbf8cc698ad7bb69c [0,1,0,0,0,0|3,0,0]=4 4892 B12R0.277 CCCC(S)CCOCCC(=O)C 92771076abdab12a32a3cce84f523584 [0,1,0,0,0,0|1,0,2]=4 4893 B12R0.277 CCCC(S)CCOCCC(=O)O 2371c3233b8a0b51c4111614aa97380a [0,1,0,0,0,0|2,0,1]=4 4894 B12R0.277 CCCC(S)CCOCCC(C)C faf137d2385be68e990631c41a9262ca [0,1,0,0,0,0|2,0,0]=3 4895 B12R0.277 CCCC(S)CCOCCN(C)C 978ba8d9ac7875eaefe71140c7569986 [0,1,0,0,0,0|3,0,0]=4 4896 B12R0.277 CCCC(S)CCOCCS(=O)C 3e9bde6a4f84e15679bfe1829fdab692 [0,1,0,0,0,0|2,0,1]=4 4897 B12R0.277 CCCC(S)CCOCOC(C)C b86de8fa2cba2e00d6b3291ff6c7fc4a [0,1,0,0,0,0|3,0,0]=4 4898 B12R0.277 CCCN(C)CCCCCC(=O)C c99025986450403871592420fae4cd13 [0,1,0,0,0,0|1,0,2]=4 4899 B12R0.277 CCCN(C)CCCCCC(C)C 2bb251bf02baa566bc1c6fa1ef7e8e89 [0,1,0,0,0,0|2,0,0]=3 4900 B12R0.277 CCCN(C)CCCCCC(F)F f4ef02efb63eb916a6e320fd723a31e2 [0,1,0,0,0,0|3,0,0]=4 4901 B12R0.277 CCC[C@@H](C)OCCCCC(=O)C 7248a6fb31744d0b559a9ff3aaf92f41 [0,1,0,0,0,0|1,0,2]=4 4902 B12R0.277 CCC[C@@H](C)OCCCCC(C)C ba703a8dbc150d293dd063086b33a27d [0,1,0,0,0,0|2,0,0]=3 4903 B12R0.277 CCC[C@@H](C)OCCCCN(C)C 6a121b1d08033a1657888355f0890bb5 [0,1,0,0,0,0|3,0,0]=4 4904 B12R0.277 CCC[C@@H](C)OCCOCC(C)C c298896749fae127bb9d62141dfbdcf9 [0,1,0,0,0,0|3,0,0]=4 4905 B12R0.277 CCC[C@H](C)NCCCCC(=O)C 11f1e833b6471803045a6df085621226 [0,1,0,0,0,0|1,0,2]=4 4906 B12R0.277 CCC[C@H](C)NCCCCC(C)C e7ff6df3b3a6ad0bac7a38410af0ad17 [0,1,0,0,0,0|2,0,0]=3 4907 B12R0.277 CCC[C@H](C)NCCCCC(C)O 0c6cd091dec852273c726a6c8ffb6dd6 [0,1,0,0,0,0|1,0,0]=2 4908 B12R0.277 CCC[C@H](C)NCCCCN(C)C ccffb993dfab92f2bbb746bb7c6ff337 [0,1,0,0,0,0|3,0,0]=4 4909 B12R0.277 CCC[C@H](C)NCCCC[C@@H](C)O 71d1542f2b8e67e4608a724095891999 [0,1,0,0,0,0|1,0,0]=2 4910 B12R0.277 CCC[C@H](C)NCCOCC(C)C 9e6236ab6da0086316fe407793ee395b [0,1,0,0,0,0|3,0,0]=4 4911 B12R0.277 CCC[C@H](C)OCCCCC(=O)C ac1027ae345aef78f745b2c44295b221 [0,1,0,0,0,0|1,0,2]=4 4912 B12R0.277 CCC[C@H](C)OCCCCC(C)C ab1f946a7b6a9f6e01e7458e8b303e53 [0,1,0,0,0,0|2,0,0]=3 4913 B12R0.277 CCC[C@H](C)OCCCCN(C)C bcef5bf14f5163308a6a0868f59c1b6f [0,1,0,0,0,0|3,0,0]=4 4914 B12R0.277 CCC[C@H](C)OCCOCC(C)C 2f0b7337b13ee9572ef847599ab8baab [0,1,0,0,0,0|3,0,0]=4 4915 B12R0.277 CCNC(=O)CCNCCC(C)O bcdeb67ab908eee44ca848a407f3ab75 [0,1,0,0,0,0|2,0,1]=4 4916 B12R0.277 CCNC(=O)CCNCC[C@@H](C)O ec0ab9d2c8c6918d6a1fa6425555f5d0 [0,1,0,0,0,0|2,0,1]=4 4917 B12R0.277 CCNC(=O)CCNCC[C@H](C)O 3e9ef350420b5fdb373d88c2d5b9968e [0,1,0,0,0,0|2,0,1]=4 4918 B12R0.277 CCNC(=O)CNCCCC(C)O e783a7c58886e23e2fb89c4e95dbfc2d [0,1,0,0,0,0|2,0,1]=4 4919 B12R0.277 CCOC(=O)CCCNCC(C)O 2bb980d483073a5e1e64291d4c5a40af [0,1,0,0,0,0|2,0,1]=4 4920 B12R0.277 CCOC(=O)CCCNC[C@@H](C)O 9aa0a14ad291c6708b69afdfdd195db0 [0,1,0,0,0,0|2,0,1]=4 4921 B12R0.277 CCOC(=O)CCCNC[C@H](C)O d98fae9006d8a436fc0a00ba0cd457b6 [0,1,0,0,0,0|2,0,1]=4 4922 B12R0.277 CCOC(=O)CCNCCC(C)O 252a56285d599d0215b45d68cc06812e [0,1,0,0,0,0|2,0,1]=4 4923 B12R0.277 CCOC(=O)CCNCC[C@@H](C)O 7cc7e4d38b41c44cc413bcb91741ee10 [0,1,0,0,0,0|2,0,1]=4 4924 B12R0.277 CCOC(=O)CCNCC[C@H](C)O a950f3606ed5f3183a59c098fa5fe67a [0,1,0,0,0,0|2,0,1]=4 4925 B12R0.277 CCOC(=O)CNCCCC(C)O d228d62bbcbbbb914689e8a6d3958f86 [0,1,0,0,0,0|2,0,1]=4 4926 B12R0.277 CCOC(C)CCCCCC(=O)O 4f8547feb077b9411df8bda2d38ffd38 [0,1,0,0,0,0|2,0,1]=4 4927 B12R0.277 CCOC(C)CNCCCC(C)C 6580d4e8bbfb91817602f2c359419047 [0,1,0,0,0,0|3,0,0]=4 4928 B12R0.277 CCOC(C)CNCCCC(C)O e265c6fc9362e94f7c45b4e80f410927 [0,1,0,0,0,0|2,0,0]=3 4929 B12R0.277 CCOC(C)COCCCC(C)C 68bfa049a98bb8d5a81e87b088d11c99 [0,1,0,0,0,0|3,0,0]=4 4930 B12R0.277 COCC(C)COCCCC(C)C d53b3afaf6f77eb6cd2fcaf012493f23 [0,1,0,0,0,0|3,0,0]=4 4931 B12R0.277 COCC(C)NCCCCC(C)C 70610662d5d7552365fbf2082bd9008f [0,1,0,0,0,0|3,0,0]=4 4932 B12R0.277 COCC(C)NCCCCC(C)O ca8121a1a49d81491626b8a7d764254d [0,1,0,0,0,0|2,0,0]=3 4933 B12R0.277 COCC(C)NCCCC[C@@H](C)O 5f51f043eedc1c7eac3e17226e670552 [0,1,0,0,0,0|2,0,0]=3 4934 B12R0.277 COCC(C)OCCCCC(C)C 75a32e0eb329b6373d797f987a771862 [0,1,0,0,0,0|3,0,0]=4 4935 B12R0.277 COCC(O)CNCCCC(C)C 3925cf79ebfbf1e6e63a559200db1d3f [0,1,0,0,0,0|3,0,0]=4 4936 B12R0.277 COCC(O)CNCCCC(C)O 693194efe52a6d87d5ddcbad0185ee7f [0,1,0,0,0,0|2,0,0]=3 4937 B12R0.277 COC[C@@H](C)NCCCCC(C)C 59c0a540b9c1e5a504947e293b460af2 [0,1,0,0,0,0|3,0,0]=4 4938 B12R0.277 COC[C@@H](C)NCCCCC(C)O 818a09f3addb0c0417112a216f223589 [0,1,0,0,0,0|2,0,0]=3 4939 B12R0.277 COC[C@@H](C)NCCCC[C@@H](C)O 3ba54ae5bdc0285f845391b20a3f26b2 [0,1,0,0,0,0|2,0,0]=3 4940 B12R0.277 COC[C@@H](C)OCCCCC(C)C 7c7b3f9f76f3dea6ea669a25968a5a79 [0,1,0,0,0,0|3,0,0]=4 4941 B12R0.277 COC[C@@H](O)CNCCCC(C)C d455470c0f1b3a2bbf8eea9a829dba9a [0,1,0,0,0,0|3,0,0]=4 4942 B12R0.277 COC[C@@H](O)CNCCCC(C)O c03c58c709e310f16207811db22ed31e [0,1,0,0,0,0|2,0,0]=3 4943 B12R0.277 COC[C@H](C)COCCCC(C)C c4e3be8080710aad5b717266ce0369e3 [0,1,0,0,0,0|3,0,0]=4 4944 B12R0.277 COC[C@H](C)NCCCCC(C)C ca447014e37bee9eb39ce0dec63bd877 [0,1,0,0,0,0|3,0,0]=4 4945 B12R0.277 COC[C@H](C)NCCCCC(C)O e4e054fe5039711d55390a97a363f743 [0,1,0,0,0,0|2,0,0]=3 4946 B12R0.277 COC[C@H](C)NCCCC[C@@H](C)O 3a7e18c3e0dd8858aa799400b59b278d [0,1,0,0,0,0|2,0,0]=3 4947 B12R0.277 COC[C@H](C)OCCCCC(C)C 0a15293f7a35e58310852c8f6384d00e [0,1,0,0,0,0|3,0,0]=4 4948 B12R0.277 CSCC(C)OCCCCC(C)C f1e6249971314a9e5aa7c6b48ae2c91d [0,1,0,0,0,0|3,0,0]=4 4949 B12R0.277 C[C@@H](O)CCCCN[C@@H](C)CCO 501d2bc6019d8cbb20806239f5fd7a00 [0,1,0,0,0,0|2,0,0]=3 4950 B12R0.277 C[C@@H](O)CNCCCN(C)CCO 8241f1851a72ae294a5278012924f9fc [0,1,0,0,0,0|3,0,0]=4 4951 B12R0.277 C[C@H](CCO)NCCCC[C@@H](C)O 366ef0fd26b0a149fd4b39d0ba8435bf [0,1,0,0,0,0|2,0,0]=3 4952 B12R0.277 C[C@H](O)CNCCCN(C)CCO 9dab567d8f827b8316a60371e3213a68 [0,1,0,0,0,0|3,0,0]=4 4953 B12R1.7 C#CCCCCN1CCC(C1)O 7a199ae9ac8454eca5aaf2ce3d53132d [0,0,0,1,0,0|1,0,2]=4 4954 B12R1.7 C#CCCCCN1CC[C@@H](C1)O d04eac9d962735cdc3040e0bf64bd9ce [0,0,0,1,0,0|1,0,2]=4 4955 B12R1.7 C#CCCCCN1CC[C@H](C1)O b6373fd23e42c5e014bf83b4e5f180b3 [0,0,0,1,0,0|1,0,2]=4 4956 B12R1.7 C#CCCCNC1CCC(C1)O 0fc8f69a349aa839c81896156d03bcb7 [0,0,0,1,0,0|1,0,2]=4 4957 B12R1.7 C#CCCCN[C@@H]1CC[C@@H](C1)O a8877d1763a99d0a8924c76924d45b21 [0,0,0,1,0,0|1,0,2]=4 4958 B12R1.7 C#CCCCN[C@@H]1CC[C@H](C1)O 6c14914424c8277d385d0c1413267b0b [0,0,0,1,0,0|1,0,2]=4 4959 B12R1.7 C#CCCCN[C@H]1CC[C@@H](C1)O ad2a783550eb78a10bfccb211c8d9eac [0,0,0,1,0,0|1,0,2]=4 4960 B12R1.7 C#CCCCN[C@H]1CC[C@H](C1)O 9832777ad5b20a622ea2ba869ca6f9ed [0,0,0,1,0,0|1,0,2]=4 4961 B12R1.7 C#CCCNCC1CCC(C1)O 6938ea9631dd60a25428c55e747bb8e7 [0,0,0,1,0,0|1,0,2]=4 4962 B12R1.7 C#CCCOCC1CCC(O1)C e2e4e693e68fb2ee7054e3e67af80446 [0,0,0,1,0,0|1,0,2]=4 4963 B12R1.7 C#CCCOC[C@@H]1CC[C@@H](O1)C dca4bea45511827415147049b5c0c74f [0,0,0,1,0,0|1,0,2]=4 4964 B12R1.7 C/C=C/CNCC1CCC(C1)O 7c29d4d84ad3346ef166b5740453e45a [0,0,0,1,0,0|1,0,2]=4 4965 B12R1.7 C/C=C/COCC1CCC(O1)C 918b3ec0f84bbd5c4fa1c0bf6e87f4f8 [0,0,0,1,0,0|1,0,2]=4 4966 B12R1.7 C/C=C/COC[C@@H]1CC[C@@H](O1)C d97e92479187d9f550f0c69e263df218 [0,0,0,1,0,0|1,0,2]=4 4967 B12R1.7 C/C=C\CCCN1CCC(C1)O af6607afece1c1ce8b6975beb255d5ee [0,0,0,1,0,0|1,0,2]=4 4968 B12R1.7 C/C=C\CCCN1CC[C@@H](C1)O 1b847c347b1e293bb5cc7132e14acce1 [0,0,0,1,0,0|1,0,2]=4 4969 B12R1.7 C/C=C\CCCN1CC[C@H](C1)O c91955bcd29003a4353c3a46d0dcd46b [0,0,0,1,0,0|1,0,2]=4 4970 B12R1.7 C/C=C\CNCC1CCC(C1)O 333e0d80415114846acfd72013dde843 [0,0,0,1,0,0|1,0,2]=4 4971 B12R1.7 C/C=C\COCC1CCC(O1)C eed24324c6bee23a702f56e23610f2bd [0,0,0,1,0,0|1,0,2]=4 4972 B12R1.7 C/C=C\COC[C@@H]1CC[C@@H](O1)C b877f7543ca3062c6f5248043946ed25 [0,0,0,1,0,0|1,0,2]=4 4973 B12R1.7 C=CCCCCN1CCC(C1)O 19b5428a82ab791454a91a1c686aaac8 [0,0,0,1,0,0|1,0,2]=4 4974 B12R1.7 C=CCCCCN1CC[C@@H](C1)O 03a8e2841cc1884aad2e0358e15d7d60 [0,0,0,1,0,0|1,0,2]=4 4975 B12R1.7 C=CCCCCN1CC[C@H](C1)O 01672be5e8e8beb30e58846e1fd68f45 [0,0,0,1,0,0|1,0,2]=4 4976 B12R1.7 C=CCCCNC1CCC(C1)O 18eba074d48bff6ebdda7809df87fcfe [0,0,0,1,0,0|1,0,2]=4 4977 B12R1.7 C=CCCCN[C@@H]1CC[C@@H](C1)O 29ecc38c518858f65ff41d4722420851 [0,0,0,1,0,0|1,0,2]=4 4978 B12R1.7 C=CCCCN[C@@H]1CC[C@H](C1)O 8aec7353fa92efaa60b113ded7cdff2c [0,0,0,1,0,0|1,0,2]=4 4979 B12R1.7 C=CCCCN[C@H]1CC[C@@H](C1)O 59608cd530c700a912c6af993c6c5ba0 [0,0,0,1,0,0|1,0,2]=4 4980 B12R1.7 C=CCCCN[C@H]1CC[C@H](C1)O 471d1144abf9f94df8fd318ef8fc009b [0,0,0,1,0,0|1,0,2]=4 4981 B12R1.7 C=CCCNCC1CCC(C1)O 373819f78147cafdb0b23657b8635095 [0,0,0,1,0,0|1,0,2]=4 4982 B12R1.7 C=CCCOCC1CCC(O1)C 5a4095510115825cc217ca7325ad49d3 [0,0,0,1,0,0|1,0,2]=4 4983 B12R1.7 C=CCCOC[C@@H]1CC[C@@H](O1)C d016a24a53465b26f413f5b27285d669 [0,0,0,1,0,0|1,0,2]=4 4984 B12R1.7 CC#CCNCC1CCC(C1)O 430c6ca3f6c020e1268d7f1882537809 [0,0,0,1,0,0|1,0,2]=4 4985 B12R1.7 CC/C=C/CNC1CCC(C1)O 957fd7e33633f8c0d3c2f6e7a191b82f [0,0,0,1,0,0|1,0,2]=4 4986 B12R1.7 CC/C=C/CN[C@@H]1CC[C@@H](C1)O ff498d112eb5a71a42ff306e05a366e9 [0,0,0,1,0,0|1,0,2]=4 4987 B12R1.7 CC/C=C/CN[C@@H]1CC[C@H](C1)O 94575a90f71ae782584ab26109eaa8fe [0,0,0,1,0,0|1,0,2]=4 4988 B12R1.7 CC/C=C/CN[C@H]1CC[C@@H](C1)O 38f124b6e481cf4a1ed68e31a7e17218 [0,0,0,1,0,0|1,0,2]=4 4989 B12R1.7 CC/C=C/CN[C@H]1CC[C@H](C1)O de87cac5f535a65db591731259abd33f [0,0,0,1,0,0|1,0,2]=4 4990 B12R1.7 CC/C=C\CCN1CCC(C1)O a4bf685982d7c4d2980c81048714a56c [0,0,0,1,0,0|1,0,2]=4 4991 B12R1.7 CC/C=C\CCN1CC[C@@H](C1)O 9f065933f6d8ec904ccf5267f2620c10 [0,0,0,1,0,0|1,0,2]=4 4992 B12R1.7 CC/C=C\CCN1CC[C@H](C1)O ecc9e07ba0a5c02bb2aa42382ea47e83 [0,0,0,1,0,0|1,0,2]=4 4993 B12R1.7 CC1CCC(C1)CCCOCF 3efa4d52cca8f179015bc800d3d6f1b3 [0,0,0,1,0,0|3,0,0]=4 4994 B12R1.7 CC1CCC(C1)COCCCF 9552c06d104776451470468c4cf56b14 [0,0,0,1,0,0|3,0,0]=4 4995 B12R1.7 CC1CCC(C1)COCCCS 4191f15557e00023a68406c4e7a7d063 [0,0,0,1,0,0|3,0,0]=4 4996 B12R1.7 CC1CCC(C1)NCCCCF 9259648c1c03a78c5b928f4d1a0298ba [0,0,0,1,0,0|3,0,0]=4 4997 B12R1.7 CC1CCC(C1)NCCCCO 380ceb6918e73b8125630082e9e171ab [0,0,0,1,0,0|3,0,0]=4 4998 B12R1.7 CC1CCC(C1)OCCCCF d06ca95d255780cfff4a59f06a54d06d [0,0,0,1,0,0|3,0,0]=4 4999 B12R1.7 CC1CCC(O1)COCCC#N f526bb8e40e302ad9ac0f817c0924f8d [0,0,0,1,0,0|2,0,1]=4 5000 B12R1.7 CC1CCC(O1)COCCC=O d8c231412448331bbb9bc489f1e6fbb7 [0,0,0,1,0,0|2,0,1]=4 5001 B12R1.7 CC1CCC(O1)COCCCF 53e51a8120e05a55528ad939a14b2ef3 [0,0,0,1,0,0|2,0,0]=3 5002 B12R1.7 CC1CCC(O1)COCCCS 8f07f8c7ff27c7cbf9b0b929da9e4454 [0,0,0,1,0,0|2,0,0]=3 5003 B12R1.7 CC1CCN(C1)CCCCCF 6cb61e0a9eefe02c56db45b3d1bba3ae [0,0,0,1,0,0|3,0,0]=4 5004 B12R1.7 CC1CCN(C1)CCCCCO 954d611c4a8b5ee66f0452058a6d8835 [0,0,0,1,0,0|3,0,0]=4 5005 B12R1.7 CCC#CCNC1CCC(C1)O 4d19bcfec70c6cdfa7bc123a81be475f [0,0,0,1,0,0|1,0,2]=4 5006 B12R1.7 CCC#CCN[C@@H]1CC[C@@H](C1)O e1e9146bd64f4e032dc2a7d56825ad9a [0,0,0,1,0,0|1,0,2]=4 5007 B12R1.7 CCC#CCN[C@@H]1CC[C@H](C1)O 941dcf00f2f47bbb22db2f46263337ce [0,0,0,1,0,0|1,0,2]=4 5008 B12R1.7 CCC#CCN[C@H]1CC[C@@H](C1)O b7dbd863e5c6e7683c7535e19cda7129 [0,0,0,1,0,0|1,0,2]=4 5009 B12R1.7 CCC#CCN[C@H]1CC[C@H](C1)O d81073cf999cb4e7dcb6231974d92238 [0,0,0,1,0,0|1,0,2]=4 5010 B12R1.7 CCC/C=C/CN1CCC(C1)O 678f927ffdecefa7b99e4fdc5eb61e65 [0,0,0,1,0,0|1,0,2]=4 5011 B12R1.7 CCC/C=C/CN1CC[C@@H](C1)O 4a8268da707f3f68b8106040755aa729 [0,0,0,1,0,0|1,0,2]=4 5012 B12R1.7 CCC/C=C/CN1CC[C@H](C1)O e771adee23d3852a0045d06b6c3d2a01 [0,0,0,1,0,0|1,0,2]=4 5013 B12R1.7 CCC/C=C\CN1CCC(C1)O 3d01aca8ec88faf917f75e0a369dc6fd [0,0,0,1,0,0|1,0,2]=4 5014 B12R1.7 CCC/C=C\CN1CC[C@@H](C1)O 55208530ae9173c9ef28c3f37f8e0787 [0,0,0,1,0,0|1,0,2]=4 5015 B12R1.7 CCC/C=C\CN1CC[C@H](C1)O 15aacf9669fb637d09eeef983a5a612d [0,0,0,1,0,0|1,0,2]=4 5016 B12R1.7 CCCCCCN1CCC(C1)C 156e77e77d3b702085e568f84a08f0f2 [0,0,0,1,0,0|2,0,0]=3 5017 B12R1.7 CCCCCCN1CCC(C1)F 66b2181e2f67ef35caf2a6156defc2d0 [0,0,0,1,0,0|2,0,0]=3 5018 B12R1.7 CCCCCCN1CCC(C1)O 86c753040dfc7917e893490f7d84fe7f [0,0,0,1,0,0|1,0,0]=2 5019 B12R1.7 CCCCCCN1CCN(C1)C ed88e0cf32d7ec643921dc4ccdec72bd [0,0,0,1,0,0|3,0,0]=4 5020 B12R1.7 CCCCCCN1CC[C@@H](C1)F 006bb41d107a76ff03f5e8e1352bde5f [0,0,0,1,0,0|2,0,0]=3 5021 B12R1.7 CCCCCCN1CC[C@@H](C1)O 493e40a4a7df830477e6025cdef1280f [0,0,0,1,0,0|1,0,0]=2 5022 B12R1.7 CCCCCCN1CC[C@H](C1)F edd954e4e1b41cf98c8e9e8df9e5c571 [0,0,0,1,0,0|2,0,0]=3 5023 B12R1.7 CCCCCCN1CC[C@H](C1)O 49ac07a6d4400e297d4f5cd35d17cfb5 [0,0,0,1,0,0|1,0,0]=2 5024 B12R1.7 CCCCCNC1CCC(C1)C 03368cfee882e33bb659a9619eb3bc9f [0,0,0,1,0,0|2,0,0]=3 5025 B12R1.7 CCCCCNC1CCC(C1)O c99be5e8b6181f7e8736df3a0532aa6b [0,0,0,1,0,0|1,0,0]=2 5026 B12R1.7 CCCCCNC1CCN(C1)C e53c72b7adfcbcf4092c0e830fbdf632 [0,0,0,1,0,0|3,0,0]=4 5027 B12R1.7 CCCCCNC1COC(C1)C 8cb0363a4a2ee251634e7e98482d1386 [0,0,0,1,0,0|3,0,0]=4 5028 B12R1.7 CCCCCN[C@@H]1C=C[C@@H](C1)O 824954210b2ef58400f37f0d1cabfdf0 [0,0,0,1,0,0|1,0,2]=4 5029 B12R1.7 CCCCCN[C@@H]1CCN(C1)C 64cd7a6c52e084110eafa454221644f2 [0,0,0,1,0,0|3,0,0]=4 5030 B12R1.7 CCCCCN[C@@H]1CC[C@@H](C1)O 40f486cf2ce31abefefc181b583d9543 [0,0,0,1,0,0|1,0,0]=2 5031 B12R1.7 CCCCCN[C@@H]1CC[C@H](C1)O f347600a436df9a0638a2d71625e4706 [0,0,0,1,0,0|1,0,0]=2 5032 B12R1.7 CCCCCN[C@H]1C=C[C@H](C1)O f831e8cc0e52877cded79a9160b7dac1 [0,0,0,1,0,0|1,0,2]=4 5033 B12R1.7 CCCCCN[C@H]1CCN(C1)C f1dd0f5d5cd49e0e1cb0a8823a4702e1 [0,0,0,1,0,0|3,0,0]=4 5034 B12R1.7 CCCCCN[C@H]1CC[C@@H](C1)O f34575264ea99989dc0cbb5c114929d7 [0,0,0,1,0,0|1,0,0]=2 5035 B12R1.7 CCCCCN[C@H]1CC[C@H](C1)O 7c3b4f47eaf0df74e35f6f0d351f9ef8 [0,0,0,1,0,0|1,0,0]=2 5036 B12R1.7 CCCCCOC1CCC(=O)C1 49023c98b372362affe65588ab23acd0 [0,0,0,1,0,0|1,0,2]=4 5037 B12R1.7 CCCCCOC1CCC(C1)C 4fda610aa55777b757bf7dba67c6b42d [0,0,0,1,0,0|2,0,0]=3 5038 B12R1.7 CCCCCOC1CCC(C1)F 0a872e47e30625f90f3aadc025aaf199 [0,0,0,1,0,0|2,0,0]=3 5039 B12R1.7 CCCCCOC1CCN(C1)C 433eb97dd72dc213f76dbcc9fa271faa [0,0,0,1,0,0|3,0,0]=4 5040 B12R1.7 CCCCCOC1COC(C1)C 72cf34322e8028e3a6723a10c3134a41 [0,0,0,1,0,0|3,0,0]=4 5041 B12R1.7 CCCCCO[C@@H]1CCN(C1)C a11364c00420317d79ced9dbe1596aca [0,0,0,1,0,0|3,0,0]=4 5042 B12R1.7 CCCCCO[C@H]1CCN(C1)C 9d5c7cde8b94636be356e410647e0107 [0,0,0,1,0,0|3,0,0]=4 5043 B12R1.7 CCCCNCC1CCC(=O)O1 6cd8011045f3aca64bc8a0d7d982ed52 [0,0,0,1,0,0|2,0,1]=4 5044 B12R1.7 CCCCNCC1CCC(C1)O 97bbeccd7445fbff58481506656f8549 [0,0,0,1,0,0|1,0,0]=2 5045 B12R1.7 CCCCNCC1CCN(C1)C 232089213ed273affab6da8c07dcbcf9 [0,0,0,1,0,0|3,0,0]=4 5046 B12R1.7 CCCCNC[C@@H]1CCN(C1)C 211105f2e70a38cc343ba8a744804af0 [0,0,0,1,0,0|3,0,0]=4 5047 B12R1.7 CCCCNC[C@H]1CCN(C1)C 8ea11b20bfee8314d997db3d8a8d5653 [0,0,0,1,0,0|3,0,0]=4 5048 B12R1.7 CCCCOCC1CCC(=O)C1 14f52ea4de436ab0d4a47fa7be44a245 [0,0,0,1,0,0|1,0,2]=4 5049 B12R1.7 CCCCOCC1CCC(=O)O1 548ccdd9b3c0f85ccc42c7a67107df18 [0,0,0,1,0,0|2,0,1]=4 5050 B12R1.7 CCCCOCC1CCC(C1)C 49a6aaef21064c3f2b276ae2d1ca62e2 [0,0,0,1,0,0|2,0,0]=3 5051 B12R1.7 CCCCOCC1CCC(C1)F 5457fa0bc578de1cde75f7a3b5a42ae1 [0,0,0,1,0,0|2,0,0]=3 5052 B12R1.7 CCCCOCC1CCC(O1)C b667273d555a33a45117888e522047f6 [0,0,0,1,0,0|1,0,0]=2 5053 B12R1.7 CCCCOCC1CCN(C1)C 4feb7dc40ffc615d66fc3bf1ca351593 [0,0,0,1,0,0|3,0,0]=4 5054 B12R1.7 CCCCOCN1CCC(C1)C 944925c5256373a08c7bb9fe1c791ca4 [0,0,0,1,0,0|3,0,0]=4 5055 B12R1.7 CCCCOCN1CCC(C1)F 1c59ea055e95540e61cf9bf7f04cf3bd [0,0,0,1,0,0|3,0,0]=4 5056 B12R1.7 CCCCOCN1CCC(C1)O 053d996fb23d0dc55e0e31444c2692d3 [0,0,0,1,0,0|2,0,0]=3 5057 B12R1.7 CCCCOCN1CC[C@@H](C1)F 10f6f38a8f0ec32fec2e52317de9e7c6 [0,0,0,1,0,0|3,0,0]=4 5058 B12R1.7 CCCCOCN1CC[C@@H](C1)O c4b2ea468c10683058f35b7bafa58993 [0,0,0,1,0,0|2,0,0]=3 5059 B12R1.7 CCCCOCN1CC[C@H](C1)F 219559a928ccc655c4558e9b02a8feb9 [0,0,0,1,0,0|3,0,0]=4 5060 B12R1.7 CCCCOCN1CC[C@H](C1)O 7407da6ba84d43db4ba57c869357c1f8 [0,0,0,1,0,0|2,0,0]=3 5061 B12R1.7 CCCCOC[C@@H]1CCC(=O)C1 3c3f16d87259e6feaf8aeac7655f11e9 [0,0,0,1,0,0|1,0,2]=4 5062 B12R1.7 CCCCOC[C@@H]1CCC(=O)O1 958d143e3b3dfa027226aeedee209e8b [0,0,0,1,0,0|2,0,1]=4 5063 B12R1.7 CCCCOC[C@@H]1CCN(C1)C 1920fbd5be8d741ea7f1d23006b9f332 [0,0,0,1,0,0|3,0,0]=4 5064 B12R1.7 CCCCOC[C@@H]1CC[C@@H](O1)C c141957d8a4a09d91655a7bd9e1ddb9e [0,0,0,1,0,0|1,0,0]=2 5065 B12R1.7 CCCCOC[C@@H]1CC[C@H](C1)F 652ff9ccf1104b7e1bef71e4cd15b55a [0,0,0,1,0,0|2,0,0]=3 5066 B12R1.7 CCCCOC[C@H]1CCC(=O)O1 6e8fd0561526e2bd363323f98b7a38f0 [0,0,0,1,0,0|2,0,1]=4 5067 B12R1.7 CCCCOC[C@H]1CCN(C1)C 649bc83c2088cd7e2495f6abbeae2dd9 [0,0,0,1,0,0|3,0,0]=4 5068 B12R1.7 CCCCOC[C@H]1CC[C@H](C1)F 3465e3f1c32c4fe28dec18b5a7453a17 [0,0,0,1,0,0|2,0,0]=3 5069 B12R1.7 CCCNCCC1CCN(C1)C 5144f71185ed7490d5b6bb4293619fa8 [0,0,0,1,0,0|3,0,0]=4 5070 B12R1.7 CCCNCCN1CCC(C1)F 3db3b80da745b002dbfe2a51bb5570cf [0,0,0,1,0,0|3,0,0]=4 5071 B12R1.7 CCCNCCN1CCC(C1)O 4a75f0a06649111b471d7d63cad9c3ba [0,0,0,1,0,0|2,0,0]=3 5072 B12R1.7 CCCNCCN1CC[C@@H](C1)F d8d4ad8b77789f2b37c11a6a4b251671 [0,0,0,1,0,0|3,0,0]=4 5073 B12R1.7 CCCNCCN1CC[C@@H](C1)O 7e1ab8a8bcfe5831b3087c72b564f17d [0,0,0,1,0,0|2,0,0]=3 5074 B12R1.7 CCCNCCN1CC[C@H](C1)F 60ffa15412636e09e20c431103bde47e [0,0,0,1,0,0|3,0,0]=4 5075 B12R1.7 CCCOCCC1CCN(C1)C b97615b4d68b13b4c9519f46f0775e64 [0,0,0,1,0,0|3,0,0]=4 5076 B12R1.7 CCCOCCN1CCC(C1)C 3a88fd8d895ff4bb090d320739a7ec64 [0,0,0,1,0,0|3,0,0]=4 5077 B12R1.7 CCCOCCN1CCC(C1)F d6241e1c9139fe18e86c19efb593fa9b [0,0,0,1,0,0|3,0,0]=4 5078 B12R1.7 CCCOCCN1CCC(C1)O d9284c8a087066f6ae64bfe76e8ba971 [0,0,0,1,0,0|2,0,0]=3 5079 B12R1.7 CCCOCCN1CC[C@@H](C1)F 0d0e379315f93447f8aad8193c58bff5 [0,0,0,1,0,0|3,0,0]=4 5080 B12R1.7 CCCOCCN1CC[C@@H](C1)O 8b8bb5269348b64d393cb6330ca9386d [0,0,0,1,0,0|2,0,0]=3 5081 B12R1.7 CCCOCCN1CC[C@H](C1)F 6a71eb92fc92964248e295a111bd6b24 [0,0,0,1,0,0|3,0,0]=4 5082 B12R1.7 CCCOCCN1CC[C@H](C1)O 068fce9eb243e2a1f5cd82bafe76b62a [0,0,0,1,0,0|2,0,0]=3 5083 B12R1.7 CCNCCCN1CC[C@@H](C1)F 560b82d43e967a4610929e9c291ace93 [0,0,0,1,0,0|3,0,0]=4 5084 B12R1.7 CCNCCCN1CC[C@H](C1)F dddf0f1037cd50f0394bfe1417171619 [0,0,0,1,0,0|3,0,0]=4 5085 B12R1.7 CCOCCCC1CCC(C1)C f44d60a97ba3c343402be7db5a456d7f [0,0,0,1,0,0|2,0,0]=3 5086 B12R1.7 CCOCCCN1CCC(C1)C b79537489fb57207ace4f597e49ce485 [0,0,0,1,0,0|3,0,0]=4 5087 B12R1.7 CCOCCCN1CCC(C1)F 85cb7e9342c3f1fa886e4980095bcced [0,0,0,1,0,0|3,0,0]=4 5088 B12R1.7 CCOCCCN1CCC(C1)O ebf471dee721976edb99fea6a4dc4b73 [0,0,0,1,0,0|2,0,0]=3 5089 B12R1.7 CCOCCCN1CC[C@@H](C1)F 4842e3ef7acbf283277090f6912191cd [0,0,0,1,0,0|3,0,0]=4 5090 B12R1.7 CCOCCCN1CC[C@@H](C1)O 2d78894f43d76de1607caf2f8de90041 [0,0,0,1,0,0|2,0,0]=3 5091 B12R1.7 CCOCCCN1CC[C@H](C1)F 8549f4090deb2ecb7828b4b5f8fd5dde 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CCSCCCN1CC[C@H](C1)O bb834e2a41c29642bdf80392b0b03fe2 [0,0,0,1,0,0|2,0,0]=3 5115 B12R1.7 CCSCCNC1CCC(C1)C 7addd59ef456809ba0e22b031319f19d [0,0,0,1,0,0|3,0,0]=4 5116 B12R1.7 CCSCCNC1CCC(C1)O ce36c9b2972ca3a0f3fef38b0933c3aa [0,0,0,1,0,0|2,0,0]=3 5117 B12R1.7 CCSCCN[C@@H]1CC[C@@H](C1)O 9d534369f6e8fe9e571cba07826a3212 [0,0,0,1,0,0|2,0,0]=3 5118 B12R1.7 CCSCCN[C@@H]1CC[C@H](C1)O 0a8288b524fb7d0ead5334b208f54cd8 [0,0,0,1,0,0|2,0,0]=3 5119 B12R1.7 CCSCCN[C@H]1CC[C@@H](C1)O 1087dc94c568e61aec3060abbbe72521 [0,0,0,1,0,0|2,0,0]=3 5120 B12R1.7 CCSCCN[C@H]1CC[C@H](C1)O d74864e1d07e8906328e46eef579f54a [0,0,0,1,0,0|2,0,0]=3 5121 B12R1.7 CCSCCOC1CCC(C1)C 9e48ba1fc312d91b6c9ea90aa33e1e30 [0,0,0,1,0,0|3,0,0]=4 5122 B12R1.7 CCSCCOC1CCC(C1)F 7262bfa71d136e7be7534a6b8d2a7bb0 [0,0,0,1,0,0|3,0,0]=4 5123 B12R1.7 COCCCCN1CCC(C1)C 695898032e0fdd5fd6c0d6f998ea0b00 [0,0,0,1,0,0|3,0,0]=4 5124 B12R1.7 COCCCCN1CCC(C1)F f2e02ead5289c710bbe849db29a1db9e [0,0,0,1,0,0|3,0,0]=4 5125 B12R1.7 COCCCCN1CCC(C1)O 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[0,0,0,1,0,0|3,0,0]=4 5170 B12R1.7 C[C@H]1CC[C@H](O1)COCCC#N 1b60a782402fe40c081d903a41c90529 [0,0,0,1,0,0|2,0,1]=4 5171 B12R1.7 C[C@H]1CC[C@H](O1)COCCC=O cca71fd8689d61045379ebcbcac2b02e [0,0,0,1,0,0|2,0,1]=4 5172 B12R1.7 C[C@H]1CC[C@H](O1)COCCCF a639f79fb5105ee336139919f0e03e7b [0,0,0,1,0,0|2,0,0]=3 5173 B12R1.7 C[C@H]1CC[C@H](O1)COCCCS f653aa3d28ce91a3e18269f12a688164 [0,0,0,1,0,0|2,0,0]=3 5174 B12R1.7 FC1CCC(C1)COCCCS 9a3ad21a152c0b4bb96a31f0f1aca8c2 [0,0,0,1,0,0|3,0,0]=4 5175 B12R1.7 FCCCCCN1CCC(C1)F ca835b29e6ef263757df2148264c983c [0,0,0,1,0,0|3,0,0]=4 5176 B12R1.7 FCCCCCN1CC[C@@H](C1)F 65c26f93a198a21e01d2cc756677ff49 [0,0,0,1,0,0|3,0,0]=4 5177 B12R1.7 FCCCCCN1CC[C@H](C1)F ec6cb999f2e78749288267c13a1a17ec [0,0,0,1,0,0|3,0,0]=4 5178 B12R1.7 FCCCCOC1CCC(C1)F c7b2a4a16cdcb6b8cd162ef880b688d4 [0,0,0,1,0,0|3,0,0]=4 5179 B12R1.7 FCCCOCC1CCC(C1)F 6f1149a6c3234ce2774d8893a951d1bd [0,0,0,1,0,0|3,0,0]=4 5180 B12R1.7 FCCCOC[C@@H]1CC[C@H](C1)F 2fd51f2766e23928760f57d9df46d328 [0,0,0,1,0,0|3,0,0]=4 5181 B12R1.7 FCCCOC[C@H]1CC[C@H](C1)F 04853017238364aa59b2f8d93a7a127d [0,0,0,1,0,0|3,0,0]=4 5182 B12R1.7 F[C@@H]1CC[C@@H](C1)COCCCS 45debf3ecd4878d2d235848228b72944 [0,0,0,1,0,0|3,0,0]=4 5183 B12R1.7 F[C@@H]1CC[C@H](C1)COCCCS 7ec496efc583cceb0ed665461946e84a [0,0,0,1,0,0|3,0,0]=4 5184 B12R1.7 N#CCCCCN1CCC(C1)O 37e5b6d5ee463a53b0eac05ff5522508 [0,0,0,1,0,0|2,0,1]=4 5185 B12R1.7 N#CCCCCN1CC[C@@H](C1)O ede8ba206a071067923ed96212ffc18f [0,0,0,1,0,0|2,0,1]=4 5186 B12R1.7 N#CCCCCN1CC[C@H](C1)O d9dd09175cc82f2a2d0b0470cb58d6f5 [0,0,0,1,0,0|2,0,1]=4 5187 B12R1.7 N#CCCCNC1CCC(C1)O 87f794d7fd49b46e4305c82de4bd171e [0,0,0,1,0,0|2,0,1]=4 5188 B12R1.7 N#CCCCN[C@@H]1CC[C@@H](C1)O 52c690e37a1cd930b72c7d877b089cf6 [0,0,0,1,0,0|2,0,1]=4 5189 B12R1.7 N#CCCCN[C@@H]1CC[C@H](C1)O a008bdeabd304ab54f90f30a6e172f3e [0,0,0,1,0,0|2,0,1]=4 5190 B12R1.7 N#CCCCN[C@H]1CC[C@@H](C1)O 26f62604f77b4d75f8f76f9b7fd7cad3 [0,0,0,1,0,0|2,0,1]=4 5191 B12R1.7 N#CCCCN[C@H]1CC[C@H](C1)O 1723cdbe9e9c2c54a1d6366e590f9d29 [0,0,0,1,0,0|2,0,1]=4 5192 B12R1.7 N#CCCNCC1CCC(C1)O bd39d6462ce951bcae2b20c4587aa2d2 [0,0,0,1,0,0|2,0,1]=4 5193 B12R1.7 NOCCCCN1CCC(C1)O b9093fb17881afcd1cc7910372f33071 [0,0,0,1,0,0|3,0,0]=4 5194 B12R1.7 NOCCCCN1CC[C@@H](C1)O 3290e989ea5159eb575e7fcae9907aa2 [0,0,0,1,0,0|3,0,0]=4 5195 B12R1.7 NOCCCCN1CC[C@H](C1)O 23cdb21359ef167dc00954035ffec26a [0,0,0,1,0,0|3,0,0]=4 5196 B12R1.7 O=CCCCCN1CCC(C1)O 6cff3fad64bec98a110592619027b054 [0,0,0,1,0,0|2,0,1]=4 5197 B12R1.7 O=CCCCCN1CC[C@@H](C1)O 8ebc8f85a94cb7b2895a8ee60365a2df [0,0,0,1,0,0|2,0,1]=4 5198 B12R1.7 O=CCCCCN1CC[C@H](C1)O 529bb80a6febd6b54ab77643acde89a6 [0,0,0,1,0,0|2,0,1]=4 5199 B12R1.7 O=CCCCNC1CCC(C1)O 0d27879f4d9075f172a310c84e3f857a [0,0,0,1,0,0|2,0,1]=4 5200 B12R1.7 O=CCCCN[C@@H]1CC[C@@H](C1)O bc1d1f2c12936d0028412e23b63801eb [0,0,0,1,0,0|2,0,1]=4 5201 B12R1.7 O=CCCCN[C@@H]1CC[C@H](C1)O b147b68f849c1274f7f0d8d867fb0043 [0,0,0,1,0,0|2,0,1]=4 5202 B12R1.7 O=CCCCN[C@H]1CC[C@@H](C1)O 0c38dc99e2e469b0099f3fe46c2368ee [0,0,0,1,0,0|2,0,1]=4 5203 B12R1.7 O=CCCCN[C@H]1CC[C@H](C1)O c1747c372dd17ccf4c13379da1ea4cf2 [0,0,0,1,0,0|2,0,1]=4 5204 B12R1.7 O=CCCNCC1CCC(C1)O 2c36b591847923fc04c166d791d12aff [0,0,0,1,0,0|2,0,1]=4 5205 B12R1.7 OC1CCC(C1)CNCCCF 670c2ad314bcbed0975fd712305d6a04 [0,0,0,1,0,0|2,0,0]=3 5206 B12R1.7 OC1CCC(C1)CNCCCS 87df8fba1e78c7c45d3e3d8b953a2096 [0,0,0,1,0,0|2,0,0]=3 5207 B12R1.7 OC1CCC(C1)NCCCCF 00e790077cd5a632e5f58130186e7346 [0,0,0,1,0,0|2,0,0]=3 5208 B12R1.7 OC1CCN(C1)CCCCCF a29262244aa5a37ab9abce3030fd6ed2 [0,0,0,1,0,0|2,0,0]=3 5209 B12R1.7 OC1CCN(C1)CCNCCF 89feecb3f87e3ac0bcc66fee08532134 [0,0,0,1,0,0|3,0,0]=4 5210 B12R1.7 OC1CCN(C1)CCNCCS 5e7b944252f99c8f24ebecc5c2e2015c [0,0,0,1,0,0|3,0,0]=4 5211 B12R1.7 OCCCCCN1CCC(C1)F a2f9e04c334174587d580b2d4d540e7e [0,0,0,1,0,0|3,0,0]=4 5212 B12R1.7 OCCCCCN1CCC(C1)O ef0917b7c70a8354489cd9773d8b7697 [0,0,0,1,0,0|2,0,0]=3 5213 B12R1.7 OCCCCCN1CC[C@@H](C1)F b8370f6cd2fadf1927a03d699de1c284 [0,0,0,1,0,0|3,0,0]=4 5214 B12R1.7 OCCCCCN1CC[C@@H](C1)O 73075ffd38b4d5c8e831db6b7a7d70ef [0,0,0,1,0,0|2,0,0]=3 5215 B12R1.7 OCCCCCN1CC[C@H](C1)F 83436ae534085df56a4eb0572203f09b [0,0,0,1,0,0|3,0,0]=4 5216 B12R1.7 OCCCCCN1CC[C@H](C1)O 7f2c188b514ebab5701e7c8251ad4df4 [0,0,0,1,0,0|2,0,0]=3 5217 B12R1.7 OCCCCNC1CCC(C1)O e9313f37668a465397ed74951c98be13 [0,0,0,1,0,0|2,0,0]=3 5218 B12R1.7 OCCCCN[C@@H]1CC[C@@H](C1)O db634823ad21ce88fecbc1f5b506611c [0,0,0,1,0,0|2,0,0]=3 5219 B12R1.7 OCCCCN[C@@H]1CC[C@H](C1)O 1198fa992a12b2fa359f889b24b94ba2 [0,0,0,1,0,0|2,0,0]=3 5220 B12R1.7 OCCCCN[C@H]1CC[C@@H](C1)O ebb0ca6811b3d41e87037a8a12c3e3b5 [0,0,0,1,0,0|2,0,0]=3 5221 B12R1.7 OCCCCN[C@H]1CC[C@H](C1)O 87b2691c99813fff96549773466926bc [0,0,0,1,0,0|2,0,0]=3 5222 B12R1.7 OCCCNCC1CCC(C1)O f2237fcbb91089414efdafea163218c0 [0,0,0,1,0,0|2,0,0]=3 5223 B12R1.7 OCCNCCN1CCC(C1)O b01fa973afc42d59b3ed02454a255364 [0,0,0,1,0,0|3,0,0]=4 5224 B12R1.7 OCCNCCN1CC[C@@H](C1)O 596f79ee479e04baa5a28578aebd8327 [0,0,0,1,0,0|3,0,0]=4 5225 B12R1.7 OCCOCCN1CCC(C1)O 65f3d6aaf7be2a94be62c8e46ace76f0 [0,0,0,1,0,0|3,0,0]=4 5226 B12R1.7 OCCOCCN1CC[C@@H](C1)O 92e6359aad404c68e389f2b18cac9c2c [0,0,0,1,0,0|3,0,0]=4 5227 B12R1.7 OCCOCCN1CC[C@H](C1)O aacb16f834ca9f570b6518f71f7ba088 [0,0,0,1,0,0|3,0,0]=4 5228 B12R1.7 O[C@@H]1CCN(C1)CCCCCF 04b6e0dc469bd99ead5bfbf7d367ce93 [0,0,0,1,0,0|2,0,0]=3 5229 B12R1.7 O[C@@H]1CC[C@@H](C1)NCCCCF a8a7963129aeb96da100c625807f98d6 [0,0,0,1,0,0|2,0,0]=3 5230 B12R1.7 O[C@@H]1CC[C@H](C1)NCCCCF 7366f66890f031fd9d82b7d90b2a124b [0,0,0,1,0,0|2,0,0]=3 5231 B12R1.7 O[C@H]1CCN(C1)CCCCCF 7fcf0c7c48e2e991d0bba06680fd76a5 [0,0,0,1,0,0|2,0,0]=3 5232 B12R1.7 O[C@H]1CCN(C1)CCNCCF f8ab1959ac921567308c1820bb2c4ff4 [0,0,0,1,0,0|3,0,0]=4 5233 B12R1.7 O[C@H]1CCN(C1)CCNCCS 0d6b6eabb00e524c4f7e8ff4a33b7c61 [0,0,0,1,0,0|3,0,0]=4 5234 B12R1.7 O[C@H]1CC[C@@H](C1)NCCCCF b9901b2d00f1207b369f5d17d891f567 [0,0,0,1,0,0|2,0,0]=3 5235 B12R1.7 O[C@H]1CC[C@H](C1)NCCCCF cac302f9453c2f08bc08f46f8b64ee41 [0,0,0,1,0,0|2,0,0]=3 5236 B12R1.28 C#CCCCN1CCCC(C1)O 1f32f0fe39b19297e10f3f24acf666fe [0,0,0,1,0,0|1,0,2]=4 5237 B12R1.28 C#CCCCN1CCC[C@@H](C1)O 244eeb1928e4a0afc32c1d4082092231 [0,0,0,1,0,0|1,0,2]=4 5238 B12R1.28 C#CCCCN1CCC[C@H](C1)O 2da8c86e6e7c71a7b0005741743090ca [0,0,0,1,0,0|1,0,2]=4 5239 B12R1.28 C#CCCNC1CCCC(C1)O 8ee8e75068cfc2b275e315c49d23d53f [0,0,0,1,0,0|1,0,2]=4 5240 B12R1.28 C#CCCN[C@@H]1CCC[C@@H](C1)O 57bb2cfe1ec101bd1e438163987f5608 [0,0,0,1,0,0|1,0,2]=4 5241 B12R1.28 C#CCCN[C@@H]1CCC[C@H](C1)O 879c139dea69d85eaa0fe9a69735d72f [0,0,0,1,0,0|1,0,2]=4 5242 B12R1.28 C#CCCN[C@H]1CCC[C@@H](C1)O 2358c433f94d527260add2bd0b5be590 [0,0,0,1,0,0|1,0,2]=4 5243 B12R1.28 C#CCCN[C@H]1CCC[C@H](C1)O 657ee265da7c26b4746efa370f0310a1 [0,0,0,1,0,0|1,0,2]=4 5244 B12R1.28 C#CCNCC1CCCC(C1)O b621a95a39caebe9b29278d32fb9ac86 [0,0,0,1,0,0|1,0,2]=4 5245 B12R1.28 C#CCNC[C@H]1CCC[C@H](C1)O 12842d63167d53375285d98c27df5051 [0,0,0,1,0,0|1,0,2]=4 5246 B12R1.28 C/C=C/CNC1CCCC(C1)O 016351098df4e0d8ce05cac4b237d824 [0,0,0,1,0,0|1,0,2]=4 5247 B12R1.28 C/C=C/CN[C@@H]1CCC[C@@H](C1)O 3a6c7545ac68d34ae0dc041cd1ef6e2e [0,0,0,1,0,0|1,0,2]=4 5248 B12R1.28 C/C=C/CN[C@@H]1CCC[C@H](C1)O 29d21351dfa0c0869dc37e19ff8e0636 [0,0,0,1,0,0|1,0,2]=4 5249 B12R1.28 C/C=C/CN[C@H]1CCC[C@@H](C1)O c8d4310a0ab3899599ae258cd09999f8 [0,0,0,1,0,0|1,0,2]=4 5250 B12R1.28 C/C=C/CN[C@H]1CCC[C@H](C1)O 216a10fade994c5348caccb3f501450c [0,0,0,1,0,0|1,0,2]=4 5251 B12R1.28 C/C=C\CNC1CCCC(C1)O a63baa96106e8cdf2946071f58c7f0c6 [0,0,0,1,0,0|1,0,2]=4 5252 B12R1.28 C/C=C\CN[C@@H]1CCC[C@@H](C1)O bed6b5dc9dab4d95fc091931f7237037 [0,0,0,1,0,0|1,0,2]=4 5253 B12R1.28 C/C=C\CN[C@@H]1CCC[C@H](C1)O 22a6a0190fe357504ff6f3ae2f4ac146 [0,0,0,1,0,0|1,0,2]=4 5254 B12R1.28 C/C=C\CN[C@H]1CCC[C@@H](C1)O 698727c3b382d4ea625234ed19a4dfaa [0,0,0,1,0,0|1,0,2]=4 5255 B12R1.28 C/C=C\CN[C@H]1CCC[C@H](C1)O 03b6e56c0bf2ee8d8a6ca59f0af3cff6 [0,0,0,1,0,0|1,0,2]=4 5256 B12R1.28 C=CCCCN1CCCC(C1)O adda0dbd74b3489279d862adcfcb7204 [0,0,0,1,0,0|1,0,2]=4 5257 B12R1.28 C=CCCCN1CCC[C@@H](C1)O 49ae4565f81a38d857f05cdf05be5194 [0,0,0,1,0,0|1,0,2]=4 5258 B12R1.28 C=CCCCN1CCC[C@H](C1)O 5c9ec4eb2864321900f0ec10ea603ad6 [0,0,0,1,0,0|1,0,2]=4 5259 B12R1.28 C=CCCNC1CCCC(C1)O 14ac7bf59ac8ca2d277377a13b4ff6e7 [0,0,0,1,0,0|1,0,2]=4 5260 B12R1.28 C=CCCN[C@@H]1CCC[C@@H](C1)O 97864fee0825b39f13b72058343ef314 [0,0,0,1,0,0|1,0,2]=4 5261 B12R1.28 C=CCCN[C@@H]1CCC[C@H](C1)O 17c3fd8a999fa55e695ab6d37a08e809 [0,0,0,1,0,0|1,0,2]=4 5262 B12R1.28 C=CCCN[C@H]1CCC[C@@H](C1)O 5cf825d6d3277d2888f6ecbd0622fbe9 [0,0,0,1,0,0|1,0,2]=4 5263 B12R1.28 C=CCCN[C@H]1CCC[C@H](C1)O d2536a30531bc95d67d695bd21d49308 [0,0,0,1,0,0|1,0,2]=4 5264 B12R1.28 C=CCNCC1CCCC(C1)O cb4e0fb7c9e01afd58799c3047fa8ad8 [0,0,0,1,0,0|1,0,2]=4 5265 B12R1.28 C=CCNC[C@H]1CCC[C@H](C1)O 61687c3b578d0d4180c1bbe46ae9da96 [0,0,0,1,0,0|1,0,2]=4 5266 B12R1.28 CC/C=C/CN1CCCC(C1)O 52dd35ebe757fef26b34a8aa402b4fb1 [0,0,0,1,0,0|1,0,2]=4 5267 B12R1.28 CC/C=C/CN1CCC[C@@H](C1)O 924b8231644e15a619e544e756e1d864 [0,0,0,1,0,0|1,0,2]=4 5268 B12R1.28 CC/C=C/CN1CCC[C@H](C1)O 36c6c45b1641fddc876d1300c997a12b [0,0,0,1,0,0|1,0,2]=4 5269 B12R1.28 CC1CCCC(C1)CNCCF fa55b63fbd6354128f740c2d363acf3a [0,0,0,1,0,0|3,0,0]=4 5270 B12R1.28 CC1CCCC(C1)CNCCO b65b6c78e9a8d2dfb0bf9f0b66ca44b5 [0,0,0,1,0,0|3,0,0]=4 5271 B12R1.28 CC1CCCC(C1)CNCCS a7b1181ad5d46715f0951222b108ed3f [0,0,0,1,0,0|3,0,0]=4 5272 B12R1.28 CC1CCCC(C1)COCCF 2164efc5bfe752b4b27a87b494818185 [0,0,0,1,0,0|3,0,0]=4 5273 B12R1.28 CC1CCCC(C1)COCCS 69a04fc7877c10c1aed8f2c0a4dbd9af [0,0,0,1,0,0|3,0,0]=4 5274 B12R1.28 CC1CCCC(C1)NCCCF 3a91d6d70c5188becd6774225f029e17 [0,0,0,1,0,0|3,0,0]=4 5275 B12R1.28 CC1CCCC(C1)NCCCO 003be4dfb0e904d82659a38ac28e386c [0,0,0,1,0,0|3,0,0]=4 5276 B12R1.28 CC1CCCC(C1)NCCCS 3a71250a82385b9b4c9e9c6add29b1be [0,0,0,1,0,0|3,0,0]=4 5277 B12R1.28 CC1CCCC(C1)OCCCF 20e022334b9b6ccec250424539c6cd93 [0,0,0,1,0,0|3,0,0]=4 5278 B12R1.28 CC1CCCC(C1)OCCCS 7b17b7a7363647c5288cb61412321a2c [0,0,0,1,0,0|3,0,0]=4 5279 B12R1.28 CC1CCCN(C1)CCCCF 80e47f4642361cdcec44f60627cc5558 [0,0,0,1,0,0|3,0,0]=4 5280 B12R1.28 CC1CCCN(C1)CCCCO c4cf21606d352459ef7631ac4a30fd34 [0,0,0,1,0,0|3,0,0]=4 5281 B12R1.28 CCC#CCN1CCCC(C1)O ee97c2f460c0d8074a7cc2852f70f051 [0,0,0,1,0,0|1,0,2]=4 5282 B12R1.28 CCC#CCN1CCC[C@@H](C1)O 842f2b66433f4ff9986bb699ab666264 [0,0,0,1,0,0|1,0,2]=4 5283 B12R1.28 CCC#CCN1CCC[C@H](C1)O b27b70f021bbc327a3dc0844d8b9be74 [0,0,0,1,0,0|1,0,2]=4 5284 B12R1.28 CCCCCN1CC=CC(C1)O 1d371ec20e7dcbdb29c750d7a985c3be [0,0,0,1,0,0|1,0,2]=4 5285 B12R1.28 CCCCCN1CCCC(=O)C1 e51b80ae756b9d9a19691a7d6d1a8d18 [0,0,0,1,0,0|1,0,2]=4 5286 B12R1.28 CCCCCN1CCCC(C1)C 034f0cd52228eec702f5e1d9f623a1ef [0,0,0,1,0,0|2,0,0]=3 5287 B12R1.28 CCCCCN1CCCC(C1)F 95daa1d12b5e70e90491d35187de563c [0,0,0,1,0,0|2,0,0]=3 5288 B12R1.28 CCCCCN1CCCC(C1)O 1876bd10a5663e3bfdca99bc671b3252 [0,0,0,1,0,0|1,0,0]=2 5289 B12R1.28 CCCCCN1CCC[C@@H](C1)C 748529eff5dbd297229860a5cd284402 [0,0,0,1,0,0|2,0,0]=3 5290 B12R1.28 CCCCCN1CCC[C@@H](C1)F 52d07b950d4ca3d133dc3dfd9703a426 [0,0,0,1,0,0|2,0,0]=3 5291 B12R1.28 CCCCCN1CCC[C@@H](C1)O fb299ef9f9162060bc153e2c9986ef09 [0,0,0,1,0,0|1,0,0]=2 5292 B12R1.28 CCCCCN1CCC[C@H](C1)C e0efc0c4adf89ae05e7382cc40619fda [0,0,0,1,0,0|2,0,0]=3 5293 B12R1.28 CCCCCN1CCC[C@H](C1)F 46ed7e196d35184d9786b35c1f7aea02 [0,0,0,1,0,0|2,0,0]=3 5294 B12R1.28 CCCCCN1CCC[C@H](C1)O b1046e9617b96b0692b9b8ea5fcb0300 [0,0,0,1,0,0|1,0,0]=2 5295 B12R1.28 CCCCCN1CCOC(C1)C 4ecd69bb000c834e56ba307546834cd1 [0,0,0,1,0,0|3,0,0]=4 5296 B12R1.28 CCCCCN1CCO[C@@H](C1)C 68a74185893e69f4e06294c47d35cf9b [0,0,0,1,0,0|3,0,0]=4 5297 B12R1.28 CCCCCN1CCO[C@H](C1)C 50294a7df960ad60adb1bbd378d7a0a7 [0,0,0,1,0,0|3,0,0]=4 5298 B12R1.28 CCCCNC1CCCC(=O)C1 b3434e6ae01328abe266df8a438d00a0 [0,0,0,1,0,0|1,0,2]=4 5299 B12R1.28 CCCCNC1CCCC(C1)C c3aedfc52b7c98688fa5c97a57bbb255 [0,0,0,1,0,0|2,0,0]=3 5300 B12R1.28 CCCCNC1CCCC(C1)O bf80df5a87af324b4cf9f232830e321a [0,0,0,1,0,0|1,0,0]=2 5301 B12R1.28 CCCCNC1CCCN(C1)C 3437a5443ea8a7cae2f4950d48482ab0 [0,0,0,1,0,0|3,0,0]=4 5302 B12R1.28 CCCCNC1CCOC(C1)C 4ac1521d6c9fb9770d7e99b89c4cbe7a [0,0,0,1,0,0|3,0,0]=4 5303 B12R1.28 CCCCNC1COCC(C1)O 06341c88163648b56c43bbc0d6b474d4 [0,0,0,1,0,0|2,0,0]=3 5304 B12R1.28 CCCCN[C@@H]1CCCN(C1)C 5edb5bbb706d5704c941acacbfa1fea4 [0,0,0,1,0,0|3,0,0]=4 5305 B12R1.28 CCCCN[C@@H]1CCC[C@@H](C1)O b76fd47ab15d04e3c310dfd8cccf123f [0,0,0,1,0,0|1,0,0]=2 5306 B12R1.28 CCCCN[C@@H]1CCC[C@H](C1)C 86f9476a269709af88d77e95af271f8e [0,0,0,1,0,0|2,0,0]=3 5307 B12R1.28 CCCCN[C@@H]1CCC[C@H](C1)O 42193708dc97e2cb6c32c077d41fa169 [0,0,0,1,0,0|1,0,0]=2 5308 B12R1.28 CCCCN[C@@H]1CCO[C@@H](C1)C 731af21179a159266e18b7b7c8612747 [0,0,0,1,0,0|3,0,0]=4 5309 B12R1.28 CCCCN[C@@H]1CCO[C@H](C1)C d8aab47e4e9a02b9ac1e83ef5a3ab90e [0,0,0,1,0,0|3,0,0]=4 5310 B12R1.28 CCCCN[C@@H]1COC[C@@H](C1)O be1bf36dacdaa3ebe928156b12c3cdde [0,0,0,1,0,0|2,0,0]=3 5311 B12R1.28 CCCCN[C@H]1CCCN(C1)C 372efcf6616c04c6a165fe390bb9ce7d [0,0,0,1,0,0|3,0,0]=4 5312 B12R1.28 CCCCN[C@H]1CCC[C@@H](C1)O 0bfac2a7eb181db05c9a3be09c312e48 [0,0,0,1,0,0|1,0,0]=2 5313 B12R1.28 CCCCN[C@H]1CCC[C@H](C1)O ad83f71f977642bea0b7531a1512f1f9 [0,0,0,1,0,0|1,0,0]=2 5314 B12R1.28 CCCCN[C@H]1CCO[C@@H](C1)C ca86d29bcf09b31a52d0dab0e61ca29c [0,0,0,1,0,0|3,0,0]=4 5315 B12R1.28 CCCCN[C@H]1CCO[C@H](C1)C 59f2c7c96ac8fc81c4fa670d412a1f4f [0,0,0,1,0,0|3,0,0]=4 5316 B12R1.28 CCCCN[C@H]1COC[C@H](C1)O 60d35effddf6be5745dbf04489ff5132 [0,0,0,1,0,0|2,0,0]=3 5317 B12R1.28 CCCCOC1C=C(CCC1)C e2e43c0cd4f6374a9c4553e97e99e9d0 [0,0,0,1,0,0|2,0,1]=4 5318 B12R1.28 CCCCOC1CCCC(=O)C1 bf043af5b4aeac8f33e9dc0bf6cd4761 [0,0,0,1,0,0|1,0,2]=4 5319 B12R1.28 CCCCOC1CCCC(C1)C b9f83489f977e221372b6c6bf7587cfc [0,0,0,1,0,0|2,0,0]=3 5320 B12R1.28 CCCCOC1CCCN(C1)C 0fcb7b7a4c0662cccaadb0d08f94d190 [0,0,0,1,0,0|3,0,0]=4 5321 B12R1.28 CCCCOC1CCOC(C1)C e816b9688319e01c017114941493ed3d [0,0,0,1,0,0|3,0,0]=4 5322 B12R1.28 CCCCO[C@@H]1CCCN(C1)C a556df82bb90d685669fad80f750ee40 [0,0,0,1,0,0|3,0,0]=4 5323 B12R1.28 CCCCO[C@@H]1CCC[C@@H](C1)C d4fbe228b58fc307beff06cf6dc06498 [0,0,0,1,0,0|2,0,0]=3 5324 B12R1.28 CCCCO[C@@H]1CCO[C@@H](C1)C 0e3119ce011a9a5071567c53bb3b1566 [0,0,0,1,0,0|3,0,0]=4 5325 B12R1.28 CCCCO[C@@H]1CCO[C@H](C1)C 254d6a854a0c21663d2746d574820602 [0,0,0,1,0,0|3,0,0]=4 5326 B12R1.28 CCCCO[C@H]1CCCN(C1)C 56272b134fe0158d33fe19495130ac86 [0,0,0,1,0,0|3,0,0]=4 5327 B12R1.28 CCCCO[C@H]1CCC[C@@H](C1)C 23f2cd09ac7f074cc53d0e5d8d8cbd3a [0,0,0,1,0,0|2,0,0]=3 5328 B12R1.28 CCCCO[C@H]1CCC[C@H](C1)C 19bcec12f12e2dd0bdff4b0d656516b7 [0,0,0,1,0,0|2,0,0]=3 5329 B12R1.28 CCCCO[C@H]1CCO[C@@H](C1)C 7fa327dedc71205c4171ececcedd0373 [0,0,0,1,0,0|3,0,0]=4 5330 B12R1.28 CCCCO[C@H]1CCO[C@H](C1)C 2401abb87f3bf755e8eb7085143438e3 [0,0,0,1,0,0|3,0,0]=4 5331 B12R1.28 CCCNCC1CCCC(C1)C e8699c4b1293870ad2c7fdbe5acf7dc8 [0,0,0,1,0,0|2,0,0]=3 5332 B12R1.28 CCCNCC1CCCC(C1)O 737ffa8c72ce53f79a04fa75e589ae02 [0,0,0,1,0,0|1,0,0]=2 5333 B12R1.28 CCCNCC1CCCN(C1)C e67bd053f6e2721ed2ecd932cdf97473 [0,0,0,1,0,0|3,0,0]=4 5334 B12R1.28 CCCNC[C@@H]1CCCN(C1)C 2dc9a2df0f2d73a0645c92ffbe424629 [0,0,0,1,0,0|3,0,0]=4 5335 B12R1.28 CCCNC[C@H]1CCCN(C1)C 172f2b235a84a2f7e705064c3b89c4aa [0,0,0,1,0,0|3,0,0]=4 5336 B12R1.28 CCCNC[C@H]1CCC[C@H](C1)O a3a70b14ee52b3579bfb9e1f898f4604 [0,0,0,1,0,0|1,0,0]=2 5337 B12R1.28 CCCOCC1CCCC(=O)C1 c6e6f3ef9305507b0c23e35e7961f245 [0,0,0,1,0,0|1,0,2]=4 5338 B12R1.28 CCCOCC1CCCC(C1)C 4c846832801db50ad0eb719c49bf75f3 [0,0,0,1,0,0|2,0,0]=3 5339 B12R1.28 CCCOCC1CCCN(C1)C e0ceabae64da10a67d733e826d71a534 [0,0,0,1,0,0|3,0,0]=4 5340 B12R1.28 CCCOC[C@@H]1CCCN(C1)C a57ebdb40e2e90e1ab5fd77eb0d171ef [0,0,0,1,0,0|3,0,0]=4 5341 B12R1.28 CCCOC[C@H]1CCCN(C1)C 067ab8d5a03fec9e91965b3836f5ba6d [0,0,0,1,0,0|3,0,0]=4 5342 B12R1.28 CCNCCC1CCCN(C1)C 318619ce72a57bedf05fa9c391d2b8a7 [0,0,0,1,0,0|3,0,0]=4 5343 B12R1.28 CCNCCN1CCCC(C1)C ce5aed5d82d7be2fe8a64f4171d540dd [0,0,0,1,0,0|3,0,0]=4 5344 B12R1.28 CCNCCN1CCCC(C1)O 4edbcadfac823db5d89c54f63000d4ba [0,0,0,1,0,0|2,0,0]=3 5345 B12R1.28 CCNCC[C@@H]1CCCN(C1)C 434763a639a827770f6842504ac985bb [0,0,0,1,0,0|3,0,0]=4 5346 B12R1.28 CCNCC[C@H]1CCCN(C1)C a426657f8f6268ca0eb981e47be0d7a8 [0,0,0,1,0,0|3,0,0]=4 5347 B12R1.28 CCOCCC1CCCN(C1)C 1ee517a8966d4d843f019432756a99f6 [0,0,0,1,0,0|3,0,0]=4 5348 B12R1.28 CCOCCN1CCCC(C1)C f524dcfa9084e4b82867599796d0f1f3 [0,0,0,1,0,0|3,0,0]=4 5349 B12R1.28 CCOCCN1CCCC(C1)F 28dbf294ca1f7d6b86eeaf845de97965 [0,0,0,1,0,0|3,0,0]=4 5350 B12R1.28 CCOCCN1CCCC(C1)O b75a9cad9f58e04b5da0141a5ee09283 [0,0,0,1,0,0|2,0,0]=3 5351 B12R1.28 CCOCCN1CCC[C@@H](C1)C bb627102caac45a49b7b832a7132db6d [0,0,0,1,0,0|3,0,0]=4 5352 B12R1.28 CCOCCN1CCC[C@@H](C1)F d0580f0b6b8fc14182a8f73a2411e66c [0,0,0,1,0,0|3,0,0]=4 5353 B12R1.28 CCOCCN1CCC[C@@H](C1)O 6f38afe51b743e8185d73da32cbd6ca1 [0,0,0,1,0,0|2,0,0]=3 5354 B12R1.28 CCOCCN1CCC[C@H](C1)C 414893bcf88f8638b6531371ff43b4be [0,0,0,1,0,0|3,0,0]=4 5355 B12R1.28 CCOCCN1CCC[C@H](C1)F d53ed9b5e84d3cf90cc2404ce37a3812 [0,0,0,1,0,0|3,0,0]=4 5356 B12R1.28 CCOCCN1CCC[C@H](C1)O e0f21755ae0ee46a5cb212bf8b4efcd1 [0,0,0,1,0,0|2,0,0]=3 5357 B12R1.28 CCOCNC1CCCC(C1)C 2ffc44347ea48fadb4270dd5d4e63dfb [0,0,0,1,0,0|3,0,0]=4 5358 B12R1.28 CCOCNC1CCCC(C1)O fd3c8deb124a0c4f2f4b7636fdc3d7fd [0,0,0,1,0,0|2,0,0]=3 5359 B12R1.28 CCOCNC1COCC(C1)O 4fadff4717f6377177e942aab7ecd5c7 [0,0,0,1,0,0|3,0,0]=4 5360 B12R1.28 CCOCN[C@@H]1CCC[C@@H](C1)O 4b23d26bc04ce36ab311eee653f37224 [0,0,0,1,0,0|2,0,0]=3 5361 B12R1.28 CCOCN[C@@H]1CCC[C@H](C1)C 16cdc6e052594d14d492ee99c5cf9cdd [0,0,0,1,0,0|3,0,0]=4 5362 B12R1.28 CCOCN[C@@H]1CCC[C@H](C1)O 5bdd156e3330578f20768c3688f904f1 [0,0,0,1,0,0|2,0,0]=3 5363 B12R1.28 CCOCN[C@@H]1COC[C@@H](C1)O acfde0d08a912e4de9d7a5cbec6a556a [0,0,0,1,0,0|3,0,0]=4 5364 B12R1.28 CCOCN[C@H]1CCC[C@@H](C1)O e90c760612b048a0bf4e3dc3eb4c246d [0,0,0,1,0,0|2,0,0]=3 5365 B12R1.28 CCOCN[C@H]1CCC[C@H](C1)O 7bbd7cfd17de10abaef2043032aaa27b [0,0,0,1,0,0|2,0,0]=3 5366 B12R1.28 CCOCN[C@H]1COC[C@H](C1)O a86e93de74c0f0fbdfe04716c7c4789a [0,0,0,1,0,0|3,0,0]=4 5367 B12R1.28 CCOCOC1CCCC(C1)C ee2cd31748268ab21c2b3a1d501dd63f [0,0,0,1,0,0|3,0,0]=4 5368 B12R1.28 CCOCO[C@@H]1CCC[C@@H](C1)C 7b3f5548e9a50d705ee24fc89681382b [0,0,0,1,0,0|3,0,0]=4 5369 B12R1.28 CCOCO[C@H]1CCC[C@@H](C1)C 96c73f92628d308d73ea0c91381853ef [0,0,0,1,0,0|3,0,0]=4 5370 B12R1.28 CCOCO[C@H]1CCC[C@H](C1)C 559746bf29dee48d944c3826a24ee6d0 [0,0,0,1,0,0|3,0,0]=4 5371 B12R1.28 CCSCCN1CCCC(C1)C 4ce55036f6c056eae10c58efcdb747f6 [0,0,0,1,0,0|3,0,0]=4 5372 B12R1.28 CCSCCN1CCCC(C1)F 19f9288ffd00d2cac83381c5e66800b2 [0,0,0,1,0,0|3,0,0]=4 5373 B12R1.28 CCSCCN1CCCC(C1)O cb61fcb25848793a76595daf5c53d980 [0,0,0,1,0,0|2,0,0]=3 5374 B12R1.28 CCSCCN1CCC[C@@H](C1)C 7cabdf72ded238590c1ae4ba35627490 [0,0,0,1,0,0|3,0,0]=4 5375 B12R1.28 CCSCCN1CCC[C@@H](C1)F d3725ce7bf361467312b456f50c989df [0,0,0,1,0,0|3,0,0]=4 5376 B12R1.28 CCSCCN1CCC[C@@H](C1)O 4954235af8c35a92a6d95b227d35a804 [0,0,0,1,0,0|2,0,0]=3 5377 B12R1.28 CCSCCN1CCC[C@H](C1)C 33d405e0f558fadcf743220793a31caa [0,0,0,1,0,0|3,0,0]=4 5378 B12R1.28 CCSCCN1CCC[C@H](C1)F c6519d7d93540710a48e36038fdb66ba [0,0,0,1,0,0|3,0,0]=4 5379 B12R1.28 CCSCCN1CCC[C@H](C1)O 2a96da2dd38cc4596b88ff223fd9e960 [0,0,0,1,0,0|2,0,0]=3 5380 B12R1.28 COCCCN1CCCC(C1)C ea3b04d4babd821cb80257e9b0c49f84 [0,0,0,1,0,0|3,0,0]=4 5381 B12R1.28 COCCCN1CCCC(C1)F 80404211ddb204d32bef3e5e368ff233 [0,0,0,1,0,0|3,0,0]=4 5382 B12R1.28 COCCCN1CCCC(C1)O 8b2c348927e69b72d9892d77c19ad74a [0,0,0,1,0,0|2,0,0]=3 5383 B12R1.28 COCCCN1CCC[C@@H](C1)C 07cd47040d0cc435e9ad7c07ff491483 [0,0,0,1,0,0|3,0,0]=4 5384 B12R1.28 COCCCN1CCC[C@@H](C1)F fdf695476804eb06d250f8e57bae1036 [0,0,0,1,0,0|3,0,0]=4 5385 B12R1.28 COCCCN1CCC[C@@H](C1)O fdee2f87e91699d170baa6f31bc82fb4 [0,0,0,1,0,0|2,0,0]=3 5386 B12R1.28 COCCCN1CCC[C@H](C1)C 01b97ed9d99b712b7bb28e9f1c694dcd [0,0,0,1,0,0|3,0,0]=4 5387 B12R1.28 COCCCN1CCC[C@H](C1)F 432e3fcf3dfe47a8257d26ae9e68b7a9 [0,0,0,1,0,0|3,0,0]=4 5388 B12R1.28 COCCCN1CCC[C@H](C1)O 464aa4add52621e16f8592bc3b1654b0 [0,0,0,1,0,0|2,0,0]=3 5389 B12R1.28 COCCNC1CCCC(C1)C 4c993551304be47ef947276766ff9e3a [0,0,0,1,0,0|3,0,0]=4 5390 B12R1.28 COCCNC1CCCC(C1)O 37d875dd1eb4a0abf2c3534b19630007 [0,0,0,1,0,0|2,0,0]=3 5391 B12R1.28 COCCNC1COCC(C1)O bc2c17daeb242a2669718601f2bd2904 [0,0,0,1,0,0|3,0,0]=4 5392 B12R1.28 COCCN[C@@H]1CCC[C@@H](C1)O ed0fb5800cf00e9bc37523f66d72350e [0,0,0,1,0,0|2,0,0]=3 5393 B12R1.28 COCCN[C@@H]1CCC[C@H](C1)C 9d73ced21b4b68fc21c8474fed7d2901 [0,0,0,1,0,0|3,0,0]=4 5394 B12R1.28 COCCN[C@@H]1CCC[C@H](C1)O e6e988566c3337221b6272a7014a52bf [0,0,0,1,0,0|2,0,0]=3 5395 B12R1.28 COCCN[C@@H]1COC[C@@H](C1)O f5a158f43aff9e5ec729e835a858b649 [0,0,0,1,0,0|3,0,0]=4 5396 B12R1.28 COCCN[C@H]1CCC[C@@H](C1)O a691bdd9d5576eb3c13083aff02bebee [0,0,0,1,0,0|2,0,0]=3 5397 B12R1.28 COCCN[C@H]1CCC[C@H](C1)O 564ead8f624ab86839d33d10276433d9 [0,0,0,1,0,0|2,0,0]=3 5398 B12R1.28 COCCN[C@H]1COC[C@H](C1)O fd31d82e3e5d7fa9d246fd71b4d7dc9a [0,0,0,1,0,0|3,0,0]=4 5399 B12R1.28 COCCOC1CCCC(C1)C c1e7b5a3ae57b08051c71a55b64e3085 [0,0,0,1,0,0|3,0,0]=4 5400 B12R1.28 COCCO[C@@H]1CCC[C@@H](C1)C e069d25dad4ff09f5dbb72d07bfb24cb [0,0,0,1,0,0|3,0,0]=4 5401 B12R1.28 COCCO[C@H]1CCC[C@@H](C1)C 1fbd5b7254618f5a0613b002f8f63953 [0,0,0,1,0,0|3,0,0]=4 5402 B12R1.28 COCCO[C@H]1CCC[C@H](C1)C 178990b6fdd00744430ccf8383e122d1 [0,0,0,1,0,0|3,0,0]=4 5403 B12R1.28 COCNCC1CCCC(C1)C bff809e47291c6bb0e20eba2f24885ca [0,0,0,1,0,0|3,0,0]=4 5404 B12R1.28 COCNCC1CCCC(C1)O dccd9ec45fa825b933f7992016f6a6b7 [0,0,0,1,0,0|2,0,0]=3 5405 B12R1.28 COCNC[C@H]1CCC[C@H](C1)O d1a333b083bbef2dbe521eff3295ceaa [0,0,0,1,0,0|2,0,0]=3 5406 B12R1.28 COCOCC1CCCC(C1)C f6d27adc1d9fdf8b642bc2dfde69f164 [0,0,0,1,0,0|3,0,0]=4 5407 B12R1.28 CSCCCN1CCCC(C1)C 8e77277a851cd4ad12539cb09bc70d93 [0,0,0,1,0,0|3,0,0]=4 5408 B12R1.28 CSCCCN1CCCC(C1)F eff2b97e156d6ee40c09b4a21cd525cb [0,0,0,1,0,0|3,0,0]=4 5409 B12R1.28 CSCCCN1CCCC(C1)O d0a9b56fb932afc62296e67dacfc84f5 [0,0,0,1,0,0|2,0,0]=3 5410 B12R1.28 CSCCCN1CCC[C@@H](C1)C d240f9b93d945731cb774a298e3082c9 [0,0,0,1,0,0|3,0,0]=4 5411 B12R1.28 CSCCCN1CCC[C@@H](C1)F 274a8102b8685e25c3fc532f7e0a148e [0,0,0,1,0,0|3,0,0]=4 5412 B12R1.28 CSCCCN1CCC[C@@H](C1)O d8aa7ff01c662af85e3409ce070afab1 [0,0,0,1,0,0|2,0,0]=3 5413 B12R1.28 CSCCCN1CCC[C@H](C1)C 2cea2aa70140d753e072d232cea0aae1 [0,0,0,1,0,0|3,0,0]=4 5414 B12R1.28 CSCCCN1CCC[C@H](C1)F 6f049edc877dea9ef4ae237f6e13ca61 [0,0,0,1,0,0|3,0,0]=4 5415 B12R1.28 CSCCCN1CCC[C@H](C1)O 4de7e40ef50db7c5f017e8c77a2ffbeb [0,0,0,1,0,0|2,0,0]=3 5416 B12R1.28 CSCCNC1CCCC(C1)C 9f133d23289a74aa76b00172b2ab9fea [0,0,0,1,0,0|3,0,0]=4 5417 B12R1.28 CSCCNC1CCCC(C1)O ca559d36044cb8c6f79559dd27a03d8d [0,0,0,1,0,0|2,0,0]=3 5418 B12R1.28 CSCCNC1COCC(C1)O ffbb77d46eef3bb678b95508bdd3e647 [0,0,0,1,0,0|3,0,0]=4 5419 B12R1.28 CSCCN[C@@H]1CCC[C@@H](C1)O d6136f58b2e1ba4c54f39a6e58f739f1 [0,0,0,1,0,0|2,0,0]=3 5420 B12R1.28 CSCCN[C@@H]1CCC[C@H](C1)C a49afaeb8362f443d6a153743402fbeb [0,0,0,1,0,0|3,0,0]=4 5421 B12R1.28 CSCCN[C@@H]1CCC[C@H](C1)O 29394ce6d1008538bcfd2abfb5a35a45 [0,0,0,1,0,0|2,0,0]=3 5422 B12R1.28 CSCCN[C@@H]1COC[C@@H](C1)O 9a7752d4bd35aa230393fdf953b8b71d [0,0,0,1,0,0|3,0,0]=4 5423 B12R1.28 CSCCN[C@H]1CCC[C@@H](C1)O dd7d3471a2acfe8bcf28cf225d918279 [0,0,0,1,0,0|2,0,0]=3 5424 B12R1.28 CSCCN[C@H]1CCC[C@H](C1)O 59489311a3d0bf2d2436451c4bfd818b [0,0,0,1,0,0|2,0,0]=3 5425 B12R1.28 CSCCN[C@H]1COC[C@H](C1)O bc13bb926fd66670cc489b69e9e32fdd [0,0,0,1,0,0|3,0,0]=4 5426 B12R1.28 CSCCOC1CCCC(C1)C 3a5a998eed97ab23685fcedeb50d6a21 [0,0,0,1,0,0|3,0,0]=4 5427 B12R1.28 CSCCO[C@@H]1CCC[C@@H](C1)C 053314813bf239509ea17abbdf6e7add [0,0,0,1,0,0|3,0,0]=4 5428 B12R1.28 CSCCO[C@H]1CCC[C@@H](C1)C 762b90c3f619d909aa923f77f04c1ea1 [0,0,0,1,0,0|3,0,0]=4 5429 B12R1.28 CSCCO[C@H]1CCC[C@H](C1)C d42e1daad32bbb6104e1982adf97aea8 [0,0,0,1,0,0|3,0,0]=4 5430 B12R1.28 CSCNCC1CCCC(C1)C f0eeb1014098e1a3cf6f8836e469b8b3 [0,0,0,1,0,0|3,0,0]=4 5431 B12R1.28 CSCNCC1CCCC(C1)O 1327080bd47db64b95ba1cabf4225f14 [0,0,0,1,0,0|2,0,0]=3 5432 B12R1.28 CSCNC[C@H]1CCC[C@H](C1)O c9fa97108eb310037a31b89143f5fda5 [0,0,0,1,0,0|2,0,0]=3 5433 B12R1.28 CSCOCC1CCCC(C1)C 4b7c9dfb2e4563f332dab0c703203965 [0,0,0,1,0,0|3,0,0]=4 5434 B12R1.28 C[C@@H]1CCCN(C1)CCCCF b8bd51f616deb4a7939fa0d08dd7b8cd [0,0,0,1,0,0|3,0,0]=4 5435 B12R1.28 C[C@@H]1CCCN(C1)CCCCO 920178349f341f96619b8f2d38164dfc [0,0,0,1,0,0|3,0,0]=4 5436 B12R1.28 C[C@@H]1CCC[C@@H](C1)OCCCF 9c53ca013fd210262ca0b94220bb997c [0,0,0,1,0,0|3,0,0]=4 5437 B12R1.28 C[C@@H]1CCC[C@@H](C1)OCCCS 138de1eab0fbea681c2b8f330784c2fc [0,0,0,1,0,0|3,0,0]=4 5438 B12R1.28 C[C@@H]1CCC[C@H](C1)NCCCF d18c37e3c176dada324b5dd50f880a37 [0,0,0,1,0,0|3,0,0]=4 5439 B12R1.28 C[C@@H]1CCC[C@H](C1)NCCCO 52b2cc67a932ceaef7649c4c5b7c1093 [0,0,0,1,0,0|3,0,0]=4 5440 B12R1.28 C[C@@H]1CCC[C@H](C1)NCCCS 30ae16d6bec5a970c67216702c82955a [0,0,0,1,0,0|3,0,0]=4 5441 B12R1.28 C[C@H]1CCCN(C1)CCCCF d9933f9075f6edf42ba7ca59de6a429a [0,0,0,1,0,0|3,0,0]=4 5442 B12R1.28 C[C@H]1CCCN(C1)CCCCO 0f5b2bddd966e84e0f4860fcc94f5459 [0,0,0,1,0,0|3,0,0]=4 5443 B12R1.28 C[C@H]1CCC[C@@H](C1)OCCCF fe174dd25d7be2d228cb280e4f42faa3 [0,0,0,1,0,0|3,0,0]=4 5444 B12R1.28 C[C@H]1CCC[C@@H](C1)OCCCS 2a345a07c92d87b28625f418fd5c2c1b [0,0,0,1,0,0|3,0,0]=4 5445 B12R1.28 C[C@H]1CCC[C@H](C1)OCCCF bed3edf03c5cde5cffb71e670d8f25a6 [0,0,0,1,0,0|3,0,0]=4 5446 B12R1.28 C[C@H]1CCC[C@H](C1)OCCCS 799159c7dac9d80c44d5fd04d90e3dc1 [0,0,0,1,0,0|3,0,0]=4 5447 B12R1.28 FCCCCN1CCCC(C1)F 3d4c6024e40ecf6272a90747f83556a3 [0,0,0,1,0,0|3,0,0]=4 5448 B12R1.28 FCCCCN1CCC[C@@H](C1)F 89e5eedc98b6a95f291f106a3f5feeca [0,0,0,1,0,0|3,0,0]=4 5449 B12R1.28 FCCCCN1CCC[C@H](C1)F 1a39e5e602c3838dbd6422f3e6c284bf [0,0,0,1,0,0|3,0,0]=4 5450 B12R1.28 N#CCCCN1CCCC(C1)O 2bab739e99fa40765e5cd7283d617265 [0,0,0,1,0,0|2,0,1]=4 5451 B12R1.28 N#CCCCN1CCC[C@@H](C1)O 9de5ebaaa5376a4eafde7242835561cd [0,0,0,1,0,0|2,0,1]=4 5452 B12R1.28 N#CCCCN1CCC[C@H](C1)O f8a06eba3b2980d045d5a0776dc1f56f [0,0,0,1,0,0|2,0,1]=4 5453 B12R1.28 N#CCCNC1CCCC(C1)O 1f1e3d6402f3cee1d8b086e366c61a6b [0,0,0,1,0,0|2,0,1]=4 5454 B12R1.28 N#CCCN[C@@H]1CCC[C@@H](C1)O d545d4b7f4f1ef55ff96be744cae0682 [0,0,0,1,0,0|2,0,1]=4 5455 B12R1.28 N#CCCN[C@@H]1CCC[C@H](C1)O 7272904894bdcddf6e87987cc46aee7b [0,0,0,1,0,0|2,0,1]=4 5456 B12R1.28 N#CCCN[C@H]1CCC[C@@H](C1)O 3f8b06ecae3870b1fe9a249fe8082893 [0,0,0,1,0,0|2,0,1]=4 5457 B12R1.28 N#CCCN[C@H]1CCC[C@H](C1)O 25ec391db4b2c49e2f124744de4a5ff4 [0,0,0,1,0,0|2,0,1]=4 5458 B12R1.28 N#CCNCC1CCCC(C1)O 9756ae17a0fc2e3c4ee41fa0e5e325a7 [0,0,0,1,0,0|2,0,1]=4 5459 B12R1.28 N#CCNC[C@H]1CCC[C@H](C1)O ce91e08c3fab03add6a59c98d1864bfe [0,0,0,1,0,0|2,0,1]=4 5460 B12R1.28 O=CCCCN1CCCC(C1)O 183b77583fa990c847bc4299f1f64f46 [0,0,0,1,0,0|2,0,1]=4 5461 B12R1.28 O=CCCCN1CCC[C@@H](C1)O 9f953720ac056950e2cd4bea06f9c690 [0,0,0,1,0,0|2,0,1]=4 5462 B12R1.28 O=CCCCN1CCC[C@H](C1)O be61daefd1f4ac55a7f241dbcf28b46d [0,0,0,1,0,0|2,0,1]=4 5463 B12R1.28 O=CCCNC1CCCC(C1)O 5437faee92481a51de08b1129d4a1657 [0,0,0,1,0,0|2,0,1]=4 5464 B12R1.28 O=CCCN[C@@H]1CCC[C@@H](C1)O c4a5afb48f4be427ec434a6d04ac6d37 [0,0,0,1,0,0|2,0,1]=4 5465 B12R1.28 O=CCCN[C@@H]1CCC[C@H](C1)O 51da8828f15b9f0e8085f5a7ef57163d [0,0,0,1,0,0|2,0,1]=4 5466 B12R1.28 O=CCCN[C@H]1CCC[C@@H](C1)O 21944898cfb07789509cdf0caa311e44 [0,0,0,1,0,0|2,0,1]=4 5467 B12R1.28 O=CCCN[C@H]1CCC[C@H](C1)O c5edcf8bdaf817f268baefa3b4e119be [0,0,0,1,0,0|2,0,1]=4 5468 B12R1.28 O=CCNCC1CCCC(C1)O 812ecf9f6bee537b1b73c4a782a3098d [0,0,0,1,0,0|2,0,1]=4 5469 B12R1.28 O=CCNC[C@H]1CCC[C@H](C1)O 74cf77e33f18da5509a12e8daa76d5ba [0,0,0,1,0,0|2,0,1]=4 5470 B12R1.28 OC1CCCC(C1)CNCCF 0b06c7d21a80d3e77020925e2595cd8d [0,0,0,1,0,0|2,0,0]=3 5471 B12R1.28 OC1CCCC(C1)CNCCS 5c2e34a01664149c4ae09faec34b9168 [0,0,0,1,0,0|2,0,0]=3 5472 B12R1.28 OC1CCCC(C1)NCCCF ea866f705d7594c2d66a35c8adb02643 [0,0,0,1,0,0|2,0,0]=3 5473 B12R1.28 OC1CCCC(C1)NCCCS b1e510351dca9f403b74710c3648c496 [0,0,0,1,0,0|2,0,0]=3 5474 B12R1.28 OC1CCCN(C1)CCCCF a80d4020e5e5d19d0b9301ee22bd9975 [0,0,0,1,0,0|2,0,0]=3 5475 B12R1.28 OC1CCCN(C1)CCNCF 419c8e9523c2f32a6be9debebaa6a8ee [0,0,0,1,0,0|3,0,0]=4 5476 B12R1.28 OC1COCC(C1)NCCCF f83bb73dce96995af5e975dd4a204f8a [0,0,0,1,0,0|3,0,0]=4 5477 B12R1.28 OC1COCC(C1)NCCCS 228495490857c0bef495b2edb22dfdcc [0,0,0,1,0,0|3,0,0]=4 5478 B12R1.28 OCCCCN1CCCC(C1)F b6b507842c1c94d1bc5ffadefa6ca547 [0,0,0,1,0,0|3,0,0]=4 5479 B12R1.28 OCCCCN1CCCC(C1)O 479902a2eb1944f9fab9f8bf0ace4c5e [0,0,0,1,0,0|2,0,0]=3 5480 B12R1.28 OCCCCN1CCC[C@@H](C1)F 97944fb7115f5428fe6815797cf1aa8f [0,0,0,1,0,0|3,0,0]=4 5481 B12R1.28 OCCCCN1CCC[C@@H](C1)O fa8742aac9088f600d053f7d3a26e744 [0,0,0,1,0,0|2,0,0]=3 5482 B12R1.28 OCCCCN1CCC[C@H](C1)F 26b0f61dba9782bd869a974a7a752d9e [0,0,0,1,0,0|3,0,0]=4 5483 B12R1.28 OCCCCN1CCC[C@H](C1)O 92015a34ca873b0d85bf36ad7676b4a8 [0,0,0,1,0,0|2,0,0]=3 5484 B12R1.28 OCCCNC1CCCC(C1)O 9c6897bf3a628579865915306417e33e [0,0,0,1,0,0|2,0,0]=3 5485 B12R1.28 OCCCNC1COCC(C1)O fd8086a3da44654e9558918c092de8b3 [0,0,0,1,0,0|3,0,0]=4 5486 B12R1.28 OCCCN[C@@H]1CCC[C@@H](C1)O 763b5bcc6091af394d58e8e03cf0fd7d [0,0,0,1,0,0|2,0,0]=3 5487 B12R1.28 OCCCN[C@@H]1CCC[C@H](C1)O 4d428558dfa6d67281973f20892eecc8 [0,0,0,1,0,0|2,0,0]=3 5488 B12R1.28 OCCCN[C@@H]1COC[C@@H](C1)O 39194934dbb56d59db6d17f5bb20145b [0,0,0,1,0,0|3,0,0]=4 5489 B12R1.28 OCCCN[C@H]1CCC[C@@H](C1)O c0d25e82e595ef1c066b78636d539172 [0,0,0,1,0,0|2,0,0]=3 5490 B12R1.28 OCCCN[C@H]1CCC[C@H](C1)O c1a5c3fb4df3115d5169f59557cfd37b [0,0,0,1,0,0|2,0,0]=3 5491 B12R1.28 OCCCN[C@H]1COC[C@H](C1)O 2c8885ce6c4f758551435926d02b7592 [0,0,0,1,0,0|3,0,0]=4 5492 B12R1.28 OCCNCC1CCCC(C1)O aecc2146af837b5a7b8652300d64dee2 [0,0,0,1,0,0|2,0,0]=3 5493 B12R1.28 OCCNC[C@H]1CCC[C@H](C1)O 43ab920efeed51d0a46aaab9e4a39e8d [0,0,0,1,0,0|2,0,0]=3 5494 B12R1.28 OCNCCN1CCCC(C1)O ea28b5b1a5419a6b179ee2c34857c75d [0,0,0,1,0,0|3,0,0]=4 5495 B12R1.28 O[C@@H]1CCCN(C1)CCCCF e804c6832b9c70c7c69cdba9c997d9ae [0,0,0,1,0,0|2,0,0]=3 5496 B12R1.28 O[C@@H]1CCC[C@@H](C1)CNCCF bc6a053bc4f4e59a5049285c8aca0549 [0,0,0,1,0,0|2,0,0]=3 5497 B12R1.28 O[C@@H]1CCC[C@@H](C1)CNCCS 84e699869ec44fef2c1b0f0317d06269 [0,0,0,1,0,0|2,0,0]=3 5498 B12R1.28 O[C@@H]1CCC[C@@H](C1)NCCCF 979bef6a06f9b58d0ac248b289b0cfa0 [0,0,0,1,0,0|2,0,0]=3 5499 B12R1.28 O[C@@H]1CCC[C@@H](C1)NCCCS f1a8814bba7eb192a2d4a566b629ae25 [0,0,0,1,0,0|2,0,0]=3 5500 B12R1.28 O[C@@H]1CCC[C@H](C1)NCCCF d43f46498c97d39f9fd91325109e9bea [0,0,0,1,0,0|2,0,0]=3 5501 B12R1.28 O[C@@H]1CCC[C@H](C1)NCCCS fe481237dd1f026b588149834765243f [0,0,0,1,0,0|2,0,0]=3 5502 B12R1.28 O[C@@H]1COC[C@@H](C1)NCCCF 6cb7b2f4143c6417686a8b4af77c50fd [0,0,0,1,0,0|3,0,0]=4 5503 B12R1.28 O[C@@H]1COC[C@@H](C1)NCCCS 8ade5efc10867589a73f241506bd5b6f [0,0,0,1,0,0|3,0,0]=4 5504 B12R1.28 O[C@H]1CCCN(C1)CCCCF 05463e166e4b0887945836698537d083 [0,0,0,1,0,0|2,0,0]=3 5505 B12R1.28 O[C@H]1CCC[C@@H](C1)NCCCF 5e533092b81855224094c3630a683e3d [0,0,0,1,0,0|2,0,0]=3 5506 B12R1.28 O[C@H]1CCC[C@@H](C1)NCCCS bcd243fdcc4213b7c44807e9f6098193 [0,0,0,1,0,0|2,0,0]=3 5507 B12R1.28 O[C@H]1CCC[C@H](C1)NCCCF 9f6c98e6ebc9fe65d0342052f5ecc6a7 [0,0,0,1,0,0|2,0,0]=3 5508 B12R1.28 O[C@H]1CCC[C@H](C1)NCCCS 95cea27d58246968a03becf98456c906 [0,0,0,1,0,0|2,0,0]=3 5509 B12R1.28 O[C@H]1COC[C@H](C1)NCCCF 0bb106615815146aaa97c8d660502740 [0,0,0,1,0,0|3,0,0]=4 5510 B12R1.28 O[C@H]1COC[C@H](C1)NCCCS 04248eee68c03b2e4cae88e4c1df17ac [0,0,0,1,0,0|3,0,0]=4 5511 B12R1.62 C#CCCCCCN1CC(C1)O 421873ccf0fb4994553efa068e888d15 [0,0,0,1,0,0|1,0,2]=4 5512 B12R1.62 C#CCCCCNC1CC(C1)O b274b5c70b7d42c3eecf65baee315fc0 [0,0,0,1,0,0|1,0,2]=4 5513 B12R1.62 C#CCCCCN[C@H]1C[C@@H](C1)O 72014e6069a178209b9cbf9e34e514d6 [0,0,0,1,0,0|1,0,2]=4 5514 B12R1.62 C#CCCCCN[C@H]1C[C@H](C1)O 89913613a1ae1a12922acc1b88bdd640 [0,0,0,1,0,0|1,0,2]=4 5515 B12R1.62 C#CCCCNCC1CC(C1)O e29d3ab32559dc53c2b31863cc37d1d6 [0,0,0,1,0,0|1,0,2]=4 5516 B12R1.62 C#CCCCNC[C@H]1C[C@@H](C1)O 4e5f0270edaed637c8834612739b46e5 [0,0,0,1,0,0|1,0,2]=4 5517 B12R1.62 C#CCCCNC[C@H]1C[C@H](C1)O 4b30e26d64494e10f1c63bcc869b9def [0,0,0,1,0,0|1,0,2]=4 5518 B12R1.62 C/C=C\CCCNC1CC(C1)O 672ee4cef705c7352f1919f4ac499455 [0,0,0,1,0,0|1,0,2]=4 5519 B12R1.62 C/C=C\CCCN[C@H]1C[C@@H](C1)O c48a76d68d6731ff05a6712d10256062 [0,0,0,1,0,0|1,0,2]=4 5520 B12R1.62 C/C=C\CCCN[C@H]1C[C@H](C1)O d24ab6e8ad8f5f7695b95ab0e9cfebb5 [0,0,0,1,0,0|1,0,2]=4 5521 B12R1.62 C=C1CC(C1)CNCCCCC 5a65f02a93ec2b599aa1c90b6e3f56b0 [0,0,0,1,0,0|2,0,1]=4 5522 B12R1.62 C=C1CC(C1)COCCCCC 21e0abcf2b2d18d2dc1bcf4287d1e63c [0,0,0,1,0,0|2,0,1]=4 5523 B12R1.62 C=CCCCCCN1CC(C1)O c2bb73c909dda68716de8058d8749b87 [0,0,0,1,0,0|1,0,2]=4 5524 B12R1.62 C=CCCCCNC1CC(C1)O 7a39769386666298b7304de3cdb1e92f [0,0,0,1,0,0|1,0,2]=4 5525 B12R1.62 C=CCCCCN[C@H]1C[C@@H](C1)O 7e5b36779d9459ed40317f80cd6ec2f3 [0,0,0,1,0,0|1,0,2]=4 5526 B12R1.62 C=CCCCCN[C@H]1C[C@H](C1)O 388e7cbc3e8866468376b2cd7d69e88c [0,0,0,1,0,0|1,0,2]=4 5527 B12R1.62 C=CCCCNCC1CC(C1)O 42ee61e85778a093f7ef09cad2ec8ef7 [0,0,0,1,0,0|1,0,2]=4 5528 B12R1.62 C=CCCCNC[C@H]1C[C@@H](C1)O b73e7b638c39af9c360ceb505960acd7 [0,0,0,1,0,0|1,0,2]=4 5529 B12R1.62 C=CCCCNC[C@H]1C[C@H](C1)O f09a33a4ba0f1a615bf0e86d32029861 [0,0,0,1,0,0|1,0,2]=4 5530 B12R1.62 CC/C=C/CNCC1CC(C1)O 23e6010d182787e082c4c05af57fea2a [0,0,0,1,0,0|1,0,2]=4 5531 B12R1.62 CC/C=C/CNC[C@H]1C[C@@H](C1)O 10106c3410613f63c6f3d7530e8e71d3 [0,0,0,1,0,0|1,0,2]=4 5532 B12R1.62 CC/C=C/CNC[C@H]1C[C@H](C1)O f2e3406186b5ba00c42fd70c63b4f9c5 [0,0,0,1,0,0|1,0,2]=4 5533 B12R1.62 CC/C=C\CCNC1CC(C1)O 221db60fae27cfe58c0f8bcf3dd3cb5d [0,0,0,1,0,0|1,0,2]=4 5534 B12R1.62 CC/C=C\CCN[C@H]1C[C@@H](C1)O 3f9953d0254a64da2e077d0ea054ed03 [0,0,0,1,0,0|1,0,2]=4 5535 B12R1.62 CC/C=C\CCN[C@H]1C[C@H](C1)O 83f76abe0e6cbbb0d460b4a901a4b0cb [0,0,0,1,0,0|1,0,2]=4 5536 B12R1.62 CC1CC(C1)CNCCCCCl 739705ca5a09542fb8f4d18d1b908ab1 [0,0,0,1,0,0|3,0,0]=4 5537 B12R1.62 CC1CC(C1)CNCCCCO 61f3261e2142913987b520afc40271f2 [0,0,0,1,0,0|3,0,0]=4 5538 B12R1.62 CC1CC(C1)CNCCCCS 550c12fe9720ade9c08ca27170edf129 [0,0,0,1,0,0|3,0,0]=4 5539 B12R1.62 CC1CC(C1)COCCCCF 93e2289b0e201d53deb7065e09354532 [0,0,0,1,0,0|3,0,0]=4 5540 B12R1.62 CC1CC(C1)COCCCCS e3fffd30ebd09c386d8fd1095cedf602 [0,0,0,1,0,0|3,0,0]=4 5541 B12R1.62 CC1CC(C1)OCCCCCF 3959368730b2b7311c1f7de01a72bcd3 [0,0,0,1,0,0|3,0,0]=4 5542 B12R1.62 CCC#CCNCC1CC(C1)O e8af1f4aed18496427210eda2f24309e [0,0,0,1,0,0|1,0,2]=4 5543 B12R1.62 CCC#CCNC[C@H]1C[C@@H](C1)O f254e3df997dc527ed59672a233805cf [0,0,0,1,0,0|1,0,2]=4 5544 B12R1.62 CCC#CCNC[C@H]1C[C@H](C1)O 475098556c663f8afced3ec75679f58c [0,0,0,1,0,0|1,0,2]=4 5545 B12R1.62 CCC/C=C/CNC1CC(C1)O dd223889217a7088239eba6f1b8c70fa [0,0,0,1,0,0|1,0,2]=4 5546 B12R1.62 CCC/C=C/CN[C@H]1C[C@@H](C1)O 04b1b48db757adde458d4ca0e51e2b6c [0,0,0,1,0,0|1,0,2]=4 5547 B12R1.62 CCC/C=C/CN[C@H]1C[C@H](C1)O 4ccde37c5e680afa44dd199ad1ba9491 [0,0,0,1,0,0|1,0,2]=4 5548 B12R1.62 CCC/C=C\CNC1CC(C1)O 0ec0763295bd24fc82c324856a14ee1d [0,0,0,1,0,0|1,0,2]=4 5549 B12R1.62 CCC/C=C\CN[C@H]1C[C@@H](C1)O f86b099ef03b28ae486d14248effe39a [0,0,0,1,0,0|1,0,2]=4 5550 B12R1.62 CCC/C=C\CN[C@H]1C[C@H](C1)O 0a27e0e6dcecc43972756f6a95ceb94a [0,0,0,1,0,0|1,0,2]=4 5551 B12R1.62 CCCC/C=C/CN1CC(C1)O 079e23dc9e5ee3da478f44b6a23d015a [0,0,0,1,0,0|1,0,2]=4 5552 B12R1.62 CCCC/C=C\CN1CC(C1)O 9087a06568d7b825ef85cd2d53ed769f [0,0,0,1,0,0|1,0,2]=4 5553 B12R1.62 CCCCCCCN1CC(C1)F d440965ec0980a102cd980d029eda2f7 [0,0,0,1,0,0|2,0,0]=3 5554 B12R1.62 CCCCCCCN1CC(C1)O 21208d961ce63cf50b736570900e0b5e [0,0,0,1,0,0|1,0,0]=2 5555 B12R1.62 CCCCCCNC1CC(=O)C1 ac882c5c8b97d937da8427593ea8dda2 [0,0,0,1,0,0|1,0,2]=4 5556 B12R1.62 CCCCCCNC1CC(C1)F 948864e95d2d7dbd57086faa5b10eb28 [0,0,0,1,0,0|2,0,0]=3 5557 B12R1.62 CCCCCCNC1CC(C1)O cced06f111028f76c0680e5f6d3f8640 [0,0,0,1,0,0|1,0,0]=2 5558 B12R1.62 CCCCCCNC1CN(C1)C cdad42433648e9b20e6399c6946052cb [0,0,0,1,0,0|3,0,0]=4 5559 B12R1.62 CCCCCCN[C@H]1C[C@@H](C1)F d64f60bdb2d9226ab5c97fed27d1730d [0,0,0,1,0,0|2,0,0]=3 5560 B12R1.62 CCCCCCN[C@H]1C[C@@H](C1)O 5308d9d5ef557a784a3ecee549a5cc12 [0,0,0,1,0,0|1,0,0]=2 5561 B12R1.62 CCCCCCN[C@H]1C[C@H](C1)F 4867703b0cbbf857fb92b3ffce4b0f18 [0,0,0,1,0,0|2,0,0]=3 5562 B12R1.62 CCCCCCN[C@H]1C[C@H](C1)O 61f7a9d85e87910535bc756c554af22e [0,0,0,1,0,0|1,0,0]=2 5563 B12R1.62 CCCCCCOC1CC(=O)C1 2cd7f90bbace9d85b6a2d2d1bb700c2c [0,0,0,1,0,0|1,0,2]=4 5564 B12R1.62 CCCCCCOC1CC(C1)C e966a836f2b197cf8ad713c9b339774b [0,0,0,1,0,0|2,0,0]=3 5565 B12R1.62 CCCCCCOC1CC(C1)F a21f5c403da3ff53dd3d788acb7af405 [0,0,0,1,0,0|2,0,0]=3 5566 B12R1.62 CCCCCCOC1CN(C1)C 276e4d99f6a8265dd5ea79e1ca7e4105 [0,0,0,1,0,0|3,0,0]=4 5567 B12R1.62 CCCCCCO[C@H]1C[C@@H](C1)F 16b205ba039d7e5a8ad9c6350c636437 [0,0,0,1,0,0|2,0,0]=3 5568 B12R1.62 CCCCCCO[C@H]1C[C@H](C1)F 679fe3e629c6d177ad2133ba0a328540 [0,0,0,1,0,0|2,0,0]=3 5569 B12R1.62 CCCCCNCC1CC(=O)C1 aa4bb3cf22a9bb2bcf82c4f43ac6b6c0 [0,0,0,1,0,0|1,0,2]=4 5570 B12R1.62 CCCCCNCC1CC(=O)O1 ff6d6a187e16761c4d1a91e2c6c1bcde [0,0,0,1,0,0|2,0,1]=4 5571 B12R1.62 CCCCCNCC1CC(C1)C 6a2615bcd028474fc14f0f1db1edc828 [0,0,0,1,0,0|2,0,0]=3 5572 B12R1.62 CCCCCNCC1CC(C1)O 1ac7f908f0586508c4eaf7247b828925 [0,0,0,1,0,0|1,0,0]=2 5573 B12R1.62 CCCCCNCC1CN(C1)C 40b72a91984bc2ca9674f1ca10a97c5c [0,0,0,1,0,0|3,0,0]=4 5574 B12R1.62 CCCCCNC[C@H]1C[C@@H](C1)O c5028ccc62811fcafbd4e0026bb2203b [0,0,0,1,0,0|1,0,0]=2 5575 B12R1.62 CCCCCNC[C@H]1C[C@H](C1)F 97cd170b57570abdb81b0a71795fb76e [0,0,0,1,0,0|2,0,0]=3 5576 B12R1.62 CCCCCNC[C@H]1C[C@H](C1)O db0495d67160823d6213f78b7c977a76 [0,0,0,1,0,0|1,0,0]=2 5577 B12R1.62 CCCCCOCC1CC(=O)C1 ae46d75230b4b94a7655de6648f931e6 [0,0,0,1,0,0|1,0,2]=4 5578 B12R1.62 CCCCCOCC1CC(=O)O1 afd83f8ec1447a38903a8d2b07eff09e [0,0,0,1,0,0|2,0,1]=4 5579 B12R1.62 CCCCCOCC1CC(C1)C 3a6cb5d1c209f45d6f8e668c6d74dd74 [0,0,0,1,0,0|2,0,0]=3 5580 B12R1.62 CCCCCOCC1CC(C1)F aa42d5b4a2e86b960a478d277d07f200 [0,0,0,1,0,0|2,0,0]=3 5581 B12R1.62 CCCCCOCC1CN(C1)C e6d1106ff6005fa2d822a7d401f534ab [0,0,0,1,0,0|3,0,0]=4 5582 B12R1.62 CCCCCOC[C@H]1C[C@@H](C1)C 951995e3402497a979761cd93473d99d [0,0,0,1,0,0|2,0,0]=3 5583 B12R1.62 CCCCCOC[C@H]1C[C@H](C1)F 87495590a9be23167c1dea9fe45bee68 [0,0,0,1,0,0|2,0,0]=3 5584 B12R1.62 CCCCNCCC1CN(C1)C 7b793d0e5a77c89229a5dbcd191af26b [0,0,0,1,0,0|3,0,0]=4 5585 B12R1.62 CCCCNCCN1CC(C1)F 57d250ec98c4688ff0e7191619fb5445 [0,0,0,1,0,0|3,0,0]=4 5586 B12R1.62 CCCCNCCN1CC(C1)O 05fb94a5948a1e9ebc4d234c58a657c7 [0,0,0,1,0,0|2,0,0]=3 5587 B12R1.62 CCCCOCCC1CN(C1)C 76f4f6276acf99370b9822b18c34ecc5 [0,0,0,1,0,0|3,0,0]=4 5588 B12R1.62 CCCCOCCN1CC(C1)F 7c7fc7195ba119d7da8e169bd33467b2 [0,0,0,1,0,0|3,0,0]=4 5589 B12R1.62 CCCCOCCN1CC(C1)O 46a1be271401f4fc161dde323af3666a [0,0,0,1,0,0|2,0,0]=3 5590 B12R1.62 CCCCOCNC1CC(C1)F a01526bd106a4a418c50be35dfc56ffc [0,0,0,1,0,0|3,0,0]=4 5591 B12R1.62 CCCCOCNC1CC(C1)O 290cd8822a6d605b659ae6ff1b4ce875 [0,0,0,1,0,0|2,0,0]=3 5592 B12R1.62 CCCCOCN[C@H]1C[C@@H](C1)F 0fd705d62b7b04171af3ae47301d78de [0,0,0,1,0,0|3,0,0]=4 5593 B12R1.62 CCCCOCN[C@H]1C[C@@H](C1)O 1e3add8f675d816164dac70f67ccdff0 [0,0,0,1,0,0|2,0,0]=3 5594 B12R1.62 CCCCOCN[C@H]1C[C@H](C1)F e061478be492be119a29859a7964a347 [0,0,0,1,0,0|3,0,0]=4 5595 B12R1.62 CCCCOCN[C@H]1C[C@H](C1)O 6a7e4e0f41250199b24393ad381d6d96 [0,0,0,1,0,0|2,0,0]=3 5596 B12R1.62 CCCCOCOC1CC(C1)C 8853c092a97ef52303488fabc3048927 [0,0,0,1,0,0|3,0,0]=4 5597 B12R1.62 CCCCOCOC1CC(C1)F 0d537e9af0c4eacb41603522c14e7868 [0,0,0,1,0,0|3,0,0]=4 5598 B12R1.62 CCCCOCO[C@H]1C[C@@H](C1)F 15611b3d763bf66733c13fade003c6ad [0,0,0,1,0,0|3,0,0]=4 5599 B12R1.62 CCCCOCO[C@H]1C[C@H](C1)F 6f39e106b19d98918320c6d35692bd7e [0,0,0,1,0,0|3,0,0]=4 5600 B12R1.62 CCCNCCCN1CC(C1)O efb1ed80dd4a0cfc82eced37477b05ff [0,0,0,1,0,0|2,0,0]=3 5601 B12R1.62 CCCOCCCN1CC(C1)F 9ab1b5bd2950734bc96203e9adf831e0 [0,0,0,1,0,0|3,0,0]=4 5602 B12R1.62 CCCOCCCN1CC(C1)O 3eda5ddac09774eb04a318c304fc0258 [0,0,0,1,0,0|2,0,0]=3 5603 B12R1.62 CCCOCCNC1CC(C1)F b1bbb92bee4e10a58ddcec83d18d7f64 [0,0,0,1,0,0|3,0,0]=4 5604 B12R1.62 CCCOCCNC1CC(C1)O e0861c81189aea18ee80e07160136817 [0,0,0,1,0,0|2,0,0]=3 5605 B12R1.62 CCCOCCN[C@H]1C[C@@H](C1)F fa4ef0dd9b20fd039afd362e7fbc80cd [0,0,0,1,0,0|3,0,0]=4 5606 B12R1.62 CCCOCCN[C@H]1C[C@@H](C1)O 3c14543f3cd87a4186cb9bb4ecc6baa4 [0,0,0,1,0,0|2,0,0]=3 5607 B12R1.62 CCCOCCN[C@H]1C[C@H](C1)F 4d34104e85cae742c38f567806ecf3c1 [0,0,0,1,0,0|3,0,0]=4 5608 B12R1.62 CCCOCCN[C@H]1C[C@H](C1)O e2a9b20932519a822fdc6b34e43d2624 [0,0,0,1,0,0|2,0,0]=3 5609 B12R1.62 CCCOCCOC1CC(C1)C 68014652fdddae818f966e40cffb81ee [0,0,0,1,0,0|3,0,0]=4 5610 B12R1.62 CCCOCCOC1CC(C1)F ef11e03c7fa46604c9e6832937b560a7 [0,0,0,1,0,0|3,0,0]=4 5611 B12R1.62 CCCOCCO[C@H]1C[C@@H](C1)F 9067e07896b1e8b39988fc270860d7a6 [0,0,0,1,0,0|3,0,0]=4 5612 B12R1.62 CCCOCCO[C@H]1C[C@H](C1)F 34ce9bc2175b5fd97093ca0eecba69eb [0,0,0,1,0,0|3,0,0]=4 5613 B12R1.62 CCOCCCNC1CC(C1)F 3d4212276aad8efd417c244e78b06a66 [0,0,0,1,0,0|3,0,0]=4 5614 B12R1.62 CCOCCCNC1CC(C1)O 87ef646678a687b6a3546742faf9ea56 [0,0,0,1,0,0|2,0,0]=3 5615 B12R1.62 CCOCCCN[C@H]1C[C@@H](C1)F 143224378cb5049e74e30ab746a7835f [0,0,0,1,0,0|3,0,0]=4 5616 B12R1.62 CCOCCCN[C@H]1C[C@@H](C1)O 7155dad1b468f9cd24c7fd6eae1cef25 [0,0,0,1,0,0|2,0,0]=3 5617 B12R1.62 CCOCCCN[C@H]1C[C@H](C1)F 7f2d6601f519953716b4c76bb7125232 [0,0,0,1,0,0|3,0,0]=4 5618 B12R1.62 CCOCCCN[C@H]1C[C@H](C1)O 4b2f000a479146ceded352ca1fc360e1 [0,0,0,1,0,0|2,0,0]=3 5619 B12R1.62 CCOCCCOC1CC(C1)C 0afd17c6297a61f7ce2429b0592943a8 [0,0,0,1,0,0|3,0,0]=4 5620 B12R1.62 CCOCCCOC1CC(C1)F ac02edf7ee32b428eecbc1099573ce32 [0,0,0,1,0,0|3,0,0]=4 5621 B12R1.62 CCOCCCO[C@H]1C[C@@H](C1)F 7fabe2ddb1eeaa816b5f0c7a454c4ebf [0,0,0,1,0,0|3,0,0]=4 5622 B12R1.62 CCOCCCO[C@H]1C[C@H](C1)F f5d35e116ba6f7c4251d071fb21d3ea1 [0,0,0,1,0,0|3,0,0]=4 5623 B12R1.62 CCOCCNCC1CC(C1)C 8d32da713c755d5a7b552fc6ab4d4a58 [0,0,0,1,0,0|3,0,0]=4 5624 B12R1.62 CCOCCNCC1CC(C1)O 8b44588d1e9d878edef61e4be6c25c58 [0,0,0,1,0,0|2,0,0]=3 5625 B12R1.62 CCOCCNC[C@H]1C[C@@H](C1)O 016b3b3ccb0a662b0542a1d54dbd6a4c [0,0,0,1,0,0|2,0,0]=3 5626 B12R1.62 CCOCCNC[C@H]1C[C@H](C1)F facec3f21a77960335e2b831a8da3b81 [0,0,0,1,0,0|3,0,0]=4 5627 B12R1.62 CCOCCNC[C@H]1C[C@H](C1)O 552398ba715b849e9e7a68ab3cfb3149 [0,0,0,1,0,0|2,0,0]=3 5628 B12R1.62 CCOCCOCC1CC(C1)C 4fde8d35d0e7942e8e88dfbe9c014de3 [0,0,0,1,0,0|3,0,0]=4 5629 B12R1.62 CCOCCOCC1CC(C1)F e36f1b1d748dc864b6294eb9af418612 [0,0,0,1,0,0|3,0,0]=4 5630 B12R1.62 CCOCCOC[C@H]1C[C@@H](C1)C 68293d015c33f6c53da3a6cb57a806e4 [0,0,0,1,0,0|3,0,0]=4 5631 B12R1.62 CCOCCOC[C@H]1C[C@H](C1)F 3566e5d839eb9b91844c392fc9533742 [0,0,0,1,0,0|3,0,0]=4 5632 B12R1.62 CCOCNCCN1CC(C1)O a6eb3b171c189c46cb15394eb9edfd74 [0,0,0,1,0,0|3,0,0]=4 5633 B12R1.62 CCSCCCNC1CC(C1)F 887fb850529a35807b9de76476b705a4 [0,0,0,1,0,0|3,0,0]=4 5634 B12R1.62 CCSCCCNC1CC(C1)O f05d8d35c89da4851ecb4f8838043ea9 [0,0,0,1,0,0|2,0,0]=3 5635 B12R1.62 CCSCCCN[C@H]1C[C@@H](C1)F c24ef2cbf9bf65b672d95de4fad2bf0e [0,0,0,1,0,0|3,0,0]=4 5636 B12R1.62 CCSCCCN[C@H]1C[C@@H](C1)O 00a073b4f4a8d4e9b281c344d43cd14c [0,0,0,1,0,0|2,0,0]=3 5637 B12R1.62 CCSCCCN[C@H]1C[C@H](C1)F 4625993f1aef75454a98e70faef15b44 [0,0,0,1,0,0|3,0,0]=4 5638 B12R1.62 CCSCCCN[C@H]1C[C@H](C1)O bfdf533196d81784ea139c135f3b1ac6 [0,0,0,1,0,0|2,0,0]=3 5639 B12R1.62 CCSCCCOC1CC(C1)C a539028e4c250e0b12ae292edd424456 [0,0,0,1,0,0|3,0,0]=4 5640 B12R1.62 CCSCCCOC1CC(C1)F 2157c0d5482bdfec93bc50ef77508bb8 [0,0,0,1,0,0|3,0,0]=4 5641 B12R1.62 CCSCCCO[C@H]1C[C@@H](C1)F 1ad5ee8b4ef6d38dfaa88a3d807dcbff [0,0,0,1,0,0|3,0,0]=4 5642 B12R1.62 CCSCCCO[C@H]1C[C@H](C1)F 8317d0842a0f9f24e27d52a13771bb99 [0,0,0,1,0,0|3,0,0]=4 5643 B12R1.62 CCSCCNCC1CC(C1)C 44fd49aa5c629f21b1745d83c0dc1efd [0,0,0,1,0,0|3,0,0]=4 5644 B12R1.62 CCSCCNCC1CC(C1)O cd98d2df30fb7dd7db746ad761b029db [0,0,0,1,0,0|2,0,0]=3 5645 B12R1.62 CCSCCNC[C@H]1C[C@@H](C1)O 89e2dc7a5849c1bcd54b71623a7473ef [0,0,0,1,0,0|2,0,0]=3 5646 B12R1.62 CCSCCNC[C@H]1C[C@H](C1)F aac679efb7fa8e19d0f021d6b8a9e333 [0,0,0,1,0,0|3,0,0]=4 5647 B12R1.62 CCSCCNC[C@H]1C[C@H](C1)O 92cff8941a0ef834583e18ecaa51ba48 [0,0,0,1,0,0|2,0,0]=3 5648 B12R1.62 CCSCCOCC1CC(C1)C a0fc16531d23779ec6a81ff078c6d7c1 [0,0,0,1,0,0|3,0,0]=4 5649 B12R1.62 CCSCCOCC1CC(C1)F ae6d68c6287c97f26b444ef962f18e2e [0,0,0,1,0,0|3,0,0]=4 5650 B12R1.62 CCSCCOC[C@H]1C[C@@H](C1)C 16c020ce7bbe95bdac006b4c1bfe8518 [0,0,0,1,0,0|3,0,0]=4 5651 B12R1.62 CCSCCOC[C@H]1C[C@H](C1)F e7cb10971caabbe7baf4f0b55636524f [0,0,0,1,0,0|3,0,0]=4 5652 B12R1.62 COCCCCCN1CC(C1)F 092ea4c1bf512d4a9c9293c84f64ba78 [0,0,0,1,0,0|3,0,0]=4 5653 B12R1.62 COCCCCCN1CC(C1)O ecbaaba3c9953477fa567045df6dc943 [0,0,0,1,0,0|2,0,0]=3 5654 B12R1.62 COCCCCNC1CC(C1)F 279c330d3a8156b2523e946bfc22eb4e [0,0,0,1,0,0|3,0,0]=4 5655 B12R1.62 COCCCCNC1CC(C1)O b725a797dfd01e8d3ff2bb852f3fac73 [0,0,0,1,0,0|2,0,0]=3 5656 B12R1.62 COCCCCN[C@H]1C[C@@H](C1)F 1a964a65e394d4b4985421770f0cf1a3 [0,0,0,1,0,0|3,0,0]=4 5657 B12R1.62 COCCCCN[C@H]1C[C@@H](C1)O 9543ccbf62d33f2a6fee352c755f1646 [0,0,0,1,0,0|2,0,0]=3 5658 B12R1.62 COCCCCN[C@H]1C[C@H](C1)F 687fb3b7c6df125ddc857a15def87780 [0,0,0,1,0,0|3,0,0]=4 5659 B12R1.62 COCCCCN[C@H]1C[C@H](C1)O 58b516333b267648c6f369472daf45ea [0,0,0,1,0,0|2,0,0]=3 5660 B12R1.62 COCCCCOC1CC(C1)C e6d30c45d7e04c7fa24e8ee72dae3a75 [0,0,0,1,0,0|3,0,0]=4 5661 B12R1.62 COCCCCOC1CC(C1)F 57c40fcc44eb7c932a2b6605791096b4 [0,0,0,1,0,0|3,0,0]=4 5662 B12R1.62 COCCCCO[C@H]1C[C@@H](C1)F 7325a9ae84c67347ec8d2912d7a79f2b [0,0,0,1,0,0|3,0,0]=4 5663 B12R1.62 COCCCCO[C@H]1C[C@H](C1)F 265acb89af6165f864de2cf8ae3a3c66 [0,0,0,1,0,0|3,0,0]=4 5664 B12R1.62 COCCCNCC1CC(C1)C 92565ab61d4a93a29e75b63482f82878 [0,0,0,1,0,0|3,0,0]=4 5665 B12R1.62 COCCCNCC1CC(C1)O 3363a8b797534288156675015f0f81c0 [0,0,0,1,0,0|2,0,0]=3 5666 B12R1.62 COCCCNC[C@H]1C[C@@H](C1)O 151fa4fc0e509a22ed6b69005f4ff114 [0,0,0,1,0,0|2,0,0]=3 5667 B12R1.62 COCCCNC[C@H]1C[C@H](C1)F 4ed3498e0180ae70d054c2aa7222613d [0,0,0,1,0,0|3,0,0]=4 5668 B12R1.62 COCCCNC[C@H]1C[C@H](C1)O 2c995f016424632b1ec2517d1ef868a0 [0,0,0,1,0,0|2,0,0]=3 5669 B12R1.62 COCCCOCC1CC(C1)C 7afc70a0c1afa310980a2f92a4798cf8 [0,0,0,1,0,0|3,0,0]=4 5670 B12R1.62 COCCCOCC1CC(C1)F ceda1dac6e4349aded10cc3160ccda29 [0,0,0,1,0,0|3,0,0]=4 5671 B12R1.62 COCCCOC[C@H]1C[C@@H](C1)C 0d0dd979f19bbbdd806c4c16d1e27a34 [0,0,0,1,0,0|3,0,0]=4 5672 B12R1.62 COCCCOC[C@H]1C[C@H](C1)F 4055ee1fd62e2124bcf6f784f8e5e13a [0,0,0,1,0,0|3,0,0]=4 5673 B12R1.62 COCCNCCN1CC(C1)O 656eea70a17567760476ce6446c916ae [0,0,0,1,0,0|3,0,0]=4 5674 B12R1.62 COCCOCCN1CC(C1)O 060b976e66d2aa1bd6f2f2e92f7840ec [0,0,0,1,0,0|3,0,0]=4 5675 B12R1.62 COCCOCNC1CC(C1)O 1167c83943feb6d56ca70ab102dd7579 [0,0,0,1,0,0|3,0,0]=4 5676 B12R1.62 COCCOCN[C@H]1C[C@@H](C1)O 6c3c93d6ede72b48958ef2409cd5f613 [0,0,0,1,0,0|3,0,0]=4 5677 B12R1.62 COCCOCN[C@H]1C[C@H](C1)O 08c26748dc40a1970988f905d3845ce5 [0,0,0,1,0,0|3,0,0]=4 5678 B12R1.62 COCNCCCN1CC(C1)O 648c04df3cd870d66b7c309a7f98b20a [0,0,0,1,0,0|3,0,0]=4 5679 B12R1.62 COCOCCNC1CC(C1)O fc80cf926788910603635355b78b7c40 [0,0,0,1,0,0|3,0,0]=4 5680 B12R1.62 COCOCCN[C@H]1C[C@@H](C1)O d8b56929fc6443206ce606e3529d475a [0,0,0,1,0,0|3,0,0]=4 5681 B12R1.62 COCOCCN[C@H]1C[C@H](C1)O 76007b3790c52b36acd962ef8c6c7a32 [0,0,0,1,0,0|3,0,0]=4 5682 B12R1.62 CSCCCCNC1CC(C1)O 6f94a04a6a2426d66976ad0748a1b360 [0,0,0,1,0,0|2,0,0]=3 5683 B12R1.62 CSCCCNCC1CC(C1)C ade9b9d02775ba401a2f2557b0aff781 [0,0,0,1,0,0|3,0,0]=4 5684 B12R1.62 CSCCCNCC1CC(C1)O 3ae9bb6d09c028db582f9b1a70216a3d [0,0,0,1,0,0|2,0,0]=3 5685 B12R1.62 CSCCCNC[C@H]1C[C@@H](C1)O f4c174b2d244e51d1f7435d330609031 [0,0,0,1,0,0|2,0,0]=3 5686 B12R1.62 CSCCCNC[C@H]1C[C@H](C1)F f6ceeab898297a35b88be9752d4ce379 [0,0,0,1,0,0|3,0,0]=4 5687 B12R1.62 CSCCCNC[C@H]1C[C@H](C1)O d547c30cab719a8a35bf16ddf61dfde1 [0,0,0,1,0,0|2,0,0]=3 5688 B12R1.62 CSCCCOCC1CC(C1)C ee2f228ee2082971f27e3a76b5b5cf22 [0,0,0,1,0,0|3,0,0]=4 5689 B12R1.62 CSCCCOCC1CC(C1)F 23e8717e1a9d4b85e10cbafe71a4821d [0,0,0,1,0,0|3,0,0]=4 5690 B12R1.62 CSCCCOC[C@H]1C[C@@H](C1)C bc37f86d7002b412dff5450fd8f6712c [0,0,0,1,0,0|3,0,0]=4 5691 B12R1.62 CSCCCOC[C@H]1C[C@H](C1)F 40a5d2535ebf7e13d5da813d7f50a776 [0,0,0,1,0,0|3,0,0]=4 5692 B12R1.62 CSCCNCCN1CC(C1)O 8040c3746b30c0fdf7a69d9acc3ef59f [0,0,0,1,0,0|3,0,0]=4 5693 B12R1.62 CSCNCCCN1CC(C1)O e58dccf5d277ba6f36abafe66f7d2bb1 [0,0,0,1,0,0|3,0,0]=4 5694 B12R1.62 C[C@H]1C[C@@H](C1)COCCCCF db1696333564b1dffc4626ded17dc688 [0,0,0,1,0,0|3,0,0]=4 5695 B12R1.62 FCCCCCCN1CC(C1)F 27380e4e7557fed6f1ae051dd8163c01 [0,0,0,1,0,0|3,0,0]=4 5696 B12R1.62 FCCCCCNC1CC(C1)F f746ee978a0883d17376e06e98e502bd [0,0,0,1,0,0|3,0,0]=4 5697 B12R1.62 FCCCCCN[C@H]1C[C@@H](C1)F 44a6198d827049b92b9ebe32d443de56 [0,0,0,1,0,0|3,0,0]=4 5698 B12R1.62 FCCCCCN[C@H]1C[C@H](C1)F f89b97218f062344d28b1087acf8507d [0,0,0,1,0,0|3,0,0]=4 5699 B12R1.62 FCCCCCOC1CC(C1)F d83ca1cae486e49a71e6550273d5f669 [0,0,0,1,0,0|3,0,0]=4 5700 B12R1.62 FCCCCCO[C@H]1C[C@@H](C1)F ead9c8e8041636fb16cc10bb63c5cd43 [0,0,0,1,0,0|3,0,0]=4 5701 B12R1.62 FCCCCCO[C@H]1C[C@H](C1)F 2ac404d4ee2003b6c0edfb8dbefbf59d [0,0,0,1,0,0|3,0,0]=4 5702 B12R1.62 FCCCCOCC1CC(C1)F f001d365ae867db402152aace35f6495 [0,0,0,1,0,0|3,0,0]=4 5703 B12R1.62 FCCCCOC[C@H]1C[C@H](C1)F 269b67d68899abf9b52a2e00aed00a21 [0,0,0,1,0,0|3,0,0]=4 5704 B12R1.62 F[C@H]1C[C@H](C1)CNCCCCCl 7435bacbc51a04feda0062938886d2af [0,0,0,1,0,0|3,0,0]=4 5705 B12R1.62 F[C@H]1C[C@H](C1)CNCCCCS 14365c01c6fdd86149fb1326e3628670 [0,0,0,1,0,0|3,0,0]=4 5706 B12R1.62 F[C@H]1C[C@H](C1)COCCCCS 376ccb38d255128ffaca9bff4e49bebf [0,0,0,1,0,0|3,0,0]=4 5707 B12R1.62 N#CCCCCCN1CC(C1)O 75486ce203623178f7bdb760ce579a2d [0,0,0,1,0,0|2,0,1]=4 5708 B12R1.62 N#CCCCCNC1CC(C1)O a28e59655fc1cc00587e58ca113591e6 [0,0,0,1,0,0|2,0,1]=4 5709 B12R1.62 N#CCCCCN[C@H]1C[C@@H](C1)O ee50ba67fa7282a06764b21a1dde965f [0,0,0,1,0,0|2,0,1]=4 5710 B12R1.62 N#CCCCCN[C@H]1C[C@H](C1)O 5e7a29a1fedf19ecbfc72db998ed181b [0,0,0,1,0,0|2,0,1]=4 5711 B12R1.62 N#CCCCNCC1CC(C1)O 207accab655e3b0f199127e3d5e329f6 [0,0,0,1,0,0|2,0,1]=4 5712 B12R1.62 N#CCCCNC[C@H]1C[C@@H](C1)O b865e28814128abe1ea35846ba253032 [0,0,0,1,0,0|2,0,1]=4 5713 B12R1.62 N#CCCCNC[C@H]1C[C@H](C1)O 3adf4465b45a329394a93835ff12bd2a [0,0,0,1,0,0|2,0,1]=4 5714 B12R1.62 NOCCCCNC1CC(C1)O ca70bf93b464a987d1a206a7e11a12d7 [0,0,0,1,0,0|3,0,0]=4 5715 B12R1.62 NOCCCCN[C@H]1C[C@@H](C1)O 76c1ed7622aa532bd7962bb31c8d07b5 [0,0,0,1,0,0|3,0,0]=4 5716 B12R1.62 NOCCCCN[C@H]1C[C@H](C1)O 776b4c6298cd9660c5ee44a1960f09a7 [0,0,0,1,0,0|3,0,0]=4 5717 B12R1.62 O=CCCCCCN1CC(C1)O 45ba441f37057857c452078d84d4dcba [0,0,0,1,0,0|2,0,1]=4 5718 B12R1.62 O=CCCCCNC1CC(C1)O 4e6e3052f0f36a2460062b7c08cec3d2 [0,0,0,1,0,0|2,0,1]=4 5719 B12R1.62 O=CCCCCN[C@H]1C[C@@H](C1)O 47dea53de857700bad218add359e400b [0,0,0,1,0,0|2,0,1]=4 5720 B12R1.62 O=CCCCCN[C@H]1C[C@H](C1)O cda8258df784f56a8389e9bf3d667564 [0,0,0,1,0,0|2,0,1]=4 5721 B12R1.62 O=CCCCNCC1CC(C1)O 7bca7b05be6c8289145337635d082d6e [0,0,0,1,0,0|2,0,1]=4 5722 B12R1.62 O=CCCCNC[C@H]1C[C@@H](C1)O de148dff22d2edea5363829208437dc5 [0,0,0,1,0,0|2,0,1]=4 5723 B12R1.62 O=CCCCNC[C@H]1C[C@H](C1)O 3f4b2d8b3b37ba9cb0e55006260442b0 [0,0,0,1,0,0|2,0,1]=4 5724 B12R1.62 OC1CC(C1)CNCCCCCl fa228fb55ea00f1ffe1cfe8171f751f1 [0,0,0,1,0,0|2,0,0]=3 5725 B12R1.62 OC1CC(C1)CNCCCCF 808560467a594fcbace595f6ff05e89e [0,0,0,1,0,0|2,0,0]=3 5726 B12R1.62 OC1CC(C1)CNCCCCS 13649c3da535095f1258277af971967b [0,0,0,1,0,0|2,0,0]=3 5727 B12R1.62 OC1CC(C1)NCCCCCCl cb644ae09ffb6bc975a39bdb6c3cae7a [0,0,0,1,0,0|2,0,0]=3 5728 B12R1.62 OC1CC(C1)NCCCCCF ef314c868f3fb8b01c8eefef785b1d15 [0,0,0,1,0,0|2,0,0]=3 5729 B12R1.62 OC1CC(C1)NCCOCCS 0194833f2a6a8e30d4d7e843c93faebf [0,0,0,1,0,0|3,0,0]=4 5730 B12R1.62 OC1CN(C1)CCCCCCF 60d8f969dbabb543e9fd46718e1d5751 [0,0,0,1,0,0|2,0,0]=3 5731 B12R1.62 OC1CN(C1)CCCNCCF 82bb4a3b4b6986152a19c8b57ba937d5 [0,0,0,1,0,0|3,0,0]=4 5732 B12R1.62 OC1CN(C1)CCCNCCS 0193665345385ddde6d147ae191ccb3a [0,0,0,1,0,0|3,0,0]=4 5733 B12R1.62 OC1CN(C1)CCNCCCF 885e4c61afd4f2cb863dc6e94fc987ea [0,0,0,1,0,0|3,0,0]=4 5734 B12R1.62 OC1CN(C1)CCNCCCS 6b1470c15d3fda8da63b6ba0a9509b9f [0,0,0,1,0,0|3,0,0]=4 5735 B12R1.62 OCCCCCCN1CC(C1)F da0807994f1c0cbce578b711137c4796 [0,0,0,1,0,0|3,0,0]=4 5736 B12R1.62 OCCCCCCN1CC(C1)O 0b8b845cc37eb1d373f41e3fdeb00401 [0,0,0,1,0,0|2,0,0]=3 5737 B12R1.62 OCCCCCNC1CC(C1)F 73df7c243c165514e6e3753c2c2d585c [0,0,0,1,0,0|3,0,0]=4 5738 B12R1.62 OCCCCCNC1CC(C1)O 810f14c46e878f74b48fd6efbe74343a [0,0,0,1,0,0|2,0,0]=3 5739 B12R1.62 OCCCCCN[C@H]1C[C@@H](C1)F 06b3278b701aa8d316112edbbcb5d02a [0,0,0,1,0,0|3,0,0]=4 5740 B12R1.62 OCCCCCN[C@H]1C[C@@H](C1)O 2f01467d622dc74f42370301589d1b47 [0,0,0,1,0,0|2,0,0]=3 5741 B12R1.62 OCCCCCN[C@H]1C[C@H](C1)F 43417789c5dd18e0d9cbb4e36d36ad16 [0,0,0,1,0,0|3,0,0]=4 5742 B12R1.62 OCCCCCN[C@H]1C[C@H](C1)O 453cb75ab742955f2867f4f6ae9e8c7a [0,0,0,1,0,0|2,0,0]=3 5743 B12R1.62 OCCCCNCC1CC(C1)O cd5306393a886b64eaea243a0e4d4fdb [0,0,0,1,0,0|2,0,0]=3 5744 B12R1.62 OCCCCNC[C@H]1C[C@@H](C1)O 56085f2c9ea76770af1f3ae50eb7af71 [0,0,0,1,0,0|2,0,0]=3 5745 B12R1.62 OCCCCNC[C@H]1C[C@H](C1)F 55e476dacef7be4d5a7afc639edbb0fd [0,0,0,1,0,0|3,0,0]=4 5746 B12R1.62 OCCCCNC[C@H]1C[C@H](C1)O 7b4fecabea2e58a6bc66a51b8a951975 [0,0,0,1,0,0|2,0,0]=3 5747 B12R1.62 OCCCNCCN1CC(C1)O e58b424a1003bc0036569691219d9bc6 [0,0,0,1,0,0|3,0,0]=4 5748 B12R1.62 OCCNCCCN1CC(C1)O adb73594cab0ce9d6a416be926d28d32 [0,0,0,1,0,0|3,0,0]=4 5749 B12R1.62 OCCOCCNC1CC(C1)O a9ed5dd23a1d0f1c0e5200acc203e2d7 [0,0,0,1,0,0|3,0,0]=4 5750 B12R1.62 OCCOCCN[C@H]1C[C@@H](C1)O dd266234bd64d22f7a62b9a6cbb10cda [0,0,0,1,0,0|3,0,0]=4 5751 B12R1.62 OCCOCCN[C@H]1C[C@H](C1)O 1601762d103dc43ba5c15a14e3bdcf92 [0,0,0,1,0,0|3,0,0]=4 5752 B12R1.62 OCCSCCNC1CC(C1)O 1f6d8879f537ad084f4c7575a6f8fd4f [0,0,0,1,0,0|3,0,0]=4 5753 B12R1.62 O[C@H]1C[C@@H](C1)CNCCCCF 6edd0313ff88a6263ceaf7fcd503e2e2 [0,0,0,1,0,0|2,0,0]=3 5754 B12R1.62 O[C@H]1C[C@@H](C1)NCCCCCF 2f2627feef7961983d3595e06f0d98d2 [0,0,0,1,0,0|2,0,0]=3 5755 B12R1.62 O[C@H]1C[C@H](C1)CNCCCCF 448e445bc14855cfd56437cd64a0738b [0,0,0,1,0,0|2,0,0]=3 5756 B12R1.62 O[C@H]1C[C@H](C1)NCCCCCF 43a604744e6eb1d5b68e258e3051c2e1 [0,0,0,1,0,0|2,0,0]=3 5757 B12R1.75 C#CC1CCCCN1CC(C)O ea608c9c5ed2c142cc711ff613dfdf4b [0,0,0,1,0,0|1,0,2]=4 5758 B12R1.75 C#CC1CCCCN1C[C@@H](C)O 67efae16b647367f16e2cec7657254c9 [0,0,0,1,0,0|1,0,2]=4 5759 B12R1.75 C#CC1CCCCN1C[C@H](C)O 308fcccd82ed6b808875d2d851a1dac6 [0,0,0,1,0,0|1,0,2]=4 5760 B12R1.75 C=C(C)CN1CCCCC1CC 96d148ee007527d140c183edbcb0be16 [0,0,0,1,0,0|2,0,1]=4 5761 B12R1.75 C=C(C)CN1CCCC[C@@H]1CC c265d55fc22dc66e7f65a47d579722e7 [0,0,0,1,0,0|2,0,1]=4 5762 B12R1.75 C=C(C)CN1CCCC[C@H]1CC 99c40e27f542b4af530dc64a4b57ed12 [0,0,0,1,0,0|2,0,1]=4 5763 B12R1.75 CC(C)CN1CCCCC1CO 1fad9e0a9b7312ec6dfb7c587aafb501 [0,0,0,1,0,0|3,0,0]=4 5764 B12R1.75 CC(C)CN1CCCC[C@@H]1CO 80dc6fccd609ae60648fe5ec17b76b20 [0,0,0,1,0,0|3,0,0]=4 5765 B12R1.75 CC(C)CN1CCCC[C@H]1CO d26752a74f8e5a5bcf5f987c5dab6b4e [0,0,0,1,0,0|3,0,0]=4 5766 B12R1.75 CC(C)N[C@@H]1CCCC[C@@H]1CO 4f47661157cc18b8784843639abe84e2 [0,0,0,1,0,0|3,0,0]=4 5767 B12R1.75 CC(C)N[C@@H]1CCCC[C@H]1CO afbc0ea00e9a154dbfe8bc557e153842 [0,0,0,1,0,0|3,0,0]=4 5768 B12R1.75 CC(C)N[C@H]1CCCC[C@H]1CO 3e89c263e7a5732d32469321e8045e99 [0,0,0,1,0,0|3,0,0]=4 5769 B12R1.75 CC(O)CN1CCCCC1C#N 678dd8e5c3a3a47c4e444e8ef8e244cb [0,0,0,1,0,0|2,0,1]=4 5770 B12R1.75 CC(O)CN1CCCCC1C=O af5cafc677b7c818227ec5ec261ab058 [0,0,0,1,0,0|2,0,1]=4 5771 B12R1.75 CC(O)CN1CCCCC1CO 720a5d039209f329e263d79df5615c43 [0,0,0,1,0,0|2,0,0]=3 5772 B12R1.75 CC(O)CN1CCCC[C@@H]1C#N 6048b0fa0dae1ec9a455d08fbf9efdc9 [0,0,0,1,0,0|2,0,1]=4 5773 B12R1.75 CC(O)CN1CCCC[C@@H]1CO d208932682dd1d10010fc1a920a7f2ff [0,0,0,1,0,0|2,0,0]=3 5774 B12R1.75 CC(O)CN1CCCC[C@H]1C#N 72e12bb2eac197791e604953c6550e2f [0,0,0,1,0,0|2,0,1]=4 5775 B12R1.75 CC(O)CN1CCCC[C@H]1CO 0d52b4eaba16f2b0f28c12fce34fe46f [0,0,0,1,0,0|2,0,0]=3 5776 B12R1.75 CC(O)CN1CCOCC1CO bce308e4c82b515bd025e926e91c0993 [0,0,0,1,0,0|3,0,0]=4 5777 B12R1.75 CC(O)CN1CCOC[C@@H]1CO 987f14a0a203219f8270d8d9f5fc027b [0,0,0,1,0,0|3,0,0]=4 5778 B12R1.75 CC(O)CN1CCOC[C@H]1CO ea11a72d694269a8e71c0ace8cac0833 [0,0,0,1,0,0|3,0,0]=4 5779 B12R1.75 CCC1CCCCC1OC(C)C 08d3f30dc6b4e35c223e3a1fb1010b2a [0,0,0,1,0,0|2,0,0]=3 5780 B12R1.75 CCC1CCCCN1CC(=O)O 927c1ccdc3bc10095f1cfa6f4f5ae3e1 [0,0,0,1,0,0|2,0,1]=4 5781 B12R1.75 CCC1CCCCN1CC(C)C de343d6547aa76d66397cfb2b085b5f4 [0,0,0,1,0,0|2,0,0]=3 5782 B12R1.75 CCC1CCCCN1CC(C)O 910693e156ae677676e1232e551852c8 [0,0,0,1,0,0|1,0,0]=2 5783 B12R1.75 CCC1CCCCN1CC(F)F 25259d11baaeda553c137a71baa0800a [0,0,0,1,0,0|3,0,0]=4 5784 B12R1.75 CCC1CCCCN1CN(C)C 7195646c94f8103134a6a6f80d572689 [0,0,0,1,0,0|3,0,0]=4 5785 B12R1.75 CCC1CCCCN1C[C@@H](C)O 0ed3d06f1d9af2b98bb3e364c1e3afb6 [0,0,0,1,0,0|1,0,0]=2 5786 B12R1.75 CCC1CCCCN1C[C@H](C)O feed4c0a18502f3cffa305cb83c043a0 [0,0,0,1,0,0|1,0,0]=2 5787 B12R1.75 CCC1COCCC1NC(C)C 8e59d9cff3dbaecb572655d3005980ea [0,0,0,1,0,0|3,0,0]=4 5788 B12R1.75 CCC1COCCN1CC(C)C 740b67a2bf4e0b5d53f42c367af383ba [0,0,0,1,0,0|3,0,0]=4 5789 B12R1.75 CCC1COCCN1CC(C)O f4f7a303e68507c79ff4269a39efee05 [0,0,0,1,0,0|2,0,0]=3 5790 B12R1.75 CCC1COCCN1C[C@@H](C)O 3e35efedf9d5638046d60370701dc7c4 [0,0,0,1,0,0|2,0,0]=3 5791 B12R1.75 CCC1COCCN1C[C@H](C)O a8fd1b8823f0f45463a0318d082c6132 [0,0,0,1,0,0|2,0,0]=3 5792 B12R1.75 CCN1CCCCC1CC(=O)O c3002eeca6985d258459f1a392e0c8f3 [0,0,0,1,0,0|2,0,1]=4 5793 B12R1.75 CCN1CCCCC1CN(C)C e94bbe4920e5ad9a58561ed4f25104f7 [0,0,0,1,0,0|3,0,0]=4 5794 B12R1.75 CCN1CCCC[C@H]1CC(=O)O 22529d59a874477d2e853ae063f37cd0 [0,0,0,1,0,0|2,0,1]=4 5795 B12R1.75 CCN1CCOCC1CC(C)C 8d39046873d89b148e52f07e186e08e8 [0,0,0,1,0,0|3,0,0]=4 5796 B12R1.75 CCN1CCOC[C@@H]1CC(C)C 0bf71588b7833d199f1db6bc29b93b6c [0,0,0,1,0,0|3,0,0]=4 5797 B12R1.75 CCN1CCOC[C@H]1CC(C)C a7a26dc758ad04779cd65b9006fe917b [0,0,0,1,0,0|3,0,0]=4 5798 B12R1.75 CC[C@@H]1CCCCN1CC(=O)O 3af3611fb81c94d9cdc25441a542c595 [0,0,0,1,0,0|2,0,1]=4 5799 B12R1.75 CC[C@@H]1CCCCN1CC(C)C 15fcde66d26311eaa7d6c3209691ecc8 [0,0,0,1,0,0|2,0,0]=3 5800 B12R1.75 CC[C@@H]1CCCCN1CC(C)O b5835df13ad9d9e85850e7dcb1162db7 [0,0,0,1,0,0|1,0,0]=2 5801 B12R1.75 CC[C@@H]1CCCCN1CC(F)F d9b4069d4d7fecfa7d4ca6fa4664cee8 [0,0,0,1,0,0|3,0,0]=4 5802 B12R1.75 CC[C@@H]1CCCCN1CN(C)C e55b06ccb18f5f966303726cb94f3b9c [0,0,0,1,0,0|3,0,0]=4 5803 B12R1.75 CC[C@@H]1CCCCN1C[C@@H](C)O 17d440d3e2fbe78b2e88074f2b2c2b92 [0,0,0,1,0,0|1,0,0]=2 5804 B12R1.75 CC[C@@H]1CCCCN1C[C@H](C)O 01ba6616d957c772e281bb1abe7dd00c [0,0,0,1,0,0|1,0,0]=2 5805 B12R1.75 CC[C@@H]1COCCN1CC(C)C f6c1b04041279bee74fcd3386eda9c85 [0,0,0,1,0,0|3,0,0]=4 5806 B12R1.75 CC[C@@H]1COCCN1CC(C)O 90f6308a2956babab33cb7cc5986e042 [0,0,0,1,0,0|2,0,0]=3 5807 B12R1.75 CC[C@@H]1COCCN1C[C@@H](C)O 4b0e09a9758637245721c9de0cfe57b4 [0,0,0,1,0,0|2,0,0]=3 5808 B12R1.75 CC[C@@H]1COCCN1C[C@H](C)O d33287f4c9048a00733ab12f431f989c [0,0,0,1,0,0|2,0,0]=3 5809 B12R1.75 CC[C@H]1CCCCN1CC(=O)O d53cd7f8b90743d8db50d82ed6978893 [0,0,0,1,0,0|2,0,1]=4 5810 B12R1.75 CC[C@H]1CCCCN1CC(C)C 745082d64914a30a0d819e1c526efadd [0,0,0,1,0,0|2,0,0]=3 5811 B12R1.75 CC[C@H]1CCCCN1CC(C)O ecb9b00f55561fb9493f32ebd5dd0984 [0,0,0,1,0,0|1,0,0]=2 5812 B12R1.75 CC[C@H]1CCCCN1CC(F)F ca0fdfb73950a0b532034679d90511aa [0,0,0,1,0,0|3,0,0]=4 5813 B12R1.75 CC[C@H]1CCCCN1CN(C)C 65bcaf5168b00b4f7d985f7912198dd1 [0,0,0,1,0,0|3,0,0]=4 5814 B12R1.75 CC[C@H]1CCCCN1C[C@@H](C)O f7f6d10834db6ef1c04716b77ec96649 [0,0,0,1,0,0|1,0,0]=2 5815 B12R1.75 CC[C@H]1CCCCN1C[C@H](C)O c4294037b1e877830bd27718de73f630 [0,0,0,1,0,0|1,0,0]=2 5816 B12R1.75 CC[C@H]1COCCN1CC(C)C 288ecf3583c1410db8b552ddab7f87e1 [0,0,0,1,0,0|3,0,0]=4 5817 B12R1.75 CC[C@H]1COCCN1CC(C)O 937d3aead879dfdc25f5972d89cb4d8e [0,0,0,1,0,0|2,0,0]=3 5818 B12R1.75 CC[C@H]1COCCN1C[C@@H](C)O 6c21e455da7321ed2ec575333365b669 [0,0,0,1,0,0|2,0,0]=3 5819 B12R1.75 CC[C@H]1COCCN1C[C@H](C)O c9568eb0e0b0aa1d9540bab1b93ca464 [0,0,0,1,0,0|2,0,0]=3 5820 B12R1.75 COC1CCCCC1NC(C)C 8858d9f1baad3c6ddc998f1c449a2659 [0,0,0,1,0,0|3,0,0]=4 5821 B12R1.75 COC1CCCCC1OC(C)C 430472e7dd6aea6f0c5e0f2cba87a9c9 [0,0,0,1,0,0|3,0,0]=4 5822 B12R1.75 CO[C@H]1CCCC[C@@H]1NC(C)C 2dadfadfd1365a491e2f4f2188ca35d0 [0,0,0,1,0,0|3,0,0]=4 5823 B12R1.75 CS[C@@H]1CCCC[C@H]1OC(C)C 0614a49f7dc8aa01c2618691e2ed955e [0,0,0,1,0,0|3,0,0]=4 5824 B12R1.75 C[C@@H](O)CN1CCCCC1C#N d466732f02c4beecdb61d8605992e0c3 [0,0,0,1,0,0|2,0,1]=4 5825 B12R1.75 C[C@@H](O)CN1CCCCC1C=O afc439aa471042a0d0dcd2c2bc9a0e8a [0,0,0,1,0,0|2,0,1]=4 5826 B12R1.75 C[C@@H](O)CN1CCCCC1CO 7095987f83bfe04e700cbe40a2e9e1ec [0,0,0,1,0,0|2,0,0]=3 5827 B12R1.75 C[C@@H](O)CN1CCCC[C@@H]1C#N 45991300a9794e94a2ba65595ee5fb61 [0,0,0,1,0,0|2,0,1]=4 5828 B12R1.75 C[C@@H](O)CN1CCCC[C@@H]1CO 0166decd7b351a52d4302b7103ceece1 [0,0,0,1,0,0|2,0,0]=3 5829 B12R1.75 C[C@@H](O)CN1CCCC[C@H]1C#N 0d2be0bc6e0662ab72dad14b0ee42625 [0,0,0,1,0,0|2,0,1]=4 5830 B12R1.75 C[C@@H](O)CN1CCCC[C@H]1CO 53e29a62850d8dea5ec0027d8312141c [0,0,0,1,0,0|2,0,0]=3 5831 B12R1.75 C[C@@H](O)CN1CCOCC1CO 0ca2c2a7c3083410de8cfdeb1c4a917e [0,0,0,1,0,0|3,0,0]=4 5832 B12R1.75 C[C@@H](O)CN1CCOC[C@@H]1CO b22812467d499b35b93191bc53cedcaa [0,0,0,1,0,0|3,0,0]=4 5833 B12R1.75 C[C@@H](O)CN1CCOC[C@H]1CO b3a8231e3aacf77e1dc583b6ac78a33a [0,0,0,1,0,0|3,0,0]=4 5834 B12R1.75 C[C@H](O)CN1CCCCC1C#N cfccd8fa5666f83240b9282275bfc969 [0,0,0,1,0,0|2,0,1]=4 5835 B12R1.75 C[C@H](O)CN1CCCCC1C=O b8cb752c7e6d2d96973f423d6f38edff [0,0,0,1,0,0|2,0,1]=4 5836 B12R1.75 C[C@H](O)CN1CCCCC1CO 61122aeb2b136552e94e6ad320c05958 [0,0,0,1,0,0|2,0,0]=3 5837 B12R1.75 C[C@H](O)CN1CCCC[C@@H]1C#N 94694e34d49c9d05bc6907307ed3585e [0,0,0,1,0,0|2,0,1]=4 5838 B12R1.75 C[C@H](O)CN1CCCC[C@@H]1CO 472883e84797d6130486a0db45a1c473 [0,0,0,1,0,0|2,0,0]=3 5839 B12R1.75 C[C@H](O)CN1CCCC[C@H]1C#N 7d7a1d7ab5aa2a1d975055ab53c2a705 [0,0,0,1,0,0|2,0,1]=4 5840 B12R1.75 C[C@H](O)CN1CCCC[C@H]1CO 1b2ffb2be71e9e34f4daa89e37ccae64 [0,0,0,1,0,0|2,0,0]=3 5841 B12R1.75 C[C@H](O)CN1CCOCC1CO 6745ee768f954f401ac450fafebb3e06 [0,0,0,1,0,0|3,0,0]=4 5842 B12R1.75 C[C@H](O)CN1CCOC[C@@H]1CO 32cfe5cddfee49972111ff7bbe71ac24 [0,0,0,1,0,0|3,0,0]=4 5843 B12R1.75 C[C@H](O)CN1CCOC[C@H]1CO bbaee3594d2caad09b52dd53094e878b [0,0,0,1,0,0|3,0,0]=4 5844 B12R1.81 C#CC1CCCN1CCC(C)O 670b8ea8c42f9d9c5faaab39b2ec3851 [0,0,0,1,0,0|1,0,2]=4 5845 B12R1.81 C=C(C)CCN1CCCC1CC fe0492efc713a998fcb24934503f85ca [0,0,0,1,0,0|2,0,1]=4 5846 B12R1.81 C=C(C)CCN1CCC[C@H]1CC c928c2450e782d9ce5b8f5274fe032c6 [0,0,0,1,0,0|2,0,1]=4 5847 B12R1.81 C=C(C)CN[C@@H]1CCC[C@H]1CC 0845e46861f5d8147932e19b3ceec47c [0,0,0,1,0,0|2,0,1]=4 5848 B12R1.81 CC(C)CCN1CCCC1CO 197c112b4ac9bc847df4fd429d371715 [0,0,0,1,0,0|3,0,0]=4 5849 B12R1.81 CC(C)CCN1CCC[C@@H]1CF f20993a2a60f8c215c79b34970cbcb1b [0,0,0,1,0,0|3,0,0]=4 5850 B12R1.81 CC(C)CCN1CCC[C@@H]1CO 5348030236e0ff68d978480aa5794e8e [0,0,0,1,0,0|3,0,0]=4 5851 B12R1.81 CC(C)CCN1CCC[C@H]1CF 131f0ffd2e497afba95ac2c6c7939602 [0,0,0,1,0,0|3,0,0]=4 5852 B12R1.81 CC(C)CCN1CCC[C@H]1CO 032f642c1e41d55c416329dd1bb7b455 [0,0,0,1,0,0|3,0,0]=4 5853 B12R1.81 CC(C)CN[C@H]1CCC[C@H]1CO a8c218e347816e75abeebd0880e0b239 [0,0,0,1,0,0|3,0,0]=4 5854 B12R1.81 CC(O)CCN1CCCC1C#N 220a2f4a595a605f349e6bae565782aa [0,0,0,1,0,0|2,0,1]=4 5855 B12R1.81 CC(O)CCN1CCCC1CO ebcc22566b53172afd97e9d339db4083 [0,0,0,1,0,0|2,0,0]=3 5856 B12R1.81 CC(O)CCN1CCC[C@@H]1CF f0ce864e86ae92f6ce614bac9786322f [0,0,0,1,0,0|2,0,0]=3 5857 B12R1.81 CC(O)CCN1CCC[C@@H]1CO a2cf11d838791394b7ca07cc8e63cacf [0,0,0,1,0,0|2,0,0]=3 5858 B12R1.81 CC(O)CCN1CCC[C@H]1C#N bf808333867b18f029db873622df9ec2 [0,0,0,1,0,0|2,0,1]=4 5859 B12R1.81 CC(O)CCN1CCC[C@H]1CF 222be4c026355c62abdff98def7421b3 [0,0,0,1,0,0|2,0,0]=3 5860 B12R1.81 CC(O)CCN1CCC[C@H]1CO 5f63e525b0d0c6a0f2a63550a4a7cd29 [0,0,0,1,0,0|2,0,0]=3 5861 B12R1.81 CC(O)CNC1COCC1CO 3f075a4fd0168e57502adde2731880e7 [0,0,0,1,0,0|3,0,0]=4 5862 B12R1.81 CC(O)CN[C@@H]1COC[C@H]1CO e28c29e24feacd7df660e9b26caf69fd [0,0,0,1,0,0|3,0,0]=4 5863 B12R1.81 CC(O)CN[C@H]1CCC[C@H]1C#N 8abd9bc33cc4562ff4005928de02d092 [0,0,0,1,0,0|2,0,1]=4 5864 B12R1.81 CC(O)CN[C@H]1CCC[C@H]1CO 6b2bc2f1cb2601e37a521e9928bcfb19 [0,0,0,1,0,0|2,0,0]=3 5865 B12R1.81 CC(O)CN[C@H]1CSC[C@@H]1CO 7d8af43fc32267ed5f402c5761071d79 [0,0,0,1,0,0|3,0,0]=4 5866 B12R1.81 CCC1CCCN1CCC(=O)C 0ee59433c78c4e9f8122814c4aefeeb7 [0,0,0,1,0,0|1,0,2]=4 5867 B12R1.81 CCC1CCCN1CCC(=O)O 6fd26b1257841ac9411640158a4963ae [0,0,0,1,0,0|2,0,1]=4 5868 B12R1.81 CCC1CCCN1CCC(C)C 12229672dca73a371e4a6690916cc72b [0,0,0,1,0,0|2,0,0]=3 5869 B12R1.81 CCC1CCCN1CCC(C)O a8c255eecfe4370d181a792790ba205d [0,0,0,1,0,0|1,0,0]=2 5870 B12R1.81 CCC1CCCN1CCN(C)C 9d747cae0e1e3afd7d8fbc4f8c468302 [0,0,0,1,0,0|3,0,0]=4 5871 B12R1.81 CCC1CCCN1CCS(=O)C 052c86c508be3eac2eccbb342eb37019 [0,0,0,1,0,0|2,0,1]=4 5872 B12R1.81 CCC1CCCN1COC(C)C 132fe023457d105dc63b7e45bfb703bc [0,0,0,1,0,0|3,0,0]=4 5873 B12R1.81 CCN1CCCC1CNC(C)C dd7c9ba7dbf54cadb3d1864b883568f2 [0,0,0,1,0,0|3,0,0]=4 5874 B12R1.81 CCN1CCCC1COC(C)C 14d3b99fc9f938e615dfddbcd37f90f3 [0,0,0,1,0,0|3,0,0]=4 5875 B12R1.81 CCN1CCC[C@@H]1CNC(C)C b2158591be5efad162ceed236097e280 [0,0,0,1,0,0|3,0,0]=4 5876 B12R1.81 CCN1CCC[C@@H]1COC(C)C 857c9b0d201d6d9d498fcfd2896495d4 [0,0,0,1,0,0|3,0,0]=4 5877 B12R1.81 CCN1CCC[C@H]1CNC(C)C ca0cd0db3e5edf7ed53a5bc2f823bc9b [0,0,0,1,0,0|3,0,0]=4 5878 B12R1.81 CCN1CCC[C@H]1COC(C)C 02a9d10c7b84f071cb900213fb13e724 [0,0,0,1,0,0|3,0,0]=4 5879 B12R1.81 CC[C@@H]1CCCN1CCC(=O)C 756fbf8bb79df748a7ac90833cc5076f [0,0,0,1,0,0|1,0,2]=4 5880 B12R1.81 CC[C@@H]1CCCN1CCC(=O)O 05f49e8eeac7fc554f0b84d208ced826 [0,0,0,1,0,0|2,0,1]=4 5881 B12R1.81 CC[C@@H]1CCCN1CCC(C)C a8547bc18ce097af7a13618315036dbe [0,0,0,1,0,0|2,0,0]=3 5882 B12R1.81 CC[C@@H]1CCCN1CCC(C)O a223818565ddefdff549c50747b2e245 [0,0,0,1,0,0|1,0,0]=2 5883 B12R1.81 CC[C@@H]1CCCN1CCN(C)C 702ba60abf8ab49687c2a70a6a0fee82 [0,0,0,1,0,0|3,0,0]=4 5884 B12R1.81 CC[C@@H]1CCCN1CCS(=O)C f5184a85f5a56ed89cd512d716421da4 [0,0,0,1,0,0|2,0,1]=4 5885 B12R1.81 CC[C@@H]1CCCN1COC(C)C a19de296808be8c07b4d19fa55d4be2d [0,0,0,1,0,0|3,0,0]=4 5886 B12R1.81 CC[C@@H]1CCC[C@H]1NCC(=O)O 9a71e551b56a84dc0fe615135c1bb943 [0,0,0,1,0,0|2,0,1]=4 5887 B12R1.81 CC[C@@H]1CCC[C@H]1NCC(C)C 855931a1fa970c8ae3a628471fdfba93 [0,0,0,1,0,0|2,0,0]=3 5888 B12R1.81 CC[C@@H]1CCC[C@H]1NCC(C)O a9f27986c3ce03f302040bc747f5f417 [0,0,0,1,0,0|1,0,0]=2 5889 B12R1.81 CC[C@@H]1CCC[C@H]1NCC(F)F 00eb0d50ea2a3011945a19740809c33e [0,0,0,1,0,0|3,0,0]=4 5890 B12R1.81 CC[C@@H]1CCC[C@H]1NCN(C)C 9c061c4559077dfdb6c3539530605b9d [0,0,0,1,0,0|3,0,0]=4 5891 B12R1.81 CC[C@@H]1CCC[C@H]1NC[C@@H](C)O f775851a9d09523b78db5d46bc04315e [0,0,0,1,0,0|1,0,0]=2 5892 B12R1.81 CC[C@@H]1CCC[C@H]1NC[C@H](C)O 87f4176bfbd37b6a21ca87f79f1b9c38 [0,0,0,1,0,0|1,0,0]=2 5893 B12R1.81 COC1CCCC1NCC(C)C 6a343099354f05970a57e00af8762a2c [0,0,0,1,0,0|3,0,0]=4 5894 B12R1.81 COC1CCCC1NCC(C)O 9134b00e07bc50cb1cc23887e19e56fc [0,0,0,1,0,0|2,0,0]=3 5895 B12R1.81 COC1CCCC1NC[C@@H](C)O c5e4a10049684e8e6a567fbe39d2d1b1 [0,0,0,1,0,0|2,0,0]=3 5896 B12R1.81 COC1CCCC1NC[C@H](C)O 420e68c68d88f6cb91e72afe828524e0 [0,0,0,1,0,0|2,0,0]=3 5897 B12R1.81 COC1CCCN1CCC(C)C f1662fce64418a18ff34f6c40d20d55e [0,0,0,1,0,0|3,0,0]=4 5898 B12R1.81 COC1CCCN1CCC(C)O 57d2f42e5e13f98808362cb2828dc6c9 [0,0,0,1,0,0|2,0,0]=3 5899 B12R1.81 COC1COCC1NCC(C)O f4ef0b5ed9024f53058ed708cd59c097 [0,0,0,1,0,0|3,0,0]=4 5900 B12R1.81 COC1COCC1NC[C@@H](C)O 237ccb8b34d4f16d381aa91145ccc25a [0,0,0,1,0,0|3,0,0]=4 5901 B12R1.81 COC1COCC1NC[C@H](C)O a64511fc337174d224a06d0f1430a56e [0,0,0,1,0,0|3,0,0]=4 5902 B12R1.81 CO[C@@H]1CCC[C@@H]1NCC(C)C 19afc7c3732b8177acb984772feb98bd [0,0,0,1,0,0|3,0,0]=4 5903 B12R1.81 CO[C@@H]1CCC[C@@H]1NCC(C)O f3679aa61b24c2280e3441796facb897 [0,0,0,1,0,0|2,0,0]=3 5904 B12R1.81 CO[C@@H]1CCC[C@@H]1NC[C@@H](C)O 9c4855a5133e7f2535a8f9267649dc5b [0,0,0,1,0,0|2,0,0]=3 5905 B12R1.81 CO[C@@H]1CCC[C@@H]1NC[C@H](C)O e10975b094e5b457e1b704cc475174bd [0,0,0,1,0,0|2,0,0]=3 5906 B12R1.81 CO[C@@H]1CCC[C@H]1NCC(C)C 9c2d425c2a065c42826d9445a45dcdfb [0,0,0,1,0,0|3,0,0]=4 5907 B12R1.81 CO[C@@H]1CCC[C@H]1NCC(C)O ede6156627ce531c0b26c97e529a3f14 [0,0,0,1,0,0|2,0,0]=3 5908 B12R1.81 CO[C@@H]1CCC[C@H]1NC[C@@H](C)O 72e9377401cc977adfdebdf1fa7e0950 [0,0,0,1,0,0|2,0,0]=3 5909 B12R1.81 CO[C@@H]1CCC[C@H]1NC[C@H](C)O 8e0dac619b51f3c23d9f675d7837d020 [0,0,0,1,0,0|2,0,0]=3 5910 B12R1.81 CO[C@@H]1COC[C@@H]1NCC(C)O 33a1fe283b58c647078ad81108c24f62 [0,0,0,1,0,0|3,0,0]=4 5911 B12R1.81 CO[C@@H]1COC[C@@H]1NC[C@@H](C)O d870cd3fed8bd761fdabff775c53c11a [0,0,0,1,0,0|3,0,0]=4 5912 B12R1.81 CO[C@@H]1COC[C@@H]1NC[C@H](C)O dd46859ac410b5ac87236efffd8928f8 [0,0,0,1,0,0|3,0,0]=4 5913 B12R1.81 CO[C@@H]1COC[C@H]1NCC(C)O a5db007e5062967b1a8a36d0238c466a [0,0,0,1,0,0|3,0,0]=4 5914 B12R1.81 CO[C@@H]1COC[C@H]1NC[C@@H](C)O 8a2d6360d6e8a02479de6a4a3e27c255 [0,0,0,1,0,0|3,0,0]=4 5915 B12R1.81 CO[C@@H]1COC[C@H]1NC[C@H](C)O c56ae4327b15febd0e57e62f44f16449 [0,0,0,1,0,0|3,0,0]=4 5916 B12R1.81 CO[C@H]1CCC[C@@H]1NCC(C)C a25f7680459463e9d5d7bf0a1245d2dd [0,0,0,1,0,0|3,0,0]=4 5917 B12R1.81 CO[C@H]1CCC[C@@H]1NCC(C)O a83f572fb6bc4a82a3e006934c21bebb [0,0,0,1,0,0|2,0,0]=3 5918 B12R1.81 CO[C@H]1CCC[C@@H]1NC[C@@H](C)O e13b51b6a666fa35535fd14b07207e86 [0,0,0,1,0,0|2,0,0]=3 5919 B12R1.81 CO[C@H]1CCC[C@@H]1NC[C@H](C)O e8f4692715d020c4d716d06f920c6d88 [0,0,0,1,0,0|2,0,0]=3 5920 B12R1.81 CO[C@H]1COC[C@@H]1NCC(C)O 4890f11efc841a63d3eb9a2327538a0e [0,0,0,1,0,0|3,0,0]=4 5921 B12R1.81 CO[C@H]1COC[C@@H]1NC[C@@H](C)O d46e74438692c748be2e7dd5e3cbd31c [0,0,0,1,0,0|3,0,0]=4 5922 B12R1.81 CO[C@H]1COC[C@@H]1NC[C@H](C)O f59a8e3a12bd416debdf89557bbc63e5 [0,0,0,1,0,0|3,0,0]=4 5923 B12R1.81 CO[C@H]1COC[C@H]1NCC(C)O a9f2d37b5fde5fcb35fea23275a23342 [0,0,0,1,0,0|3,0,0]=4 5924 B12R1.81 CO[C@H]1COC[C@H]1NC[C@@H](C)O 47e046a9c159f9af3183042d61efa5ba [0,0,0,1,0,0|3,0,0]=4 5925 B12R1.81 CO[C@H]1COC[C@H]1NC[C@H](C)O 43d6817b17179df472b7640f91cf698f [0,0,0,1,0,0|3,0,0]=4 5926 B12R1.81 C[C@@H](O)CNC1COCC1CO 099aa5a540c3b93ad9e1465937017e7b [0,0,0,1,0,0|3,0,0]=4 5927 B12R1.81 C[C@@H](O)CN[C@@H]1COC[C@H]1CO 27232635af426a469d8b4e1c6e1eae0b [0,0,0,1,0,0|3,0,0]=4 5928 B12R1.81 C[C@@H](O)CN[C@H]1CCC[C@H]1C#N 416b5f7a8f95c8859c4c45c0f6df134b [0,0,0,1,0,0|2,0,1]=4 5929 B12R1.81 C[C@@H](O)CN[C@H]1CCC[C@H]1CO ff4e34919a8f90c9740a33459e670dc2 [0,0,0,1,0,0|2,0,0]=3 5930 B12R1.81 C[C@@H](O)CN[C@H]1CSC[C@@H]1CO 824c6e4d32990b4788971e7430f4fac1 [0,0,0,1,0,0|3,0,0]=4 5931 B12R1.81 C[C@H](O)CNC1COCC1CO 0e4d0208ea58d99d5aa021c0a09be9ee [0,0,0,1,0,0|3,0,0]=4 5932 B12R1.81 C[C@H](O)CN[C@@H]1COC[C@H]1CO 1ded0eea66925d05e72ec75d8527a918 [0,0,0,1,0,0|3,0,0]=4 5933 B12R1.81 C[C@H](O)CN[C@H]1CCC[C@H]1C#N 827e130d06617e40524977a277426d0e [0,0,0,1,0,0|2,0,1]=4 5934 B12R1.81 C[C@H](O)CN[C@H]1CCC[C@H]1CO ca9fa7180f88e5ef4e9f172de30d845e [0,0,0,1,0,0|2,0,0]=3 5935 B12R1.81 C[C@H](O)CN[C@H]1CSC[C@@H]1CO 72a9ca243e90b3aa40798aba8a03834c [0,0,0,1,0,0|3,0,0]=4 5936 B12R1.125 C=C(C)CCN1CCCCC1C 5e3948e378c54a08d74ac3b12e9e243b [0,0,0,1,0,0|2,0,1]=4 5937 B12R1.125 C=C(C)CCN1CCCC[C@@H]1C 4853860152fd175c45aebb26b9f3c584 [0,0,0,1,0,0|2,0,1]=4 5938 B12R1.125 C=C(C)CCN1CCCC[C@H]1C efbf669d9cef146a1e6c8a750c829ef9 [0,0,0,1,0,0|2,0,1]=4 5939 B12R1.125 C=C(C)CNC1CCCCC1C d354e3a7b03f36127b6d934935584bf3 [0,0,0,1,0,0|2,0,1]=4 5940 B12R1.125 C=C(C)CN[C@@H]1CCCC[C@@H]1C aa3cdb38a418ab54b431f16842a75e18 [0,0,0,1,0,0|2,0,1]=4 5941 B12R1.125 C=C(C)CN[C@@H]1CCCC[C@H]1C 49ff88d43cd211b5e40c3fa79d718916 [0,0,0,1,0,0|2,0,1]=4 5942 B12R1.125 C=C(C)CN[C@H]1CCCC[C@@H]1C 6dbfde6e045d7353f1b6058d658365db [0,0,0,1,0,0|2,0,1]=4 5943 B12R1.125 C=C(C)CN[C@H]1CCCC[C@H]1C 1cedbbdff4c21f90dd11a6ce2550a59f [0,0,0,1,0,0|2,0,1]=4 5944 B12R1.125 C=C(C)COC1CCCCC1C c21ae74c6806932443719fd3e10e8ea8 [0,0,0,1,0,0|2,0,1]=4 5945 B12R1.125 C=C(C)CO[C@@H]1CCCC[C@@H]1C ab673181c4a7b9ec245493339d874abb [0,0,0,1,0,0|2,0,1]=4 5946 B12R1.125 C=C(C)CO[C@H]1CCCC[C@@H]1C 30804d0053f65e56d3ca7f6f0172ab4d [0,0,0,1,0,0|2,0,1]=4 5947 B12R1.125 C=C(C)CO[C@H]1CCCC[C@H]1C c869d5bab3e458a96656f87add14c36e [0,0,0,1,0,0|2,0,1]=4 5948 B12R1.125 CC(=O)CCN1CCCCC1C aa745b8f303bbb7710d77a5ea955c557 [0,0,0,1,0,0|1,0,2]=4 5949 B12R1.125 CC(=O)CCN1CCCC[C@@H]1C ec29656b7b61586f32a18528a6b8c70e [0,0,0,1,0,0|1,0,2]=4 5950 B12R1.125 CC(=O)CCN1CCCC[C@H]1C 2620bdaf27a96734997072416d5b0014 [0,0,0,1,0,0|1,0,2]=4 5951 B12R1.125 CC(=O)CN[C@H]1CCCC[C@H]1C ee102bf7fa95e24028ce4080aed42e05 [0,0,0,1,0,0|1,0,2]=4 5952 B12R1.125 CC(=O)CO[C@H]1CCCC[C@H]1C 1dcd57c6fd842f45365c605c58c0076d [0,0,0,1,0,0|1,0,2]=4 5953 B12R1.125 CC(=O)NCC1CCCCC1C a21317628d068bc5e57e9a0774389ae3 [0,0,0,1,0,0|1,0,2]=4 5954 B12R1.125 CC(C)CCN1CCCCC1C 7b15d9e8b3b13ae6522e353d0e285aee [0,0,0,1,0,0|2,0,0]=3 5955 B12R1.125 CC(C)CCN1CCCC[C@@H]1C 4e43868c5501d7cd5a30704a1b398213 [0,0,0,1,0,0|2,0,0]=3 5956 B12R1.125 CC(C)CCN1CCCC[C@H]1C 920ec740721aa577ccf8102c18ba7a98 [0,0,0,1,0,0|2,0,0]=3 5957 B12R1.125 CC(C)CCN1CCOCC1C 84d43c9fcb3fdd142318b353cfddfbf5 [0,0,0,1,0,0|3,0,0]=4 5958 B12R1.125 CC(C)CCN1CCOC[C@@H]1C 74eb50b8579e1185e44fed973a5c79ef [0,0,0,1,0,0|3,0,0]=4 5959 B12R1.125 CC(C)CCN1CCOC[C@H]1C 0db4b0fcaa71b5baea2dea11b14e0cf2 [0,0,0,1,0,0|3,0,0]=4 5960 B12R1.125 CC(C)CNC1CCCCC1C fffdc9108224b35e19a6fce3f0e6f2d4 [0,0,0,1,0,0|2,0,0]=3 5961 B12R1.125 CC(C)CNC1CCCCC1F 35ae5f7c4978805c6e66398d1cf5529a [0,0,0,1,0,0|3,0,0]=4 5962 B12R1.125 CC(C)CNC1CCCCC1O 3127bd0d1bc1f2aef1153044b1ff2f59 [0,0,0,1,0,0|3,0,0]=4 5963 B12R1.125 CC(C)CNC1CCOCC1C a63159fcdd0d436773e1f29addd70119 [0,0,0,1,0,0|3,0,0]=4 5964 B12R1.125 CC(C)CN[C@@H]1CCCC[C@@H]1C e1481aa23c57b18d29a4bf6d01404a81 [0,0,0,1,0,0|2,0,0]=3 5965 B12R1.125 CC(C)CN[C@@H]1CCCC[C@H]1C d3b40ec580250d069ec411ff5a6bee7d [0,0,0,1,0,0|2,0,0]=3 5966 B12R1.125 CC(C)CN[C@@H]1CCCC[C@H]1O 28df2f68e62ede6cb2220cac518bc90f [0,0,0,1,0,0|3,0,0]=4 5967 B12R1.125 CC(C)CN[C@@H]1CCOC[C@@H]1C 3fe4d6ace6f9fb2ce229207fca98fe72 [0,0,0,1,0,0|3,0,0]=4 5968 B12R1.125 CC(C)CN[C@H]1CCCC[C@@H]1C f7c2c25b2588739463dbfa20787eaa89 [0,0,0,1,0,0|2,0,0]=3 5969 B12R1.125 CC(C)CN[C@H]1CCCC[C@@H]1O 3d6dacb898586f2c03b6c9afc6bc0c8f [0,0,0,1,0,0|3,0,0]=4 5970 B12R1.125 CC(C)CN[C@H]1CCCC[C@H]1C 594bf23acf78672f3a48d6cdfce57a0a [0,0,0,1,0,0|2,0,0]=3 5971 B12R1.125 CC(C)CN[C@H]1CCCC[C@H]1O 8a57de45941839778ab2141ae4aa556b [0,0,0,1,0,0|3,0,0]=4 5972 B12R1.125 CC(C)CN[C@H]1CCOC[C@H]1C a5419d3ed5a48af11dbaafd96e0a57dc [0,0,0,1,0,0|3,0,0]=4 5973 B12R1.125 CC(C)COC1CCCCC1C b92226d2b012f230180a1f49901555f8 [0,0,0,1,0,0|2,0,0]=3 5974 B12R1.125 CC(C)COC1CCCCC1F 3f42a91fcfa1c821a15d654dc6814e6a [0,0,0,1,0,0|3,0,0]=4 5975 B12R1.125 CC(C)COC1CCOCC1C d98fedb29ad52792091752ff8a6412c1 [0,0,0,1,0,0|3,0,0]=4 5976 B12R1.125 CC(C)CO[C@@H]1CCCC[C@@H]1C 1a3ccab1ca8bb8eaa46436fb2e937418 [0,0,0,1,0,0|2,0,0]=3 5977 B12R1.125 CC(C)CO[C@@H]1CCCC[C@H]1F a9a6f686d803ed5ab15c56c9320e9176 [0,0,0,1,0,0|3,0,0]=4 5978 B12R1.125 CC(C)CO[C@H]1CCCC[C@@H]1C b6318973f7233ef10aa72f2c1496c513 [0,0,0,1,0,0|2,0,0]=3 5979 B12R1.125 CC(C)CO[C@H]1CCCC[C@H]1C 2cf479744bfb96638eebdacc2036d1b4 [0,0,0,1,0,0|2,0,0]=3 5980 B12R1.125 CC(C)NCC1CCCCC1C e9c5c63ccfed63f8ac2746ee863abac1 [0,0,0,1,0,0|2,0,0]=3 5981 B12R1.125 CC(C)NCC1CCCCC1O f58b4837a0be97afbe4f88488778eebd [0,0,0,1,0,0|3,0,0]=4 5982 B12R1.125 CC(C)NCC1CCCCN1C d272a7bc47280c2d032ebf386441b9ee [0,0,0,1,0,0|3,0,0]=4 5983 B12R1.125 CC(C)OCC1CCCCN1C 93cb7dbb203d58c65971a36c0d23f171 [0,0,0,1,0,0|3,0,0]=4 5984 B12R1.125 CC(C)OCN1CCCCC1C 2d5d2113d97b791276d6f6c8c0a04fc8 [0,0,0,1,0,0|3,0,0]=4 5985 B12R1.125 CC(C)OCN1CCCC[C@@H]1C 92c51408507f20809a75704db3851108 [0,0,0,1,0,0|3,0,0]=4 5986 B12R1.125 CC(C)OCN1CCCC[C@H]1C c2f8b72fa557b4f68de6f7a7e7cd190d [0,0,0,1,0,0|3,0,0]=4 5987 B12R1.125 CC(C)OC[C@@H]1CCCCN1C dab5cc13d83777890576d5a0b2fcfca2 [0,0,0,1,0,0|3,0,0]=4 5988 B12R1.125 CC(C)OC[C@H]1CCCCN1C 4cba2b539fcecaf8b63a4e2c676bd7d8 [0,0,0,1,0,0|3,0,0]=4 5989 B12R1.125 CC(F)COC1CCCCC1F 0c68d5cbda376cb603c391c1cddef2ec [0,0,0,1,0,0|3,0,0]=4 5990 B12R1.125 CC(F)CO[C@H]1CCCC[C@H]1C 5743284fbdc7bd4526da45a8245d7187 [0,0,0,1,0,0|2,0,0]=3 5991 B12R1.125 CC(O)CCN1CCCCC1C bad134293fe1831ecbd843f9187da699 [0,0,0,1,0,0|1,0,0]=2 5992 B12R1.125 CC(O)CCN1CCCC[C@@H]1C ea2bec3cc0d59644c03de4c497e957be [0,0,0,1,0,0|1,0,0]=2 5993 B12R1.125 CC(O)CCN1CCCC[C@H]1C 2ac4efc97929cf1d83dda89ccc5389c3 [0,0,0,1,0,0|1,0,0]=2 5994 B12R1.125 CC(O)CCN1CCOCC1C e124ad57aa231ff671e0fa99390c20b5 [0,0,0,1,0,0|2,0,0]=3 5995 B12R1.125 CC(O)CCN1CCOC[C@@H]1C 33e91ba2fa7aceca0c7183eb7ae39680 [0,0,0,1,0,0|2,0,0]=3 5996 B12R1.125 CC(O)CCN1CCOC[C@H]1C 610c25e6d7002d4b5fbafc0b0b7deee6 [0,0,0,1,0,0|2,0,0]=3 5997 B12R1.125 CC(O)CNC1CCCCC1=O 77f1fb7c2ed0fd4a479515fede2da2e9 [0,0,0,1,0,0|2,0,1]=4 5998 B12R1.125 CC(O)CNC1CCCCC1C 5e046f2405340c55aec81472f170f06a [0,0,0,1,0,0|1,0,0]=2 5999 B12R1.125 CC(O)CNC1CCCCC1F 10849eaf317332c587955f55fd7c185a [0,0,0,1,0,0|2,0,0]=3 6000 B12R1.125 CC(O)CNC1CCCCC1O e99e764067ca6f74c6f6fcd6a554f900 [0,0,0,1,0,0|2,0,0]=3 6001 B12R1.125 CC(O)CNC1CCOCC1C 37958973f96117a5247e8101e94a5667 [0,0,0,1,0,0|2,0,0]=3 6002 B12R1.125 CC(O)CNC1CCOCC1O e6ee748e0e2be8646009d987ea9496be [0,0,0,1,0,0|3,0,0]=4 6003 B12R1.125 CC(O)CN[C@@H]1CCCC[C@@H]1C 83da5b4dd7c84fe52deb2aff8f0c53ed [0,0,0,1,0,0|1,0,0]=2 6004 B12R1.125 CC(O)CN[C@@H]1CCCC[C@H]1C c823d18dc8661bad69af53f1ccba5285 [0,0,0,1,0,0|1,0,0]=2 6005 B12R1.125 CC(O)CN[C@@H]1CCCC[C@H]1O 0d4793c5b4460882a1dfbfdc08751c7f [0,0,0,1,0,0|2,0,0]=3 6006 B12R1.125 CC(O)CN[C@@H]1CCOC[C@@H]1C 7abbf5fe6f2a4add41416d718ea4c3da [0,0,0,1,0,0|2,0,0]=3 6007 B12R1.125 CC(O)CN[C@@H]1CCOC[C@@H]1O 7eb71b8b3bb3d9bd9aee517d49146823 [0,0,0,1,0,0|3,0,0]=4 6008 B12R1.125 CC(O)CN[C@@H]1CCOC[C@H]1F 7c528a5eeb55c88233b25c906f16ee15 [0,0,0,1,0,0|3,0,0]=4 6009 B12R1.125 CC(O)CN[C@@H]1CCOC[C@H]1O 164a7e9b67d9e89735029dc9f654dfd1 [0,0,0,1,0,0|3,0,0]=4 6010 B12R1.125 CC(O)CN[C@@H]1COCC[C@@H]1O ee6517a9eab36000c0cbe77a889c4061 [0,0,0,1,0,0|3,0,0]=4 6011 B12R1.125 CC(O)CN[C@@H]1COCC[C@H]1O 3d7f0814dd51709e702c89f7a95c5f9b [0,0,0,1,0,0|3,0,0]=4 6012 B12R1.125 CC(O)CN[C@H]1CCCC[C@@H]1C b3bc463234f9f42ebca891a805635e14 [0,0,0,1,0,0|1,0,0]=2 6013 B12R1.125 CC(O)CN[C@H]1CCCC[C@@H]1O a9ed02a53a7ff74c1500e0b00891b6d5 [0,0,0,1,0,0|2,0,0]=3 6014 B12R1.125 CC(O)CN[C@H]1CCCC[C@H]1C fbed6f3c7e2a91fdcfab3b1ef44746c3 [0,0,0,1,0,0|1,0,0]=2 6015 B12R1.125 CC(O)CN[C@H]1CCCC[C@H]1O f2432259695789a32f768bdbfa7f8e47 [0,0,0,1,0,0|2,0,0]=3 6016 B12R1.125 CC(O)CN[C@H]1CCOC[C@@H]1F 30214df1109ed61ddfad3474fe340f97 [0,0,0,1,0,0|3,0,0]=4 6017 B12R1.125 CC(O)CN[C@H]1CCOC[C@@H]1O b34def528b1312e8b8e6aded777e68b2 [0,0,0,1,0,0|3,0,0]=4 6018 B12R1.125 CC(O)CN[C@H]1CCOC[C@H]1C b91e52816bce7357dae44d57afb31db9 [0,0,0,1,0,0|2,0,0]=3 6019 B12R1.125 CC(O)CN[C@H]1CCOC[C@H]1O 53eb870fc0b8f7c4b03ca16181bc0fa7 [0,0,0,1,0,0|3,0,0]=4 6020 B12R1.125 CC(O)CN[C@H]1COCC[C@@H]1O 2a471799df4ff66b8a1579605ded3c82 [0,0,0,1,0,0|3,0,0]=4 6021 B12R1.125 CC(O)CN[C@H]1COCC[C@H]1O b4dfe765b9f98f869a1d743e6d9ea763 [0,0,0,1,0,0|3,0,0]=4 6022 B12R1.125 CC(S)COC1CCCCC1F c1743c9fab576374135cef61fbf86ae9 [0,0,0,1,0,0|2,1,0]=4 6023 B12R1.125 CC(S)CO[C@H]1CCCC[C@H]1C 89a1801984f6e7f960c2c0c7ddaaae52 [0,0,0,1,0,0|1,1,0]=3 6024 B12R1.125 CC1CCCCC1NCC(=O)O b09a7a7f6b8cbd436b25a37fb8d89cda [0,0,0,1,0,0|2,0,1]=4 6025 B12R1.125 CC1CCCCC1NCC(F)F 9a60d08a3714250dcf565f3def58458a [0,0,0,1,0,0|3,0,0]=4 6026 B12R1.125 CC1CCCCC1NCN(C)C 759a04589e7f9ee0f40f3dc95e40b130 [0,0,0,1,0,0|3,0,0]=4 6027 B12R1.125 CC1CCCCC1NC[C@@H](C)O 5ab6c09945e6014cd8be40680fe4ddee [0,0,0,1,0,0|1,0,0]=2 6028 B12R1.125 CC1CCCCC1NC[C@H](C)O adce6b93f3425f6084d231599f861106 [0,0,0,1,0,0|1,0,0]=2 6029 B12R1.125 CC1CCCCC1OCC(=O)O abf18bab3fd3a06a5323de49c56b5de2 [0,0,0,1,0,0|2,0,1]=4 6030 B12R1.125 CC1CCCCC1OCC(F)F fd0f0e9917467b531f81195d20abca3e [0,0,0,1,0,0|3,0,0]=4 6031 B12R1.125 CC1CCCCC1OCN(C)C 18fa93974f3daf905b7c9ebcd8a025c1 [0,0,0,1,0,0|3,0,0]=4 6032 B12R1.125 CC1CCCCN1CCC(=O)O f1ed9228421a1404653422ac85334fbc [0,0,0,1,0,0|2,0,1]=4 6033 B12R1.125 CC1CCCCN1CCN(C)C 19cec0a677857947940e8c350cd61f02 [0,0,0,1,0,0|3,0,0]=4 6034 B12R1.125 CC1CCCCN1CCS(=O)C 88fe409cfa4f525c0ff35a2aebc29756 [0,0,0,1,0,0|2,0,1]=4 6035 B12R1.125 CC1COCCC1NC[C@@H](C)O b9e8a4b705bc4061e53b6081d043dd3d [0,0,0,1,0,0|2,0,0]=3 6036 B12R1.125 CC1COCCC1NC[C@H](C)O 6a2b74cbbff56ed23d9fc8e601969bb8 [0,0,0,1,0,0|2,0,0]=3 6037 B12R1.125 C[C@@H](F)COC1CCCCC1F f644b6bbf30870227ad7aae1b1bab01c [0,0,0,1,0,0|3,0,0]=4 6038 B12R1.125 C[C@@H](O)CNC1CCCCC1=O 2790235d8bd36517d0111567b1738437 [0,0,0,1,0,0|2,0,1]=4 6039 B12R1.125 C[C@@H](O)CNC1CCCCC1F 84383c9192f9e6cb78151441da0dd53b [0,0,0,1,0,0|2,0,0]=3 6040 B12R1.125 C[C@@H](O)CNC1CCCCC1O 0e41d10c9028fb63296a7b676605a1b6 [0,0,0,1,0,0|2,0,0]=3 6041 B12R1.125 C[C@@H](O)CNC1CCOCC1O e5945749412f96a9801d46b95d0cd7de [0,0,0,1,0,0|3,0,0]=4 6042 B12R1.125 C[C@@H](O)CN[C@@H]1CCCC[C@@H]1C 79e54341626e6841f0d7902d5339567a [0,0,0,1,0,0|1,0,0]=2 6043 B12R1.125 C[C@@H](O)CN[C@@H]1CCCC[C@H]1O 42a47d2b2ae995d2bc5e5381e3dffc2b [0,0,0,1,0,0|2,0,0]=3 6044 B12R1.125 C[C@@H](O)CN[C@@H]1CCOC[C@@H]1C b22f21dab086b5c3294710c03f502f1c [0,0,0,1,0,0|2,0,0]=3 6045 B12R1.125 C[C@@H](O)CN[C@@H]1CCOC[C@@H]1O 74e3bfbb71ed53fc387ef83263038c0c [0,0,0,1,0,0|3,0,0]=4 6046 B12R1.125 C[C@@H](O)CN[C@@H]1CCOC[C@H]1F 352260c5b98061527ac0f818e88e105e [0,0,0,1,0,0|3,0,0]=4 6047 B12R1.125 C[C@@H](O)CN[C@@H]1CCOC[C@H]1O 1ecc9836d83bf65341243148eab1edb3 [0,0,0,1,0,0|3,0,0]=4 6048 B12R1.125 C[C@@H](O)CN[C@@H]1COCC[C@@H]1O 3556a9b40ccfccaff63a64c58dbd734e [0,0,0,1,0,0|3,0,0]=4 6049 B12R1.125 C[C@@H](O)CN[C@@H]1COCC[C@H]1O ae6311c1cc950fe2c686d381160a4e44 [0,0,0,1,0,0|3,0,0]=4 6050 B12R1.125 C[C@@H](O)CN[C@H]1CCCC[C@@H]1C 742b1bce7120291189c99f9fb5a31d83 [0,0,0,1,0,0|1,0,0]=2 6051 B12R1.125 C[C@@H](O)CN[C@H]1CCCC[C@@H]1O a1139e5e1f631ca13a327a76c75232cd [0,0,0,1,0,0|2,0,0]=3 6052 B12R1.125 C[C@@H](O)CN[C@H]1CCCC[C@H]1O 2e98717822e0e30b7a46251b4f6ac278 [0,0,0,1,0,0|2,0,0]=3 6053 B12R1.125 C[C@@H](O)CN[C@H]1CCOC[C@@H]1F a561f7c911f5ffac328fdf79e43b501f [0,0,0,1,0,0|3,0,0]=4 6054 B12R1.125 C[C@@H](O)CN[C@H]1CCOC[C@@H]1O c08d267e48d4739b046e7a6896e00f89 [0,0,0,1,0,0|3,0,0]=4 6055 B12R1.125 C[C@@H](O)CN[C@H]1CCOC[C@H]1O c24f9abc7f2742a631f02dfb514d5e12 [0,0,0,1,0,0|3,0,0]=4 6056 B12R1.125 C[C@@H](O)CN[C@H]1COCC[C@@H]1O 488b5b054bd2e87a6f00b28951c05c89 [0,0,0,1,0,0|3,0,0]=4 6057 B12R1.125 C[C@@H](O)CN[C@H]1COCC[C@H]1O 777c2fb3de201cd00398334d944bc950 [0,0,0,1,0,0|3,0,0]=4 6058 B12R1.125 C[C@@H]1CCCCN1CCC(=O)O a33fdbbb9f1952959ad035ffb902a3f2 [0,0,0,1,0,0|2,0,1]=4 6059 B12R1.125 C[C@@H]1CCCCN1CCN(C)C 65ae0289bf0f1a50ec9a1e9ea3591e43 [0,0,0,1,0,0|3,0,0]=4 6060 B12R1.125 C[C@@H]1CCCCN1CCS(=O)C 1113bcd821d0e081568647a170b654e5 [0,0,0,1,0,0|2,0,1]=4 6061 B12R1.125 C[C@@H]1CCCC[C@@H]1NCC(=O)O 7632a5bf53c142e4580acf93ede82a57 [0,0,0,1,0,0|2,0,1]=4 6062 B12R1.125 C[C@@H]1CCCC[C@@H]1NCC(F)F 16698f3ff2c95f78b458cf0c09701164 [0,0,0,1,0,0|3,0,0]=4 6063 B12R1.125 C[C@@H]1CCCC[C@@H]1NCN(C)C c82be4642e8163a1fa1ee6dd2ece0746 [0,0,0,1,0,0|3,0,0]=4 6064 B12R1.125 C[C@@H]1CCCC[C@@H]1NC[C@@H](C)O cd1b608c1ae6f291e7af04c7510bc625 [0,0,0,1,0,0|1,0,0]=2 6065 B12R1.125 C[C@@H]1CCCC[C@@H]1OCC(=O)O 058100008c8586337bed34eca6a04016 [0,0,0,1,0,0|2,0,1]=4 6066 B12R1.125 C[C@@H]1CCCC[C@@H]1OCC(F)F 193866b0fbbe481af6d8bb0fec8b4c32 [0,0,0,1,0,0|3,0,0]=4 6067 B12R1.125 C[C@@H]1CCCC[C@@H]1OCN(C)C 4cb2edd5ba5b5a60fffac24094e31110 [0,0,0,1,0,0|3,0,0]=4 6068 B12R1.125 C[C@@H]1CCCC[C@@H]1OCS(=O)O 88d4051fa9df9390b0ac3de3005dd636 [0,0,0,1,0,0|3,0,0]=4 6069 B12R1.125 C[C@@H]1CCCC[C@@H]1OC[C@@H](C)F 521512f9e09f30803875e6c06fe1c1a0 [0,0,0,1,0,0|2,0,0]=3 6070 B12R1.125 C[C@@H]1CCCC[C@H]1NCC(=O)O 5c454eb124ce5b3d92889a06237e847f [0,0,0,1,0,0|2,0,1]=4 6071 B12R1.125 C[C@@H]1CCCC[C@H]1NCC(F)F 23418d5e0e13bde1c784d6d4f6d6dff4 [0,0,0,1,0,0|3,0,0]=4 6072 B12R1.125 C[C@@H]1CCCC[C@H]1NCN(C)C 354481ea1fa590f79cfffffb2c67897e [0,0,0,1,0,0|3,0,0]=4 6073 B12R1.125 C[C@@H]1CCCC[C@H]1NC[C@@H](C)O 48274bc144bc97294656e0c5a076043d [0,0,0,1,0,0|1,0,0]=2 6074 B12R1.125 C[C@@H]1COCC[C@@H]1NC[C@@H](C)O 7bf628eff4f682afeb8389442640de4d [0,0,0,1,0,0|2,0,0]=3 6075 B12R1.125 C[C@H](F)COC1CCCCC1F 484e0b657de6785d52e0ca8d4f8f2c32 [0,0,0,1,0,0|3,0,0]=4 6076 B12R1.125 C[C@H](F)CO[C@H]1CCCC[C@H]1C d0e9f63bc4f9653c6dba6a646cf8c141 [0,0,0,1,0,0|2,0,0]=3 6077 B12R1.125 C[C@H](O)CNC1CCCCC1=O ecfeac1fe0295721a0068a2f606f9479 [0,0,0,1,0,0|2,0,1]=4 6078 B12R1.125 C[C@H](O)CNC1CCCCC1F c87cd387e3e98d047410f24a0783585d [0,0,0,1,0,0|2,0,0]=3 6079 B12R1.125 C[C@H](O)CNC1CCCCC1O e5dc8f0411d6d08c648d1396cf6be81b [0,0,0,1,0,0|2,0,0]=3 6080 B12R1.125 C[C@H](O)CNC1CCOCC1O 6105b6ee72edb50c8c07f8fcc715cb29 [0,0,0,1,0,0|3,0,0]=4 6081 B12R1.125 C[C@H](O)CN[C@@H]1CCCC[C@@H]1C 2c3089a0b0936eb5f9cbd8ee93641301 [0,0,0,1,0,0|1,0,0]=2 6082 B12R1.125 C[C@H](O)CN[C@@H]1CCCC[C@H]1C f1334fc77028d787efe26b5225e5f77e [0,0,0,1,0,0|1,0,0]=2 6083 B12R1.125 C[C@H](O)CN[C@@H]1CCCC[C@H]1O d18f89c60aad0377774d8244e83c2595 [0,0,0,1,0,0|2,0,0]=3 6084 B12R1.125 C[C@H](O)CN[C@@H]1CCOC[C@@H]1C 2e8c84c0e080d1daf3c5dc9073813a25 [0,0,0,1,0,0|2,0,0]=3 6085 B12R1.125 C[C@H](O)CN[C@@H]1CCOC[C@@H]1O 83558d8b108d22e8ea7f6cfef36deb7b [0,0,0,1,0,0|3,0,0]=4 6086 B12R1.125 C[C@H](O)CN[C@@H]1CCOC[C@H]1F 463cab675faf10879aedd3061fc1f3b7 [0,0,0,1,0,0|3,0,0]=4 6087 B12R1.125 C[C@H](O)CN[C@@H]1CCOC[C@H]1O 45612d96d03e8da40c66bd4ae0a720d5 [0,0,0,1,0,0|3,0,0]=4 6088 B12R1.125 C[C@H](O)CN[C@@H]1COCC[C@@H]1O 0a8e6fe052f6b4571fdb93eaa2b386aa [0,0,0,1,0,0|3,0,0]=4 6089 B12R1.125 C[C@H](O)CN[C@@H]1COCC[C@H]1O f8d4fb9b6ad9f475ba0e8042f36b07c1 [0,0,0,1,0,0|3,0,0]=4 6090 B12R1.125 C[C@H](O)CN[C@H]1CCCC[C@@H]1C f224bba2439a70c9d7bfe00a4fee490a [0,0,0,1,0,0|1,0,0]=2 6091 B12R1.125 C[C@H](O)CN[C@H]1CCCC[C@@H]1O b17c1bdadf0e146ea25d17331bb08e78 [0,0,0,1,0,0|2,0,0]=3 6092 B12R1.125 C[C@H](O)CN[C@H]1CCCC[C@H]1C e8706331985a20e25b837f49a4f653ca [0,0,0,1,0,0|1,0,0]=2 6093 B12R1.125 C[C@H](O)CN[C@H]1CCCC[C@H]1O f68f1916c3428b3bd1107217f515e997 [0,0,0,1,0,0|2,0,0]=3 6094 B12R1.125 C[C@H](O)CN[C@H]1CCOC[C@@H]1F f91846fc9901f7758e55d0631b48c3a6 [0,0,0,1,0,0|3,0,0]=4 6095 B12R1.125 C[C@H](O)CN[C@H]1CCOC[C@@H]1O 0cd11d16d258012fcb62adf04caf54c5 [0,0,0,1,0,0|3,0,0]=4 6096 B12R1.125 C[C@H](O)CN[C@H]1CCOC[C@H]1C ae2435029833a7d6bf296911a51260e4 [0,0,0,1,0,0|2,0,0]=3 6097 B12R1.125 C[C@H](O)CN[C@H]1CCOC[C@H]1O a646be029a1b9cbbb1241ef4405701ad [0,0,0,1,0,0|3,0,0]=4 6098 B12R1.125 C[C@H](O)CN[C@H]1COCC[C@@H]1O 470001a316d5ccb39e1cb2faf6c51fbb [0,0,0,1,0,0|3,0,0]=4 6099 B12R1.125 C[C@H](O)CN[C@H]1COCC[C@H]1O 94ca70a56d97fa77c8a5af854880ff99 [0,0,0,1,0,0|3,0,0]=4 6100 B12R1.125 C[C@H]1CCCCN1CCC(=O)O c9290f325501f9baa3b2ecc780bc54a2 [0,0,0,1,0,0|2,0,1]=4 6101 B12R1.125 C[C@H]1CCCCN1CCN(C)C 623a1d1b3c0355cbb583bb13b7e35323 [0,0,0,1,0,0|3,0,0]=4 6102 B12R1.125 C[C@H]1CCCCN1CCS(=O)C abc132bcb30a1a3fc6ee9794c9857eba [0,0,0,1,0,0|2,0,1]=4 6103 B12R1.125 C[C@H]1CCCC[C@@H]1NCC(=O)O 40f0f18769643cee425fe491ed7a5613 [0,0,0,1,0,0|2,0,1]=4 6104 B12R1.125 C[C@H]1CCCC[C@@H]1NCC(F)F c8ed63ddefb116c868cf6ee2fbd757d9 [0,0,0,1,0,0|3,0,0]=4 6105 B12R1.125 C[C@H]1CCCC[C@@H]1NCN(C)C ea5335f412eeb1d1254dbd70bb62067d [0,0,0,1,0,0|3,0,0]=4 6106 B12R1.125 C[C@H]1CCCC[C@@H]1OCC(=O)O 044aed10f4c3c89ecd76d791a1612e14 [0,0,0,1,0,0|2,0,1]=4 6107 B12R1.125 C[C@H]1CCCC[C@@H]1OCC(F)F 619ca808b125801e2bf3a7844db5a4c4 [0,0,0,1,0,0|3,0,0]=4 6108 B12R1.125 C[C@H]1CCCC[C@@H]1OCN(C)C 015c17170ccdd17de8b62a734452c655 [0,0,0,1,0,0|3,0,0]=4 6109 B12R1.125 C[C@H]1CCCC[C@H]1NCC(=O)O 0ab6a34fb8a428f99e931db1915c7a5d [0,0,0,1,0,0|2,0,1]=4 6110 B12R1.125 C[C@H]1CCCC[C@H]1NCC(F)F fd303e07c2c2886858227f8de88ba4ed [0,0,0,1,0,0|3,0,0]=4 6111 B12R1.125 C[C@H]1CCCC[C@H]1NCN(C)C d777d4c88928591f398c71b2d4ffb6d8 [0,0,0,1,0,0|3,0,0]=4 6112 B12R1.125 C[C@H]1CCCC[C@H]1OCC(=O)O 4ba3c5ece2b751a10a26e800b7b556bd [0,0,0,1,0,0|2,0,1]=4 6113 B12R1.125 C[C@H]1CCCC[C@H]1OCC(F)F 6d5145d213d0de429f53220a1894a96b [0,0,0,1,0,0|3,0,0]=4 6114 B12R1.125 C[C@H]1CCCC[C@H]1OCN(C)C f14e931df27ce0c60b7ffbc174fb8c31 [0,0,0,1,0,0|3,0,0]=4 6115 B12R1.130 C=C(C)CCCN1CCCC1C 0bf0179a4cc952c8c1c04d7181eae5ef [0,0,0,1,0,0|2,0,1]=4 6116 B12R1.130 C=C(C)CCCN1CCC[C@@H]1C fbfa3e5ac6f2424f2855b4728971f0c5 [0,0,0,1,0,0|2,0,1]=4 6117 B12R1.130 C=C(C)CCCN1CCC[C@H]1C 6d4215e5f4e150bfd8e2e6240e1fb60c [0,0,0,1,0,0|2,0,1]=4 6118 B12R1.130 C=C(C)CCOC1CCCC1C 5c69adb2c551559124561be80e218fd5 [0,0,0,1,0,0|2,0,1]=4 6119 B12R1.130 C=C(C)CCO[C@@H]1CCC[C@@H]1C 4494d533f5ad24043dfcbfc29efd5cf4 [0,0,0,1,0,0|2,0,1]=4 6120 B12R1.130 C=C(C)CCO[C@@H]1CCC[C@H]1C a89a7f569f60e7024f3070162610b0d5 [0,0,0,1,0,0|2,0,1]=4 6121 B12R1.130 C=C(C)CCO[C@H]1CCC[C@@H]1C e98ae2a6b0804cd22801f0a06031ec1e [0,0,0,1,0,0|2,0,1]=4 6122 B12R1.130 C=C(C)CCO[C@H]1CCC[C@H]1C 9bee8219b16e5ac5c835639c1fafb463 [0,0,0,1,0,0|2,0,1]=4 6123 B12R1.130 C=C(C)COCC1CCCC1C ef39d1bf33d1bf9b76301f0eb433bfcb [0,0,0,1,0,0|2,0,1]=4 6124 B12R1.130 CC(=O)CCCN1CCCC1C dde1b9e8bf9567e285903739a6c286ae [0,0,0,1,0,0|1,0,2]=4 6125 B12R1.130 CC(=O)CCCN1CCC[C@@H]1C 841c2ca72e401772975f412cbbeaf059 [0,0,0,1,0,0|1,0,2]=4 6126 B12R1.130 CC(=O)CCCN1CCC[C@H]1C ece84e5b96312ca830d8301458815d8e [0,0,0,1,0,0|1,0,2]=4 6127 B12R1.130 CC(=O)CCOC1CCCC1C 6505f58b02c1b7d1fccd4e6f2ac4e698 [0,0,0,1,0,0|1,0,2]=4 6128 B12R1.130 CC(=O)CCO[C@@H]1CCC[C@@H]1C 10170fa43a42ea03c9690273b1ba218b [0,0,0,1,0,0|1,0,2]=4 6129 B12R1.130 CC(=O)CCO[C@@H]1CCC[C@H]1C bc11a5203dce1a29031dfaae7e29317f [0,0,0,1,0,0|1,0,2]=4 6130 B12R1.130 CC(=O)CCO[C@H]1CCC[C@@H]1C d000d93c64f2d120135215c4a01f5222 [0,0,0,1,0,0|1,0,2]=4 6131 B12R1.130 CC(=O)CCO[C@H]1CCC[C@H]1C 9d947f9876e261829479ad15dbb43e98 [0,0,0,1,0,0|1,0,2]=4 6132 B12R1.130 CC(C)CCCN1CCCC1C 86c6457b56f5b43104eb36ca56f1664d [0,0,0,1,0,0|2,0,0]=3 6133 B12R1.130 CC(C)CCCN1CCCC1O 7bd1e4a81b15d696e7ff17608757eb59 [0,0,0,1,0,0|3,0,0]=4 6134 B12R1.130 CC(C)CCCN1CCC[C@@H]1C 2a6480cb4a97f3b4a88d0aa57275c736 [0,0,0,1,0,0|2,0,0]=3 6135 B12R1.130 CC(C)CCCN1CCC[C@H]1C 91043a8cc4b5b430988c6886458c3da6 [0,0,0,1,0,0|2,0,0]=3 6136 B12R1.130 CC(C)CCCN1CCSC1C be09b8202b7b7002146e04d0a4cfc92c [0,0,0,1,0,0|3,0,0]=4 6137 B12R1.130 CC(C)CCNC1CCCC1O 9284c9257fd3048d771b0505ca494a8d [0,0,0,1,0,0|3,0,0]=4 6138 B12R1.130 CC(C)CCN[C@@H]1CCC[C@@H]1O 42e063ab015b88097fbcf6fb8bb43b83 [0,0,0,1,0,0|3,0,0]=4 6139 B12R1.130 CC(C)CCN[C@@H]1CCC[C@H]1O 1e0f6993404673a25f8a736675efcaac [0,0,0,1,0,0|3,0,0]=4 6140 B12R1.130 CC(C)CCN[C@H]1CCC[C@@H]1O 88ea5396e680b47c7a3bce810b533a7f [0,0,0,1,0,0|3,0,0]=4 6141 B12R1.130 CC(C)CCN[C@H]1CCC[C@H]1O d08690b357191e2fd0b0e8a705f0ea4d [0,0,0,1,0,0|3,0,0]=4 6142 B12R1.130 CC(C)CCOC1CCCC1C 55ddd67b205cc87f9d8a4ecc513d91dd [0,0,0,1,0,0|2,0,0]=3 6143 B12R1.130 CC(C)CCOC1COCC1C 5383498a3f2fc072422193f4f30e592a [0,0,0,1,0,0|3,0,0]=4 6144 B12R1.130 CC(C)CCO[C@@H]1CCC[C@@H]1C e59c1323e858c9c3d2bf317c0fd61c74 [0,0,0,1,0,0|2,0,0]=3 6145 B12R1.130 CC(C)CCO[C@@H]1CCC[C@H]1C 74ebbbf15f3e4aaeaaad525df6ba374f [0,0,0,1,0,0|2,0,0]=3 6146 B12R1.130 CC(C)CCO[C@@H]1CCC[C@H]1F 2c063e2512bbdb35ff7912c9bbbcf3a8 [0,0,0,1,0,0|3,0,0]=4 6147 B12R1.130 CC(C)CCO[C@@H]1COC[C@@H]1C c898f35037b6ef175c8912066caf6115 [0,0,0,1,0,0|3,0,0]=4 6148 B12R1.130 CC(C)CCO[C@H]1CCC[C@@H]1C 3ee8196bc72337edf7e94b77c0a3b3da [0,0,0,1,0,0|2,0,0]=3 6149 B12R1.130 CC(C)CCO[C@H]1CCC[C@H]1C c90c234a52c37dcb8b6930ea70082dd0 [0,0,0,1,0,0|2,0,0]=3 6150 B12R1.130 CC(C)CCO[C@H]1COC[C@@H]1C 8ce3e12148cc8388ed292f53cb388af8 [0,0,0,1,0,0|3,0,0]=4 6151 B12R1.130 CC(C)CCO[C@H]1COC[C@H]1C cb1fd625c78d46680976c8a798fbb091 [0,0,0,1,0,0|3,0,0]=4 6152 B12R1.130 CC(C)CNCC1CCCC1O b1c15c8d84bfc51012de32e34db6e508 [0,0,0,1,0,0|3,0,0]=4 6153 B12R1.130 CC(C)CNCC1CCCN1C d2f33c1ba5bb885aab1f35e875430c18 [0,0,0,1,0,0|3,0,0]=4 6154 B12R1.130 CC(C)CNCC1COCC1C 7a9ff37d80d15b3dddd307073b6a4ca7 [0,0,0,1,0,0|3,0,0]=4 6155 B12R1.130 CC(C)CNC[C@@H]1CCCN1C 482b8bebf53cc18ccceb9c8dab6643fd [0,0,0,1,0,0|3,0,0]=4 6156 B12R1.130 CC(C)CNC[C@H]1CCCN1C 5b86a3989193f7d91dd15beaa33b93ad [0,0,0,1,0,0|3,0,0]=4 6157 B12R1.130 CC(C)COCC1CCCC1C 25a379906e701179b1f1262eba327967 [0,0,0,1,0,0|2,0,0]=3 6158 B12R1.130 CC(C)COCC1CCCN1C 3765885d811a0763182f4ce700f6cbea [0,0,0,1,0,0|3,0,0]=4 6159 B12R1.130 CC(C)COCC1COCC1C ee2232d670e257f4ab13378aac156f0b [0,0,0,1,0,0|3,0,0]=4 6160 B12R1.130 CC(C)COCC1OCCC1C 07e7621cca6e9d38993f0d2a48583845 [0,0,0,1,0,0|3,0,0]=4 6161 B12R1.130 CC(C)COC[C@@H]1CCCN1C 31f5b0930d85f8fe402d4fab4238094f [0,0,0,1,0,0|3,0,0]=4 6162 B12R1.130 CC(C)COC[C@@H]1CCC[C@H]1F d90be6f2735313381ffc4283696c00c9 [0,0,0,1,0,0|3,0,0]=4 6163 B12R1.130 CC(C)COC[C@@H]1CCO[C@@H]1C 2d19381726fb8a7ae4f8a371b4d09771 [0,0,0,1,0,0|3,0,0]=4 6164 B12R1.130 CC(C)COC[C@H]1CCCN1C c3b103173f0e38d67782ee0be8cef022 [0,0,0,1,0,0|3,0,0]=4 6165 B12R1.130 CC(C)NCCC1CCCN1C 00b3bc8abab752d598a839754250600d [0,0,0,1,0,0|3,0,0]=4 6166 B12R1.130 CC(C)NCC[C@@H]1CCCN1C a3a15570b47b7f83d644294b6c1700d4 [0,0,0,1,0,0|3,0,0]=4 6167 B12R1.130 CC(C)NCC[C@H]1CCCN1C 2066fa1e2a42e47875ce227ff518ea39 [0,0,0,1,0,0|3,0,0]=4 6168 B12R1.130 CC(C)OCCC1CCCN1C 8bfc94e9341130c48a9dcf79bf3ba006 [0,0,0,1,0,0|3,0,0]=4 6169 B12R1.130 CC(C)OCCN1CCCC1C f8df31cff2ddbd1c0ac9a8293ce011a4 [0,0,0,1,0,0|3,0,0]=4 6170 B12R1.130 CC(C)OCCN1CCC[C@@H]1C 62dc67f3f78da554fc31fde466d85896 [0,0,0,1,0,0|3,0,0]=4 6171 B12R1.130 CC(C)OCCN1CCC[C@H]1C e2d20ae7c0f1d34ab09e13860712c723 [0,0,0,1,0,0|3,0,0]=4 6172 B12R1.130 CC(C)OCC[C@@H]1CCCN1C d43e72bf913f8c825c2e57a73c092783 [0,0,0,1,0,0|3,0,0]=4 6173 B12R1.130 CC(C)OCC[C@H]1CCCN1C 2187428190f134b8663ca4227bec956c [0,0,0,1,0,0|3,0,0]=4 6174 B12R1.130 CC(C)OCOC1CCCC1C e4c9d7819ba65ac3e01113c70248bb04 [0,0,0,1,0,0|3,0,0]=4 6175 B12R1.130 CC(C)OCO[C@@H]1CCC[C@@H]1C a3cf271d04faf5e4332d95abb6e3de10 [0,0,0,1,0,0|3,0,0]=4 6176 B12R1.130 CC(C)OCO[C@@H]1CCC[C@H]1C 188bd73cde6b0c3eb9ee7b4f04b3442f [0,0,0,1,0,0|3,0,0]=4 6177 B12R1.130 CC(C)OCO[C@H]1CCC[C@@H]1C eed40b8bd275ed94081208f395693df4 [0,0,0,1,0,0|3,0,0]=4 6178 B12R1.130 CC(C)OCO[C@H]1CCC[C@H]1C 130328a8dabcb5224dc1e361b707c089 [0,0,0,1,0,0|3,0,0]=4 6179 B12R1.130 CC(C)SCCN1CCCC1C 25610307aff45bfd0e6621755b8b44c0 [0,0,0,1,0,0|3,0,0]=4 6180 B12R1.130 CC(C)SCCN1CCC[C@@H]1C 51910affb98f74d598c3e30e885c18e5 [0,0,0,1,0,0|3,0,0]=4 6181 B12R1.130 CC(C)SCCN1CCC[C@H]1C b5d00616bb2c6dc59caa7a6387baccc0 [0,0,0,1,0,0|3,0,0]=4 6182 B12R1.130 CC(F)COCC1COCC1C a81e6f03f54ed9b75983c96f2975ff5e [0,0,0,1,0,0|3,0,0]=4 6183 B12R1.130 CC(O)CCCN1CCCC1C 07bbfca7dbe2a9df3407be5bed30fc8f [0,0,0,1,0,0|1,0,0]=2 6184 B12R1.130 CC(O)CCCN1CCCC1O 954f474897226519601f90699ec378b2 [0,0,0,1,0,0|2,0,0]=3 6185 B12R1.130 CC(O)CCCN1CCC[C@@H]1C 3c81e812dd208d68c66e263556e377d5 [0,0,0,1,0,0|1,0,0]=2 6186 B12R1.130 CC(O)CCCN1CCC[C@H]1C 79c35954d2b06dbfbe9004387ccab7dd [0,0,0,1,0,0|1,0,0]=2 6187 B12R1.130 CC(O)CCCN1CCSC1C 500eed896d0bf71646f3451dffd7c777 [0,0,0,1,0,0|2,0,0]=3 6188 B12R1.130 CC(O)CCNC1CCCC1O f5d1b0f7ecfb0856bd2664891c9340df [0,0,0,1,0,0|2,0,0]=3 6189 B12R1.130 CC(O)CCNC1COCC1O 87a191e13ec9e15926c87c93aa201593 [0,0,0,1,0,0|3,0,0]=4 6190 B12R1.130 CC(O)CCN[C@@H]1CCC[C@@H]1O 51371093b255e2771cf70d9d40c884ce [0,0,0,1,0,0|2,0,0]=3 6191 B12R1.130 CC(O)CCN[C@@H]1CCC[C@H]1O 779192d309da7b474182bf2c7e8f267d [0,0,0,1,0,0|2,0,0]=3 6192 B12R1.130 CC(O)CCN[C@@H]1COC[C@@H]1O df6ba115208f766486bd54c76d12725b [0,0,0,1,0,0|3,0,0]=4 6193 B12R1.130 CC(O)CCN[C@@H]1COC[C@H]1O be3327ad5b35cce9b8b98d34015bb0b7 [0,0,0,1,0,0|3,0,0]=4 6194 B12R1.130 CC(O)CCN[C@H]1CCC[C@@H]1O 8d618448ee96366f9ac1d4059b03a4ca [0,0,0,1,0,0|2,0,0]=3 6195 B12R1.130 CC(O)CCN[C@H]1CCC[C@H]1O dc32ea7bb42d3196fd6b8da427b03879 [0,0,0,1,0,0|2,0,0]=3 6196 B12R1.130 CC(O)CCN[C@H]1COC[C@@H]1O b1920415b5e8ab94c3b07686db913014 [0,0,0,1,0,0|3,0,0]=4 6197 B12R1.130 CC(O)CCN[C@H]1COC[C@H]1F f8d7a3086b8d54c64174d3d8593d7316 [0,0,0,1,0,0|3,0,0]=4 6198 B12R1.130 CC(O)CCN[C@H]1COC[C@H]1O cb1f48dd4722fca0c1f5d9bf9dd467ce [0,0,0,1,0,0|3,0,0]=4 6199 B12R1.130 CC(O)CNCC1CCCC1O 00afced8434df9509f3893957b6b2222 [0,0,0,1,0,0|2,0,0]=3 6200 B12R1.130 CC(O)CNCC1CCCN1C c382762e69ed9c1bee3323eafafa44a6 [0,0,0,1,0,0|2,0,0]=3 6201 B12R1.130 CC(O)CNCC1COCC1C 87d0269737ba8ba926dca39ef1feab81 [0,0,0,1,0,0|2,0,0]=3 6202 B12R1.130 CC(O)CNC[C@@H]1CCCN1C 23cb6364b80cfb5e8285a4b9d85bbf66 [0,0,0,1,0,0|2,0,0]=3 6203 B12R1.130 CC(O)CNC[C@@H]1COC[C@@H]1O 8a51a632cf1e3a3d28e3ea6a0469cf7b [0,0,0,1,0,0|3,0,0]=4 6204 B12R1.130 CC(O)CNC[C@H]1CCCN1C 27ec24b270057f2673bab68bf24d9a32 [0,0,0,1,0,0|2,0,0]=3 6205 B12R1.130 CC(S)COCC1COCC1C 3c1ec09d405223b1a445ca0a22f17640 [0,0,0,1,0,0|2,1,0]=4 6206 B12R1.130 CC1CCCC1COCC(=O)O 5d747dc77f69b0ec1ca2e97827cb59a5 [0,0,0,1,0,0|2,0,1]=4 6207 B12R1.130 CC1CCCC1COCC(F)F 5ee56bef5365dfd0877be89aa2b80e21 [0,0,0,1,0,0|3,0,0]=4 6208 B12R1.130 CC1CCCC1COCN(C)C ba6db364246180c5a95bc5271e3301a0 [0,0,0,1,0,0|3,0,0]=4 6209 B12R1.130 CC1CCCC1OCCC(=O)O 56a676c9348d4a291a6176d63e2ef24f [0,0,0,1,0,0|2,0,1]=4 6210 B12R1.130 CC1CCCC1OCCN(C)C 6a0a3c6ff7c283028b0b2703a095c469 [0,0,0,1,0,0|3,0,0]=4 6211 B12R1.130 CC1CCCC1OCCS(=O)C 3f1ff7dbebcb89a252da68a4131f2bf4 [0,0,0,1,0,0|2,0,1]=4 6212 B12R1.130 CC1CCCN1CCCC(=O)O 4ab47bf7f7a600f154632a8b1ae321e6 [0,0,0,1,0,0|2,0,1]=4 6213 B12R1.130 CC1CCCN1CCCN(C)C 15368d320a92badcbce28f26651f5caa [0,0,0,1,0,0|3,0,0]=4 6214 B12R1.130 CC1COCC1CNC[C@@H](C)O 1348940b383da585aa44bffeb6964800 [0,0,0,1,0,0|2,0,0]=3 6215 B12R1.130 CC1COCC1CNC[C@H](C)O 2d08b5efb3fba2655df58e36bea47675 [0,0,0,1,0,0|2,0,0]=3 6216 B12R1.130 CC1COCC1COC[C@@H](C)F 180a947ec1d2094491bf9515d9f1676d [0,0,0,1,0,0|3,0,0]=4 6217 B12R1.130 CC1COCC1COC[C@H](C)F bf66614622a0cb97045356af28f0c8e9 [0,0,0,1,0,0|3,0,0]=4 6218 B12R1.130 C[C@@H](O)CCNC1CCCC1O b5d204413262c59430bbdfadd2a2b916 [0,0,0,1,0,0|2,0,0]=3 6219 B12R1.130 C[C@@H](O)CCNC1COCC1O c7aa2b915fb1852b8b26fb2a3d8cc074 [0,0,0,1,0,0|3,0,0]=4 6220 B12R1.130 C[C@@H](O)CCN[C@@H]1CCC[C@H]1O 87c715507834a609269210877a8e3b66 [0,0,0,1,0,0|2,0,0]=3 6221 B12R1.130 C[C@@H](O)CCN[C@@H]1COC[C@H]1O 6715251af4a4b17e910540fa534f6125 [0,0,0,1,0,0|3,0,0]=4 6222 B12R1.130 C[C@@H](O)CCN[C@H]1CCC[C@@H]1O 9d4eb8817c33b5100968323895f19d3e [0,0,0,1,0,0|2,0,0]=3 6223 B12R1.130 C[C@@H](O)CNCC1CCCC1O 3ceea2a2ce893f150edbccc9d2a47587 [0,0,0,1,0,0|2,0,0]=3 6224 B12R1.130 C[C@@H](O)CNCC1CCCN1C 3f07d703db1fdcf95ef10092d5cf5c7b [0,0,0,1,0,0|2,0,0]=3 6225 B12R1.130 C[C@@H](O)CNC[C@@H]1CCCN1C 2e9c1771b9b39d8cc2c08ced0e0d9290 [0,0,0,1,0,0|2,0,0]=3 6226 B12R1.130 C[C@@H](O)CNC[C@@H]1COC[C@@H]1O d837237dd0d7b7f31d96b44a9044241b [0,0,0,1,0,0|3,0,0]=4 6227 B12R1.130 C[C@@H](O)CNC[C@H]1CCCN1C 733a217d7544b36dfc2f18bd0dfb2c12 [0,0,0,1,0,0|2,0,0]=3 6228 B12R1.130 C[C@@H]1CCCN1CCCC(=O)O 668734cdbcb71bf415fa2c681e572718 [0,0,0,1,0,0|2,0,1]=4 6229 B12R1.130 C[C@@H]1CCCN1CCCN(C)C 7e6e2d04c90a8aada6d238a470808025 [0,0,0,1,0,0|3,0,0]=4 6230 B12R1.130 C[C@@H]1CCC[C@@H]1OCCC(=O)O 5a5ecffa7effcc121266ff800207ec13 [0,0,0,1,0,0|2,0,1]=4 6231 B12R1.130 C[C@@H]1CCC[C@@H]1OCCN(C)C 64a9d80f288d08f8ce5d3900d70ab71d [0,0,0,1,0,0|3,0,0]=4 6232 B12R1.130 C[C@@H]1CCC[C@@H]1OCCS(=O)C ad9e559bd31d149078387f6619a2c645 [0,0,0,1,0,0|2,0,1]=4 6233 B12R1.130 C[C@@H]1CCC[C@H]1OCCC(=O)O 08fc9aac06b6f43e522f643cf1b1b1f3 [0,0,0,1,0,0|2,0,1]=4 6234 B12R1.130 C[C@@H]1CCC[C@H]1OCCN(C)C c4b2225fad837870364ed7d86e9c7e33 [0,0,0,1,0,0|3,0,0]=4 6235 B12R1.130 C[C@@H]1CCC[C@H]1OCCS(=O)C 21e9f9f61ac8cce50a24480cc06c8650 [0,0,0,1,0,0|2,0,1]=4 6236 B12R1.130 C[C@H](O)CCNC1CCCC1O 8d97f776b7be4beded535b9cf99ae1b9 [0,0,0,1,0,0|2,0,0]=3 6237 B12R1.130 C[C@H](O)CCNC1COCC1O 036603bccbe03a2bda7f63466a512c1e [0,0,0,1,0,0|3,0,0]=4 6238 B12R1.130 C[C@H](O)CCN[C@@H]1CCC[C@H]1O 68f4b62ddeedb5747ad518f35090961c [0,0,0,1,0,0|2,0,0]=3 6239 B12R1.130 C[C@H](O)CCN[C@@H]1COC[C@H]1O 9902d1bc0877760d3630c5c08f4f76e0 [0,0,0,1,0,0|3,0,0]=4 6240 B12R1.130 C[C@H](O)CCN[C@H]1CCC[C@@H]1O 2298f5ee00024db3a7095e3a5cd38323 [0,0,0,1,0,0|2,0,0]=3 6241 B12R1.130 C[C@H](O)CNCC1CCCC1O 04a064981a7efebacbc7371927c0c34a [0,0,0,1,0,0|2,0,0]=3 6242 B12R1.130 C[C@H](O)CNCC1CCCN1C ed8ba37b11ebeccb529671ac6dbb0ce3 [0,0,0,1,0,0|2,0,0]=3 6243 B12R1.130 C[C@H](O)CNC[C@@H]1CCCN1C 042869d9d840c0be936bf37b362e4b70 [0,0,0,1,0,0|2,0,0]=3 6244 B12R1.130 C[C@H](O)CNC[C@@H]1COC[C@@H]1O c18348eb6670e88c2bbbaa3de82fcc94 [0,0,0,1,0,0|3,0,0]=4 6245 B12R1.130 C[C@H](O)CNC[C@H]1CCCN1C 70f38c9eaf65fd0ca763f89ea0923b1f [0,0,0,1,0,0|2,0,0]=3 6246 B12R1.130 C[C@H]1CCCN1CCCC(=O)O 6d13ef1e639c38c80ed29a186c3fc3ae [0,0,0,1,0,0|2,0,1]=4 6247 B12R1.130 C[C@H]1CCCN1CCCN(C)C a347a6b95ff876b8e568be3a5e238e37 [0,0,0,1,0,0|3,0,0]=4 6248 B12R1.130 C[C@H]1CCC[C@@H]1OCCC(=O)O 3a7b18a9f03c4de5bec7c30bf0be3457 [0,0,0,1,0,0|2,0,1]=4 6249 B12R1.130 C[C@H]1CCC[C@@H]1OCCN(C)C fc9b3dfed7b9836848db5acf533e8f82 [0,0,0,1,0,0|3,0,0]=4 6250 B12R1.130 C[C@H]1CCC[C@@H]1OCCS(=O)C af32a78aa8c4347432d952c8125b6fb2 [0,0,0,1,0,0|2,0,1]=4 6251 B12R1.130 C[C@H]1CCC[C@H]1OCCC(=O)O 92b80d798b8af41bd97490339c211682 [0,0,0,1,0,0|2,0,1]=4 6252 B12R1.130 C[C@H]1CCC[C@H]1OCCN(C)C 25fcc0085a2f95bb1b9fb2588be9c294 [0,0,0,1,0,0|3,0,0]=4 6253 B12R1.130 C[C@H]1CCC[C@H]1OCCS(=O)C 8fd067e2762b9d4640b3bb535dceaec0 [0,0,0,1,0,0|2,0,1]=4 6254 B12R1.143 C=C(C)CCCOCC1CC1C 4a157e18e3b824c8e50ab5753dd8a3bf [0,0,0,1,0,0|2,0,1]=4 6255 B12R1.143 C=C(C)CCCOC[C@@H]1C[C@@H]1C 948b9673faf0ea3e4f19aaff828cc04d [0,0,0,1,0,0|2,0,1]=4 6256 B12R1.143 C=C(C)CCCOC[C@@H]1C[C@H]1C 863d1b9a4e0450c71bf1170ab9c077c2 [0,0,0,1,0,0|2,0,1]=4 6257 B12R1.143 C=C(C)CCCOC[C@H]1C[C@@H]1C 16da1cd242ac69578c59f9cf0f8f36eb [0,0,0,1,0,0|2,0,1]=4 6258 B12R1.143 CC(=O)CCCCNC1CC1C 55bbf993b7c8f2bbf1ac7a79455b05b3 [0,0,0,1,0,0|1,0,2]=4 6259 B12R1.143 CC(=O)CCCOCC1CC1C aa22d4f4262dfa088fd4f2328334e4ab [0,0,0,1,0,0|1,0,2]=4 6260 B12R1.143 CC(=O)CCCOC[C@@H]1C[C@@H]1C 7c7fcdf9159e672ec3f9c82e191b90b0 [0,0,0,1,0,0|1,0,2]=4 6261 B12R1.143 CC(=O)CCCOC[C@@H]1C[C@H]1C 4068970b116183d71203a662da6b161d [0,0,0,1,0,0|1,0,2]=4 6262 B12R1.143 CC(=O)CCCOC[C@H]1C[C@@H]1C 69388d143590813b85339ade60aa3c70 [0,0,0,1,0,0|1,0,2]=4 6263 B12R1.143 CC(C)CCCCNC1CC1C 7dd40b309285d27f47992d72724c7a95 [0,0,0,1,0,0|2,0,0]=3 6264 B12R1.143 CC(C)CCCCN[C@@H]1C[C@H]1F 51854a2a0c02c6de5c4464ea70d26126 [0,0,0,1,0,0|3,0,0]=4 6265 B12R1.143 CC(C)CCCCN[C@H]1C[C@@H]1F ae943138caef41bb8bb493f8c9e4e39b [0,0,0,1,0,0|3,0,0]=4 6266 B12R1.143 CC(C)CCCCN[C@H]1C[C@H]1F 6533cc312636eb41b1d588066a28229b [0,0,0,1,0,0|3,0,0]=4 6267 B12R1.143 CC(C)CCCOCC1CC1C 46606da454d203c70411fe571b24f097 [0,0,0,1,0,0|2,0,0]=3 6268 B12R1.143 CC(C)CCCOC[C@@H]1C[C@@H]1C c1db9ef3db44480d32efbe6686a9fdd2 [0,0,0,1,0,0|2,0,0]=3 6269 B12R1.143 CC(C)CCCOC[C@@H]1C[C@@H]1F 8ffae98c46f983db3ad25780112d4c45 [0,0,0,1,0,0|3,0,0]=4 6270 B12R1.143 CC(C)CCCOC[C@@H]1C[C@H]1C 209cba845e05b0c46f0812c9cada77b0 [0,0,0,1,0,0|2,0,0]=3 6271 B12R1.143 CC(C)CCCOC[C@@H]1C[C@H]1F 3418b3e71834e8ecc1fa8534812fae67 [0,0,0,1,0,0|3,0,0]=4 6272 B12R1.143 CC(C)CCCOC[C@H]1C[C@@H]1C 8f2431ec6beba1f602e047c0e14a2baf [0,0,0,1,0,0|2,0,0]=3 6273 B12R1.143 CC(C)CCCOC[C@H]1C[C@@H]1F 5f8d433250e4cccc145755727b97b99b [0,0,0,1,0,0|3,0,0]=4 6274 B12R1.143 CC(C)CCCOC[C@H]1C[C@H]1F 5a839e5658efe776bc0ecf3ce3e7e212 [0,0,0,1,0,0|3,0,0]=4 6275 B12R1.143 CC(C)COCCNC1CC1C fd0e22657df242c7b95905b8261725a0 [0,0,0,1,0,0|3,0,0]=4 6276 B12R1.143 CC(C)OCCOCC1CC1C 9caf3765fab80e75f30bc5636a044587 [0,0,0,1,0,0|3,0,0]=4 6277 B12R1.143 CC(C)OCCOC[C@@H]1C[C@@H]1C 7e918b452f52b884d0857d721ad76242 [0,0,0,1,0,0|3,0,0]=4 6278 B12R1.143 CC(C)OCCOC[C@@H]1C[C@H]1C ec2bf896ff5d7547b879a77daa0abb73 [0,0,0,1,0,0|3,0,0]=4 6279 B12R1.143 CC(C)OCCOC[C@H]1C[C@@H]1C 544eb5c50ee298127a645087b2e9d4dc [0,0,0,1,0,0|3,0,0]=4 6280 B12R1.143 CC(C)SCCOCC1CC1C 90520eac86048d22c44e59e43a309691 [0,0,0,1,0,0|3,0,0]=4 6281 B12R1.143 CC(C)SCCOC[C@@H]1C[C@@H]1C 5c9b55ac5e20e22ed37e46f86c234af7 [0,0,0,1,0,0|3,0,0]=4 6282 B12R1.143 CC(C)SCCOC[C@@H]1C[C@H]1C 45b251e4b4add50f5a84ee2c223def54 [0,0,0,1,0,0|3,0,0]=4 6283 B12R1.143 CC(C)SCCOC[C@H]1C[C@@H]1C a24ceee19fa45227437fb7624563bea6 [0,0,0,1,0,0|3,0,0]=4 6284 B12R1.143 CC(O)CCCCNC1CC1C 29655dba1e6b00da237064026134f39e [0,0,0,1,0,0|1,0,0]=2 6285 B12R1.143 CC(O)CCCCN[C@@H]1C[C@H]1F 4d3a30bcc15afca6a268b93f9b869b2c [0,0,0,1,0,0|2,0,0]=3 6286 B12R1.143 CC(O)CCCCN[C@H]1C[C@@H]1F afd5770e9fbd8bb887d164000235dde6 [0,0,0,1,0,0|2,0,0]=3 6287 B12R1.143 CC(O)CCCCN[C@H]1C[C@H]1F a13a4e9b072c39ee113b961d4110a7d8 [0,0,0,1,0,0|2,0,0]=3 6288 B12R1.143 CC1CC1COCCCC(=O)O 6035d8c58cc1ce90a6456790cbff342f [0,0,0,1,0,0|2,0,1]=4 6289 B12R1.143 CC1CC1COCCCN(C)C a191ff3b345860c7adc17a8a5234a8d5 [0,0,0,1,0,0|3,0,0]=4 6290 B12R1.143 CC1CC1NCCCCC(=O)O 0f16b0427d6ce6178d2dbb892215b39a [0,0,0,1,0,0|2,0,1]=4 6291 B12R1.143 CC1CC1NCCCCN(C)C 294e30d20cd77e20774da6ba81a0913b [0,0,0,1,0,0|3,0,0]=4 6292 B12R1.143 CC1CC1NCCCC[C@@H](C)O c65f045495772fd4ca5e3ca74e33fb9b [0,0,0,1,0,0|1,0,0]=2 6293 B12R1.143 C[C@@H](O)CCCCN[C@@H]1C[C@H]1F f804dcc69c3f466fc2e0850c7633a1b5 [0,0,0,1,0,0|2,0,0]=3 6294 B12R1.143 C[C@@H](O)CCCCN[C@H]1C[C@@H]1F dfcae454a06bf024fb39f114f3f689d7 [0,0,0,1,0,0|2,0,0]=3 6295 B12R1.143 C[C@@H](O)CCCCN[C@H]1C[C@H]1F 41d4ed1d4987d2f571b1b8d5a3d85438 [0,0,0,1,0,0|2,0,0]=3 6296 B12R1.143 C[C@@H]1C[C@H]1COCCCC(=O)O e1b316f49ab33a5e2379ed02e211735e [0,0,0,1,0,0|2,0,1]=4 6297 B12R1.143 C[C@@H]1C[C@H]1COCCCN(C)C fe93aee3fb9aa9fa8c1530b545177bbd [0,0,0,1,0,0|3,0,0]=4 6298 B12R1.143 C[C@H]1C[C@@H]1COCCCC(=O)O 60b4ea2f2c06aed11bbad4fc3189baaa [0,0,0,1,0,0|2,0,1]=4 6299 B12R1.143 C[C@H]1C[C@@H]1COCCCN(C)C 167945bb3a2a376c32f9d6ffc662b185 [0,0,0,1,0,0|3,0,0]=4 6300 B12R1.143 C[C@H]1C[C@H]1COCCCC(=O)O abff6659801b457839b67e942e9f2a2c [0,0,0,1,0,0|2,0,1]=4 6301 B12R1.143 C[C@H]1C[C@H]1COCCCN(C)C b5bdeb71e3c8e87f11b70cd7de4d1063 [0,0,0,1,0,0|3,0,0]=4 6302 B12R1.162 CC(C)CCN1CCC1CCO 4e27dabfbbc1f7af58c614a81efe5e72 [0,0,0,1,0,0|3,0,0]=4 6303 B12R1.162 CC(O)CCN1CCC1CCO 2c527cc9974dedd94adf4ffc2ef816c9 [0,0,0,1,0,0|2,0,0]=3 6304 B12R1.162 COCC1CCN1CCC(C)C dd365e499d9b4ac63845603e3d1794cc [0,0,0,1,0,0|3,0,0]=4 6305 B12R1.162 COCC1CCN1CCC(C)O a2c9ba93eaf1a3e9455acc88ac97be59 [0,0,0,1,0,0|2,0,0]=3 6306 B12R1.162 COC[C@@H]1CCN1CCC(C)C ddcbfc90fb3216ca8a16658df56a3679 [0,0,0,1,0,0|3,0,0]=4 6307 B12R1.162 COC[C@@H]1CCN1CCC(C)O a76bf21101c37cfd755d699520bc29c7 [0,0,0,1,0,0|2,0,0]=3 6308 B12R1.162 COC[C@H]1CCN1CCC(C)C 9a95221c932fffd4cc9d342b97cc52d8 [0,0,0,1,0,0|3,0,0]=4 6309 B12R1.162 COC[C@H]1CCN1CCC(C)O e207429a0706e2daba3563b1db9d00a8 [0,0,0,1,0,0|2,0,0]=3 6310 B12R1.188 COC[C@@H]1C[C@@H]1NCCC(C)C 83e6666d94fbe376c737c987519d6b84 [0,0,0,1,0,0|3,0,0]=4 6311 B12R1.188 COC[C@@H]1C[C@@H]1NCCC(C)O 3aa709b5ffbe056660506b7aaed04132 [0,0,0,1,0,0|2,0,0]=3 6312 B12R1.188 COC[C@H]1C[C@@H]1NCCC(C)C 639558ee53d9e9aa47b1c3c887dd29b9 [0,0,0,1,0,0|3,0,0]=4 6313 B12R1.188 COC[C@H]1C[C@@H]1NCCC(C)O 99cd53498e3c852e18e56d16f7ec98de [0,0,0,1,0,0|2,0,0]=3 6314 B12R1.210 C=C(C)CN1CCCCCC1C 5bbb6611371a85d3a4f1e4e0d03ef0a5 [0,0,0,1,0,0|2,0,1]=4 6315 B12R1.210 CC(C)CN1CCCCCC1C 12734b44e39861a5f1a71bd23ec9db6d [0,0,0,1,0,0|2,0,0]=3 6316 B12R1.210 CC(C)CN1CCCOCC1C 58dfeeceddcf19ff8541925eb6166a4d [0,0,0,1,0,0|3,0,0]=4 6317 B12R1.210 CC(C)CN1CCOCCC1C b07585bd06916f9ae6495809bb69c806 [0,0,0,1,0,0|3,0,0]=4 6318 B12R1.210 CC(C)CN1CCSCCC1C 0c693117fac61356284c356c9b8b4772 [0,0,0,1,0,0|3,0,0]=4 6319 B12R1.210 CC(C)N[C@@H]1CCCCC[C@@H]1O be68bf84e7d02d67b5f9b5cb3f783228 [0,0,0,1,0,0|3,0,0]=4 6320 B12R1.210 CC(C)N[C@@H]1CCCCC[C@H]1O 64e7a0f07aa1e3985c40a9f9d09b2dcc [0,0,0,1,0,0|3,0,0]=4 6321 B12R1.210 CC(C)N[C@H]1CCCCC[C@@H]1O 46945af90dfe805847ad29e8f873bdf2 [0,0,0,1,0,0|3,0,0]=4 6322 B12R1.210 CC(O)CN1CCCCCC1C 24097186230ad28b9b3fb73e0d0c63bc [0,0,0,1,0,0|1,0,0]=2 6323 B12R1.210 CC(O)CN1CCCOCC1C 6c0e3067e68c67871a6783b180e3765a [0,0,0,1,0,0|2,0,0]=3 6324 B12R1.210 CC(O)CN1CCOCCC1C 95e7ca6fde9e40b684fbfd6752283f21 [0,0,0,1,0,0|2,0,0]=3 6325 B12R1.210 CC(O)CN1CCSCCC1C c0167f5a71f6cbd92c6ddc7ecac53930 [0,0,0,1,0,0|2,0,0]=3 6326 B12R1.210 CC1CCCCCN1CC(=O)O 32a1dc2217e57877c80e95a979b40d16 [0,0,0,1,0,0|2,0,1]=4 6327 B12R1.210 CC1CCCCCN1CC(F)F b0196226ed7441bdcf026539a3684d58 [0,0,0,1,0,0|3,0,0]=4 6328 B12R1.210 CC1CCCCCN1CN(C)C 52baf05e0bd6714e8280c3bd31412bd1 [0,0,0,1,0,0|3,0,0]=4 6329 B12R1.210 CC1CCCCCN1C[C@@H](C)O a505e0219aee70a874a749d791fe50e4 [0,0,0,1,0,0|1,0,0]=2 6330 B12R1.210 CC1CCCCCN1C[C@H](C)O 5f8487efc4d7409925de831e5d191737 [0,0,0,1,0,0|1,0,0]=2 6331 B12R1.210 CC1CCOCCN1C[C@@H](C)O dc6e7f3f044837fb4e096b4dfcadf899 [0,0,0,1,0,0|2,0,0]=3 6332 B12R1.210 CC1CCOCCN1C[C@H](C)O 2327e91438b2f747fcf78c56ca26d542 [0,0,0,1,0,0|2,0,0]=3 6333 B12R1.210 CC1CCSCCN1C[C@@H](C)O f1e80ca6a29467409c8c308873ebf29a [0,0,0,1,0,0|2,0,0]=3 6334 B12R1.210 CC1CCSCCN1C[C@H](C)O e94d9f0480aa26548473fb685ecb57ab [0,0,0,1,0,0|2,0,0]=3 6335 B12R1.210 CC1COCCCN1C[C@@H](C)O a4673d69c386fcb0b0995cd5502d3a3b [0,0,0,1,0,0|2,0,0]=3 6336 B12R1.210 CC1COCCCN1C[C@H](C)O ddf0379b3a23671622e53c7d50a866f1 [0,0,0,1,0,0|2,0,0]=3 6337 B12R1.229 C=C(C)CCCN[C@@H]1CC[C@H]1C 6eb3f68f8e5e011dfd24c82a038607dd [0,0,0,1,0,0|2,0,1]=4 6338 B12R1.229 C=C(C)CCCN[C@H]1CC[C@H]1C 6a421fee9a4c3883ea796aab95969167 [0,0,0,1,0,0|2,0,1]=4 6339 B12R1.229 CC(=O)CCCN[C@@H]1CC[C@H]1C ae3ba55c4c5c76126d7eae87df30d420 [0,0,0,1,0,0|1,0,2]=4 6340 B12R1.229 CC(=O)CCCN[C@H]1CC[C@H]1C 8667365698507ddc20123017f98402f7 [0,0,0,1,0,0|1,0,2]=4 6341 B12R1.229 CC(C)CCCNC1CCC1F fa094f8d590b426bec8330bdea5b6c51 [0,0,0,1,0,0|3,0,0]=4 6342 B12R1.229 CC(C)CCCNC1CCC1O 9311cb6416ed89fcbb9d2dad79c0cfb8 [0,0,0,1,0,0|3,0,0]=4 6343 B12R1.229 CC(C)CCCNC1COC1C 043fb471a60a3d54cd0764d8e757b18a [0,0,0,1,0,0|3,0,0]=4 6344 B12R1.229 CC(C)CCCN[C@@H]1CC[C@@H]1O ebc94772a88bd2ed445a16efe1b40936 [0,0,0,1,0,0|3,0,0]=4 6345 B12R1.229 CC(C)CCCN[C@@H]1CC[C@H]1C 81ebacd158e259d652a7b77d966ba789 [0,0,0,1,0,0|2,0,0]=3 6346 B12R1.229 CC(C)CCCN[C@@H]1CC[C@H]1O 4dc2d455d4362603fce08fb1dfb8ca9b [0,0,0,1,0,0|3,0,0]=4 6347 B12R1.229 CC(C)CCCN[C@H]1CC[C@@H]1O 8dfb029d751250fac5841e38fe28bfcb [0,0,0,1,0,0|3,0,0]=4 6348 B12R1.229 CC(C)CCCN[C@H]1CC[C@H]1C 57f13625c349b0567244281fa9c3c900 [0,0,0,1,0,0|2,0,0]=3 6349 B12R1.229 CC(C)CCCN[C@H]1CC[C@H]1O d30128f70dd8c366e8b382378b98c6af [0,0,0,1,0,0|3,0,0]=4 6350 B12R1.229 CC(C)CCCOC1COC1C 2429de5d0df9b179cf3f85359265606c [0,0,0,1,0,0|3,0,0]=4 6351 B12R1.229 CC(C)CCNCC1CCN1C 3ad977e244094653ff8e3798954faa2c [0,0,0,1,0,0|3,0,0]=4 6352 B12R1.229 CC(C)CCOCC1CCC1F 7cdca1169dbcf51098360258eadf59f0 [0,0,0,1,0,0|3,0,0]=4 6353 B12R1.229 CC(C)CCOCC1CCN1C e9d1eca7a3c2ed1ac7f4ff00c306a625 [0,0,0,1,0,0|3,0,0]=4 6354 B12R1.229 CC(C)CCOC[C@@H]1CCN1C f91fa5e5349e7cb831d55c0d291e217a [0,0,0,1,0,0|3,0,0]=4 6355 B12R1.229 CC(C)CCOC[C@H]1CCN1C 1a6edaa0f52f3e632c3dfdbe25b453fa [0,0,0,1,0,0|3,0,0]=4 6356 B12R1.229 CC(C)OCCN[C@@H]1CC[C@H]1C f56a1281b29ace0186d79a50de3083f2 [0,0,0,1,0,0|3,0,0]=4 6357 B12R1.229 CC(C)OCCN[C@H]1CC[C@H]1C c20e28c00f2be4ee9e5034161ec92d42 [0,0,0,1,0,0|3,0,0]=4 6358 B12R1.229 CC(C)SCCN[C@@H]1CC[C@H]1C f2be3aec3057088cebdba471903411d5 [0,0,0,1,0,0|3,0,0]=4 6359 B12R1.229 CC(C)SCCN[C@H]1CC[C@H]1C 38c85eb2e37734c241d4c73ebeda93c2 [0,0,0,1,0,0|3,0,0]=4 6360 B12R1.229 CC(O)CCCNC1CCC1F f91cf98b5f5b32f4a45e1b8efffb0098 [0,0,0,1,0,0|2,0,0]=3 6361 B12R1.229 CC(O)CCCNC1CCC1O 07f701b353b579d51ecb661c0a548fc1 [0,0,0,1,0,0|2,0,0]=3 6362 B12R1.229 CC(O)CCCNC1COC1C 1dd5689941d606e1ee1f8a8f52a3bfb8 [0,0,0,1,0,0|2,0,0]=3 6363 B12R1.229 CC(O)CCCN[C@@H]1CC[C@@H]1O dc19a9f626cdc077856a6b3a126bf0d6 [0,0,0,1,0,0|2,0,0]=3 6364 B12R1.229 CC(O)CCCN[C@@H]1CC[C@H]1C f49922c3ceaf2294c5e48ce72fd9c9a7 [0,0,0,1,0,0|1,0,0]=2 6365 B12R1.229 CC(O)CCCN[C@@H]1CC[C@H]1O 186cbb7c18a5961d2baecb92f8288223 [0,0,0,1,0,0|2,0,0]=3 6366 B12R1.229 CC(O)CCCN[C@H]1CC[C@@H]1O 41a4ab4f8462aae6fc9cbc24a79b1adb [0,0,0,1,0,0|2,0,0]=3 6367 B12R1.229 CC(O)CCCN[C@H]1CC[C@H]1C d0584c099cb2acb5d867307a3f07d4f5 [0,0,0,1,0,0|1,0,0]=2 6368 B12R1.229 CC(O)CCCN[C@H]1CC[C@H]1O fbb30e4e905f9699381b428a6a854b57 [0,0,0,1,0,0|2,0,0]=3 6369 B12R1.229 CC(O)CCNCC1CCN1C 8145717ad4a2e811da775bcefedc8d14 [0,0,0,1,0,0|2,0,0]=3 6370 B12R1.229 CC(O)CNCCC1CCC1=O 5de3ae42573e6739f48ee80fb17db1fa [0,0,0,1,0,0|2,0,1]=4 6371 B12R1.229 C[C@@H](O)CNCCC1CCC1=O cc950ebe6735362d6b419fcdd0d1a429 [0,0,0,1,0,0|2,0,1]=4 6372 B12R1.229 C[C@@H]1CC[C@@H]1NCCCC(=O)O 4c9067773c0d714dbacc323c077e4124 [0,0,0,1,0,0|2,0,1]=4 6373 B12R1.229 C[C@@H]1CC[C@@H]1NCCCN(C)C 14a51614794365725f191ab06017b215 [0,0,0,1,0,0|3,0,0]=4 6374 B12R1.229 C[C@@H]1CC[C@H]1NCCCC(=O)O a7d50323b924d74a01366ddd9cf91e00 [0,0,0,1,0,0|2,0,1]=4 6375 B12R1.229 C[C@@H]1CC[C@H]1NCCCN(C)C 737c04af0a707e1dbe00b21ae17b3ff6 [0,0,0,1,0,0|3,0,0]=4 6376 B12R1.229 C[C@H](O)CNCCC1CCC1=O a2c4182c36d1aa46d7d55a38edae596a [0,0,0,1,0,0|2,0,1]=4 6377 B12R1.252 C=C(C)CCNC1CCCCC1 420dcb02e1ae627fd65550a58fbaa5d6 [0,0,0,1,0,0|2,0,1]=4 6378 B12R1.252 C=C(C)CCOC1CCCCC1 f56ba0adb90104f8e9998ca09c1fc244 [0,0,0,1,0,0|2,0,1]=4 6379 B12R1.252 C=C(C)CNCC1CCCCC1 d33d68ab421ce5cea3a2e77c92db2cc2 [0,0,0,1,0,0|2,0,1]=4 6380 B12R1.252 C=C(C)COCC1CCCCC1 190678baf478f378d21d5dc57a40d4d4 [0,0,0,1,0,0|2,0,1]=4 6381 B12R1.252 CC(=O)CCOC1CCCCC1 e4251c9461462d5687b8cd3122a2cce2 [0,0,0,1,0,0|1,0,2]=4 6382 B12R1.252 CC(=O)CNCC1CCCCC1 5af34adf99db67dd0b4c9e762216606c [0,0,0,1,0,0|1,0,2]=4 6383 B12R1.252 CC(=O)COCC1CCCCC1 9d264feb1e18e4c3f2aaf1dd03fdd588 [0,0,0,1,0,0|1,0,2]=4 6384 B12R1.252 CC(=O)NCCC1CCCCC1 6b26a3d89dc79374fdd398a6ae5f443e [0,0,0,1,0,0|1,0,2]=4 6385 B12R1.252 CC(C)CCCN1CCCOC1 1abfb3a49826a2c4ccaa5d070b227c08 [0,0,0,1,0,0|3,0,0]=4 6386 B12R1.252 CC(C)CCCN1CCCSC1 931c44fed56968d3884cfe882f90de6f [0,0,0,1,0,0|3,0,0]=4 6387 B12R1.252 CC(C)CCCN1CCOCC1 2dd5b1c403b7390faf66d37780547a0d [0,0,0,1,0,0|3,0,0]=4 6388 B12R1.252 CC(C)CCCN1CCSCC1 bfa78d7687c5ce6f2a6826b3700bab94 [0,0,0,1,0,0|3,0,0]=4 6389 B12R1.252 CC(C)CCNC1CCCCC1 6a0a77755c6f3027b0ae7d20fcec2433 [0,0,0,1,0,0|2,0,0]=3 6390 B12R1.252 CC(C)CCNC1CCCCO1 d9d0bb00febdfcfd67b133686ebee790 [0,0,0,1,0,0|3,0,0]=4 6391 B12R1.252 CC(C)CCNC1CCCOC1 7edbd919e2af59dc31b9d4424f676609 [0,0,0,1,0,0|3,0,0]=4 6392 B12R1.252 CC(C)CCNC1CCOCC1 d64a9794500fd6a324d8784e07021e70 [0,0,0,1,0,0|3,0,0]=4 6393 B12R1.252 CC(C)CCNC1CCSCC1 3ce88bd70f508125aeb059c51c10c1d9 [0,0,0,1,0,0|3,0,0]=4 6394 B12R1.252 CC(C)CCN[C@@H]1CCCOC1 11afe199c0a49cb34b9965ac198863e0 [0,0,0,1,0,0|3,0,0]=4 6395 B12R1.252 CC(C)CCN[C@H]1CCCOC1 c964d7dd4f7daafb48841073a2b9b6b4 [0,0,0,1,0,0|3,0,0]=4 6396 B12R1.252 CC(C)CCOC1CCCCC1 7ace09065cf5c249b87b500a45dc4808 [0,0,0,1,0,0|2,0,0]=3 6397 B12R1.252 CC(C)CCOC1CCCCO1 b9341562c24dcf38b397bf3ce9263246 [0,0,0,1,0,0|3,0,0]=4 6398 B12R1.252 CC(C)CCOC1CCCOC1 bb9950fdee020af23a2eb06862fb47fe [0,0,0,1,0,0|3,0,0]=4 6399 B12R1.252 CC(C)CCOC1CCCSC1 1e86025f7ea5d9193f48ae160a366db4 [0,0,0,1,0,0|3,0,0]=4 6400 B12R1.252 CC(C)CCOC1CCOCC1 ff3a7c609e4520607e568fe261665c62 [0,0,0,1,0,0|3,0,0]=4 6401 B12R1.252 CC(C)CCOC1CCSCC1 8e04a55f73cfb33bd9ec9cf9ba3b3eaf [0,0,0,1,0,0|3,0,0]=4 6402 B12R1.252 CC(C)CCO[C@@H]1CCCOC1 2bd32438de5a2b88fd9b02c3b5bcd2a3 [0,0,0,1,0,0|3,0,0]=4 6403 B12R1.252 CC(C)CCO[C@H]1CCCOC1 75ffd4cf369989646db60cfacd8c16d1 [0,0,0,1,0,0|3,0,0]=4 6404 B12R1.252 CC(C)CNCC1CCCCC1 0e450c31f59baeb8f040b06ae78415c2 [0,0,0,1,0,0|2,0,0]=3 6405 B12R1.252 CC(C)CNCC1CCCCO1 d24974d2a5a61f9a7cc02d3246b03c76 [0,0,0,1,0,0|3,0,0]=4 6406 B12R1.252 CC(C)CNCC1CCCOC1 c35838b744d946b834ace33e71ff42aa [0,0,0,1,0,0|3,0,0]=4 6407 B12R1.252 CC(C)CNCC1CCOCC1 b364dfe536743114576a635c4ec4bbf0 [0,0,0,1,0,0|3,0,0]=4 6408 B12R1.252 CC(C)CNCC1CCSCC1 50b41f92d0a94b52d0f705a9ec42ef1b [0,0,0,1,0,0|3,0,0]=4 6409 B12R1.252 CC(C)CNC[C@@H]1CCCOC1 d44720824149924593a8ead7d9a43955 [0,0,0,1,0,0|3,0,0]=4 6410 B12R1.252 CC(C)CNC[C@H]1CCCOC1 0687e22442972c97bdb938eefea0fc3e [0,0,0,1,0,0|3,0,0]=4 6411 B12R1.252 CC(C)COCC1CCCCC1 ce3165575d9db58d48e5dfe46e04961b [0,0,0,1,0,0|2,0,0]=3 6412 B12R1.252 CC(C)COCC1CCCCO1 1798ce25d83de0b72d2b1b5ce0a31530 [0,0,0,1,0,0|3,0,0]=4 6413 B12R1.252 CC(C)COCC1CCCOC1 e5cd00889d356d260fa85886b785d5a6 [0,0,0,1,0,0|3,0,0]=4 6414 B12R1.252 CC(C)COCC1CCOCC1 e6af12767ebffb73ba4c4960042a4089 [0,0,0,1,0,0|3,0,0]=4 6415 B12R1.252 CC(C)COCC1CCSCC1 9fa04984a3c95ed99ab079e8c7c08010 [0,0,0,1,0,0|3,0,0]=4 6416 B12R1.252 CC(C)COC[C@@H]1CCCCO1 3f99ed458f3eb6c83ce67daed9882990 [0,0,0,1,0,0|3,0,0]=4 6417 B12R1.252 CC(C)COC[C@@H]1CCCOC1 296fb44fb299ed4e07b12ed48af3f2ec [0,0,0,1,0,0|3,0,0]=4 6418 B12R1.252 CC(C)COC[C@H]1CCCCO1 bec62f904c509d9d85a1139342408c96 [0,0,0,1,0,0|3,0,0]=4 6419 B12R1.252 CC(C)COC[C@H]1CCCOC1 10012893c18c44c3d6c18194ff58a0d2 [0,0,0,1,0,0|3,0,0]=4 6420 B12R1.252 CC(C)NCCC1CCCCC1 3fce6fce0b70d444482c14b84c9b0f3e [0,0,0,1,0,0|2,0,0]=3 6421 B12R1.252 CC(C)NCCC1CCCCO1 6921254ad0ae84847067a5b56daffc8f [0,0,0,1,0,0|3,0,0]=4 6422 B12R1.252 CC(C)NCCC1CCCOC1 8c85cf8a889b456d8107d66f795842f2 [0,0,0,1,0,0|3,0,0]=4 6423 B12R1.252 CC(C)NCCC1CCOCC1 6138fc60fd5bf95ea70621df29ca564e [0,0,0,1,0,0|3,0,0]=4 6424 B12R1.252 CC(C)NCCC1CCSCC1 38be16bfa82fec507cf866dc0362ab9f [0,0,0,1,0,0|3,0,0]=4 6425 B12R1.252 CC(C)NCCN1CCCCC1 0c19f5e25fb8de9f6364e411bff9b374 [0,0,0,1,0,0|3,0,0]=4 6426 B12R1.252 CC(C)OCCC1CCCCC1 ab4c0c8c2e264e10579912c65ff1fddf [0,0,0,1,0,0|2,0,0]=3 6427 B12R1.252 CC(C)OCCC1CCCCO1 6a6ba34df90e9ddc4facb8ddb90eb158 [0,0,0,1,0,0|3,0,0]=4 6428 B12R1.252 CC(C)OCCC1CCCOC1 39f105a191d4028f75cbededef5a1aae [0,0,0,1,0,0|3,0,0]=4 6429 B12R1.252 CC(C)OCCC1CCOCC1 643b523421b894488345552acf47245b [0,0,0,1,0,0|3,0,0]=4 6430 B12R1.252 CC(C)OCCC1CCSCC1 d7f2227d3e4f2ccbf79cb44d5fed9713 [0,0,0,1,0,0|3,0,0]=4 6431 B12R1.252 CC(C)OCCN1CCCCC1 3fcf7b047affd28da00978b7cd72a969 [0,0,0,1,0,0|3,0,0]=4 6432 B12R1.252 CC(C)OCOC1CCCCC1 d920419b91a5583eb6f23fefeeba4877 [0,0,0,1,0,0|3,0,0]=4 6433 B12R1.252 CC(F)COCC1CCCCC1 9b2d22dc5b2425c1755a1d1e9e88e5ee [0,0,0,1,0,0|2,0,0]=3 6434 B12R1.252 CC(F)COCC1CCCCO1 920f511a6054fa7ff8aeee5ec3f71e3a [0,0,0,1,0,0|3,0,0]=4 6435 B12R1.252 CC(F)COCC1CCCOC1 81a648831d6b29efea1f36c2b1839373 [0,0,0,1,0,0|3,0,0]=4 6436 B12R1.252 CC(F)COCC1CCOCC1 3eb395c13590748b71ce0b1436748b8b [0,0,0,1,0,0|3,0,0]=4 6437 B12R1.252 CC(F)COCC1CCSCC1 b7776aefe1ac865fecfc1a558e96645f [0,0,0,1,0,0|3,0,0]=4 6438 B12R1.252 CC(O)CCCN1CC=CCC1 3172aebe42ed0cd2fe3ea1f29ffae35e [0,0,0,1,0,0|1,0,2]=4 6439 B12R1.252 CC(O)CCCN1CCCOC1 e201eef98c1bc23bc1d2741f4fdea09e [0,0,0,1,0,0|2,0,0]=3 6440 B12R1.252 CC(O)CCCN1CCCSC1 8abcf0ce1f54e6246a0d1f44a870b374 [0,0,0,1,0,0|2,0,0]=3 6441 B12R1.252 CC(O)CCCN1CCOCC1 989a0161ba96f5e97645afe6b7be64ac [0,0,0,1,0,0|2,0,0]=3 6442 B12R1.252 CC(O)CCCN1CCSCC1 071fe2497ab9422b31d38065f1ce1224 [0,0,0,1,0,0|2,0,0]=3 6443 B12R1.252 CC(O)CCNC1C=CCCC1 74997462aa5b54b028b0dde2f480b503 [0,0,0,1,0,0|1,0,2]=4 6444 B12R1.252 CC(O)CCNC1CCCCC1 520eb6162ef0b970738c856512a30acd [0,0,0,1,0,0|1,0,0]=2 6445 B12R1.252 CC(O)CCNC1CCCCO1 f8be353c66768e69c596d032353fa8ba [0,0,0,1,0,0|2,0,0]=3 6446 B12R1.252 CC(O)CCNC1CCCOC1 2fd907fb150c9288761d4cd3efb916ef [0,0,0,1,0,0|2,0,0]=3 6447 B12R1.252 CC(O)CCNC1CCOCC1 67b3a69185ad5df658142ca8e0e4dc37 [0,0,0,1,0,0|2,0,0]=3 6448 B12R1.252 CC(O)CCNC1CCSCC1 cb5e7be816c8f72af034bee255bfa9cd [0,0,0,1,0,0|2,0,0]=3 6449 B12R1.252 CC(O)CCNC1CSCSC1 1208f0ca4d9c070adf9de7471854b3c4 [0,0,0,1,0,0|3,0,0]=4 6450 B12R1.252 CC(O)CCN[C@@H]1CCCOC1 4e27aef51c0764914e094cbaad523ca9 [0,0,0,1,0,0|2,0,0]=3 6451 B12R1.252 CC(O)CCN[C@H]1CCCOC1 8c453737d95e4e1e3b91771db3ed40a9 [0,0,0,1,0,0|2,0,0]=3 6452 B12R1.252 CC(O)CNCC1=CCCCC1 a6be01923bd082984b73f6e1776c5314 [0,0,0,1,0,0|1,0,2]=4 6453 B12R1.252 CC(O)CNCC1CC=CCC1 798e7cc0db03939f521a3c7dc2b1cd68 [0,0,0,1,0,0|1,0,2]=4 6454 B12R1.252 CC(O)CNCC1CCCCC1 9242cd9cf543cf00889fce3d740d211e [0,0,0,1,0,0|1,0,0]=2 6455 B12R1.252 CC(O)CNCC1CCCCO1 e3891ea160a0cd019917abdc57cbfced [0,0,0,1,0,0|2,0,0]=3 6456 B12R1.252 CC(O)CNCC1CCCOC1 18be76d11470da2875d6b6f48888a458 [0,0,0,1,0,0|2,0,0]=3 6457 B12R1.252 CC(O)CNCC1CCOCC1 324ebd0c8c4dcd944601127fb21f8184 [0,0,0,1,0,0|2,0,0]=3 6458 B12R1.252 CC(O)CNCC1CCSCC1 95e1d03992864d2384b1735558bb0717 [0,0,0,1,0,0|2,0,0]=3 6459 B12R1.252 CC(O)CNCC1COCCO1 4ce1e11e2ad1978c61bd2a6b62459433 [0,0,0,1,0,0|3,0,0]=4 6460 B12R1.252 CC(O)CNC[C@@H]1CCCOC1 8611b2c8b3f4163a36f87aba8f99e4e5 [0,0,0,1,0,0|2,0,0]=3 6461 B12R1.252 CC(O)CNC[C@H]1CCCOC1 8a91b012e5ce5c55c5842109244d4757 [0,0,0,1,0,0|2,0,0]=3 6462 B12R1.252 CC(O)CNC[C@H]1COCCO1 0a3e6e8b6a6b8174f79eed5a26b9de9e [0,0,0,1,0,0|3,0,0]=4 6463 B12R1.252 CC(S)COCC1CCCCC1 705094199dc2f27897c517549dee9c0e [0,0,0,1,0,0|1,1,0]=3 6464 B12R1.252 CC(S)COCC1CCCCO1 1c82ae60327314ab52cc7891cac9d27c [0,0,0,1,0,0|2,1,0]=4 6465 B12R1.252 CC(S)COCC1CCCOC1 92f7f3c28b931b8796c494b908128ed3 [0,0,0,1,0,0|2,1,0]=4 6466 B12R1.252 CC(S)COCC1CCOCC1 eaf079656a8737df3c332f18bf1ed12c [0,0,0,1,0,0|2,1,0]=4 6467 B12R1.252 CC(S)COCC1CCSCC1 1531f5fcd531ac0b2352194b13d4d5ac [0,0,0,1,0,0|2,1,0]=4 6468 B12R1.252 CN(C)CCNC1CCCCC1 44e773b81c08c980b7adc0571fce4acb [0,0,0,1,0,0|3,0,0]=4 6469 B12R1.252 CN(C)CCOC1CCCCC1 a023ee9f3afe6ed6a31aec4e1ea9aeb4 [0,0,0,1,0,0|3,0,0]=4 6470 B12R1.252 CN(C)CNCC1CCCCC1 3c403d5e8d59a09a3c65d5312999e30d [0,0,0,1,0,0|3,0,0]=4 6471 B12R1.252 CN(C)COCC1CCCCC1 0f07a17f246ce65921ff0690df1aa10e [0,0,0,1,0,0|3,0,0]=4 6472 B12R1.252 CS(=O)CCNC1CCCCC1 21454a01e08c285db1a5566d9452a1a0 [0,0,0,1,0,0|2,0,1]=4 6473 B12R1.252 CS(=O)CCOC1CCCCC1 554ef7ac6072f0df6dc6125fa74c6605 [0,0,0,1,0,0|2,0,1]=4 6474 B12R1.252 C[C@@H](F)COCC1CCCCC1 d0e9b759a11b26e3ea5331a76a085140 [0,0,0,1,0,0|2,0,0]=3 6475 B12R1.252 C[C@@H](F)COCC1CCCCO1 8a718329ffce931ce587e63cb4a21b45 [0,0,0,1,0,0|3,0,0]=4 6476 B12R1.252 C[C@@H](F)COCC1CCCOC1 10488132d0fa75e56c65e75c40d8c27a [0,0,0,1,0,0|3,0,0]=4 6477 B12R1.252 C[C@@H](F)COCC1CCOCC1 6065b2b7e7a65674257ba3ef798084a6 [0,0,0,1,0,0|3,0,0]=4 6478 B12R1.252 C[C@@H](F)COCC1CCSCC1 2dc96ecf04033ca58686606fccbc3aa6 [0,0,0,1,0,0|3,0,0]=4 6479 B12R1.252 C[C@@H](O)CCNC1C=CCCC1 cca0fe6b1a27f996579d136dbd23badc [0,0,0,1,0,0|1,0,2]=4 6480 B12R1.252 C[C@@H](O)CCNC1CCCCC1 2bd7253c4667a7d99b6f51e894873ca0 [0,0,0,1,0,0|1,0,0]=2 6481 B12R1.252 C[C@@H](O)CCNC1CCCCO1 2df27c9151932e31eb111b7bd24e998c [0,0,0,1,0,0|2,0,0]=3 6482 B12R1.252 C[C@@H](O)CCNC1CCCOC1 29bfc1ddb25b641ad97ee2b31234b89e [0,0,0,1,0,0|2,0,0]=3 6483 B12R1.252 C[C@@H](O)CCNC1CCOCC1 5b26b7162a5f0bd5a15937ef53b2f293 [0,0,0,1,0,0|2,0,0]=3 6484 B12R1.252 C[C@@H](O)CCNC1CCSCC1 81fb43630c0ddd7c41831a5a31881f46 [0,0,0,1,0,0|2,0,0]=3 6485 B12R1.252 C[C@@H](O)CNCC1=CCCCC1 b4a0af4678a909fd8c00a76005b35240 [0,0,0,1,0,0|1,0,2]=4 6486 B12R1.252 C[C@@H](O)CNCC1CC=CCC1 e5f0db6faa15bc07b52f83e8bbb8c06b [0,0,0,1,0,0|1,0,2]=4 6487 B12R1.252 C[C@@H](O)CNCC1CCCCC1 3a9bbfcdeca94a96b7075e7ac0da4604 [0,0,0,1,0,0|1,0,0]=2 6488 B12R1.252 C[C@@H](O)CNCC1CCCCO1 f24377f33dec6916870ddb8cc3301145 [0,0,0,1,0,0|2,0,0]=3 6489 B12R1.252 C[C@@H](O)CNCC1CCCOC1 f773505651513782bda87f0e97d60317 [0,0,0,1,0,0|2,0,0]=3 6490 B12R1.252 C[C@@H](O)CNCC1CCOCC1 d610d7adf266dc6b0c234462bd9ec378 [0,0,0,1,0,0|2,0,0]=3 6491 B12R1.252 C[C@@H](O)CNCC1CCSCC1 090967db3c47dda475044f31da4b91d4 [0,0,0,1,0,0|2,0,0]=3 6492 B12R1.252 C[C@@H](O)CNCC1COCCO1 8ffac134afbb4b7d29d099de490df35e [0,0,0,1,0,0|3,0,0]=4 6493 B12R1.252 C[C@@H](O)CNC[C@@H]1CCCOC1 789db0f9ee8584e11e1f3d154a123aec [0,0,0,1,0,0|2,0,0]=3 6494 B12R1.252 C[C@@H](O)CNC[C@H]1CCCOC1 090385690e9b6e93aa66f6b6164d01f9 [0,0,0,1,0,0|2,0,0]=3 6495 B12R1.252 C[C@@H](O)CNC[C@H]1COCCO1 4f9714d79eda476ddac731a24fcd048b [0,0,0,1,0,0|3,0,0]=4 6496 B12R1.252 C[C@H](F)COCC1CCCCC1 d3e169974d85bde04045a02cd246e96d [0,0,0,1,0,0|2,0,0]=3 6497 B12R1.252 C[C@H](F)COCC1CCCCO1 bbdbb46c8563b3e44b31c16a3cd56557 [0,0,0,1,0,0|3,0,0]=4 6498 B12R1.252 C[C@H](F)COCC1CCCOC1 55d73260698993ed76db95d1f2ad3f67 [0,0,0,1,0,0|3,0,0]=4 6499 B12R1.252 C[C@H](F)COCC1CCOCC1 11f84c0cfdc751d8cede203cdc27da60 [0,0,0,1,0,0|3,0,0]=4 6500 B12R1.252 C[C@H](F)COCC1CCSCC1 151075790b10bf75f612011520c936a5 [0,0,0,1,0,0|3,0,0]=4 6501 B12R1.252 C[C@H](O)CCNC1C=CCCC1 5de0c3a06efd4ac87765da06b2747e57 [0,0,0,1,0,0|1,0,2]=4 6502 B12R1.252 C[C@H](O)CCNC1CCCCC1 cf9077ff7721c9be8e6fcd5f484c545f [0,0,0,1,0,0|1,0,0]=2 6503 B12R1.252 C[C@H](O)CCNC1CCCCO1 bebfc903e8b787223b3966680be4bef0 [0,0,0,1,0,0|2,0,0]=3 6504 B12R1.252 C[C@H](O)CCNC1CCCOC1 e49b38cbaf9ecbd0e49f71de9df3af98 [0,0,0,1,0,0|2,0,0]=3 6505 B12R1.252 C[C@H](O)CCNC1CCOCC1 5479faa60a050fe4f703f2f348030d57 [0,0,0,1,0,0|2,0,0]=3 6506 B12R1.252 C[C@H](O)CCNC1CCSCC1 fb77d938cfd1694a485664e5c15fe497 [0,0,0,1,0,0|2,0,0]=3 6507 B12R1.252 C[C@H](O)CNCC1=CCCCC1 05a35a972b0f4c6b9ee9793ad7e7e4dd [0,0,0,1,0,0|1,0,2]=4 6508 B12R1.252 C[C@H](O)CNCC1CC=CCC1 5afe3029abb2b2b70d823f5a62e273b6 [0,0,0,1,0,0|1,0,2]=4 6509 B12R1.252 C[C@H](O)CNCC1CCCCC1 850814ff1efd41e3b6bc80675fe903cd [0,0,0,1,0,0|1,0,0]=2 6510 B12R1.252 C[C@H](O)CNCC1CCCCO1 6ac75fec62cebc3f5a8eb3248598fa7f [0,0,0,1,0,0|2,0,0]=3 6511 B12R1.252 C[C@H](O)CNCC1CCCOC1 ffeb1efc645de0c07431b300ab661324 [0,0,0,1,0,0|2,0,0]=3 6512 B12R1.252 C[C@H](O)CNCC1CCOCC1 2d83bccbfb3d1298dc46785ee55b5320 [0,0,0,1,0,0|2,0,0]=3 6513 B12R1.252 C[C@H](O)CNCC1CCSCC1 b2b9fc52d30565522cc922f3001bb06d [0,0,0,1,0,0|2,0,0]=3 6514 B12R1.252 C[C@H](O)CNCC1COCCO1 b8498d20a82c2130be5dcdda67c6c53e [0,0,0,1,0,0|3,0,0]=4 6515 B12R1.252 C[C@H](O)CNC[C@@H]1CCCOC1 24f60bd4eaab52b2d8e9ab3052d33ad9 [0,0,0,1,0,0|2,0,0]=3 6516 B12R1.252 C[C@H](O)CNC[C@H]1CCCOC1 6d0bfb02a119477d0db221007b11fbf1 [0,0,0,1,0,0|2,0,0]=3 6517 B12R1.252 C[C@H](O)CNC[C@H]1COCCO1 a3eaf5b96eae829d0f1f465636c79ae5 [0,0,0,1,0,0|3,0,0]=4 6518 B12R1.252 FC(F)CCNC1CCCCC1 95f21d91de46596f3e89ac1d35f8ef35 [0,0,0,1,0,0|3,0,0]=4 6519 B12R1.252 FC(F)CCOC1CCCCC1 55300ecb7bd71a76d416ea2177655ba9 [0,0,0,1,0,0|3,0,0]=4 6520 B12R1.252 FC(F)CNCC1CCCCC1 501fa95ffc66e197c866f665c15e32f6 [0,0,0,1,0,0|3,0,0]=4 6521 B12R1.252 FC(F)COCC1CCCCC1 e3d9c5c08b24f8c5ad368d82ec5afa1d [0,0,0,1,0,0|3,0,0]=4 6522 B12R1.252 O=C(O)CCNC1CCCCC1 f66ea53c90c672a0766bb4581e244543 [0,0,0,1,0,0|2,0,1]=4 6523 B12R1.252 O=C(O)CCOC1CCCCC1 b3cd5f51484769f962d8ff5f20fc9a7e [0,0,0,1,0,0|2,0,1]=4 6524 B12R1.252 O=C(O)CNCC1CCCCC1 06caf03ec055ddf04488cab225457e93 [0,0,0,1,0,0|2,0,1]=4 6525 B12R1.252 O=C(O)COCC1CCCCC1 2c67702fa501448667ee0f733c062aa5 [0,0,0,1,0,0|2,0,1]=4 6526 B12R1.252 O=S(O)CCNC1CCCCC1 bb8c76227f32fe42654dc69df7a70fd9 [0,0,0,1,0,0|3,0,0]=4 6527 B12R1.252 O=S(O)COCC1CCCCC1 72a8b3a537115ba9e1a0ca6773d866f3 [0,0,0,1,0,0|3,0,0]=4 6528 B12R1.255 C=C(C)CCCNC1CCCC1 9a3c6c7831edbcfaf70618d9d9c8a08d [0,0,0,1,0,0|2,0,1]=4 6529 B12R1.255 C=C(C)CCCOC1CCCC1 11082a40e798c6d9e6cb289fc21a75b5 [0,0,0,1,0,0|2,0,1]=4 6530 B12R1.255 C=C(C)CCNCC1CCCC1 f796ad0befaa98ea800f8e8f23320052 [0,0,0,1,0,0|2,0,1]=4 6531 B12R1.255 C=C(C)CCOCC1CCCC1 101d7c542e236513cb3fd9b00277d6d5 [0,0,0,1,0,0|2,0,1]=4 6532 B12R1.255 C=C(C)CNCCC1CCCC1 7f003586eb2b48124d7bcff88818dfae [0,0,0,1,0,0|2,0,1]=4 6533 B12R1.255 C=C(C)COCCC1CCCC1 33f00194e87648ea4760f777c56c53cb [0,0,0,1,0,0|2,0,1]=4 6534 B12R1.255 CC(=O)CCCNC1CCCC1 9e1109b7a3870b23cd3bce982426e3e5 [0,0,0,1,0,0|1,0,2]=4 6535 B12R1.255 CC(=O)CCCOC1CCCC1 5a7d0f5e8f7a4c82692c85ceb0de4502 [0,0,0,1,0,0|1,0,2]=4 6536 B12R1.255 CC(=O)CCNCC1CCCC1 7ab3bcf2f5d55209d1046cb41a4c5d86 [0,0,0,1,0,0|1,0,2]=4 6537 B12R1.255 CC(=O)CCOCC1CCCC1 efb5c67ae81af3413188f00bf5f3a603 [0,0,0,1,0,0|1,0,2]=4 6538 B12R1.255 CC(=O)CNCCC1CCCC1 41f413e7936da8afb65537e13627baf6 [0,0,0,1,0,0|1,0,2]=4 6539 B12R1.255 CC(=O)COCCC1CCCC1 9677f0b253eb2cdc842e57b249d4920b [0,0,0,1,0,0|1,0,2]=4 6540 B12R1.255 CC(=O)NCCCC1CCCC1 e0d623c95c90549904a1509ea40a9461 [0,0,0,1,0,0|1,0,2]=4 6541 B12R1.255 CC(C)CCCCN1CCSC1 e22b2110a33b85b023aa7e1093344d20 [0,0,0,1,0,0|3,0,0]=4 6542 B12R1.255 CC(C)CCCNC1CCCC1 2da235df02e62913f7daf4771000e4ac [0,0,0,1,0,0|2,0,0]=3 6543 B12R1.255 CC(C)CCCNC1CCOC1 7102a443d3669cb874ddfcb434738bb3 [0,0,0,1,0,0|3,0,0]=4 6544 B12R1.255 CC(C)CCCNC1CCSC1 9b9dfbe99f93ed9fa1dbf026bea67baa [0,0,0,1,0,0|3,0,0]=4 6545 B12R1.255 CC(C)CCCN[C@@H]1CCOC1 07da8b68111dd73efe99455c2064e74b [0,0,0,1,0,0|3,0,0]=4 6546 B12R1.255 CC(C)CCCN[C@H]1CCOC1 43af7dc9bf4e8ea0d547b4f6894ad828 [0,0,0,1,0,0|3,0,0]=4 6547 B12R1.255 CC(C)CCCOC1CCCC1 4b8f1f37b87b0335211d3231961aadc9 [0,0,0,1,0,0|2,0,0]=3 6548 B12R1.255 CC(C)CCCOC1CCCO1 6580db3bf17a8833c31b1cbd4a4b8177 [0,0,0,1,0,0|3,0,0]=4 6549 B12R1.255 CC(C)CCCOC1CCOC1 5679203f104e0d82089d7f4e84228b0d [0,0,0,1,0,0|3,0,0]=4 6550 B12R1.255 CC(C)CCCOC1CCSC1 95e81e45cc4203a9bc50514af1f643e3 [0,0,0,1,0,0|3,0,0]=4 6551 B12R1.255 CC(C)CCCO[C@@H]1CCOC1 078ea1a78d96bf0031d082ae6dbf7d12 [0,0,0,1,0,0|3,0,0]=4 6552 B12R1.255 CC(C)CCCO[C@@H]1CCSC1 477f8f0c91d9c94ab575737c81211b0d [0,0,0,1,0,0|3,0,0]=4 6553 B12R1.255 CC(C)CCCO[C@H]1CCOC1 0dff211d197227c61d6406830c0c8d69 [0,0,0,1,0,0|3,0,0]=4 6554 B12R1.255 CC(C)CCCO[C@H]1CCSC1 3102826d149033df223c95a13f06121a [0,0,0,1,0,0|3,0,0]=4 6555 B12R1.255 CC(C)CCNCC1CCCC1 335b548f185980a5fe13745827672351 [0,0,0,1,0,0|2,0,0]=3 6556 B12R1.255 CC(C)CCNCC1CCCO1 de4f7dc93401fa19eb63f982dc70e718 [0,0,0,1,0,0|3,0,0]=4 6557 B12R1.255 CC(C)CCNCC1CCOC1 c33a627cff8c7c759404a3c96b43273f [0,0,0,1,0,0|3,0,0]=4 6558 B12R1.255 CC(C)CCNC[C@@H]1CCCO1 5de20e2a14767b6d62d2de9449aef72a [0,0,0,1,0,0|3,0,0]=4 6559 B12R1.255 CC(C)CCNC[C@@H]1CCOC1 3ac7b685b7e5711754ea74f8d23de4b3 [0,0,0,1,0,0|3,0,0]=4 6560 B12R1.255 CC(C)CCNC[C@H]1CCCO1 87081da679e132cef8bb8692fa3a4bb1 [0,0,0,1,0,0|3,0,0]=4 6561 B12R1.255 CC(C)CCNC[C@H]1CCOC1 765c28836dced250da04298d9c8f2372 [0,0,0,1,0,0|3,0,0]=4 6562 B12R1.255 CC(C)CCOCC1CCCC1 fee412ea9039bb5cf6ec5ae77fbc33a8 [0,0,0,1,0,0|2,0,0]=3 6563 B12R1.255 CC(C)CCOCC1CCCO1 8446406c7f31c46b14132d0b1721ab73 [0,0,0,1,0,0|3,0,0]=4 6564 B12R1.255 CC(C)CCOCC1CCCS1 d6799e93876dd177caa42887b3d0bf20 [0,0,0,1,0,0|3,0,0]=4 6565 B12R1.255 CC(C)CCOCC1CCOC1 0256d887a65364040644cd4f60e02ee1 [0,0,0,1,0,0|3,0,0]=4 6566 B12R1.255 CC(C)CCOCN1CCCC1 0fde17e337870cf53dac83b6c57aa5a4 [0,0,0,1,0,0|3,0,0]=4 6567 B12R1.255 CC(C)CCOC[C@@H]1CCCO1 8818d8561826537de09e9f2abaeb32af [0,0,0,1,0,0|3,0,0]=4 6568 B12R1.255 CC(C)CCOC[C@@H]1CCOC1 6856ab9ac715c6012ec6e3b4b14ac853 [0,0,0,1,0,0|3,0,0]=4 6569 B12R1.255 CC(C)CCOC[C@H]1CCCO1 ab8f5513359190ba90c88b99e92ee725 [0,0,0,1,0,0|3,0,0]=4 6570 B12R1.255 CC(C)CCOC[C@H]1CCOC1 e492df09baee91a9fd855d1046c182de [0,0,0,1,0,0|3,0,0]=4 6571 B12R1.255 CC(C)CNCCC1CCCC1 fbb36a6521a590b3d59ff42976a9edde [0,0,0,1,0,0|2,0,0]=3 6572 B12R1.255 CC(C)CNCCC1CCCO1 6340e80e68c97b5e92397069c1621aae [0,0,0,1,0,0|3,0,0]=4 6573 B12R1.255 CC(C)CNCCC1CCOC1 b842278744591e0125a9c6847e6bc223 [0,0,0,1,0,0|3,0,0]=4 6574 B12R1.255 CC(C)CNCCN1CCCC1 67349f12dd5afa8a4b663db0c4a61baf [0,0,0,1,0,0|3,0,0]=4 6575 B12R1.255 CC(C)COCCC1CCCC1 9442ee5b97e381ea9b1194d87f16312c [0,0,0,1,0,0|2,0,0]=3 6576 B12R1.255 CC(C)COCCC1CCCO1 02c377f1b3206f089fcd7abfeba2dc99 [0,0,0,1,0,0|3,0,0]=4 6577 B12R1.255 CC(C)COCCC1CCOC1 f4f9cf6d881928303632925370f261a9 [0,0,0,1,0,0|3,0,0]=4 6578 B12R1.255 CC(C)COCCN1CCCC1 ba74a5efa7a7db82a35e513a5f37a164 [0,0,0,1,0,0|3,0,0]=4 6579 B12R1.255 CC(C)NCCCC1CCCC1 8ac98c4225633d5501291538540a1d58 [0,0,0,1,0,0|2,0,0]=3 6580 B12R1.255 CC(C)NCCCC1CCOC1 c17d16c8bd4161c9c53ee6797fa32fd1 [0,0,0,1,0,0|3,0,0]=4 6581 B12R1.255 CC(C)NCCCN1CCCC1 aa511d938df8369e166a784667f89621 [0,0,0,1,0,0|3,0,0]=4 6582 B12R1.255 CC(C)NCCOC1CCCC1 bfa104d441ddd37999eba81e2f2d6317 [0,0,0,1,0,0|3,0,0]=4 6583 B12R1.255 CC(C)NCCSC1CCCC1 b89ab8ca09b522f7447aed119b9e00e4 [0,0,0,1,0,0|3,0,0]=4 6584 B12R1.255 CC(C)OCCCC1CCCC1 a128ff853717bc0254eefad4e474e3e5 [0,0,0,1,0,0|2,0,0]=3 6585 B12R1.255 CC(C)OCCCN1CCCC1 07aac5083a6da660b2cae848e7d9b5b4 [0,0,0,1,0,0|3,0,0]=4 6586 B12R1.255 CC(C)OCCNC1CCCC1 99b34aeb8147ba78487bcc70c54dc318 [0,0,0,1,0,0|3,0,0]=4 6587 B12R1.255 CC(C)OCCOC1CCCC1 dbd68ecd0262f3e4af5099d45e5cd9d0 [0,0,0,1,0,0|3,0,0]=4 6588 B12R1.255 CC(C)OCNCC1CCCC1 0111ab6b6f607751325f59f8b2653495 [0,0,0,1,0,0|3,0,0]=4 6589 B12R1.255 CC(C)OCOCC1CCCC1 1237053430818f490dd16bcadfb8a45c [0,0,0,1,0,0|3,0,0]=4 6590 B12R1.255 CC(C)SCCNC1CCCC1 0da853cb8b82dcb62afafdcce56a91d0 [0,0,0,1,0,0|3,0,0]=4 6591 B12R1.255 CC(C)SCCOC1CCCC1 0e169c6cca3bdd29066e76366b9a98ec [0,0,0,1,0,0|3,0,0]=4 6592 B12R1.255 CC(F)COCCC1CCCC1 956689178710f2927c3b91431d40a38f [0,0,0,1,0,0|2,0,0]=3 6593 B12R1.255 CC(F)COCCC1CCCO1 e86469c0d6b8d9cad6f7ff2fbcdd55aa [0,0,0,1,0,0|3,0,0]=4 6594 B12R1.255 CC(F)COCCC1CCOC1 a75e55ed45ec70c2c2d1e52f62392ea3 [0,0,0,1,0,0|3,0,0]=4 6595 B12R1.255 CC(F)COCCN1CCCC1 efc2fa7c8a21425d44da34c8da48e5a3 [0,0,0,1,0,0|3,0,0]=4 6596 B12R1.255 CC(O)CCCCN1CC=CC1 3c9fe38b2db1cd1c73a3e016d3304a9d [0,0,0,1,0,0|1,0,2]=4 6597 B12R1.255 CC(O)CCCCN1CCSC1 71afd2a309b714492b7600f6a6d93322 [0,0,0,1,0,0|2,0,0]=3 6598 B12R1.255 CC(O)CCCNC1CC=CC1 20e9ada1161138dc6d767184902a3762 [0,0,0,1,0,0|1,0,2]=4 6599 B12R1.255 CC(O)CCCNC1CCCC1 dc7a4cbd146af81d6e30d92d70ad2158 [0,0,0,1,0,0|1,0,0]=2 6600 B12R1.255 CC(O)CCCNC1CCOC1 3385fee2eeb59278b1ccefbd655ea337 [0,0,0,1,0,0|2,0,0]=3 6601 B12R1.255 CC(O)CCCNC1CCSC1 2e4d5981f83641b736c19458de58a443 [0,0,0,1,0,0|2,0,0]=3 6602 B12R1.255 CC(O)CCCN[C@@H]1CCOC1 fbfaa351b709764e80e7d548d13f6d83 [0,0,0,1,0,0|2,0,0]=3 6603 B12R1.255 CC(O)CCCN[C@H]1CCOC1 62eca09ef477ee8168a7667d727bdd42 [0,0,0,1,0,0|2,0,0]=3 6604 B12R1.255 CC(O)CCNCC1=CCCC1 ffc1a057d246b4ea0b3bd94bb97bafde [0,0,0,1,0,0|1,0,2]=4 6605 B12R1.255 CC(O)CCNCC1CC=CC1 be08b911b6ff1084c5c2640057380b1c [0,0,0,1,0,0|1,0,2]=4 6606 B12R1.255 CC(O)CCNCC1CCCC1 6ecf2015920bdcaf7e0c320e0162e3ba [0,0,0,1,0,0|1,0,0]=2 6607 B12R1.255 CC(O)CCNCC1CCCO1 5aa0a56621812bd8220b1c5615cf664d [0,0,0,1,0,0|2,0,0]=3 6608 B12R1.255 CC(O)CCNCC1CCOC1 7f5bf5f1a2d71d4921468f7775a983a4 [0,0,0,1,0,0|2,0,0]=3 6609 B12R1.255 CC(O)CCNC[C@@H]1CCCO1 cca0a9a173f9619607978e70ba883c2d [0,0,0,1,0,0|2,0,0]=3 6610 B12R1.255 CC(O)CCNC[C@@H]1CCOC1 13f22f698276344eda2d68bba47c7ad1 [0,0,0,1,0,0|2,0,0]=3 6611 B12R1.255 CC(O)CCNC[C@H]1CCCO1 e82b45aa8c655834bdd4b34f4e3ebda5 [0,0,0,1,0,0|2,0,0]=3 6612 B12R1.255 CC(O)CCNC[C@H]1CCOC1 d258c30fe7cf996ab202cd07a7483d3f [0,0,0,1,0,0|2,0,0]=3 6613 B12R1.255 CC(O)CNCCC1CCCC1 150d6abf626837471dea729715c2fe10 [0,0,0,1,0,0|1,0,0]=2 6614 B12R1.255 CC(O)CNCCC1CCCO1 7d2dbd4ec7226bd5bcbf1d7f8ef38496 [0,0,0,1,0,0|2,0,0]=3 6615 B12R1.255 CC(O)CNCCC1CCOC1 dc14f476785f51db1954b0295e7ff063 [0,0,0,1,0,0|2,0,0]=3 6616 B12R1.255 CC(O)CNCCN1CCCC1 251ff4db31bdab11d20a925dca6f060e [0,0,0,1,0,0|2,0,0]=3 6617 B12R1.255 CC(S)COCCC1CCCC1 5bbdbc14cdf9e11dda099344e8a367b4 [0,0,0,1,0,0|1,1,0]=3 6618 B12R1.255 CC(S)COCCC1CCCO1 011cfd34f22a8d83154f5b8d8affb26a [0,0,0,1,0,0|2,1,0]=4 6619 B12R1.255 CC(S)COCCC1CCOC1 95a6f3a8f7eca545dac925699a296aa2 [0,0,0,1,0,0|2,1,0]=4 6620 B12R1.255 CC(S)COCCN1CCCC1 6fd3c414ae63fcbdfc79db331d2a7aaa [0,0,0,1,0,0|2,1,0]=4 6621 B12R1.255 CN(C)CCCNC1CCCC1 1a99862f65888694f97355870b83a39a [0,0,0,1,0,0|3,0,0]=4 6622 B12R1.255 CN(C)CCCOC1CCCC1 bcea6a00440cc21ff1c011372fe2ba88 [0,0,0,1,0,0|3,0,0]=4 6623 B12R1.255 CN(C)CCNCC1CCCC1 d8632c3aa7d02553ba98555337cdcc58 [0,0,0,1,0,0|3,0,0]=4 6624 B12R1.255 CN(C)CCOCC1CCCC1 577bd140248fc62c9fca796c609d1461 [0,0,0,1,0,0|3,0,0]=4 6625 B12R1.255 CN(C)CNCCC1CCCC1 97bd00993ab9c8d415ca0b571988f016 [0,0,0,1,0,0|3,0,0]=4 6626 B12R1.255 CN(C)COCCC1CCCC1 21814c2ec4c5f9c5f47adf1cb691cb40 [0,0,0,1,0,0|3,0,0]=4 6627 B12R1.255 CS(=O)CCCNC1CCCC1 2ea69945fd665094e0b89856e069f737 [0,0,0,1,0,0|2,0,1]=4 6628 B12R1.255 CS(=O)CCNCC1CCCC1 7cd925dfa66377d94d903f161dcc6e7d [0,0,0,1,0,0|2,0,1]=4 6629 B12R1.255 CS(=O)CCOCC1CCCC1 27fde2bd95d6fe14c93820c85a12eb2e [0,0,0,1,0,0|2,0,1]=4 6630 B12R1.255 C[C@@H](F)COCCC1CCCC1 3116a21f9aa2ac5e6ad6d28aade96e8c [0,0,0,1,0,0|2,0,0]=3 6631 B12R1.255 C[C@@H](F)COCCC1CCCO1 08d8a0cdf7ce0e302491534d008933aa [0,0,0,1,0,0|3,0,0]=4 6632 B12R1.255 C[C@@H](F)COCCC1CCOC1 056f666a91e7b587721cb516d3eaa65c [0,0,0,1,0,0|3,0,0]=4 6633 B12R1.255 C[C@@H](F)COCCN1CCCC1 44901ca36e12f357b101434eb2082e0a [0,0,0,1,0,0|3,0,0]=4 6634 B12R1.255 C[C@@H](O)CCCCN1CC=CC1 5e4026522a47968c55c5c40f06257de0 [0,0,0,1,0,0|1,0,2]=4 6635 B12R1.255 C[C@@H](O)CCCCN1CCSC1 af8aff25d6704fa3fddcc5bfcb7fa093 [0,0,0,1,0,0|2,0,0]=3 6636 B12R1.255 C[C@@H](O)CCNCC1=CCCC1 bff8743f956cde724a22941e23199e1f [0,0,0,1,0,0|1,0,2]=4 6637 B12R1.255 C[C@@H](O)CCNCC1CC=CC1 664f2b09ff8d8527d3afebb50b78afbd [0,0,0,1,0,0|1,0,2]=4 6638 B12R1.255 C[C@@H](O)CCNCC1CCCC1 f5803b8e21f20a4fa493a507103eaba0 [0,0,0,1,0,0|1,0,0]=2 6639 B12R1.255 C[C@@H](O)CCNCC1CCCO1 9ccb6acbcc349558730af0e39fe71c41 [0,0,0,1,0,0|2,0,0]=3 6640 B12R1.255 C[C@@H](O)CCNCC1CCOC1 0414d37c28778efdd1411739501f0624 [0,0,0,1,0,0|2,0,0]=3 6641 B12R1.255 C[C@@H](O)CNCCC1CCCC1 f9213f6d8d7769970256eb2444e0cf9b [0,0,0,1,0,0|1,0,0]=2 6642 B12R1.255 C[C@@H](O)CNCCC1CCCO1 7abb1756f8ade14947060e69d8905e36 [0,0,0,1,0,0|2,0,0]=3 6643 B12R1.255 C[C@@H](O)CNCCC1CCOC1 9d2eb9eb6f148082f1b194de1a8f97f8 [0,0,0,1,0,0|2,0,0]=3 6644 B12R1.255 C[C@@H](O)CNCCN1CCCC1 8b6349776261b9c34b65890324d3c06a [0,0,0,1,0,0|2,0,0]=3 6645 B12R1.255 C[C@H](F)COCCC1CCCC1 efb34e98fd37f4b222db2c78a7c5ac74 [0,0,0,1,0,0|2,0,0]=3 6646 B12R1.255 C[C@H](F)COCCC1CCCO1 405e637ebd5aec8b24563f16ff981bf7 [0,0,0,1,0,0|3,0,0]=4 6647 B12R1.255 C[C@H](F)COCCC1CCOC1 a0ae91ca650559ae7745aca36c7018c3 [0,0,0,1,0,0|3,0,0]=4 6648 B12R1.255 C[C@H](F)COCCN1CCCC1 f5f2d7b7ae43e3de325b64425ad57e0e [0,0,0,1,0,0|3,0,0]=4 6649 B12R1.255 C[C@H](O)CCNCC1=CCCC1 d53753e1b84ac79eb04b3c07d570e1c7 [0,0,0,1,0,0|1,0,2]=4 6650 B12R1.255 C[C@H](O)CCNCC1CC=CC1 0b4e63713dc463275ab3c5430e54ad1f [0,0,0,1,0,0|1,0,2]=4 6651 B12R1.255 C[C@H](O)CCNCC1CCCC1 76e599538f93e05363eaa9c57e8fa850 [0,0,0,1,0,0|1,0,0]=2 6652 B12R1.255 C[C@H](O)CCNCC1CCCO1 a6bf2d27f5b3d91869b12ade16c0c0ce [0,0,0,1,0,0|2,0,0]=3 6653 B12R1.255 C[C@H](O)CCNCC1CCOC1 2248c2988ad64996935279506576333a [0,0,0,1,0,0|2,0,0]=3 6654 B12R1.255 C[C@H](O)CNCCC1CCCC1 ccbe607e7e39e99d9d2644e927b75900 [0,0,0,1,0,0|1,0,0]=2 6655 B12R1.255 C[C@H](O)CNCCC1CCCO1 21541b705801f31d2ff93784b3ba6270 [0,0,0,1,0,0|2,0,0]=3 6656 B12R1.255 C[C@H](O)CNCCC1CCOC1 fd8160f698fa5e9f3c58ca5d2528cece [0,0,0,1,0,0|2,0,0]=3 6657 B12R1.255 C[C@H](O)CNCCN1CCCC1 930ed835de85d5d1eed5c28fabbc8ba5 [0,0,0,1,0,0|2,0,0]=3 6658 B12R1.255 FC(F)CCNCC1CCCC1 18c165d1797910675627288829e2de9f [0,0,0,1,0,0|3,0,0]=4 6659 B12R1.255 FC(F)CCOCC1CCCC1 8857ba27e02eae7239a9d1bee686a336 [0,0,0,1,0,0|3,0,0]=4 6660 B12R1.255 FC(F)CNCCC1CCCC1 fb89174c1f2c2dd4bab1c20b6707791d [0,0,0,1,0,0|3,0,0]=4 6661 B12R1.255 FC(F)COCCC1CCCC1 3bff58e208f2778c04e6d1fe5eca41eb [0,0,0,1,0,0|3,0,0]=4 6662 B12R1.255 O=C(O)CCCOC1CCCC1 99bc43476fc63e5fbe03c71111b0689d [0,0,0,1,0,0|2,0,1]=4 6663 B12R1.255 O=C(O)CCNCC1CCCC1 4d18a330c62979fee5f0178a497f80d0 [0,0,0,1,0,0|2,0,1]=4 6664 B12R1.255 O=C(O)CCOCC1CCCC1 988b046a92322d1038b6ce57d1132960 [0,0,0,1,0,0|2,0,1]=4 6665 B12R1.255 O=C(O)CNCCC1CCCC1 324f85356df7a32eacba93e5a4f8ba31 [0,0,0,1,0,0|2,0,1]=4 6666 B12R1.255 O=C(O)COCCC1CCCC1 fab27bb93cf625b0c938c51342b434ce [0,0,0,1,0,0|2,0,1]=4 6667 B12R1.255 O=S(O)CCNCC1CCCC1 0cdf243e5270c31dbda143ba2b34c34a [0,0,0,1,0,0|3,0,0]=4 6668 B12R1.255 O=S(O)COCCC1CCCC1 b479dda34b427599079230d970417977 [0,0,0,1,0,0|3,0,0]=4 6669 B12R1.257 C=C(C)CCCNCC1CCC1 87532844ea2ff72f2549ccbec2dae5af [0,0,0,1,0,0|2,0,1]=4 6670 B12R1.257 C=C(C)CCCOCC1CCC1 10e40385bb4eef82d04e7d9e8476f9cd [0,0,0,1,0,0|2,0,1]=4 6671 B12R1.257 C=C(C)CCNCCC1CCC1 d114552d04688a85696520114d26076d [0,0,0,1,0,0|2,0,1]=4 6672 B12R1.257 C=C(C)CCOCCC1CCC1 70c19607bfc618d87bdefba0e7cde0b3 [0,0,0,1,0,0|2,0,1]=4 6673 B12R1.257 C=C(C)COCCCC1CCC1 15d5e4298820d7c118b1d1f8cb6b3b11 [0,0,0,1,0,0|2,0,1]=4 6674 B12R1.257 CC(=O)CCCCCN1CCC1 efe7b58e7215f9ad1bd4fb4e5e4853eb [0,0,0,1,0,0|1,0,2]=4 6675 B12R1.257 CC(=O)CCCCNC1CCC1 b4db55fd0a97b73708647e38a6cea15f [0,0,0,1,0,0|1,0,2]=4 6676 B12R1.257 CC(=O)CCCCOC1CCC1 c935acdd1b4bbc157dc7c158c3291571 [0,0,0,1,0,0|1,0,2]=4 6677 B12R1.257 CC(=O)CCCNCC1CCC1 d958b86e9e0093e24a8412a5ddcf5640 [0,0,0,1,0,0|1,0,2]=4 6678 B12R1.257 CC(=O)CCCOCC1CCC1 742d444b0d64c95aee91fdef9ffa00a8 [0,0,0,1,0,0|1,0,2]=4 6679 B12R1.257 CC(=O)CCNCCC1CCC1 6611f750b4db5a236a4c3b09a686d4ee [0,0,0,1,0,0|1,0,2]=4 6680 B12R1.257 CC(=O)CCOCCC1CCC1 7fd4128189263f6ed6bd49dea1c016ec [0,0,0,1,0,0|1,0,2]=4 6681 B12R1.257 CC(C)CCCCCN1CCC1 a35541bdd6204a75f09842f926153c16 [0,0,0,1,0,0|2,0,0]=3 6682 B12R1.257 CC(C)CCCCNC1CCC1 a61c0aa3d0aac17334a68eca33153ee8 [0,0,0,1,0,0|2,0,0]=3 6683 B12R1.257 CC(C)CCCCNC1COC1 705603ee4f735ca3d3e737f7683fc5ec [0,0,0,1,0,0|3,0,0]=4 6684 B12R1.257 CC(C)CCCCOC1CCC1 532e85bf65ec5c926938b4a0778e37e9 [0,0,0,1,0,0|2,0,0]=3 6685 B12R1.257 CC(C)CCCCOC1COC1 a76a09a31e815f2b3a21be04e51e724b [0,0,0,1,0,0|3,0,0]=4 6686 B12R1.257 CC(C)CCCCOC1CSC1 fe474d776e63abc3c11f94220261fd67 [0,0,0,1,0,0|3,0,0]=4 6687 B12R1.257 CC(C)CCCNCC1CCC1 c8165ecb605efc907cbcae4dc0cad2ec [0,0,0,1,0,0|2,0,0]=3 6688 B12R1.257 CC(C)CCCNCC1CCO1 a64c859b83b882e8e6120da3e9d64fc6 [0,0,0,1,0,0|3,0,0]=4 6689 B12R1.257 CC(C)CCCNCC1COC1 91dc1e02e403ed3a23266b1c146c88e2 [0,0,0,1,0,0|3,0,0]=4 6690 B12R1.257 CC(C)CCCNC[C@@H]1CCO1 b7ac4d900a7ed006f6173963174152ac [0,0,0,1,0,0|3,0,0]=4 6691 B12R1.257 CC(C)CCCNC[C@H]1CCO1 861f69fa4ef573b662fe55e22cd21803 [0,0,0,1,0,0|3,0,0]=4 6692 B12R1.257 CC(C)CCCOCC1CCC1 6bfe7572b76ea6afc2787259db1b3242 [0,0,0,1,0,0|2,0,0]=3 6693 B12R1.257 CC(C)CCCOCC1CCO1 307e138ee7d14c989376df040d7f7fe5 [0,0,0,1,0,0|3,0,0]=4 6694 B12R1.257 CC(C)CCCOCC1COC1 ada3a6b269ca5d533702305f2b135936 [0,0,0,1,0,0|3,0,0]=4 6695 B12R1.257 CC(C)CCCOCC1CSC1 bec223d5e5743bb4d8a2692ad88ea31c [0,0,0,1,0,0|3,0,0]=4 6696 B12R1.257 CC(C)CCCOC[C@@H]1CCO1 9e28d389c8799606dfb4ec50a9100ea4 [0,0,0,1,0,0|3,0,0]=4 6697 B12R1.257 CC(C)CCCOC[C@H]1CCO1 41e64804c1f0a5d3fc93c94ef3f3ffbd [0,0,0,1,0,0|3,0,0]=4 6698 B12R1.257 CC(C)CCNCCC1CCC1 892d0b1f1297abf2ce12060602553194 [0,0,0,1,0,0|2,0,0]=3 6699 B12R1.257 CC(C)CCNCCC1CCO1 2b74a7c41332011ad0aeaecf5497f1ef [0,0,0,1,0,0|3,0,0]=4 6700 B12R1.257 CC(C)CCNCCC1COC1 5391128a50e74b9a1c84837d642fb768 [0,0,0,1,0,0|3,0,0]=4 6701 B12R1.257 CC(C)CCNCCN1CCC1 fbb3f76ffb76c0dea90b118cb55eb1b5 [0,0,0,1,0,0|3,0,0]=4 6702 B12R1.257 CC(C)CCNCC[C@@H]1CCO1 0e5aad8f756313b920cfe7ca0019df1c [0,0,0,1,0,0|3,0,0]=4 6703 B12R1.257 CC(C)CCOCCC1CCC1 2a800190d191cba1dfab16cb90e98d09 [0,0,0,1,0,0|2,0,0]=3 6704 B12R1.257 CC(C)CCOCCC1CCO1 280f140af322e80678ce11380aa95e01 [0,0,0,1,0,0|3,0,0]=4 6705 B12R1.257 CC(C)CCOCCC1COC1 c0592351f04937dc68dd669ab05afd47 [0,0,0,1,0,0|3,0,0]=4 6706 B12R1.257 CC(C)CCOCCN1CCC1 fa3eda93bb9654577181d8e24308111c [0,0,0,1,0,0|3,0,0]=4 6707 B12R1.257 CC(C)CCOCC[C@@H]1CCO1 d15ec928df4a8db4d0d8050c8996df8e [0,0,0,1,0,0|3,0,0]=4 6708 B12R1.257 CC(C)CCOCC[C@H]1CCO1 f7ad0880cab67e973c9f6933d12950d8 [0,0,0,1,0,0|3,0,0]=4 6709 B12R1.257 CC(C)CNCCCN1CCC1 a47c50807829a3c74c5634847d24a8f6 [0,0,0,1,0,0|3,0,0]=4 6710 B12R1.257 CC(C)CNCCOC1CCC1 2016b826b966e3117dc0caca81f798e3 [0,0,0,1,0,0|3,0,0]=4 6711 B12R1.257 CC(C)COCCCC1CCC1 5a2ea7b1f3305cc062e5d87b4c7ff2c5 [0,0,0,1,0,0|2,0,0]=3 6712 B12R1.257 CC(C)COCCCC1COC1 049e4cdd44df5dfd7cb548a9ce8ac08f [0,0,0,1,0,0|3,0,0]=4 6713 B12R1.257 CC(C)COCCCN1CCC1 68accd04538ec4e13b5042d4c0cfaabe [0,0,0,1,0,0|3,0,0]=4 6714 B12R1.257 CC(C)COCCNC1CCC1 ecb4960da8eac8070e9cb8518b9f2867 [0,0,0,1,0,0|3,0,0]=4 6715 B12R1.257 CC(C)COCCOC1CCC1 18b3a8cc4b7793be6464eff600283c76 [0,0,0,1,0,0|3,0,0]=4 6716 B12R1.257 CC(C)CSCCOC1CCC1 9ad48206394e3a8e5ec085ebe9f479bc [0,0,0,1,0,0|3,0,0]=4 6717 B12R1.257 CC(C)OCCCNC1CCC1 611c990b6ae712f34491296043f8bf9b [0,0,0,1,0,0|3,0,0]=4 6718 B12R1.257 CC(C)OCCCOC1CCC1 ad43bb17ee99c2e8096ba089c57616a9 [0,0,0,1,0,0|3,0,0]=4 6719 B12R1.257 CC(C)OCCNCC1CCC1 4a1ab7d3e489d2023c65abc7215082fc [0,0,0,1,0,0|3,0,0]=4 6720 B12R1.257 CC(C)OCCOCC1CCC1 198cc3beeb8282fc562c6407fa5d5d66 [0,0,0,1,0,0|3,0,0]=4 6721 B12R1.257 CC(C)OCNCCC1CCC1 30383f4b2cddc2dcccc8c2380d921b3e [0,0,0,1,0,0|3,0,0]=4 6722 B12R1.257 CC(C)OCOCCC1CCC1 cafc55dee2cbab414826ac68bfda015c [0,0,0,1,0,0|3,0,0]=4 6723 B12R1.257 CC(C)SCCCNC1CCC1 952976b23afc08db13f13d920c8826e7 [0,0,0,1,0,0|3,0,0]=4 6724 B12R1.257 CC(C)SCCCOC1CCC1 0dd5f348080b49929b85744d5f53269e [0,0,0,1,0,0|3,0,0]=4 6725 B12R1.257 CC(C)SCCNCC1CCC1 52a432df8af3247559a9e81dfb1e569f [0,0,0,1,0,0|3,0,0]=4 6726 B12R1.257 CC(C)SCCOCC1CCC1 41c9722d0e20d0992b30d9c14439bb14 [0,0,0,1,0,0|3,0,0]=4 6727 B12R1.257 CC(F)COCCOC1CCC1 3422b2825c11e787055d980e66163920 [0,0,0,1,0,0|3,0,0]=4 6728 B12R1.257 CC(O)CCCCNC1CCC1 09a3a6695ea3926122d9db9bebe6f05b [0,0,0,1,0,0|1,0,0]=2 6729 B12R1.257 CC(O)CCCCNC1COC1 f04b9df81162f302ef2a1b0d8f610e8e [0,0,0,1,0,0|2,0,0]=3 6730 B12R1.257 CC(O)CCCNCC1CCC1 c147b05bb5f91696575b37310e592c9b [0,0,0,1,0,0|1,0,0]=2 6731 B12R1.257 CC(O)CCCNCC1CCO1 a44d35bac1b9e4638fe31291f9520233 [0,0,0,1,0,0|2,0,0]=3 6732 B12R1.257 CC(O)CCCNCC1COC1 b9ae47916bedbfa6bdc8329cb338b394 [0,0,0,1,0,0|2,0,0]=3 6733 B12R1.257 CC(O)CCCNC[C@@H]1CCO1 42fcf8190508686f8d0cffcc0d705057 [0,0,0,1,0,0|2,0,0]=3 6734 B12R1.257 CC(O)CCCNC[C@H]1CCO1 0bbe369ecada016736fa5f100b5f1bc9 [0,0,0,1,0,0|2,0,0]=3 6735 B12R1.257 CC(O)CCNCCC1CCC1 71dacf7b917d1af74b019a49ef8645f6 [0,0,0,1,0,0|1,0,0]=2 6736 B12R1.257 CC(O)CCNCCC1CCO1 ea5887f4338c5b41660dc38796885915 [0,0,0,1,0,0|2,0,0]=3 6737 B12R1.257 CC(O)CCNCCC1COC1 d962fd8b44e0965b602bdf6d9bac0a99 [0,0,0,1,0,0|2,0,0]=3 6738 B12R1.257 CC(O)CCNCCN1CCC1 39464af335a4b47eb8ca23d6ba8ee7e0 [0,0,0,1,0,0|2,0,0]=3 6739 B12R1.257 CC(O)CCNCC[C@@H]1CCO1 44452a2b6aaefbdaf3570ae7f56ac759 [0,0,0,1,0,0|2,0,0]=3 6740 B12R1.257 CC(O)CNCCCN1CCC1 a356520bd45d3345d6b2cceee027294e [0,0,0,1,0,0|2,0,0]=3 6741 B12R1.257 CC(O)CNCCOC1CCC1 f9824b38153ecf4364dae178f1cfe308 [0,0,0,1,0,0|2,0,0]=3 6742 B12R1.257 CC(S)COCCOC1CCC1 efe1f180d41e09bf69a89e12994fc7dd [0,0,0,1,0,0|2,1,0]=4 6743 B12R1.257 CN(C)CCCCNC1CCC1 618c37c869edcec721ef1991bba0648e [0,0,0,1,0,0|3,0,0]=4 6744 B12R1.257 CN(C)CCCCOC1CCC1 3559d6e5b6e069a449fadc2b6acbd755 [0,0,0,1,0,0|3,0,0]=4 6745 B12R1.257 CN(C)CCCNCC1CCC1 746ae91bd3f0be0f13c94797c79387fd [0,0,0,1,0,0|3,0,0]=4 6746 B12R1.257 CN(C)CCCOCC1CCC1 46cc4d0ce71ba3839b47d40a8efc2615 [0,0,0,1,0,0|3,0,0]=4 6747 B12R1.257 CN(C)CCNCCC1CCC1 2d3086b4d17bce38c943d0f1cd7ace92 [0,0,0,1,0,0|3,0,0]=4 6748 B12R1.257 CN(C)CCOCCC1CCC1 ee21c3db2c0e52bc5c2509a6fdb08b47 [0,0,0,1,0,0|3,0,0]=4 6749 B12R1.257 CN(C)COCCCC1CCC1 29200dad05cffa1421db21885608036b [0,0,0,1,0,0|3,0,0]=4 6750 B12R1.257 CS(=O)CCCNCC1CCC1 2b559ff578c208fcf045cee55429621c [0,0,0,1,0,0|2,0,1]=4 6751 B12R1.257 CS(=O)CCNCCC1CCC1 d7fc350a32754abf27f32ccfbcb4494d [0,0,0,1,0,0|2,0,1]=4 6752 B12R1.257 CS(=O)CCOCCC1CCC1 da9c158383d86674bef51c8e823ca61c [0,0,0,1,0,0|2,0,1]=4 6753 B12R1.257 C[C@@H](F)COCCOC1CCC1 682a9108b3af646bf39f135fb494372c [0,0,0,1,0,0|3,0,0]=4 6754 B12R1.257 C[C@@H](O)CCCCNC1CCC1 62ea18892c3a89b5090be0a2e3c5ea91 [0,0,0,1,0,0|1,0,0]=2 6755 B12R1.257 C[C@@H](O)CCCCNC1COC1 0dc188a2de98076741f623c1c9f5b0df [0,0,0,1,0,0|2,0,0]=3 6756 B12R1.257 C[C@@H](O)CCNCCC1CCC1 f4bcff188f4f38f2964be8ce6a13d35a [0,0,0,1,0,0|1,0,0]=2 6757 B12R1.257 C[C@@H](O)CCNCCC1CCO1 8dc8279d53ab574d172c4478510fdac8 [0,0,0,1,0,0|2,0,0]=3 6758 B12R1.257 C[C@@H](O)CCNCCC1COC1 ca1fc0ad2808134d9a45f8ab88af6e12 [0,0,0,1,0,0|2,0,0]=3 6759 B12R1.257 C[C@@H](O)CNCCCN1CCC1 89a47d1f23886912a6e8cc1152ca39e7 [0,0,0,1,0,0|2,0,0]=3 6760 B12R1.257 C[C@@H](O)CNCCOC1CCC1 8aca11c51a2e3bb2811210c9cd44efb4 [0,0,0,1,0,0|2,0,0]=3 6761 B12R1.257 C[C@H](F)COCCOC1CCC1 af6dac3f5b9061bee7016f9ce73e4a86 [0,0,0,1,0,0|3,0,0]=4 6762 B12R1.257 C[C@H](O)CCNCCC1CCC1 0d2cb89910c40c173b588181e3847c97 [0,0,0,1,0,0|1,0,0]=2 6763 B12R1.257 C[C@H](O)CCNCCC1CCO1 a12feec57d2ea1fd4e416b8d2334f1e4 [0,0,0,1,0,0|2,0,0]=3 6764 B12R1.257 C[C@H](O)CCNCCC1COC1 ca0f6141517d7b2d8047f308744f6d70 [0,0,0,1,0,0|2,0,0]=3 6765 B12R1.257 C[C@H](O)CNCCCN1CCC1 5e78f6a400ee11f712ad0f4cf7d6a4e3 [0,0,0,1,0,0|2,0,0]=3 6766 B12R1.257 C[C@H](O)CNCCOC1CCC1 a4adbe45d5313a7dd82a7aef60eb32da [0,0,0,1,0,0|2,0,0]=3 6767 B12R1.257 FC(F)CCCCCN1CCC1 206e7cb3ee6b7c02c662dd18a95d482a [0,0,0,1,0,0|3,0,0]=4 6768 B12R1.257 FC(F)CCCCNC1CCC1 0f955a0b61ca262ce6d1717623514113 [0,0,0,1,0,0|3,0,0]=4 6769 B12R1.257 FC(F)CCNCCC1CCC1 4dbd16c73966f78a98878dac55042f3f [0,0,0,1,0,0|3,0,0]=4 6770 B12R1.257 FC(F)CCOCCC1CCC1 7a79f05376ebae2c0aee0b34e7915378 [0,0,0,1,0,0|3,0,0]=4 6771 B12R1.257 FC(F)COCCCC1CCC1 27a5d6608edbec392254b92dcbc7fe2e [0,0,0,1,0,0|3,0,0]=4 6772 B12R1.257 O=C(O)CCCCNC1CCC1 8c47e392b662667e9c316e378eb973b0 [0,0,0,1,0,0|2,0,1]=4 6773 B12R1.257 O=C(O)CCCCOC1CCC1 1fdb76a3e3b199883a9ad69599b6cb2c [0,0,0,1,0,0|2,0,1]=4 6774 B12R1.257 O=C(O)CCCNCC1CCC1 97344480eadad049288902e57ea670ec [0,0,0,1,0,0|2,0,1]=4 6775 B12R1.257 O=C(O)CCNCCC1CCC1 89341b80152249ae63d8c6f8fb43bdbf [0,0,0,1,0,0|2,0,1]=4 6776 B12R1.257 O=C(O)CCOCCC1CCC1 f014e0910ae5fde508e2bc800d57a87f [0,0,0,1,0,0|2,0,1]=4 6777 B12R1.257 O=C(O)COCCCC1CCC1 ba000324a3df4f318fc6414303193d92 [0,0,0,1,0,0|2,0,1]=4 6778 B12R1.257 O=S(O)CCNCCC1CCC1 4f3cdaa2feafd5213a8b093c23d40c67 [0,0,0,1,0,0|3,0,0]=4 6779 B12R1.271 C=C1CC1COCCCCCC 869a2c97573a88780e2747c36be1cccc [0,0,0,1,0,0|2,0,1]=4 6780 B12R1.271 CC1CC1COCCCCCF e576f86af2d9ae0f8114758df36e492e [0,0,0,1,0,0|3,0,0]=4 6781 B12R1.271 CC1CC1NCCCCCCF 5d4ec6bd4e949dcea26c30636ea6fd00 [0,0,0,1,0,0|3,0,0]=4 6782 B12R1.271 CC1CC1NCCCCCCO 9ca55ff423135930d30db5a4a59b327a [0,0,0,1,0,0|3,0,0]=4 6783 B12R1.271 CCCCCCCNC1CC1C 83ba7726aaf65dccb1e638608e6cbbde [0,0,0,1,0,0|2,0,0]=3 6784 B12R1.271 CCCCCCCN[C@@H]1C[C@H]1F c6a1d2eb38d634003910546c6c9d0e96 [0,0,0,1,0,0|2,0,0]=3 6785 B12R1.271 CCCCCCCN[C@H]1C[C@@H]1F 7a1e141de7ce1560b544691a92869d5b [0,0,0,1,0,0|2,0,0]=3 6786 B12R1.271 CCCCCCCN[C@H]1C[C@H]1F fc05609951259c0557cf128cc695a9ee [0,0,0,1,0,0|2,0,0]=3 6787 B12R1.271 CCCCCCOCC1CC1C 1dd05a60b90fbc05082ec82f76c55286 [0,0,0,1,0,0|2,0,0]=3 6788 B12R1.271 CCCCCCOC[C@@H]1C[C@@H]1C 0961a3fa6327d1ed3cafbe11e4ef32fd [0,0,0,1,0,0|2,0,0]=3 6789 B12R1.271 CCCCCCOC[C@@H]1C[C@@H]1F 360e132742acc63972118c8adbaa30c6 [0,0,0,1,0,0|2,0,0]=3 6790 B12R1.271 CCCCCCOC[C@@H]1C[C@H]1C d7a8d4023ea20eb6f1b756d09813caa9 [0,0,0,1,0,0|2,0,0]=3 6791 B12R1.271 CCCCCCOC[C@@H]1C[C@H]1F 2dd0dd89d1ff11751ce8b8c33f61957a [0,0,0,1,0,0|2,0,0]=3 6792 B12R1.271 CCCCCCOC[C@H]1C[C@@H]1C 9c057e15d2d44d96f5cc72efdb1817d8 [0,0,0,1,0,0|2,0,0]=3 6793 B12R1.271 CCCCCCOC[C@H]1C[C@@H]1F 8fa73622f13e4322aec4bd0f85118cf4 [0,0,0,1,0,0|2,0,0]=3 6794 B12R1.271 CCCCCCOC[C@H]1C[C@H]1F 2d989aa5da9935fa9757f0b3ef39e506 [0,0,0,1,0,0|2,0,0]=3 6795 B12R1.271 CCCCOCCNC1CC1C b1565a85cba006fd6590792b12f9be83 [0,0,0,1,0,0|3,0,0]=4 6796 B12R1.271 CCCCOCCN[C@@H]1C[C@H]1F 50c29c17f8b6051436a253f43bee1962 [0,0,0,1,0,0|3,0,0]=4 6797 B12R1.271 CCCCOCCN[C@H]1C[C@@H]1F 711c2847bb4a6722d1511970751b9e81 [0,0,0,1,0,0|3,0,0]=4 6798 B12R1.271 CCCCOCCN[C@H]1C[C@H]1F 1e5ca5173a487db4dbd1049a588d7419 [0,0,0,1,0,0|3,0,0]=4 6799 B12R1.271 CCCCOCOCC1CC1C e72c04524a3190d03bbaa6be79e6c9a2 [0,0,0,1,0,0|3,0,0]=4 6800 B12R1.271 CCCCOCOC[C@@H]1C[C@@H]1C 73dd02611d7c1580eb8357f11ede4442 [0,0,0,1,0,0|3,0,0]=4 6801 B12R1.271 CCCCOCOC[C@@H]1C[C@@H]1F 1011cf019216df01b7c4800215a1bdf6 [0,0,0,1,0,0|3,0,0]=4 6802 B12R1.271 CCCCOCOC[C@@H]1C[C@H]1C 789c65a2d646e57b73f35cae295fce2a [0,0,0,1,0,0|3,0,0]=4 6803 B12R1.271 CCCCOCOC[C@@H]1C[C@H]1F 01c265cf27f9d5ebdeaea7e4a108c3b0 [0,0,0,1,0,0|3,0,0]=4 6804 B12R1.271 CCCCOCOC[C@H]1C[C@@H]1C e361b85e2a681c1ff1c7bd5bb4c1c699 [0,0,0,1,0,0|3,0,0]=4 6805 B12R1.271 CCCCOCOC[C@H]1C[C@@H]1F 19a442a16f995f793ef47958546afaf1 [0,0,0,1,0,0|3,0,0]=4 6806 B12R1.271 CCCCOCOC[C@H]1C[C@H]1F 8b8918576b28967f41b076d9b4354f8f [0,0,0,1,0,0|3,0,0]=4 6807 B12R1.271 CCCOCCCNC1CC1C 2488fdb76d46c61648996d31113e6e6b [0,0,0,1,0,0|3,0,0]=4 6808 B12R1.271 CCCOCCCN[C@@H]1C[C@H]1F 949a6e37e487bee7cf72ae52262c2079 [0,0,0,1,0,0|3,0,0]=4 6809 B12R1.271 CCCOCCCN[C@H]1C[C@@H]1F 04e2c08c5e18a62431af61d3be721204 [0,0,0,1,0,0|3,0,0]=4 6810 B12R1.271 CCCOCCCN[C@H]1C[C@H]1F 9af1e3a0527270f3770bfb5c3dbcc6e8 [0,0,0,1,0,0|3,0,0]=4 6811 B12R1.271 CCCOCCOCC1CC1C 4e440fbe4d02112cd52852e68d7a641f [0,0,0,1,0,0|3,0,0]=4 6812 B12R1.271 CCCOCCOC[C@@H]1C[C@@H]1C b350fa6419e7077635418d390487a6c5 [0,0,0,1,0,0|3,0,0]=4 6813 B12R1.271 CCCOCCOC[C@@H]1C[C@@H]1F eed82053ff988fb4a9ea1bfd8f2ade44 [0,0,0,1,0,0|3,0,0]=4 6814 B12R1.271 CCCOCCOC[C@@H]1C[C@H]1C 3297c764423e2f3eefc3cc614e3002f9 [0,0,0,1,0,0|3,0,0]=4 6815 B12R1.271 CCCOCCOC[C@@H]1C[C@H]1F ebe8498fd1d22dbf44d94e582f6fa080 [0,0,0,1,0,0|3,0,0]=4 6816 B12R1.271 CCCOCCOC[C@H]1C[C@@H]1C 591534b7ea41fcd979fdaf55add70beb [0,0,0,1,0,0|3,0,0]=4 6817 B12R1.271 CCCOCCOC[C@H]1C[C@@H]1F 8fa0b66c86a9146e89e1ffcb62124797 [0,0,0,1,0,0|3,0,0]=4 6818 B12R1.271 CCCOCCOC[C@H]1C[C@H]1F 2277f601dc9c4e5e324001d03d131070 [0,0,0,1,0,0|3,0,0]=4 6819 B12R1.271 CCOCCCOCC1CC1C 76fb692ead8ddd890b31c2a4656da93e [0,0,0,1,0,0|3,0,0]=4 6820 B12R1.271 CCOCCCOC[C@@H]1C[C@@H]1C ad33c8cad1b28ad4328325bc1539fd94 [0,0,0,1,0,0|3,0,0]=4 6821 B12R1.271 CCOCCCOC[C@@H]1C[C@@H]1F 2748f414d206456eb53686f9528a4ee0 [0,0,0,1,0,0|3,0,0]=4 6822 B12R1.271 CCOCCCOC[C@@H]1C[C@H]1C 65c8cf78bbb761744dd8572d2a75632a [0,0,0,1,0,0|3,0,0]=4 6823 B12R1.271 CCOCCCOC[C@@H]1C[C@H]1F b5987df32f96e44d0378e7c590d792c1 [0,0,0,1,0,0|3,0,0]=4 6824 B12R1.271 CCOCCCOC[C@H]1C[C@@H]1C bde691ae2438a4f70673eef86a4a7893 [0,0,0,1,0,0|3,0,0]=4 6825 B12R1.271 CCOCCCOC[C@H]1C[C@@H]1F 99fbde9e16ee4e7c7a89cbd9d6aff1af [0,0,0,1,0,0|3,0,0]=4 6826 B12R1.271 CCOCCCOC[C@H]1C[C@H]1F b1cdaed6746dd5eb3a3869885c46c478 [0,0,0,1,0,0|3,0,0]=4 6827 B12R1.271 CCSCCCOCC1CC1C 1406dbbef0785d75d44b2b6a7d9eff31 [0,0,0,1,0,0|3,0,0]=4 6828 B12R1.271 CCSCCCOC[C@@H]1C[C@@H]1C 009077e6ce84b73ff8c19ea0b8a8a635 [0,0,0,1,0,0|3,0,0]=4 6829 B12R1.271 CCSCCCOC[C@@H]1C[C@@H]1F 8aaf79101a93cb4527cab4fb9d9ec32c [0,0,0,1,0,0|3,0,0]=4 6830 B12R1.271 CCSCCCOC[C@@H]1C[C@H]1C fb8ed1c24eb394176e17b9aa67b3464d [0,0,0,1,0,0|3,0,0]=4 6831 B12R1.271 CCSCCCOC[C@@H]1C[C@H]1F fabe84cf0718491b458145d262fd8cab [0,0,0,1,0,0|3,0,0]=4 6832 B12R1.271 CCSCCCOC[C@H]1C[C@@H]1C d45de04c73ef6e92a88ed753155faa35 [0,0,0,1,0,0|3,0,0]=4 6833 B12R1.271 CCSCCCOC[C@H]1C[C@@H]1F 5ae557c0c16bf305bf1286393d91de75 [0,0,0,1,0,0|3,0,0]=4 6834 B12R1.271 CCSCCCOC[C@H]1C[C@H]1F bf25ee4daacf60e177402e8c34508518 [0,0,0,1,0,0|3,0,0]=4 6835 B12R1.271 COCCCCCNC1CC1C af9e434f2a8d11d0e4d7f1fb18e5c48d [0,0,0,1,0,0|3,0,0]=4 6836 B12R1.271 COCCCCCN[C@@H]1C[C@H]1F 57019617253afc8fb076c44710b14963 [0,0,0,1,0,0|3,0,0]=4 6837 B12R1.271 COCCCCCN[C@H]1C[C@@H]1F 5b5fd6098ae1d15846d1b3a028738998 [0,0,0,1,0,0|3,0,0]=4 6838 B12R1.271 COCCCCCN[C@H]1C[C@H]1F 7eef929db5f7b7f00362deda726af61d [0,0,0,1,0,0|3,0,0]=4 6839 B12R1.271 COCCCCOCC1CC1C fc440a4cdb39375bc72be01d27ae7b04 [0,0,0,1,0,0|3,0,0]=4 6840 B12R1.271 COCCCCOC[C@@H]1C[C@@H]1C 5741453cbaa5f02e9317bb2d35a48423 [0,0,0,1,0,0|3,0,0]=4 6841 B12R1.271 COCCCCOC[C@@H]1C[C@@H]1F eb2471899c76f7808ef3f995944aa5b0 [0,0,0,1,0,0|3,0,0]=4 6842 B12R1.271 COCCCCOC[C@@H]1C[C@H]1C 130463d7fca5b78170d5ceee6b567b84 [0,0,0,1,0,0|3,0,0]=4 6843 B12R1.271 COCCCCOC[C@@H]1C[C@H]1F 50314795499f99d02ed444093171dbbe [0,0,0,1,0,0|3,0,0]=4 6844 B12R1.271 COCCCCOC[C@H]1C[C@@H]1C 7380ccf8299ebb7dfaff9c4329bf3a62 [0,0,0,1,0,0|3,0,0]=4 6845 B12R1.271 COCCCCOC[C@H]1C[C@@H]1F a2d458182e06342a19cc60107e491c4c [0,0,0,1,0,0|3,0,0]=4 6846 B12R1.271 COCCCCOC[C@H]1C[C@H]1F ad63d62bd400b78cab3eaa769134c465 [0,0,0,1,0,0|3,0,0]=4 6847 B12R1.271 C[C@@H]1C[C@H]1COCCCCCF 9a225f3e01910551247d14a160e52609 [0,0,0,1,0,0|3,0,0]=4 6848 B12R1.271 C[C@H]1C[C@@H]1COCCCCCF b2a9cc09b24927867680a6cd5758c59b [0,0,0,1,0,0|3,0,0]=4 6849 B12R1.271 C[C@H]1C[C@H]1COCCCCCF 68c4684b3bda17ebc9ee304ece3dd389 [0,0,0,1,0,0|3,0,0]=4 6850 B12R1.271 FCCCCCCN[C@@H]1C[C@H]1F 7d4a9377f8ad76294238b992b92b07bb [0,0,0,1,0,0|3,0,0]=4 6851 B12R1.271 FCCCCCCN[C@H]1C[C@@H]1F ea1c60dbc8493491eef347049a47f7f2 [0,0,0,1,0,0|3,0,0]=4 6852 B12R1.271 FCCCCCCN[C@H]1C[C@H]1F 602a3c2a5866ddc3ac98237e1022fb9c [0,0,0,1,0,0|3,0,0]=4 6853 B12R1.271 FCCCCCOC[C@@H]1C[C@@H]1F a1a7fb76edaaa507218efd2a788bdfa2 [0,0,0,1,0,0|3,0,0]=4 6854 B12R1.271 FCCCCCOC[C@@H]1C[C@H]1F 24247ce836c2c85a2c63542b5d37b1a2 [0,0,0,1,0,0|3,0,0]=4 6855 B12R1.271 FCCCCCOC[C@H]1C[C@@H]1F 068e40725b6530e52a3db8a8146b5e14 [0,0,0,1,0,0|3,0,0]=4 6856 B12R1.271 FCCCCCOC[C@H]1C[C@H]1F b911445a4a2653c686379efb32ee4449 [0,0,0,1,0,0|3,0,0]=4 6857 B12R1.271 OCCCCCCN[C@@H]1C[C@H]1F 9f545afb00c179981428faf9ea1c0000 [0,0,0,1,0,0|3,0,0]=4 6858 B12R1.271 OCCCCCCN[C@H]1C[C@@H]1F 5f3ba7f2bc250f283de00ddcce9d6a7b [0,0,0,1,0,0|3,0,0]=4 6859 B12R1.271 OCCCCCCN[C@H]1C[C@H]1F 9dacc038d335b17ee89262eec781240a [0,0,0,1,0,0|3,0,0]=4 6860 B12R1.283 CC(C)C1CCCCC1OCF 29aa1db01df4b0b5ed713a191469158a [0,0,0,1,0,0|3,0,0]=4 6861 B12R1.283 CC(C)N1CCCCC1CCCl a3f2f5f48f777ea8c6b1616cf57623ae [0,0,0,1,0,0|3,0,0]=4 6862 B12R1.283 CC(C)N1CCCCC1CCO c75d78d26600fe6d8d9652df9b16b5ac [0,0,0,1,0,0|3,0,0]=4 6863 B12R1.283 CC(C)N1CCCC[C@@H]1CCO 220cb9806d2909c4200456a4f09e5ec3 [0,0,0,1,0,0|3,0,0]=4 6864 B12R1.283 CC(C)N1CCCC[C@H]1CCO 35c3fa13ed2df62e35f40b9a387f053d [0,0,0,1,0,0|3,0,0]=4 6865 B12R1.283 CCCC1COCCN1C(C)C 939a2d08fb00f40df2fb6634947d77af [0,0,0,1,0,0|3,0,0]=4 6866 B12R1.283 CCCN1CCCCC1C(=O)C 7c2c223f521e0536b13116c4b90da35e [0,0,0,1,0,0|1,0,2]=4 6867 B12R1.283 CCCN1CCCCC1C(=O)O abc904457c95c595db72ccb051ad6a80 [0,0,0,1,0,0|2,0,1]=4 6868 B12R1.283 CCCN1CCCCC1C(F)F 2ac509bfa31ff7342aae4fb074f3ec31 [0,0,0,1,0,0|3,0,0]=4 6869 B12R1.283 CCCN1CCCC[C@@H]1C(=O)O e827085340113380b3effa328728f865 [0,0,0,1,0,0|2,0,1]=4 6870 B12R1.283 CCCN1CCCC[C@@H]1C(F)F f27ecb701eb97b38379d56b6c458cb5b [0,0,0,1,0,0|3,0,0]=4 6871 B12R1.283 CCCN1CCCC[C@H]1C(=O)O 048bd70b07e44b81e3a792298ad86f3d [0,0,0,1,0,0|2,0,1]=4 6872 B12R1.283 CCCN1CCCC[C@H]1C(F)F f942d1f56074064933506b344710996d [0,0,0,1,0,0|3,0,0]=4 6873 B12R1.283 CCCN1CCOCC1C(C)C f16d7c32693ddcb44e285265f762ef25 [0,0,0,1,0,0|3,0,0]=4 6874 B12R1.283 CCCN1CCOC[C@@H]1C(C)C 426cb7edd78c13e756354acc40336d10 [0,0,0,1,0,0|3,0,0]=4 6875 B12R1.283 CCCN1CCOC[C@H]1C(C)C cbc90e1343156e45e2505c7e969f3663 [0,0,0,1,0,0|3,0,0]=4 6876 B12R1.283 CCNC1CCCCC1C(=O)O 2801e5865e0e37e41e6303c6c8aa0aad [0,0,0,1,0,0|2,0,1]=4 6877 B12R1.283 CCNC1CCCCC1N(C)C 6671f6871b4aebe5d5b4358248fea55b [0,0,0,1,0,0|3,0,0]=4 6878 B12R1.283 CCN[C@@H]1CCCC[C@H]1N(C)C 55c69e132d10442566c7a5e565a44d49 [0,0,0,1,0,0|3,0,0]=4 6879 B12R1.283 CCN[C@H]1CCCC[C@@H]1C(=O)O 3e939cae097addbcc14cc6c3fba239b5 [0,0,0,1,0,0|2,0,1]=4 6880 B12R1.283 CCN[C@H]1CCCC[C@@H]1N(C)C faaf5077f5da2580ff3b6a8eeea86df0 [0,0,0,1,0,0|3,0,0]=4 6881 B12R1.283 CCN[C@H]1CCCC[C@H]1C(=O)O b70442dbb9aa3c442c7b613fcb81ed5a [0,0,0,1,0,0|2,0,1]=4 6882 B12R1.283 CCOC1CCCCC1C(=O)O 8727008b5a3064458f9a59b0ef36913b [0,0,0,1,0,0|2,0,1]=4 6883 B12R1.283 CCOC1CCCCC1C(C)C 3a59cb196f896af9454138e3c3a07ffd [0,0,0,1,0,0|2,0,0]=3 6884 B12R1.283 CCOC1CCCCC1N(C)C 4c9264c119a71a6205f3e565d5b5c667 [0,0,0,1,0,0|3,0,0]=4 6885 B12R1.283 CCO[C@@H]1CCCC[C@@H]1N(C)C 3856a4818ba945edd624d715398aab00 [0,0,0,1,0,0|3,0,0]=4 6886 B12R1.283 CCO[C@@H]1CCCC[C@H]1N(C)C 2287e0231ec6a5708695dafa0f751096 [0,0,0,1,0,0|3,0,0]=4 6887 B12R1.283 CCO[C@H]1CCCC[C@H]1N(C)C 5ea980fa96fee10b1a8d264f2700d34a [0,0,0,1,0,0|3,0,0]=4 6888 B12R1.283 COCC1CCCCN1C(C)C c542de3106d0586cdc68eed111d44876 [0,0,0,1,0,0|3,0,0]=4 6889 B12R1.289 CC(C)CC1CCCN1CCF c645a93a0451d843352f9f55100d2547 [0,0,0,1,0,0|3,0,0]=4 6890 B12R1.289 CC(C)CC1CCCN1CCO c7b6ebccf7a02f0d6ae6a995885ecb10 [0,0,0,1,0,0|3,0,0]=4 6891 B12R1.289 CC(C)CC1CCCN1CCS 5a9df783fb0b49c0813609df3a40a33a [0,0,0,1,0,0|3,0,0]=4 6892 B12R1.289 CC(C)CN1CCCC1CCO 16641d095c7b8c19cbc30d3ad862f776 [0,0,0,1,0,0|3,0,0]=4 6893 B12R1.289 CC(C)CN1CCC[C@@H]1CCO c3e2c2154e90f63b936b012399e831a6 [0,0,0,1,0,0|3,0,0]=4 6894 B12R1.289 CC(O)CN1CCCC1CCO 6bbc9804fd8469d92e585b337929caa1 [0,0,0,1,0,0|2,0,0]=3 6895 B12R1.289 CC(O)CN1CCC[C@@H]1CCO d2cbf15ff9e45819864a9068bf355f9a [0,0,0,1,0,0|2,0,0]=3 6896 B12R1.289 CCCC1C=CCN1CC(C)O df791f7001b8599c99f786557c1ace5e [0,0,0,1,0,0|1,0,2]=4 6897 B12R1.289 CCCC1C=CCN1C[C@@H](C)O 196d92d6e01bea5e96a6a3d760724ca4 [0,0,0,1,0,0|1,0,2]=4 6898 B12R1.289 CCCC1C=CCN1C[C@H](C)O b3abf0b7d06c2f1bb6ca526614dc28d1 [0,0,0,1,0,0|1,0,2]=4 6899 B12R1.289 CCCC1SCCN1CC(C)C edcfd1a33c3e674183c651cdd2c9e27c [0,0,0,1,0,0|3,0,0]=4 6900 B12R1.289 CCCC1SCCN1CC(C)O db248195164e0994a5b11f78adaebf2c [0,0,0,1,0,0|2,0,0]=3 6901 B12R1.289 CCCC1SCCN1C[C@@H](C)O 23eea1c8e10d17271153b25e9f72653f [0,0,0,1,0,0|2,0,0]=3 6902 B12R1.289 CCCC1SCCN1C[C@H](C)O 46aa79a63a7f605befaf72c5958e5b2a [0,0,0,1,0,0|2,0,0]=3 6903 B12R1.289 CCCN1CCCC1CC(=O)O 5ab52f7819964ea5746c897e9f209b5d [0,0,0,1,0,0|2,0,1]=4 6904 B12R1.289 CCCN1CCCC1CC(C)C 38270a4663756852dd551516112f52e2 [0,0,0,1,0,0|2,0,0]=3 6905 B12R1.289 CCCN1CCC[C@@H]1CC(=O)O bf160ee86cef9555754ad1c4c493993f [0,0,0,1,0,0|2,0,1]=4 6906 B12R1.289 CCCN1CCC[C@@H]1CN(C)C 9a666264d8d4b647c4c5e4f13d01bbb9 [0,0,0,1,0,0|3,0,0]=4 6907 B12R1.289 CCCN1CCC[C@H]1CC(=O)O 0926e28dbaa25186f0b0fee71283ef15 [0,0,0,1,0,0|2,0,1]=4 6908 B12R1.289 CCCN1CCC[C@H]1CN(C)C 035c6c09da29b522ab6aead99e00079b [0,0,0,1,0,0|3,0,0]=4 6909 B12R1.289 COCC1CCCN1CC(C)C f72d049b8b42e69cd03a4c0e1bce703e [0,0,0,1,0,0|3,0,0]=4 6910 B12R1.289 COCC1CCCN1CC(C)O 4cf37f1473c2e13f5680f860b7b62f89 [0,0,0,1,0,0|2,0,0]=3 6911 B12R1.289 COCC1CCCN1C[C@@H](C)O 1ad04d62799226dbfb8e46e7665cece6 [0,0,0,1,0,0|2,0,0]=3 6912 B12R1.289 COCC1CCCN1C[C@H](C)O 17d19c46a20b4a85aa9838c0d6165715 [0,0,0,1,0,0|2,0,0]=3 6913 B12R1.289 COCN1CCCC1CC(C)C caa18a07b6f4a1533e809ddc96b28833 [0,0,0,1,0,0|3,0,0]=4 6914 B12R1.289 COC[C@@H]1CCCN1CC(C)C 954c8c1eedefc99dd0efbdd28706ce46 [0,0,0,1,0,0|3,0,0]=4 6915 B12R1.289 COC[C@@H]1CCCN1CC(C)O beb19fbfaf88b4f9317e9d51202fc247 [0,0,0,1,0,0|2,0,0]=3 6916 B12R1.289 COC[C@@H]1CCCN1C[C@@H](C)O 002a2fb62d60d71453e8d4f55c8b02d7 [0,0,0,1,0,0|2,0,0]=3 6917 B12R1.289 COC[C@@H]1CCCN1C[C@H](C)O 66e4b1a220164b289fdb2ac49a268046 [0,0,0,1,0,0|2,0,0]=3 6918 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CCCCN1CCC[C@H]1C(F)F 01f6331bb5df72eb2adfd54a211a500a [0,0,0,1,0,0|3,0,0]=4 7120 B12R1.386 CCCCN1CCC[C@H]1[C@H](C)O 42d2cf09affa9283b250e4f573c0b35e [0,0,0,1,0,0|1,0,0]=2 7121 B12R1.386 CCCN[C@@H]1CCC[C@@H]1C(=O)O cfad12ade12f99a87002af6ea9f0932a [0,0,0,1,0,0|2,0,1]=4 7122 B12R1.386 CCCN[C@@H]1CCC[C@H]1N(C)C 63faf463e6b986297574040fd11b5d2d [0,0,0,1,0,0|3,0,0]=4 7123 B12R1.386 CCCN[C@H]1CCC[C@@H]1C(=O)O 79616891427e1d4385f831e5e0a6f18c [0,0,0,1,0,0|2,0,1]=4 7124 B12R1.386 CCCN[C@H]1CCC[C@@H]1N(C)C 38cfceb76c47eaceae644655b3dfdeba [0,0,0,1,0,0|3,0,0]=4 7125 B12R1.386 CCCN[C@H]1CCC[C@H]1C(=O)O 7ac340d2f94a27891b1a8a8d65014002 [0,0,0,1,0,0|2,0,1]=4 7126 B12R1.386 CCCOC1CCCC1C(=O)O 9501ea922c9ec74de76107ab6828f48e [0,0,0,1,0,0|2,0,1]=4 7127 B12R1.386 CCCOC1CCCC1C(C)C 9cc378b24572566613f235ff847a11a9 [0,0,0,1,0,0|2,0,0]=3 7128 B12R1.386 CCCOC1CCCC1N(C)C 2a6b58d7e4ad70effabb568a10708e32 [0,0,0,1,0,0|3,0,0]=4 7129 B12R1.386 CCCO[C@@H]1CCC[C@@H]1C(=O)O 0bb4c9ade21944eabef58e324215cff7 [0,0,0,1,0,0|2,0,1]=4 7130 B12R1.386 CCCO[C@@H]1CCC[C@H]1C(=O)O 65bec8f1ca36232606a9e9ea7bc075a3 [0,0,0,1,0,0|2,0,1]=4 7131 B12R1.386 CCCO[C@@H]1CCC[C@H]1N(C)C bc05f19f74e1fb70cb40ba6dbeb8d0ea [0,0,0,1,0,0|3,0,0]=4 7132 B12R1.386 CCCO[C@H]1CCC[C@H]1C(=O)O 3d0418fcac664d10915b2c9cd7fdabb2 [0,0,0,1,0,0|2,0,1]=4 7133 B12R1.386 CCNCC1CCCN1C(C)C 7ed53cb98f16b599810c8434855af18d [0,0,0,1,0,0|3,0,0]=4 7134 B12R1.386 CCOCC1CCCN1C(C)C 3e59dc1146d45a755cd403df233188f3 [0,0,0,1,0,0|3,0,0]=4 7135 B12R1.386 CCOCN1CCCC1C(C)C e5f229e3b5f0dc970dca730d8f007e80 [0,0,0,1,0,0|3,0,0]=4 7136 B12R1.386 CCOCN1CCCC1C(C)O 29dea69300480944f1c2add731c63f33 [0,0,0,1,0,0|2,0,0]=3 7137 B12R1.386 CCOCN1CCC[C@@H]1C(C)O 80aae2ffc204f716d02e62e6124420d4 [0,0,0,1,0,0|2,0,0]=3 7138 B12R1.386 CCOCN1CCC[C@H]1C(C)C 5194992e24c8404ddb57eda7266507ab [0,0,0,1,0,0|3,0,0]=4 7139 B12R1.386 CCOCN1CCC[C@H]1[C@H](C)O e542d71159fcd48f6ae89bd8b228a751 [0,0,0,1,0,0|2,0,0]=3 7140 B12R1.386 CCOC[C@@H]1CCCN1C(C)C 48fea9a003713a7e05b1bb4465821bad [0,0,0,1,0,0|3,0,0]=4 7141 B12R1.386 CCOC[C@H]1CCCN1C(C)C 7f8d54ca1c40785fc635964baef9837a [0,0,0,1,0,0|3,0,0]=4 7142 B12R1.386 COCCC1CCCN1C(C)C 016a94627d262c0ec55f28c30910ca3f [0,0,0,1,0,0|3,0,0]=4 7143 B12R1.386 COCCN1CCCC1C(C)C e41b377847074bcd97f0171a2df36ee5 [0,0,0,1,0,0|3,0,0]=4 7144 B12R1.386 COCCN1CCCC1C(C)O 3f6e3498d1417bc51d703ba927b772c2 [0,0,0,1,0,0|2,0,0]=3 7145 B12R1.386 COCCN1CCC[C@@H]1C(C)O 02e0048635065d20f48fe13ca8518ce4 [0,0,0,1,0,0|2,0,0]=3 7146 B12R1.386 COCCN1CCC[C@H]1C(C)C f30e5122a7d5ab7f3a733ee3ea330e85 [0,0,0,1,0,0|3,0,0]=4 7147 B12R1.386 COCCN1CCC[C@H]1[C@H](C)O 1134b32f4e85545db7c19b7c4e1ab4b8 [0,0,0,1,0,0|2,0,0]=3 7148 B12R1.386 COCOC1CCCC1C(C)C 52a4a68550469d36f0d909b82ed2df87 [0,0,0,1,0,0|3,0,0]=4 7149 B12R1.386 CSCCN1CCCC1C(C)C 3de0a7ef5269e13cd14342a7b1ffa78f [0,0,0,1,0,0|3,0,0]=4 7150 B12R1.386 CSCCN1CCCC1C(C)O e5e68d583e119a805a915ea2a69f0ce5 [0,0,0,1,0,0|2,0,0]=3 7151 B12R1.386 CSCCN1CCC[C@@H]1C(C)O c9846d0205a44aeae1a203e59d5693c8 [0,0,0,1,0,0|2,0,0]=3 7152 B12R1.386 CSCCN1CCC[C@H]1C(C)C bd8164f05582de6882346c12c3469fe3 [0,0,0,1,0,0|3,0,0]=4 7153 B12R1.386 CSCCN1CCC[C@H]1[C@H](C)O f8310ba1a874dca8ad6db1d9169ce10a [0,0,0,1,0,0|2,0,0]=3 7154 B12R1.386 CSCOC1CCCC1C(C)C 952ad30a07c5adcf727a5ec5f28bb867 [0,0,0,1,0,0|3,0,0]=4 7155 B12R1.386 C[C@H](O)[C@@H]1CCCN1CCC#N c6ed21a7c9e3530411c9270e67daa844 [0,0,0,1,0,0|2,0,1]=4 7156 B12R1.386 C[C@H](O)[C@@H]1CCCN1CCC=O b850f3d5c26a9a6579dd113a614ce6ab [0,0,0,1,0,0|2,0,1]=4 7157 B12R1.386 C[C@H](O)[C@@H]1CCCN1CCCF a8e33d6bf19d56c35d864885f4b4efeb [0,0,0,1,0,0|2,0,0]=3 7158 B12R1.386 C[C@H](O)[C@@H]1CCCN1CCCO 41d409ad62238fa53a3cd56e445ed0e1 [0,0,0,1,0,0|2,0,0]=3 7159 B12R1.386 C[C@H](O)[C@@H]1CCCN1CCCS ff84e7a6f57f4c0abe48b2e8d5de36bf [0,0,0,1,0,0|2,0,0]=3 7160 B12R1.390 C=C(C)CCCNCCC1CC1 f5c2f7f4e46428fd4ab915c7063a1f8a [0,0,0,1,0,0|2,0,1]=4 7161 B12R1.390 C=C(C)CCCOCCC1CC1 2f7ec4ec7d45e11302bb79093561fff6 [0,0,0,1,0,0|2,0,1]=4 7162 B12R1.390 C=C(C)CCOCCCC1CC1 aa0e0ebb415d536474b1e330e612f50f [0,0,0,1,0,0|2,0,1]=4 7163 B12R1.390 CC(=O)CCCCCNC1CC1 e8062cd98dbb22d0287fb43792a2ab84 [0,0,0,1,0,0|1,0,2]=4 7164 B12R1.390 CC(=O)CCCCCOC1CC1 a5ad8e1dc0290f028ec2bab875875022 [0,0,0,1,0,0|1,0,2]=4 7165 B12R1.390 CC(=O)CCCCNCC1CC1 309fbdb962c6e9cd7704fb3ae91b248d [0,0,0,1,0,0|1,0,2]=4 7166 B12R1.390 CC(=O)CCCCOCC1CC1 f84a1ed9d9a93077acb82bc1a331e2c2 [0,0,0,1,0,0|1,0,2]=4 7167 B12R1.390 CC(=O)CCCNCCC1CC1 bb663138f7dda6cbf97733575bac5f40 [0,0,0,1,0,0|1,0,2]=4 7168 B12R1.390 CC(=O)CCCOCCC1CC1 16fc571b39f6cfb35414377a119053b4 [0,0,0,1,0,0|1,0,2]=4 7169 B12R1.390 CC(=O)CCOCCCC1CC1 4638f665f5c69b6be447981598236020 [0,0,0,1,0,0|1,0,2]=4 7170 B12R1.390 CC(C)CCCCCNC1CC1 692859c549b83d7d28f2c8fdbbd4ff74 [0,0,0,1,0,0|2,0,0]=3 7171 B12R1.390 CC(C)CCCCCOC1CC1 be4708fd411f87d0ef8e3b40cfff6709 [0,0,0,1,0,0|2,0,0]=3 7172 B12R1.390 CC(C)CCCCNCC1CC1 eeed175d768f86df902a25194c70b964 [0,0,0,1,0,0|2,0,0]=3 7173 B12R1.390 CC(C)CCCCOCC1CC1 a027ae618bd0c28d50a741c69c2c4db2 [0,0,0,1,0,0|2,0,0]=3 7174 B12R1.390 CC(C)CCCNCCC1CC1 e3597d5566540fb80bc4b71a04887d39 [0,0,0,1,0,0|2,0,0]=3 7175 B12R1.390 CC(C)CCCNCCN1CC1 81a06e35b2c4ef3ff7c39d20cc05a632 [0,0,0,1,0,0|3,0,0]=4 7176 B12R1.390 CC(C)CCCOCCC1CC1 c56a2495d046536299f020c800b584c3 [0,0,0,1,0,0|2,0,0]=3 7177 B12R1.390 CC(C)CCCOCCN1CC1 a85dedd10e6b752e327bea9d17e71dff [0,0,0,1,0,0|3,0,0]=4 7178 B12R1.390 CC(C)CCNCCOC1CC1 8f0e31098fbce82e0039067706872df9 [0,0,0,1,0,0|3,0,0]=4 7179 B12R1.390 CC(C)CCOCCCC1CC1 925dcb7ac9fa4556d11a422d14f1bd3c [0,0,0,1,0,0|2,0,0]=3 7180 B12R1.390 CC(C)CCOCCOC1CC1 585b48b3dabedfbdf301e38c912f014b [0,0,0,1,0,0|3,0,0]=4 7181 B12R1.390 CC(C)CNCCSCC1CC1 a52ae366390ffa489eec0b3c42c60486 [0,0,0,1,0,0|3,0,0]=4 7182 B12R1.390 CC(C)COCCCNC1CC1 5053dee3eac784c3d0c4726ab5e258db [0,0,0,1,0,0|3,0,0]=4 7183 B12R1.390 CC(C)COCCCOC1CC1 b6036c057b461b4ad4a15608c4242832 [0,0,0,1,0,0|3,0,0]=4 7184 B12R1.390 CC(C)COCCCSC1CC1 923d0c846d5ff4d75bd94306cab4a33d [0,0,0,1,0,0|3,0,0]=4 7185 B12R1.390 CC(C)COCCNCC1CC1 b82cd18f8baf8f2dab9f48cc230fd844 [0,0,0,1,0,0|3,0,0]=4 7186 B12R1.390 CC(C)COCCOCC1CC1 73e706f5badbad8d36cfe129a021b5bd [0,0,0,1,0,0|3,0,0]=4 7187 B12R1.390 CC(C)CSCCCOC1CC1 747b9b8dc77ed8f7ce6807217ce37250 [0,0,0,1,0,0|3,0,0]=4 7188 B12R1.390 CC(C)CSCCOCC1CC1 734f89d585558b87673af50cd5645640 [0,0,0,1,0,0|3,0,0]=4 7189 B12R1.390 CC(C)NCCCOCC1CC1 b638c63ec2780ce67b6641c48f08ad3e [0,0,0,1,0,0|3,0,0]=4 7190 B12R1.390 CC(C)OCCCNCC1CC1 3edb58a433b80800d9cc92a881c401d1 [0,0,0,1,0,0|3,0,0]=4 7191 B12R1.390 CC(C)OCCCOCC1CC1 20a681645d9f481cef714e4e8b977694 [0,0,0,1,0,0|3,0,0]=4 7192 B12R1.390 CC(C)OCCNCCC1CC1 03193bf1125ad5485c2ccef084df7c60 [0,0,0,1,0,0|3,0,0]=4 7193 B12R1.390 CC(C)OCCOCCC1CC1 cf365324f78a68862e763f0c2437a5ac [0,0,0,1,0,0|3,0,0]=4 7194 B12R1.390 CC(C)OCOCCCC1CC1 1c46a9f2e9037540536b8a3ac374e1fd [0,0,0,1,0,0|3,0,0]=4 7195 B12R1.390 CC(C)SCCCNCC1CC1 5bdd99ebf3fcd77bac98594e8a1ee245 [0,0,0,1,0,0|3,0,0]=4 7196 B12R1.390 CC(C)SCCCOCC1CC1 b799230eca4f892e425abbb8ba139699 [0,0,0,1,0,0|3,0,0]=4 7197 B12R1.390 CC(C)SCCNCCC1CC1 3b48968cac761f0b602499b41dcb7471 [0,0,0,1,0,0|3,0,0]=4 7198 B12R1.390 CC(C)SCCOCCC1CC1 796a3c6e04082a590a42f261c292d569 [0,0,0,1,0,0|3,0,0]=4 7199 B12R1.390 CC(O)CCCCNCC1CC1 f49b6d04d4f3023d58cc9b08b3d41976 [0,0,0,1,0,0|1,0,0]=2 7200 B12R1.390 CC(O)CCCNCCC1CC1 e2eea692ac8ff8395ba7388dde558d73 [0,0,0,1,0,0|1,0,0]=2 7201 B12R1.390 CC(O)CCCNCCN1CC1 0f3481b1dd055219e57b5d93a045af32 [0,0,0,1,0,0|2,0,0]=3 7202 B12R1.390 CC(O)CCNCC#CC1CC1 cff9e6988607ece7e9343588809e212b [0,0,0,1,0,0|1,0,2]=4 7203 B12R1.390 CC(O)CCNCCOC1CC1 1f95be95272841640a8e33050907eeba [0,0,0,1,0,0|2,0,0]=3 7204 B12R1.390 CC(O)CNCCCC=C1CC1 5fa3559c3fb41dbec58db1da97742947 [0,0,0,1,0,0|1,0,2]=4 7205 B12R1.390 CC(O)CNCCSCC1CC1 2929ace955e1d888d3132053fd59c7c1 [0,0,0,1,0,0|2,0,0]=3 7206 B12R1.390 CN(C)CCCCCNC1CC1 cbd4584e788420ce4482e1cfc2da7358 [0,0,0,1,0,0|3,0,0]=4 7207 B12R1.390 CN(C)CCCCCOC1CC1 af566d6bca5bbc58bf3ae56099309efc [0,0,0,1,0,0|3,0,0]=4 7208 B12R1.390 CN(C)CCCCNCC1CC1 38cdbb446d2747b844812228e370b626 [0,0,0,1,0,0|3,0,0]=4 7209 B12R1.390 CN(C)CCCCOCC1CC1 1640bf8a94831d16796623827bca5977 [0,0,0,1,0,0|3,0,0]=4 7210 B12R1.390 CN(C)CCCNCCC1CC1 39c5acc73ccf0024e8e47b4929168895 [0,0,0,1,0,0|3,0,0]=4 7211 B12R1.390 CN(C)CCCOCCC1CC1 d35349f2b330a0967986c55bedbe8170 [0,0,0,1,0,0|3,0,0]=4 7212 B12R1.390 CN(C)CCOCCCC1CC1 5843a3f2024a82b8c6d617c5d1a2cf04 [0,0,0,1,0,0|3,0,0]=4 7213 B12R1.390 CS(=O)CCCNCCC1CC1 60b4d4ccc7c2d1bc812fb7f1dbf7999d [0,0,0,1,0,0|2,0,1]=4 7214 B12R1.390 CS(=O)CCOCCCC1CC1 af948e400f1453336e215d0e4c945c6b [0,0,0,1,0,0|2,0,1]=4 7215 B12R1.390 C[C@@H](O)CCCCNCC1CC1 68fbb5bb61d687571ad36d559f530b34 [0,0,0,1,0,0|1,0,0]=2 7216 B12R1.390 C[C@@H](O)CCNCC#CC1CC1 06a020d9d5bad8f2dadf582665430d5a [0,0,0,1,0,0|1,0,2]=4 7217 B12R1.390 C[C@@H](O)CCNCCOC1CC1 54b20c43b23e7087809c349d4be3c466 [0,0,0,1,0,0|2,0,0]=3 7218 B12R1.390 C[C@@H](O)CNCCCC=C1CC1 0e98dc64ac73ba2210b2e66ca74be45c [0,0,0,1,0,0|1,0,2]=4 7219 B12R1.390 C[C@@H](O)CNCCSCC1CC1 b6f6d485816cc87fdb7636e1e85109cc [0,0,0,1,0,0|2,0,0]=3 7220 B12R1.390 C[C@H](O)CCNCC#CC1CC1 854e3b4a34c7447e8fd6bbb1667ff8ca [0,0,0,1,0,0|1,0,2]=4 7221 B12R1.390 C[C@H](O)CCNCCOC1CC1 f3cc3d74cb9de65fef2d6179c4825abb [0,0,0,1,0,0|2,0,0]=3 7222 B12R1.390 C[C@H](O)CNCCCC=C1CC1 f68f656e788557b7a6b883c1ccb56ba4 [0,0,0,1,0,0|1,0,2]=4 7223 B12R1.390 C[C@H](O)CNCCSCC1CC1 4a123442aace7484af490992b7482b0d [0,0,0,1,0,0|2,0,0]=3 7224 B12R1.390 FC(F)CCCCCNC1CC1 b5f66a7190c1eece5f4cabf546dc72ee [0,0,0,1,0,0|3,0,0]=4 7225 B12R1.390 FC(F)CCCCCOC1CC1 f72fff58b8ea4472a113d735df1a855e [0,0,0,1,0,0|3,0,0]=4 7226 B12R1.390 FC(F)CCCCNCC1CC1 f9eb6965f4109635cc7a15770ecd9b36 [0,0,0,1,0,0|3,0,0]=4 7227 B12R1.390 O=C(O)CCCCCNC1CC1 9d2efd054b2df89f273859f3cf87b696 [0,0,0,1,0,0|2,0,1]=4 7228 B12R1.390 O=C(O)CCCCCOC1CC1 d9f73c1f75605c8c666b29a2329ba2d3 [0,0,0,1,0,0|2,0,1]=4 7229 B12R1.390 O=C(O)CCCCNCC1CC1 2332e86a60f2402d937abc8d0f9b81a5 [0,0,0,1,0,0|2,0,1]=4 7230 B12R1.390 O=C(O)CCCCOCC1CC1 b7c6452faf2ef5cc08b9da872439324a [0,0,0,1,0,0|2,0,1]=4 7231 B12R1.390 O=C(O)CCCNCCC1CC1 21f7f789f47361c988dde0b9bcd8bb3a [0,0,0,1,0,0|2,0,1]=4 7232 B12R1.390 O=C(O)CCCOCCC1CC1 32c69780f07b26ee36a3826018eab396 [0,0,0,1,0,0|2,0,1]=4 7233 B12R1.390 O=C(O)CCOCCCC1CC1 a7571845e3911af88a130ff18aba8d17 [0,0,0,1,0,0|2,0,1]=4 7234 B12R1.395 CC(C)CCCN[C@@H]1C[C@H]1CO 3a61315fe5571cb6d71a92cfaf6f6e97 [0,0,0,1,0,0|3,0,0]=4 7235 B12R1.395 CC(C)CCCN[C@H]1C[C@@H]1CO f941d550bbe19da543da45e5528946f8 [0,0,0,1,0,0|3,0,0]=4 7236 B12R1.395 CC(C)CCCN[C@H]1C[C@H]1CO 7951cce53a202b9302c65296a50f2c17 [0,0,0,1,0,0|3,0,0]=4 7237 B12R1.395 CC(C)CCNCC1CC1CO 9841a7cfff066a3d546a1f7935c74b47 [0,0,0,1,0,0|3,0,0]=4 7238 B12R1.395 CC(O)CCCN[C@@H]1C[C@H]1CO 71dad51e4f20883b6e1e7693922ce6ac [0,0,0,1,0,0|2,0,0]=3 7239 B12R1.395 CC(O)CCCN[C@H]1C[C@@H]1CO 3a9119ff6279fe65e1b746735e0d120c [0,0,0,1,0,0|2,0,0]=3 7240 B12R1.395 CC(O)CCCN[C@H]1C[C@H]1CO f2e4104fdd50f43dd4c4fe1165ab35c1 [0,0,0,1,0,0|2,0,0]=3 7241 B12R1.395 CC(O)CCNCC1CC1CO 5f6da3c11166e74b30159524bd0fb653 [0,0,0,1,0,0|2,0,0]=3 7242 B12R1.395 CO[C@H]1C[C@H]1NCCCC(C)C 0e866409d47cd3e67bbcbb5f243a8559 [0,0,0,1,0,0|3,0,0]=4 7243 B12R1.395 CO[C@H]1C[C@H]1NCCCC(C)O 631ae47fd1bd5142fe070b97b2d3f3b4 [0,0,0,1,0,0|2,0,0]=3 7244 B12R1.405 CC(C)N1CCCCCC1CO 3211a82b9279e45fe5146160558554fd [0,0,0,1,0,0|3,0,0]=4 7245 B12R1.405 CCN1CCCCCC1C(=O)O 28d0ecd95a31d5490656ce91b7ffad18 [0,0,0,1,0,0|2,0,1]=4 7246 B12R1.405 CCN1CCCCC[C@@H]1C(=O)O 1a87655fa87733b28a46795465e1469d [0,0,0,1,0,0|2,0,1]=4 7247 B12R1.405 CCN1CCCCC[C@H]1C(=O)O fbb1612037de3d2034737b6a6c708a12 [0,0,0,1,0,0|2,0,1]=4 7248 B12R1.444 C=C(C)CCCN1CCC1CC 8a73f44f33112a211cbad8fcaeaa5190 [0,0,0,1,0,0|2,0,1]=4 7249 B12R1.444 CC(C)CCCN1CCC1CO 0b52e8db948d2064acc6573b1c2ce10c [0,0,0,1,0,0|3,0,0]=4 7250 B12R1.444 CC(C)CCCN1CC[C@@H]1CO 3ca527cef769a9a799e5a52f57964a78 [0,0,0,1,0,0|3,0,0]=4 7251 B12R1.444 CC(C)CCCN1CC[C@H]1CO d85d42011bdb4020343b3edfb9bee781 [0,0,0,1,0,0|3,0,0]=4 7252 B12R1.444 CC(O)CCCN1CCC1CO 18ba034f30a1f4c2192402abde4ab81f [0,0,0,1,0,0|2,0,0]=3 7253 B12R1.444 CC(O)CCCN1CC[C@@H]1CO b202f3857428d1298c5cfee0369e0662 [0,0,0,1,0,0|2,0,0]=3 7254 B12R1.444 CC(O)CCCN1CC[C@H]1CO 06775149a712ce196d7138bc21143ad0 [0,0,0,1,0,0|2,0,0]=3 7255 B12R1.444 CCC1CCN1CCCC(=O)C 775bb23651d11e332042ed32bdc450ef [0,0,0,1,0,0|1,0,2]=4 7256 B12R1.444 CCC1CCN1CCCC(=O)O b5261ace6f44f98d2d9e52cc6bfb60a9 [0,0,0,1,0,0|2,0,1]=4 7257 B12R1.444 CCC1CCN1CCCC(C)C 7fe19c1bf3419c5b68ea21ef362b77b8 [0,0,0,1,0,0|2,0,0]=3 7258 B12R1.444 CCC1CCN1CCCC(C)O 4882379f24626875c1adf004c7633287 [0,0,0,1,0,0|1,0,0]=2 7259 B12R1.444 CCC1CCN1CCCN(C)C 22b558299c2b2900138a10fe0fd84bfb [0,0,0,1,0,0|3,0,0]=4 7260 B12R1.444 CCC1CCN1CCOC(C)C 905cbf238075d24259175032f9c9007c [0,0,0,1,0,0|3,0,0]=4 7261 B12R1.444 CCC1CCN1CCSC(C)C 7f74fc1e45e15bcfb37820bb65efe29b [0,0,0,1,0,0|3,0,0]=4 7262 B12R1.444 COC1CCC1COCC(C)C 3b41ab8c6075f9a7239ddd3bf110a801 [0,0,0,1,0,0|3,0,0]=4 7263 B12R1.444 COC1CCC1NCCC(C)C a11d067e09745422ae1cffd0a20d5b48 [0,0,0,1,0,0|3,0,0]=4 7264 B12R1.444 COC1CCC1NCCC(C)O 7b46e303efd45eb1f0e6fef1d75a6579 [0,0,0,1,0,0|2,0,0]=3 7265 B12R1.444 CO[C@@H]1CC[C@@H]1COCC(C)C a13a794a72eef2f721f5073750fbdfc7 [0,0,0,1,0,0|3,0,0]=4 7266 B12R1.444 CO[C@@H]1CC[C@@H]1NCCC(C)C ea8bd0e7617e0595b034f4c7ba665b68 [0,0,0,1,0,0|3,0,0]=4 7267 B12R1.444 CO[C@@H]1CC[C@@H]1NCCC(C)O 68c68b8949c692ba42bd0c30297d4c5e [0,0,0,1,0,0|2,0,0]=3 7268 B12R1.444 CO[C@@H]1CC[C@H]1COCC(C)C 9b0c4781d57b9168246a9a22962f7fcd [0,0,0,1,0,0|3,0,0]=4 7269 B12R1.444 CO[C@@H]1CC[C@H]1NCCC(C)C eee8659a45b86307c95a8eed00edccc6 [0,0,0,1,0,0|3,0,0]=4 7270 B12R1.444 CO[C@@H]1CC[C@H]1NCCC(C)O a16f2861ec896c488d9402cdeb0aa8dd [0,0,0,1,0,0|2,0,0]=3 7271 B12R1.444 CO[C@H]1CC[C@@H]1NCCC(C)C b5478de49e000c90e0b325967df3c4f3 [0,0,0,1,0,0|3,0,0]=4 7272 B12R1.444 CO[C@H]1CC[C@@H]1NCCC(C)O bb605ed9191da0ac2fef7fffc345b351 [0,0,0,1,0,0|2,0,0]=3 7273 B12R1.444 CO[C@H]1CC[C@H]1NCCC(C)C db121c5b79d2792d49df0797e738e44f [0,0,0,1,0,0|3,0,0]=4 7274 B12R1.444 CO[C@H]1CC[C@H]1NCCC(C)O 027a9e352ae0cdc424ab47c9ff89a8dc [0,0,0,1,0,0|2,0,0]=3 7275 B12R1.459 C#CCCNC1CCCC1(C)O 630557d53a4b0503bfe93122f4898b04 [0,0,0,1,0,0|1,0,2]=4 7276 B12R1.459 C#CCCN[C@@H]1CCC[C@@]1(C)O 4a6a5e470e5db82c45508175e4afe57a [0,0,0,1,0,0|1,0,2]=4 7277 B12R1.459 C#CCCN[C@H]1CCC[C@]1(C)O 4c32c700b62f465cfa87b5a4ecdee504 [0,0,0,1,0,0|1,0,2]=4 7278 B12R1.459 C/C=C/CNC1CCCC1(C)O a61e5c39d059e52d1a17c039952f043c [0,0,0,1,0,0|1,0,2]=4 7279 B12R1.459 C/C=C/CN[C@@H]1CCC[C@@]1(C)O 5608387aaf385e36f378c63fce597af5 [0,0,0,1,0,0|1,0,2]=4 7280 B12R1.459 C/C=C/CN[C@H]1CCC[C@]1(C)O 535df398c268e02ee534ab6e8589d673 [0,0,0,1,0,0|1,0,2]=4 7281 B12R1.459 C/C=C\CNC1CCCC1(C)O 5c5f62804216ddacdbf63551f66b3ac5 [0,0,0,1,0,0|1,0,2]=4 7282 B12R1.459 C/C=C\CN[C@@H]1CCC[C@@]1(C)O 1560acf738123623af3b505091fc77dd [0,0,0,1,0,0|1,0,2]=4 7283 B12R1.459 C/C=C\CN[C@H]1CCC[C@]1(C)O 40aa4cdfa505c7a8b8425aa51fdff47b [0,0,0,1,0,0|1,0,2]=4 7284 B12R1.459 C=CCCNC1CCCC1(C)O bf83c6c7dc10e60171fb78f082bfce99 [0,0,0,1,0,0|1,0,2]=4 7285 B12R1.459 C=CCCN[C@@H]1CCC[C@@]1(C)O b3375948d60c305e78d957f2c1d66410 [0,0,0,1,0,0|1,0,2]=4 7286 B12R1.459 C=CCCN[C@H]1CCC[C@]1(C)O 5739df8749177b6b194520754f0fb7ff [0,0,0,1,0,0|1,0,2]=4 7287 B12R1.459 CC1(CCCC1NCCC#N)O a60efeabeff968a1df4ffa95a9ba9831 [0,0,0,1,0,0|2,0,1]=4 7288 B12R1.459 CC1(CCCC1NCCC=O)O c878f85a5d7ff6e91e4f44febdba78c5 [0,0,0,1,0,0|2,0,1]=4 7289 B12R1.459 CC1(CCCC1NCCCF)C bc2b878f386def2882e858016548b55f [0,0,0,1,0,0|3,0,0]=4 7290 B12R1.459 CC1(CCCC1NCCCF)O f5201e2c5ceb61419a961feaeeacb736 [0,0,0,1,0,0|2,0,0]=3 7291 B12R1.459 CC1(CCCC1NCCCO)C f33397d49bd55e028e5bf86e7f06a98f [0,0,0,1,0,0|3,0,0]=4 7292 B12R1.459 CC1(CCCC1NCCCO)O a5e5961891339e97b379276cc13cb296 [0,0,0,1,0,0|2,0,0]=3 7293 B12R1.459 CC1(CCCC1NCCCS)C d4727ad5fda06d669d97763f15ad57bf [0,0,0,1,0,0|3,0,0]=4 7294 B12R1.459 CC1(CCCC1NCCCS)O 8dd6f0b5d0120bf8c6e527ca77cacacc [0,0,0,1,0,0|2,0,0]=3 7295 B12R1.459 CC1(CCCC1OCCCF)C 880037ddb282fd3457d5a1d8e875fce0 [0,0,0,1,0,0|3,0,0]=4 7296 B12R1.459 CC1(CCCC1OCCCS)C 220d0e7ad20b63a4d34afba0836088b0 [0,0,0,1,0,0|3,0,0]=4 7297 B12R1.459 CC1(CCCN1CCCCF)C 4881521142a2975de303f0c2cc311575 [0,0,0,1,0,0|3,0,0]=4 7298 B12R1.459 CC1(CCCN1CCCCO)C e14ebd9f81af9b38290b86d63ea4dafc [0,0,0,1,0,0|3,0,0]=4 7299 B12R1.459 CC1(CCC[C@@H]1OCCCF)C 97c9d559150dbebfe1f17ac251748a92 [0,0,0,1,0,0|3,0,0]=4 7300 B12R1.459 CC1(CCC[C@@H]1OCCCS)C f63e6fc65161fc1a0b8e188f16b6d85a [0,0,0,1,0,0|3,0,0]=4 7301 B12R1.459 CC1(CCC[C@H]1OCCCF)C e58be465cbb2fffaa72e1d6de0f0a839 [0,0,0,1,0,0|3,0,0]=4 7302 B12R1.459 CC1(CCC[C@H]1OCCCS)C f4409a520de26f91006a8450d4397de2 [0,0,0,1,0,0|3,0,0]=4 7303 B12R1.459 CCCCCN1CCCC1(C)C b3ba3c574032aa14718fc5901788ae82 [0,0,0,1,0,0|2,0,0]=3 7304 B12R1.459 CCCCCN1CCOC1(C)C e6e7ff1ce7d185f0cbca06fc453222ba [0,0,0,1,0,0|3,0,0]=4 7305 B12R1.459 CCCCCN1CCSC1(C)C 69361a822fbfdabc71f7dba0f8aedfcd [0,0,0,1,0,0|3,0,0]=4 7306 B12R1.459 CCCCCN1COCC1(C)C 255e0b57abeeae41d44004985634ad61 [0,0,0,1,0,0|3,0,0]=4 7307 B12R1.459 CCCCNC1CCCC1(C)C 3083850443a7dd71ea530cc3d542b6bd [0,0,0,1,0,0|2,0,0]=3 7308 B12R1.459 CCCCNC1CCCC1(C)O cd0d5792c45cc05bd48edae2ac432fff [0,0,0,1,0,0|1,0,0]=2 7309 B12R1.459 CCCCNC1CCCC1(F)F 4f34c0ec1bdf607a9a40f0e243fafbd6 [0,0,0,1,0,0|3,0,0]=4 7310 B12R1.459 CCCCNC1CCOC1(C)C 71e6cdf7cdedac06aed5334703a9b636 [0,0,0,1,0,0|3,0,0]=4 7311 B12R1.459 CCCCN[C@@H]1CCC[C@@]1(C)O e464c92e88374105aef2a8134cf63636 [0,0,0,1,0,0|1,0,0]=2 7312 B12R1.459 CCCCN[C@H]1CCC[C@]1(C)O 195dd8692808db67e786e708f559fc8c [0,0,0,1,0,0|1,0,0]=2 7313 B12R1.459 CCCCOC1CCCC1(C)C 18a58fa7d4186ff95878cdeb67abbe6b [0,0,0,1,0,0|2,0,0]=3 7314 B12R1.459 CCCCOC1CCCC1(F)F be430357b7397031affa914b1d3480b3 [0,0,0,1,0,0|3,0,0]=4 7315 B12R1.459 CCCCO[C@@H]1CCCC1(C)C 6f5b8ed48c28be79a95c771c358adbfb [0,0,0,1,0,0|2,0,0]=3 7316 B12R1.459 CCCCO[C@H]1CCCC1(C)C d7143126c19e31c76e5df951a092b0a9 [0,0,0,1,0,0|2,0,0]=3 7317 B12R1.459 CCCNCC1CCOC1(C)C 173f1bdda3cbe85c22483f96aff8f311 [0,0,0,1,0,0|3,0,0]=4 7318 B12R1.459 CCCOCC1CCOC1(C)C bc3dd37b9cf0fb0aa790b3cfd0bec3fd [0,0,0,1,0,0|3,0,0]=4 7319 B12R1.459 CCNCCN1CCCC1(C)C 130a142c7311645de484552b02f2e5bc [0,0,0,1,0,0|3,0,0]=4 7320 B12R1.459 CCOCCC1CCCC1(F)F 4c890d0418c2dbe0db4697872abf062d [0,0,0,1,0,0|3,0,0]=4 7321 B12R1.459 CCOCCN1CCCC1(C)C 47eada66ca9a5e83a6301533a274c13d [0,0,0,1,0,0|3,0,0]=4 7322 B12R1.459 CCOCOC1CCCC1(C)C f2e301f6b7ccd2f913b5236d5f0d39c6 [0,0,0,1,0,0|3,0,0]=4 7323 B12R1.459 CCOCO[C@@H]1CCCC1(C)C a55bf6c01e70695de01d388d1e95003b [0,0,0,1,0,0|3,0,0]=4 7324 B12R1.459 CCOCO[C@H]1CCCC1(C)C 546afbf401691cfa99bebc2a64ddea8f [0,0,0,1,0,0|3,0,0]=4 7325 B12R1.459 CCSCCN1CCCC1(C)C b915bdfd7251520747ec773fbc95dedd [0,0,0,1,0,0|3,0,0]=4 7326 B12R1.459 COCCCN1CCCC1(C)C 726599e640f602c694a62e77c67f3d70 [0,0,0,1,0,0|3,0,0]=4 7327 B12R1.459 COCCNC1CCCC1(C)C cb9338a41770c9d3cb891a996ad04989 [0,0,0,1,0,0|3,0,0]=4 7328 B12R1.459 COCCNC1CCCC1(C)O c6341a328b0579b3f95bd8906f88950c [0,0,0,1,0,0|2,0,0]=3 7329 B12R1.459 COCCN[C@@H]1CCC[C@@]1(C)O 8444534ae706f748ccf0c4be3053450a [0,0,0,1,0,0|2,0,0]=3 7330 B12R1.459 COCCN[C@H]1CCC[C@]1(C)O 37a596115d34d380dbaed41adae3ec21 [0,0,0,1,0,0|2,0,0]=3 7331 B12R1.459 COCCOC1CCCC1(C)C 0d928ee59d9a00076a00511ec4943181 [0,0,0,1,0,0|3,0,0]=4 7332 B12R1.459 COCCO[C@@H]1CCCC1(C)C 32a7b81a2c9d75ef0c19edeace9656dd [0,0,0,1,0,0|3,0,0]=4 7333 B12R1.459 COCCO[C@H]1CCCC1(C)C 84d9df3aa5c29841a6bcba5de3750b8d [0,0,0,1,0,0|3,0,0]=4 7334 B12R1.459 CSCCCN1CCCC1(C)C fe75f8633f184bee941fec6552fa14e1 [0,0,0,1,0,0|3,0,0]=4 7335 B12R1.459 CSCCNC1CCCC1(C)C cfef5f13fe1784af9ca9fcbc4746abfd [0,0,0,1,0,0|3,0,0]=4 7336 B12R1.459 CSCCNC1CCCC1(C)O c73e0694088a0674c51c9d766cfda98e [0,0,0,1,0,0|2,0,0]=3 7337 B12R1.459 CSCCN[C@@H]1CCC[C@@]1(C)O ddd6388fa9a19093ad960c119f711430 [0,0,0,1,0,0|2,0,0]=3 7338 B12R1.459 CSCCN[C@H]1CCC[C@]1(C)O d0661fce39ee8aa744aa74ef8de73d8b [0,0,0,1,0,0|2,0,0]=3 7339 B12R1.459 CSCCOC1CCCC1(C)C 92f4c6920afada9819ab9a00bbdcb7d8 [0,0,0,1,0,0|3,0,0]=4 7340 B12R1.459 CSCCO[C@@H]1CCCC1(C)C 322537a117d24aab75c33a3161515658 [0,0,0,1,0,0|3,0,0]=4 7341 B12R1.459 CSCCO[C@H]1CCCC1(C)C 6e40d42d66fbaa40dfa9729595671ab6 [0,0,0,1,0,0|3,0,0]=4 7342 B12R1.459 C[C@@]1(CCC[C@@H]1NCCC#N)O 31f415718c6cb52d2aa02002d10834cf [0,0,0,1,0,0|2,0,1]=4 7343 B12R1.459 C[C@@]1(CCC[C@@H]1NCCC=O)O 7f8b6fd6860471531d855c079bf75c01 [0,0,0,1,0,0|2,0,1]=4 7344 B12R1.459 C[C@@]1(CCC[C@@H]1NCCCF)O 852afe69091cbca7607a40954a04e570 [0,0,0,1,0,0|2,0,0]=3 7345 B12R1.459 C[C@@]1(CCC[C@@H]1NCCCO)O 1b48a0aed0345dd59a71c4d93c403326 [0,0,0,1,0,0|2,0,0]=3 7346 B12R1.459 C[C@@]1(CCC[C@@H]1NCCCS)O a9fe9b83ba135ad7cfa91922f940e25a [0,0,0,1,0,0|2,0,0]=3 7347 B12R1.459 C[C@]1(CCC[C@H]1NCCC#N)O edfa07046041e4b0501f254499562838 [0,0,0,1,0,0|2,0,1]=4 7348 B12R1.459 C[C@]1(CCC[C@H]1NCCC=O)O f4b444060d40764c9bf5dbe9c781ad50 [0,0,0,1,0,0|2,0,1]=4 7349 B12R1.459 C[C@]1(CCC[C@H]1NCCCF)O da030b2388aac3b6a5441d2482914f36 [0,0,0,1,0,0|2,0,0]=3 7350 B12R1.459 C[C@]1(CCC[C@H]1NCCCO)O 65c3f1765a0d7c0e4bf09876c455e0f4 [0,0,0,1,0,0|2,0,0]=3 7351 B12R1.459 C[C@]1(CCC[C@H]1NCCCS)O fbca5d4525d92b350ed091cc7d332976 [0,0,0,1,0,0|2,0,0]=3 7352 B12R1.522 CCCCCN1CCC1C(=O)O 868ef6ee956f72f47502d06d7f48c294 [0,0,0,1,0,0|2,0,1]=4 7353 B12R1.522 CCCCCN1CC[C@@H]1C(=O)O 527dfc21ae8859936644a484936e3ac3 [0,0,0,1,0,0|2,0,1]=4 7354 B12R1.522 CCCCCN1CC[C@H]1C(=O)O e660d12881171deded76f2ed1f507815 [0,0,0,1,0,0|2,0,1]=4 7355 B12R1.522 CCCCNC1COC1C(C)C 92544df0d5baf901d230e5705ff4dffa [0,0,0,1,0,0|3,0,0]=4 7356 B12R1.522 CCCCN[C@@H]1CO[C@@H]1C(C)C 4d083502d508f02c060ac66a02fc17aa [0,0,0,1,0,0|3,0,0]=4 7357 B12R1.522 CCCCN[C@H]1CC[C@H]1C(=O)O 0718609899241007041aea70c5170d05 [0,0,0,1,0,0|2,0,1]=4 7358 B12R1.522 CCCCOC1CCC1C(=O)O 31fb62568f257eeb7251cdcb2723daa8 [0,0,0,1,0,0|2,0,1]=4 7359 B12R1.522 CCCCO[C@H]1CC[C@@H]1C(=O)O be56f78fbaef715fca1975af1b02085e [0,0,0,1,0,0|2,0,1]=4 7360 B12R1.522 CCCOC[C@@H]1CC[C@@H]1N(C)C 5dc362c44b82182db468965cb278ea0a [0,0,0,1,0,0|3,0,0]=4 7361 B12R1.842 CC1(CCC1OCCCCF)C 5f6b44de4516cb4a3141f2984b85a15a [0,0,0,1,0,0|3,0,0]=4 7362 B12R1.842 CCCCCNC1CCC1(F)F 29abc293a0fe6d60b6448f3345fb914f [0,0,0,1,0,0|3,0,0]=4 7363 B12R1.842 CCCCCNC1COC1(C)C ab64c0791975c766ae1e2d5ee714984c [0,0,0,1,0,0|3,0,0]=4 7364 B12R1.842 CCCCCOC1CCC1(C)C 8f598a294179eb1815b71af810931d2c [0,0,0,1,0,0|2,0,0]=3 7365 B12R1.842 CCCCCOC1CCC1(F)F 196d66137e5aefa46c0c230d314d678b [0,0,0,1,0,0|3,0,0]=4 7366 B12R1.842 CCCCCOC1COC1(C)C 2a0921b7d530a944d15416b883a0c98c [0,0,0,1,0,0|3,0,0]=4 7367 B12R1.842 CCCCNCC1CCC1(F)F ac387ac623bc0661470a406191e72a68 [0,0,0,1,0,0|3,0,0]=4 7368 B12R1.842 CCCCNCC1OCC1(C)C 438beb6f27bcc6db6d0e7e557c946f14 [0,0,0,1,0,0|3,0,0]=4 7369 B12R1.842 CCCCOCC1CCC1(F)F c11413b9c68d1d2c5501021cb4de1cb0 [0,0,0,1,0,0|3,0,0]=4 7370 B12R1.842 CCCCOCC1COC1(C)C 9bf1605f38f76caf5a40c3e803fc2e19 [0,0,0,1,0,0|3,0,0]=4 7371 B12R1.842 CCOCCOC1CCC1(C)C d643cc7331c5be036baa3747ad6d26e0 [0,0,0,1,0,0|3,0,0]=4 7372 B12R1.842 CCSCCOC1CCC1(C)C fb97c98dfd162d78b3e1859391314d54 [0,0,0,1,0,0|3,0,0]=4 7373 B12R1.842 COCCCOC1CCC1(C)C e79c16034f019009914386b429914c5f [0,0,0,1,0,0|3,0,0]=4 7374 B12R1.842 CSCCCOC1CCC1(C)C c2becf39e8b0d4159d6616f2c1040a9f [0,0,0,1,0,0|3,0,0]=4 7375 B12R1.1335 CC(=O)N1CCCCCCCC1 472bcb41fa3fc1d5d8be9a24287e8823 [0,0,0,1,0,0|1,0,2]=4 7376 B12R1.1335 CC(C)N1CCCCCCCC1 8137bfa2396ba4675a03b4358695e277 [0,0,0,1,0,0|2,0,0]=3 7377 B12R1.1343 C=C(C)CCN1CCCCCC1 b5834cd3f9bced0444538dc9a5d2adff [0,0,0,1,0,0|2,0,1]=4 7378 B12R1.1343 C=C(C)CNC1CCCCCC1 f467465cd42c14c49673722f0509f4ee [0,0,0,1,0,0|2,0,1]=4 7379 B12R1.1343 C=C(C)COC1CCCCCC1 9d6338f86ff00bfafe94f43920542e26 [0,0,0,1,0,0|2,0,1]=4 7380 B12R1.1343 CC(=O)CCN1CCCCCC1 9db15848eb5a0afe3b5199eaf4f54938 [0,0,0,1,0,0|1,0,2]=4 7381 B12R1.1343 CC(=O)CNC1CCCCCC1 472d52fc3a3f9e34562900413429031a [0,0,0,1,0,0|1,0,2]=4 7382 B12R1.1343 CC(=O)COC1CCCCCC1 c5d3f177a64f6ef4de1601b127407ff7 [0,0,0,1,0,0|1,0,2]=4 7383 B12R1.1343 CC(=O)NCC1CCCCCC1 6de497aff6b4d44ba8330446be88d57e [0,0,0,1,0,0|1,0,2]=4 7384 B12R1.1343 CC(C)CCN1CCCCCC1 b8026f312735234059e45972414b878b [0,0,0,1,0,0|2,0,0]=3 7385 B12R1.1343 CC(C)CCN1CCCOCC1 61ef9dfa3a456cdd52f9d0fe4cd17429 [0,0,0,1,0,0|3,0,0]=4 7386 B12R1.1343 CC(C)CNC1CCCCCC1 326b862169c42b96fad2950ab8c6a2e3 [0,0,0,1,0,0|2,0,0]=3 7387 B12R1.1343 CC(C)CNC1CCCOCC1 41320953b914bf1427d6e551e8ead570 [0,0,0,1,0,0|3,0,0]=4 7388 B12R1.1343 CC(C)COC1CCCCCC1 a543c67eb61bd039825940a0b227907c [0,0,0,1,0,0|2,0,0]=3 7389 B12R1.1343 CC(C)COC1CCCOCC1 b42e66b9f4b3bf4bdd8eedef42ed8fa3 [0,0,0,1,0,0|3,0,0]=4 7390 B12R1.1343 CC(C)NCC1CCCCCC1 c2a8e074d5a8dbafdd22e3143e2bd358 [0,0,0,1,0,0|2,0,0]=3 7391 B12R1.1343 CC(C)OCC1CCCCCC1 1d7223bfc94290235c543bbf748d0778 [0,0,0,1,0,0|2,0,0]=3 7392 B12R1.1343 CC(C)OCN1CCCCCC1 497fa9ee937430a2cfec24a4399e1de6 [0,0,0,1,0,0|3,0,0]=4 7393 B12R1.1343 CC(F)COC1CCCCCC1 45e8eca45ee0f8bafeb19ea3ec15fa46 [0,0,0,1,0,0|2,0,0]=3 7394 B12R1.1343 CC(F)COC1CCCOCC1 b7169077aa7cc012cd105a0279a44849 [0,0,0,1,0,0|3,0,0]=4 7395 B12R1.1343 CC(O)CCN1CCCCCC1 88e9123459fa44c589502ba38c4aa8b6 [0,0,0,1,0,0|1,0,0]=2 7396 B12R1.1343 CC(O)CCN1CCCOCC1 1d2e16e5e9a8b3e9b4d85b707d5122a3 [0,0,0,1,0,0|2,0,0]=3 7397 B12R1.1343 CC(O)CNC1CCC=CCC1 22df50902a374f7005eda1889b389f63 [0,0,0,1,0,0|1,0,2]=4 7398 B12R1.1343 CC(O)CNC1CCCCCC1 8f9f0b4e0d70b7efda3f98247703d7b8 [0,0,0,1,0,0|1,0,0]=2 7399 B12R1.1343 CC(O)CNC1CCCOCC1 a73f361fffb66953b32b8e3cbc10c46e [0,0,0,1,0,0|2,0,0]=3 7400 B12R1.1343 CC(S)COC1CCCCCC1 516401eb92dadad2ac6ee52d3f144290 [0,0,0,1,0,0|1,1,0]=3 7401 B12R1.1343 CC(S)COC1CCCOCC1 b21fb38693e5e92f420cc45f5f7205e4 [0,0,0,1,0,0|2,1,0]=4 7402 B12R1.1343 CN(C)CCN1CCCCCC1 79b17f1a2a92648526f32fa2ebcbb630 [0,0,0,1,0,0|3,0,0]=4 7403 B12R1.1343 CN(C)CNC1CCCCCC1 7e6dd4b17e652ff3bd4c51c8e929274c [0,0,0,1,0,0|3,0,0]=4 7404 B12R1.1343 CN(C)COC1CCCCCC1 c6b88bc6c80ea56b1642ba8dad094247 [0,0,0,1,0,0|3,0,0]=4 7405 B12R1.1343 CS(=O)CCN1CCCCCC1 3c2cd9ef9db675bf964f39eea6a6df89 [0,0,0,1,0,0|2,0,1]=4 7406 B12R1.1343 C[C@@H](F)COC1CCCCCC1 3c4a1a6e8bdb03da8161a778f1973056 [0,0,0,1,0,0|2,0,0]=3 7407 B12R1.1343 C[C@@H](F)COC1CCCOCC1 ba9eafc7e1ffdf24b4262ad891971870 [0,0,0,1,0,0|3,0,0]=4 7408 B12R1.1343 C[C@@H](O)CNC1CCC=CCC1 4655ace7fd1147e921d4a2a481ff44d8 [0,0,0,1,0,0|1,0,2]=4 7409 B12R1.1343 C[C@@H](O)CNC1CCCCCC1 ff8e7e104a44ab8afb24c266502f3528 [0,0,0,1,0,0|1,0,0]=2 7410 B12R1.1343 C[C@@H](O)CNC1CCCOCC1 a8168888590c957fb9bfe883e7a1e6c8 [0,0,0,1,0,0|2,0,0]=3 7411 B12R1.1343 C[C@H](F)COC1CCCCCC1 cb5d3cc911f4c2488eff8e7f8b8f1d9d [0,0,0,1,0,0|2,0,0]=3 7412 B12R1.1343 C[C@H](F)COC1CCCOCC1 481b93c8edf8e1eb0e0581719e362c6d [0,0,0,1,0,0|3,0,0]=4 7413 B12R1.1343 C[C@H](O)CNC1CCC=CCC1 f43dba91b0201cd0e846602b1cb292cd [0,0,0,1,0,0|1,0,2]=4 7414 B12R1.1343 C[C@H](O)CNC1CCCCCC1 0d27f221717ea4c206dfb107e1177348 [0,0,0,1,0,0|1,0,0]=2 7415 B12R1.1343 C[C@H](O)CNC1CCCOCC1 529a6842ebdef232b5192d8ebd68b792 [0,0,0,1,0,0|2,0,0]=3 7416 B12R1.1343 FC(F)CNC1CCCCCC1 cffa10375b918640175b7a6037b32061 [0,0,0,1,0,0|3,0,0]=4 7417 B12R1.1343 FC(F)COC1CCCCCC1 2150d73f54d73e619a68e8520dbb73fe [0,0,0,1,0,0|3,0,0]=4 7418 B12R1.1343 O=C(O)CCN1CCCCCC1 6ed2e90f731eac4e658979eda5d73780 [0,0,0,1,0,0|2,0,1]=4 7419 B12R1.1343 O=C(O)CNC1CCCCCC1 3682f9e28927883757889fb3d93aede3 [0,0,0,1,0,0|2,0,1]=4 7420 B12R1.1343 O=C(O)COC1CCCCCC1 7e5cc9ed47a0c03f4fe7fb85c985896c [0,0,0,1,0,0|2,0,1]=4 7421 B12R1.1343 O=S(O)COC1CCCCCC1 52ffe6b56378a860f6698bebe15c2a2d [0,0,0,1,0,0|3,0,0]=4 7422 B12R1.1392 C=C(C)CN1CCCCCCC1 9d79d9bed91e55fb2fb73288f3a48d32 [0,0,0,1,0,0|2,0,1]=4 7423 B12R1.1392 CC(=O)NC1CCCCCCC1 706b4665a4d0397396f67ba93d627708 [0,0,0,1,0,0|1,0,2]=4 7424 B12R1.1392 CC(C)CN1CCCCCCC1 875db15dc93577c59f280f4bfcb2a079 [0,0,0,1,0,0|2,0,0]=3 7425 B12R1.1392 CC(C)NC1CCCCCCC1 4960df66dfec5c783ead5219ce2db7c5 [0,0,0,1,0,0|2,0,0]=3 7426 B12R1.1392 CC(C)OC1CCCCCCC1 2cc939b3b0003aeb698784dce3d74023 [0,0,0,1,0,0|2,0,0]=3 7427 B12R1.1392 CC(O)CN1CCCCCCC1 844ad6b1fe1423cf22ee789eaa44b646 [0,0,0,1,0,0|1,0,0]=2 7428 B12R1.1392 CN(C)CN1CCCCCCC1 4465b9e7c85ee342661285f5a18ef63d [0,0,0,1,0,0|3,0,0]=4 7429 B12R1.1392 C[C@@H](O)CN1CCCCCCC1 ddcedaa286b87f599dcef10fe2700d4d [0,0,0,1,0,0|1,0,0]=2 7430 B12R1.1392 C[C@H](O)CN1CCCCCCC1 45b5fcd2ac9f1ea0f8389f9e0e58d63b [0,0,0,1,0,0|1,0,0]=2 7431 B12R1.1392 FC(F)CN1CCCCCCC1 1f72862ad712b9844ab9e0ef3904a688 [0,0,0,1,0,0|3,0,0]=4 7432 B12R1.1392 O=C(O)CN1CCCCCCC1 b947e4536c1423929c78c658665cc4c1 [0,0,0,1,0,0|2,0,1]=4 7433 B12R1.1755 CCCCCN[C@@H]1C[C@@H]1C(=O)O dc7a208490e75010e46b3e231a3c362e [0,0,0,1,0,0|2,0,1]=4 7434 B12R1.1755 CCCCCN[C@H]1C[C@@H]1C(=O)O aee5fbd6b6032990369b006524f546be [0,0,0,1,0,0|2,0,1]=4 7435 B12R1.1755 CCCCCN[C@H]1C[C@H]1C(=O)O d63ff5065e1e05c318a77db19eca620a [0,0,0,1,0,0|2,0,1]=4 7436 B12R1.1755 CCCCCO[C@@H]1C[C@@H]1C(=O)O 0de3b40982f4bf69442cd8f4f5d3369c [0,0,0,1,0,0|2,0,1]=4 7437 B12R1.1755 CCCCCO[C@H]1C[C@@H]1C(=O)O a35a1e2087a6e5cd445b48ca19572c22 [0,0,0,1,0,0|2,0,1]=4 7438 B12R1.1755 CCCCCO[C@H]1C[C@H]1C(=O)O ac5e67675507d1b46d847e01c497f0b1 [0,0,0,1,0,0|2,0,1]=4 7439 B12R1.1755 CCCCNCC1CC1C(=O)O 54459448b6659e20c9715d1a25cea263 [0,0,0,1,0,0|2,0,1]=4 7440 B12R1.1755 CCCCNC[C@@H]1C[C@H]1C(=O)O 724c370bbd468c0a2cdb3f6046b9bb3b [0,0,0,1,0,0|2,0,1]=4 7441 B12R1.1755 CCCCOCC1CC1C(=O)O 1540be510903897b88d1579006ee0d5a [0,0,0,1,0,0|2,0,1]=4 7442 B12R1.1755 CCCCOC[C@@H]1C[C@H]1C(=O)O 636afe16e837ecf8e8261d29f171be53 [0,0,0,1,0,0|2,0,1]=4 7443 B12R1.1755 CCCCOC[C@H]1C[C@@H]1C(=O)O fff6cd54ae73d4eec9d728a0fd3fb6e7 [0,0,0,1,0,0|2,0,1]=4 7444 B12R1.1755 CCCCOC[C@H]1C[C@H]1C(=O)O 5827add97c6eb51837ecdbdf511fc88f [0,0,0,1,0,0|2,0,1]=4 7445 B12R1.1995 CC1(CC1COCCCCF)C fc7c79051a7b4d783daea935f863ff5d [0,0,0,1,0,0|3,0,0]=4 7446 B12R1.1995 CC1(CC1NCCCCCCl)C 06920bd8cc078ff31d2d55d23f0fbdae [0,0,0,1,0,0|3,0,0]=4 7447 B12R1.1995 CC1(CC1NCCCCCF)C 08e868cd386702e6b878d41d7bc95d4e [0,0,0,1,0,0|3,0,0]=4 7448 B12R1.1995 CC1(CC1NCCCCCO)C 81bf46f279e9de13ba985fa02ccd4eb5 [0,0,0,1,0,0|3,0,0]=4 7449 B12R1.1995 CC1(CN1CCCCCCF)C ac89a23a967fbc3e2b8cece888d4ba49 [0,0,0,1,0,0|3,0,0]=4 7450 B12R1.1995 CC1(CN1CCCCCCO)C bad0fccc8fe7c3dea959e096e12fd563 [0,0,0,1,0,0|3,0,0]=4 7451 B12R1.1995 CC1(C[C@@H]1CNCCCCF)C 6e7bf174ba012371df321d1b667a9498 [0,0,0,1,0,0|3,0,0]=4 7452 B12R1.1995 CC1(C[C@@H]1CNCCCCO)C c99cab7165a76b5a7f5d484f4a1e239f [0,0,0,1,0,0|3,0,0]=4 7453 B12R1.1995 CC1(C[C@@H]1COCCCCF)C e559cda0acbb909b1ae3b17f139d0d24 [0,0,0,1,0,0|3,0,0]=4 7454 B12R1.1995 CC1(C[C@@H]1NCCCCCF)C 9caa49e5a20776698fdddee089e1cdba [0,0,0,1,0,0|3,0,0]=4 7455 B12R1.1995 CC1(C[C@@H]1NCCCCCO)C 03a49b7921e4b2095f9f568962b346a3 [0,0,0,1,0,0|3,0,0]=4 7456 B12R1.1995 CC1(C[C@H]1CNCCCCF)C 06683347f6761efebe8c65ac31a6176e [0,0,0,1,0,0|3,0,0]=4 7457 B12R1.1995 CC1(C[C@H]1CNCCCCO)C ddc6649d85365ef811b09869af6933a4 [0,0,0,1,0,0|3,0,0]=4 7458 B12R1.1995 CC1(C[C@H]1COCCCCF)C 50e40f029f827f36fa98565cdba403e4 [0,0,0,1,0,0|3,0,0]=4 7459 B12R1.1995 CC1(C[C@H]1NCCCCCF)C fb4e35bfe540a9067a8ecb4d4d452afd [0,0,0,1,0,0|3,0,0]=4 7460 B12R1.1995 CC1(C[C@H]1NCCCCCO)C 8ad62a70e2cbdb7839195a4558e49d38 [0,0,0,1,0,0|3,0,0]=4 7461 B12R1.1995 CCCCCCCN1CC1(C)C 3057a3e13def7997ca8b66b115c5c739 [0,0,0,1,0,0|2,0,0]=3 7462 B12R1.1995 CCCCCCNC1CC1(C)C 9f7d89274cfd1c3242aa2134fb7db7a1 [0,0,0,1,0,0|2,0,0]=3 7463 B12R1.1995 CCCCCCNC1CC1(F)F 70efae80c22a5ec597693b482dc23409 [0,0,0,1,0,0|3,0,0]=4 7464 B12R1.1995 CCCCCCN[C@@H]1CC1(C)C 714943d96857704cb34935b3914da5f2 [0,0,0,1,0,0|2,0,0]=3 7465 B12R1.1995 CCCCCCN[C@H]1CC1(C)C 73f39c208c1ea17bac4944735f42ea3c [0,0,0,1,0,0|2,0,0]=3 7466 B12R1.1995 CCCCCCOC1CC1(C)C a7a59cac0db0d58bd7e2967771bf7396 [0,0,0,1,0,0|2,0,0]=3 7467 B12R1.1995 CCCCCCOC1CC1(F)F 137c953bcd88ca4b0c477fe27048035a [0,0,0,1,0,0|3,0,0]=4 7468 B12R1.1995 CCCCCNCC1CC1(F)F cfcd82ae2946c720ed6a8cd7c2b92763 [0,0,0,1,0,0|3,0,0]=4 7469 B12R1.1995 CCCCCNC[C@@H]1CC1(C)C 319ebec165d93774814b433d456fa019 [0,0,0,1,0,0|2,0,0]=3 7470 B12R1.1995 CCCCCNC[C@H]1CC1(C)C df124c82da37ceb7bca854ff1fe3843f [0,0,0,1,0,0|2,0,0]=3 7471 B12R1.1995 CCCCCNC[C@H]1CC1(F)F 53eaa83425f58eda3be6e7e86e618e6f [0,0,0,1,0,0|3,0,0]=4 7472 B12R1.1995 CCCCCOCC1CC1(C)C 286a51bee151c0462a5d3382a9db1143 [0,0,0,1,0,0|2,0,0]=3 7473 B12R1.1995 CCCCCOCC1CC1(F)F 9d4e31e2d4ee0227370bc553c0a383e6 [0,0,0,1,0,0|3,0,0]=4 7474 B12R1.1995 CCCCCOC[C@@H]1CC1(C)C 165e1475b260dbfe02ce9794eff531d4 [0,0,0,1,0,0|2,0,0]=3 7475 B12R1.1995 CCCCCOC[C@@H]1CC1(F)F 8821c14e92fbeca4ccb6a5bedda8869c [0,0,0,1,0,0|3,0,0]=4 7476 B12R1.1995 CCCCCOC[C@H]1CC1(C)C 662cec4efd5c0bad8570a6f70f82de82 [0,0,0,1,0,0|2,0,0]=3 7477 B12R1.1995 CCCCCOC[C@H]1CC1(F)F f8a6b94a4be6b21c3d049667cb847ea9 [0,0,0,1,0,0|3,0,0]=4 7478 B12R1.1995 CCCCNCCC1CC1(F)F 445b80070b96ae5303339e8e0d5a110c [0,0,0,1,0,0|3,0,0]=4 7479 B12R1.1995 CCCCOCCC1CC1(F)F 4629e5bdba79595fc4c8c4144a39415e [0,0,0,1,0,0|3,0,0]=4 7480 B12R1.1995 CCCCOCCN1CC1(C)C fb83ef4f5e7ff0d05b07f92a3634c7f9 [0,0,0,1,0,0|3,0,0]=4 7481 B12R1.1995 CCCCOCNC1CC1(C)C aeb108482e0e38815906c7dfefa014b6 [0,0,0,1,0,0|3,0,0]=4 7482 B12R1.1995 CCCCOCN[C@@H]1CC1(C)C 82a67b5b3ecfa5c5116e69560001eec8 [0,0,0,1,0,0|3,0,0]=4 7483 B12R1.1995 CCCCOCN[C@H]1CC1(C)C 1993e89624e7c71e0300c01978435bb5 [0,0,0,1,0,0|3,0,0]=4 7484 B12R1.1995 CCCOCCCN1CC1(C)C f0c52b4d4b525ad74af993ced05f7b02 [0,0,0,1,0,0|3,0,0]=4 7485 B12R1.1995 CCCOCCNC1CC1(C)C 38721ee82759ccbfd06bd98aec29e06d [0,0,0,1,0,0|3,0,0]=4 7486 B12R1.1995 CCCOCCN[C@@H]1CC1(C)C c1a0741894d59ed3f9750c39c894f274 [0,0,0,1,0,0|3,0,0]=4 7487 B12R1.1995 CCCOCCN[C@H]1CC1(C)C 4bfa01319cef4e3d1518f18ea3039919 [0,0,0,1,0,0|3,0,0]=4 7488 B12R1.1995 CCCOCCOC1CC1(C)C 0dba295cf97516943d68ea3fc178e0b4 [0,0,0,1,0,0|3,0,0]=4 7489 B12R1.1995 CCCSCCOC1CC1(C)C 8dd03d020251e5feac71e6cc6f344dd5 [0,0,0,1,0,0|3,0,0]=4 7490 B12R1.1995 CCOCCCCC1CC1(F)F 43e4aac88d8f278b2947fc5d55426149 [0,0,0,1,0,0|3,0,0]=4 7491 B12R1.1995 CCOCCCNC1CC1(C)C e7be98ee76cdece4bb9632f19a397c30 [0,0,0,1,0,0|3,0,0]=4 7492 B12R1.1995 CCOCCCN[C@@H]1CC1(C)C af22d241229ab36999801dcd684f7025 [0,0,0,1,0,0|3,0,0]=4 7493 B12R1.1995 CCOCCCN[C@H]1CC1(C)C a676ea462fd42f3c1e8d4c9e96754fb3 [0,0,0,1,0,0|3,0,0]=4 7494 B12R1.1995 CCOCCCOC1CC1(C)C cbf73fd3992cdb55fc7faab640edf551 [0,0,0,1,0,0|3,0,0]=4 7495 B12R1.1995 CCOCCNC[C@@H]1CC1(C)C 443bf667340cf5a0919f6dabb972fc50 [0,0,0,1,0,0|3,0,0]=4 7496 B12R1.1995 CCOCCNC[C@H]1CC1(C)C 4f9765848490dc8d9ec13a0b431b9c7d [0,0,0,1,0,0|3,0,0]=4 7497 B12R1.1995 CCOCCOCC1CC1(C)C 1fb71c7fc978abbad2b209b11f678a70 [0,0,0,1,0,0|3,0,0]=4 7498 B12R1.1995 CCOCCOC[C@@H]1CC1(C)C 81eaf0c14af382e22a24cce897faa32a [0,0,0,1,0,0|3,0,0]=4 7499 B12R1.1995 CCOCCOC[C@H]1CC1(C)C 10766927bba375f74fcd738ec23dcf70 [0,0,0,1,0,0|3,0,0]=4 7500 B12R1.1995 CCSCCCNC1CC1(C)C 5fa707fe30a8971e6d5fcdd93c1c2055 [0,0,0,1,0,0|3,0,0]=4 7501 B12R1.1995 CCSCCCN[C@@H]1CC1(C)C 13318a43f76b7139cea5ca906c47257b [0,0,0,1,0,0|3,0,0]=4 7502 B12R1.1995 CCSCCCN[C@H]1CC1(C)C 56944edf4ad1b120e245a65d6cbb02b4 [0,0,0,1,0,0|3,0,0]=4 7503 B12R1.1995 CCSCCCOC1CC1(C)C a19fb030f97dee82c563391688860ba1 [0,0,0,1,0,0|3,0,0]=4 7504 B12R1.1995 CCSCCNC[C@@H]1CC1(C)C ab72a9960d2ab2226b98bc148b9801df [0,0,0,1,0,0|3,0,0]=4 7505 B12R1.1995 CCSCCNC[C@H]1CC1(C)C 7401746b6d4c9b83fa6cb6376b48d0b9 [0,0,0,1,0,0|3,0,0]=4 7506 B12R1.1995 CCSCCOCC1CC1(C)C 04f329477ba3d6480c8b3f639d751882 [0,0,0,1,0,0|3,0,0]=4 7507 B12R1.1995 CCSCCOC[C@@H]1CC1(C)C 2369e034264b6525195578f8fa61a76f [0,0,0,1,0,0|3,0,0]=4 7508 B12R1.1995 CCSCCOC[C@H]1CC1(C)C 415e9c9aaf3a532cec56d90d29ae5a28 [0,0,0,1,0,0|3,0,0]=4 7509 B12R1.1995 COCCCCCN1CC1(C)C 768ce40eab3093f4ac17e4f15807e79b [0,0,0,1,0,0|3,0,0]=4 7510 B12R1.1995 COCCCCNC1CC1(C)C e7e10d471d18083d66c7c1bff219b215 [0,0,0,1,0,0|3,0,0]=4 7511 B12R1.1995 COCCCCN[C@@H]1CC1(C)C 6fdcd775549e2ad7559e9bd6f8e835bf [0,0,0,1,0,0|3,0,0]=4 7512 B12R1.1995 COCCCCN[C@H]1CC1(C)C 750cc201fbae419cb1499e93c13fe845 [0,0,0,1,0,0|3,0,0]=4 7513 B12R1.1995 COCCCCOC1CC1(C)C 66a73b136e78f6e735681e707875fbfa [0,0,0,1,0,0|3,0,0]=4 7514 B12R1.1995 COCCCNC[C@@H]1CC1(C)C 567b279d75544f8ae3a05c31684c0340 [0,0,0,1,0,0|3,0,0]=4 7515 B12R1.1995 COCCCNC[C@H]1CC1(C)C 72056c3cf9d025fa1c4f09661ee19c73 [0,0,0,1,0,0|3,0,0]=4 7516 B12R1.1995 COCCCOCC1CC1(C)C d0b055658bdca20dba6338cc9d8d11de [0,0,0,1,0,0|3,0,0]=4 7517 B12R1.1995 COCCCOC[C@@H]1CC1(C)C e09a9f88d303c581bb187567c7475d9c [0,0,0,1,0,0|3,0,0]=4 7518 B12R1.1995 COCCCOC[C@H]1CC1(C)C 878c604419abfbfd22eb26185c0b715d [0,0,0,1,0,0|3,0,0]=4 7519 B12R1.1995 CSCCCCNC1CC1(C)C 45640106b72738575748549089aab8f7 [0,0,0,1,0,0|3,0,0]=4 7520 B12R1.1995 CSCCCCOC1CC1(C)C 234185497de7c9b631e79e474f9ae9a1 [0,0,0,1,0,0|3,0,0]=4 7521 B12R1.1995 CSCCCNC[C@@H]1CC1(C)C a82098bdf36927d5505c255a83a382e0 [0,0,0,1,0,0|3,0,0]=4 7522 B12R1.1995 CSCCCNC[C@H]1CC1(C)C 616a6615d14069903e69a3ee5d398a46 [0,0,0,1,0,0|3,0,0]=4 7523 B12R1.1995 CSCCCOCC1CC1(C)C ffdf5bf5b67089df2690f45c2dadef95 [0,0,0,1,0,0|3,0,0]=4 7524 B12R1.1995 CSCCCOC[C@@H]1CC1(C)C f772aca0b798d31d5bed5143b448a4a8 [0,0,0,1,0,0|3,0,0]=4 7525 B12R1.1995 CSCCCOC[C@H]1CC1(C)C 3bfd39f4860c51372bcc53e25d04f94e [0,0,0,1,0,0|3,0,0]=4 7526 B9R0.2 CC(O)CCCNCCBr 846a80d7bd351c20925246d05170fa0a [2,0,0,0,0,0|2,0,0]=4 7527 B9R0.2 CC(O)CCCNCCF c8e3887a2439ccb3592fe170015fe6da [2,0,0,0,0,0|2,0,0]=4 7528 B9R0.2 CC(O)CCCNCCI d049963d4683c730c11fc2ac87702d47 [2,0,0,0,0,0|2,0,0]=4 7529 B9R0.2 CC(O)CCCNCCO 0303877d92750e8a64756316fc4bb9e6 [2,0,0,0,0,0|2,0,0]=4 7530 B9R0.2 CC(O)CCCNCCS c6438b2d80c9f6ff85d85ecf0e281737 [2,0,0,0,0,0|2,0,0]=4 7531 B9R0.2 CC(O)CCNCCCCl 0a32bed6279f094ef9401ca250c5ffa2 [2,0,0,0,0,0|2,0,0]=4 7532 B9R0.2 CC(O)CCNCCCF 9569faec1da967f7c66c5e0a60d104de [2,0,0,0,0,0|2,0,0]=4 7533 B9R0.2 CC(O)CCNCCCO 87acb0957134460d35e20a94643a56a5 [2,0,0,0,0,0|2,0,0]=4 7534 B9R0.2 CC(O)CCNCCCS c89ad0b413e9833571309ce26aa67448 [2,0,0,0,0,0|2,0,0]=4 7535 B9R0.2 CC(O)CNCCCCCl 65186c06faac50c9aeb9e91831d3a163 [2,0,0,0,0,0|2,0,0]=4 7536 B9R0.2 CC(O)CNCCCCF b87c1fb327b802173c8612462c330132 [2,0,0,0,0,0|2,0,0]=4 7537 B9R0.2 CC(O)CNCCCCO ce2dc7373bb7b816c2a9a5d12a2b9a76 [2,0,0,0,0,0|2,0,0]=4 7538 B9R0.2 CC(O)CNCCCCS 730d016fdad462f5c9daec1e7d2aec50 [2,0,0,0,0,0|2,0,0]=4 7539 B9R0.2 CCCCCCNC(C)C b4470bdb41ca94cf2ace2a9a22274307 [2,0,0,0,0,0|2,0,0]=4 7540 B9R0.2 CCCCCCOC(C)C 7177762ff96f664d7658fbf17ddec082 [2,0,0,0,0,0|2,0,0]=4 7541 B9R0.2 CCCCCNCC(C)C 2a266c7fc85c9a2097a02175858c3e33 [2,0,0,0,0,0|2,0,0]=4 7542 B9R0.2 CCCCCNCC(C)O 9e9132e8083003550d3545b55a454f7b [2,0,0,0,0,0|1,0,0]=3 7543 B9R0.2 CCCCCNC[C@@H](C)O 089be76a49b8d969c37e3bf761f099cf [2,0,0,0,0,0|1,0,0]=3 7544 B9R0.2 CCCCCNC[C@H](C)O 5a490e8ff74a89416bf9c7c48d9e8ab5 [2,0,0,0,0,0|1,0,0]=3 7545 B9R0.2 CCCCCOCC(C)C a6db06e9998ef0b98995e61e46447184 [2,0,0,0,0,0|2,0,0]=4 7546 B9R0.2 CCCCCOCC(C)F eea869a5391d0127cad74008c90486f9 [2,0,0,0,0,0|2,0,0]=4 7547 B9R0.2 CCCCCOCC(C)S 1bb6ad855d7b5438b56773aa5b3dc08b [2,0,0,0,0,0|1,1,0]=4 7548 B9R0.2 CCCCCOC[C@@H](C)F 9a29c6c5b8fac1212082a3622373ef64 [2,0,0,0,0,0|2,0,0]=4 7549 B9R0.2 CCCCCOC[C@H](C)F 994b6cd7a84a65d29551f84dadbfb8db [2,0,0,0,0,0|2,0,0]=4 7550 B9R0.2 CCCCNCCC(C)C 44a9470711d30a7f4f911ef0e5708bda [2,0,0,0,0,0|2,0,0]=4 7551 B9R0.2 CCCCNCCC(C)O a3707e567169e0cb89818b82dd0db2ad [2,0,0,0,0,0|1,0,0]=3 7552 B9R0.2 CCCCNCC[C@@H](C)O b4194f7259d3966751a8302ac0afc5f6 [2,0,0,0,0,0|1,0,0]=3 7553 B9R0.2 CCCCNCC[C@H](C)O 2bd9e0d91881457396737c14485be5ce [2,0,0,0,0,0|1,0,0]=3 7554 B9R0.2 CCCCOCCC(C)C 957ebfe7946e25745350d003aae73b70 [2,0,0,0,0,0|2,0,0]=4 7555 B9R0.2 CCCNCCCC(C)C 56db38ca7131898df70223675d651c95 [2,0,0,0,0,0|2,0,0]=4 7556 B9R0.2 CCCNCCCC(C)O 6371182df2267961651c217c5a9d8ec2 [2,0,0,0,0,0|1,0,0]=3 7557 B9R0.2 CCCOCCCC(C)C c11f5e919ab6207bf876cd919599bef7 [2,0,0,0,0,0|2,0,0]=4 7558 B9R0.2 CCOCCCCC(C)C 342635d8f7fe78b6b1c62374e4a1ad34 [2,0,0,0,0,0|2,0,0]=4 7559 B9R0.2 CCOCCNCC(C)O 611c0ca058030afcafaa92e361f179d4 [2,0,0,0,0,0|2,0,0]=4 7560 B9R0.2 CCOCCNC[C@@H](C)O 6d9cab9a552edc18dd5f7603d3564ae0 [2,0,0,0,0,0|2,0,0]=4 7561 B9R0.2 CCOCCNC[C@H](C)O 223aa1e1127120cb9bd81fef9db0a862 [2,0,0,0,0,0|2,0,0]=4 7562 B9R0.2 CCOCNCCC(C)O 3138bbeaedff2fa3dde2a5a9e1e37e46 [2,0,0,0,0,0|2,0,0]=4 7563 B9R0.2 CCOCNCC[C@@H](C)O 0c1a73cdbcd329869c52458b6af4331f [2,0,0,0,0,0|2,0,0]=4 7564 B9R0.2 CCOCNCC[C@H](C)O 003c7a0673a396cd2acd25751a1511c1 [2,0,0,0,0,0|2,0,0]=4 7565 B9R0.2 CCSCCNCC(C)O 255c79b1ecfe5100a12c3f45792442aa [2,0,0,0,0,0|2,0,0]=4 7566 B9R0.2 CCSCCNC[C@@H](C)O dce2c609bf5c9629ce4288427c7c1b86 [2,0,0,0,0,0|2,0,0]=4 7567 B9R0.2 CCSCCNC[C@H](C)O 57cfac9b9d430cd163d92566fb0015bb [2,0,0,0,0,0|2,0,0]=4 7568 B9R0.2 COCCCNCC(C)O 3fa2a5428f19c5ffc20a47da566fdcc9 [2,0,0,0,0,0|2,0,0]=4 7569 B9R0.2 COCCCNC[C@@H](C)O 19ff1dcbdf3c48021f5a90586903a0ef [2,0,0,0,0,0|2,0,0]=4 7570 B9R0.2 COCCCNC[C@H](C)O d9eaf91d3d886af5c13acd54dbb750ef [2,0,0,0,0,0|2,0,0]=4 7571 B9R0.2 COCCNCCC(C)O 5a263a3731f96a2126baacd5857d34eb [2,0,0,0,0,0|2,0,0]=4 7572 B9R0.2 COCCNCC[C@@H](C)O f612119892ead8b98da5c14432e134c2 [2,0,0,0,0,0|2,0,0]=4 7573 B9R0.2 COCCNCC[C@H](C)O a9e2983c33d9a1a4326532535161c921 [2,0,0,0,0,0|2,0,0]=4 7574 B9R0.2 CSCCCNCC(C)O 70ba937df7d6587395a5fab866fc28ac [2,0,0,0,0,0|2,0,0]=4 7575 B9R0.2 CSCCCNC[C@@H](C)O ec89de1321ce8438e9244c3e8270c36c [2,0,0,0,0,0|2,0,0]=4 7576 B9R0.2 CSCCCNC[C@H](C)O 475d2e539a8bb49c6c6a6ef930e9a225 [2,0,0,0,0,0|2,0,0]=4 7577 B9R0.2 CSCCNCCC(C)O 4a4c316f91a0372beec10a189d68dd5b [2,0,0,0,0,0|2,0,0]=4 7578 B9R0.2 CSCCNCC[C@@H](C)O 7a799516c179e00cbc9167de39b00a4c [2,0,0,0,0,0|2,0,0]=4 7579 B9R0.2 CSCCNCC[C@H](C)O 186d378f131bc2cabd51a436e26a9ce8 [2,0,0,0,0,0|2,0,0]=4 7580 B9R0.2 C[C@@H](O)CCNCCCF 521c04738e2931c8a66f22d645802491 [2,0,0,0,0,0|2,0,0]=4 7581 B9R0.2 C[C@@H](O)CCNCCCO 879875d53905068a86ee9621ae8c2b21 [2,0,0,0,0,0|2,0,0]=4 7582 B9R0.2 C[C@@H](O)CCNCCCS ebf487901d26eddea2cf7ce80728d7f7 [2,0,0,0,0,0|2,0,0]=4 7583 B9R0.2 C[C@@H](O)CNCCCCCl 491b5c1622254008509a4ba8e9ab1cd6 [2,0,0,0,0,0|2,0,0]=4 7584 B9R0.2 C[C@@H](O)CNCCCCF fe799b76acda16431cb6fa5d25600b49 [2,0,0,0,0,0|2,0,0]=4 7585 B9R0.2 C[C@@H](O)CNCCCCO fa414208f6ad4c98dcfebb658b545113 [2,0,0,0,0,0|2,0,0]=4 7586 B9R0.2 C[C@@H](O)CNCCCCS 84fb62362fb54da5594d3cc03c2130c9 [2,0,0,0,0,0|2,0,0]=4 7587 B9R0.2 C[C@H](O)CCNCCCF d124f436f6525e8f868f951a59d90c84 [2,0,0,0,0,0|2,0,0]=4 7588 B9R0.2 C[C@H](O)CCNCCCO a698db67babc45413efb0087ad25aad2 [2,0,0,0,0,0|2,0,0]=4 7589 B9R0.2 C[C@H](O)CCNCCCS 35694b8a490fc55e24732d5b3a080a19 [2,0,0,0,0,0|2,0,0]=4 7590 B9R0.2 C[C@H](O)CNCCCCCl 10f974d9cf94c158b1c6d32ae2032c20 [2,0,0,0,0,0|2,0,0]=4 7591 B9R0.2 C[C@H](O)CNCCCCF bcc3069b5de5f2b89ea30d65e6f3b680 [2,0,0,0,0,0|2,0,0]=4 7592 B9R0.2 C[C@H](O)CNCCCCO a15a5bb9bd70a0ca5b76d0de8e96df0c [2,0,0,0,0,0|2,0,0]=4 7593 B9R0.2 C[C@H](O)CNCCCCS 57a34e18d1e9185556f58eb4a371705c [2,0,0,0,0,0|2,0,0]=4 7594 B9R0.45 CCCCCCCNCC 31fa4e94f188453162c86e218e83a3fe [2,0,0,0,0,0|1,0,0]=3 7595 B9R0.45 CCCCCCCNCF 39b29e109b290c792595feab642af08e [2,0,0,0,0,0|2,0,0]=4 7596 B9R0.45 CCCCCCCNCO 7598d2cec5f82b679ede94b43530bd89 [2,0,0,0,0,0|1,0,0]=3 7597 B9R0.45 CCCCCCCOCC afc5a86de4d9d2aada96fa893fe06937 [2,0,0,0,0,0|1,0,0]=3 7598 B9R0.45 CCCCCCCOCF 34dddba0abdfe53e071e6123614e32ad [2,0,0,0,0,0|2,0,0]=4 7599 B9R0.45 CCCCCCNCCBr 432851e349f9c8ac31da8524f48578e2 [2,0,0,0,0,0|2,0,0]=4 7600 B9R0.45 CCCCCCNCCC e9c4dc74296e69be276b9ef8aee733d2 [2,0,0,0,0,0|1,0,0]=3 7601 B9R0.45 CCCCCCNCCF 9254cc0c3491162ddb811a1ca350686d [2,0,0,0,0,0|2,0,0]=4 7602 B9R0.45 CCCCCCNCCI 211348b41f09447d155ab96e959b3555 [2,0,0,0,0,0|2,0,0]=4 7603 B9R0.45 CCCCCCNCCO 2c640e5cf0d398eb15c3da8e201ff9a9 [2,0,0,0,0,0|1,0,0]=3 7604 B9R0.45 CCCCCCNCCS 295b56fa02564919637f2af1760de842 [2,0,0,0,0,0|1,1,0]=4 7605 B9R0.45 CCCCCCNCOC aba2e41598bd49d27de9d216a6960960 [2,0,0,0,0,0|2,0,0]=4 7606 B9R0.45 CCCCCCNCSC 26b8d5c53ba2ffb7a0ad7aeefcef29cb [2,0,0,0,0,0|2,0,0]=4 7607 B9R0.45 CCCCCCOCCC e53b5b4f9e861a4f0969c775813c954e [2,0,0,0,0,0|1,0,0]=3 7608 B9R0.45 CCCCCCOCCF 5c07b9abefb4c7383b2510ed2f25aa7d [2,0,0,0,0,0|2,0,0]=4 7609 B9R0.45 CCCCCCOCCS dfca5cb8f17cf53fc21013be4aea075a [2,0,0,0,0,0|1,1,0]=4 7610 B9R0.45 CCCCCCOCOC 6663dbbf181def3e6cf6b976451eb0e9 [2,0,0,0,0,0|2,0,0]=4 7611 B9R0.45 CCCCCCOCSC ea8aeb7aec2e44107948b184f1a2484b [2,0,0,0,0,0|2,0,0]=4 7612 B9R0.45 CCCCCNCCCC 4b3b475ebd19f4e81120126dc44604b9 [2,0,0,0,0,0|1,0,0]=3 7613 B9R0.45 CCCCCNCCCCl 109aece1b500375b78357a337e9896e4 [2,0,0,0,0,0|2,0,0]=4 7614 B9R0.45 CCCCCNCCCF 5ad689e26c296fbe8637b1c72c8b1ac8 [2,0,0,0,0,0|2,0,0]=4 7615 B9R0.45 CCCCCNCCCO 3cb5b804fc7f29c415be4738c214f571 [2,0,0,0,0,0|1,0,0]=3 7616 B9R0.45 CCCCCNCCCS 7d387ec49be60b8d3336c43db9a47159 [2,0,0,0,0,0|1,1,0]=4 7617 B9R0.45 CCCCCNCCOC 0d0c9f836b1b0f565b919320cde5807e [2,0,0,0,0,0|2,0,0]=4 7618 B9R0.45 CCCCCNCCSC 738dc92cc1ee7c68b53e333bc3c1249e [2,0,0,0,0,0|2,0,0]=4 7619 B9R0.45 CCCCCNCOCC 106dd0a5d7506881af71fe2f076cb844 [2,0,0,0,0,0|2,0,0]=4 7620 B9R0.45 CCCCCOCCCC 452d4f5e08ae861a8237c2e4edaffcee [2,0,0,0,0,0|1,0,0]=3 7621 B9R0.45 CCCCCOCCCF fafa7792cbca75bb6104f416c496b552 [2,0,0,0,0,0|2,0,0]=4 7622 B9R0.45 CCCCCOCCCS d7a2eff0ce3ac908cbe201d57fc422a2 [2,0,0,0,0,0|1,1,0]=4 7623 B9R0.45 CCCCCOCCOC 64d0f3f4ad4f7f2b3f2cc5427c5eba08 [2,0,0,0,0,0|2,0,0]=4 7624 B9R0.45 CCCCCOCCSC 35787b22863a0bdd2a717cb23597facb [2,0,0,0,0,0|2,0,0]=4 7625 B9R0.45 CCCCCOCOCC 61d6517ecd367dc788621782453f190f [2,0,0,0,0,0|2,0,0]=4 7626 B9R0.45 CCCCNCCCCCl 8e0e9ebf8dfb1495f624013ef828e19e [2,0,0,0,0,0|2,0,0]=4 7627 B9R0.45 CCCCNCCCCF 953d043841cd25eff2ef5c3d0831f1dd [2,0,0,0,0,0|2,0,0]=4 7628 B9R0.45 CCCCNCCCCO 74a60cb017e8f2dcfff3bd80cde22232 [2,0,0,0,0,0|1,0,0]=3 7629 B9R0.45 CCCCNCCCCS 293a84436b4673ea4650c3832cb6a843 [2,0,0,0,0,0|1,1,0]=4 7630 B9R0.45 CCCCNCCCOC 788f960a3da4a154a6d1eb4fd6357034 [2,0,0,0,0,0|2,0,0]=4 7631 B9R0.45 CCCCNCCCSC 1307aea73f697be7347c70961c337c72 [2,0,0,0,0,0|2,0,0]=4 7632 B9R0.45 CCCCNCCOCC 39271ffac0a4948f82700c61c9eec153 [2,0,0,0,0,0|2,0,0]=4 7633 B9R0.45 CCCCNCCSCC b1ef8d1aa777f7abf26f9f2c6eb99f55 [2,0,0,0,0,0|2,0,0]=4 7634 B9R0.45 CCCCOCCCCF 42830ea441c5128d22602f571e3205b9 [2,0,0,0,0,0|2,0,0]=4 7635 B9R0.45 CCCCOCCCCS ec359e1317d20b353c1e6ee1fa4be1a0 [2,0,0,0,0,0|1,1,0]=4 7636 B9R0.45 CCCCOCCCOC 94ce11a6d684ef526eb2e193b6598c58 [2,0,0,0,0,0|2,0,0]=4 7637 B9R0.45 CCCCOCCCSC 62b74f8edfba0d3c5255c58121a65cb5 [2,0,0,0,0,0|2,0,0]=4 7638 B9R0.45 CCCCOCCNCC c0f6eb404167932e0e88f86a69bff347 [2,0,0,0,0,0|2,0,0]=4 7639 B9R0.45 CCCCOCCNCO cd975e60385ed19fb54161372698cee4 [2,0,0,0,0,0|2,0,0]=4 7640 B9R0.45 CCCCOCCOCC bc40d3f7a271e2ee8715a56f03d564ef [2,0,0,0,0,0|2,0,0]=4 7641 B9R0.45 CCCCOCCSCC 4b27bedc971633e9128e01c7169daa62 [2,0,0,0,0,0|2,0,0]=4 7642 B9R0.45 CCCCOCNCCC a731432b21a93145f59a9eee5ade548a [2,0,0,0,0,0|2,0,0]=4 7643 B9R0.45 CCCCOCNCCO 6bb9eca64afcebb6f28e84a821a2a862 [2,0,0,0,0,0|2,0,0]=4 7644 B9R0.45 CCCCOCOCCC bf8c796cfd1bba6ec2766c9548b22b8d [2,0,0,0,0,0|2,0,0]=4 7645 B9R0.45 CCCCSCCOCC 696d57545195b0a32e7d1cb44c602929 [2,0,0,0,0,0|2,0,0]=4 7646 B9R0.45 CCCNCCCCCCl 2d5ae8cd51b6a7e591941cb7b0622e55 [2,0,0,0,0,0|2,0,0]=4 7647 B9R0.45 CCCNCCCCCF 7ddf79ca6b37ad2b5e8ddc392231f404 [2,0,0,0,0,0|2,0,0]=4 7648 B9R0.45 CCCNCCCCCO f3d6f4913e5f254c1bf460b36dd70b4c [2,0,0,0,0,0|1,0,0]=3 7649 B9R0.45 CCCNCCCCOC 3a911d7832cca15ffba1db8d75c3525f [2,0,0,0,0,0|2,0,0]=4 7650 B9R0.45 CCCNCCCCSC 83af594d195aec376428f00fc6e6852d [2,0,0,0,0,0|2,0,0]=4 7651 B9R0.45 CCCNCCCOCC a836c1341cedce3cb982b7dda3393120 [2,0,0,0,0,0|2,0,0]=4 7652 B9R0.45 CCCNCCCSCC da25d421765166ddce276c23e4b27d3a [2,0,0,0,0,0|2,0,0]=4 7653 B9R0.45 CCCNCCOCCC c9636642ffae561b1adc5cd9ae1dccad [2,0,0,0,0,0|2,0,0]=4 7654 B9R0.45 CCCNCCOCCO 26e2580fee42af23b6bec1a5344f6efe [2,0,0,0,0,0|2,0,0]=4 7655 B9R0.45 CCCNCCSCCO 1f86c5fc79a4d95fd86404e323963902 [2,0,0,0,0,0|2,0,0]=4 7656 B9R0.45 CCCOCCCCCF b14e93115958730ea8214bff1c89eb77 [2,0,0,0,0,0|2,0,0]=4 7657 B9R0.45 CCCOCCCCOC 3aa974714759e935d3dbeb5a361d1541 [2,0,0,0,0,0|2,0,0]=4 7658 B9R0.45 CCCOCCCCSC 28df677e6e1829a07cbf3784e5a5b453 [2,0,0,0,0,0|2,0,0]=4 7659 B9R0.45 CCCOCCCNCC 9c5f9e1a8eab534703971dfcd50dc3a4 [2,0,0,0,0,0|2,0,0]=4 7660 B9R0.45 CCCOCCCNCO f453546a549baebba8d4dda9dd1f2b96 [2,0,0,0,0,0|2,0,0]=4 7661 B9R0.45 CCCOCCCOCC 7ae5cc2cef81f72870de148e55495f6e [2,0,0,0,0,0|2,0,0]=4 7662 B9R0.45 CCCOCCCSCC a587632712094e0a386067bb302c3743 [2,0,0,0,0,0|2,0,0]=4 7663 B9R0.45 CCCOCCNCCO 2fe038760c01b7075e45b162c476ceb9 [2,0,0,0,0,0|2,0,0]=4 7664 B9R0.45 CCCOCCOCCC 96ef823798ad295a7793168e0a9a50d1 [2,0,0,0,0,0|2,0,0]=4 7665 B9R0.45 CCCOCCSCCC ef95f0015148e44bf9c71ec82f7f1f36 [2,0,0,0,0,0|2,0,0]=4 7666 B9R0.45 CCNCCCCCCCl 59b5285c49bc16b0b152df55e767300a [2,0,0,0,0,0|2,0,0]=4 7667 B9R0.45 CCNCCCCCCO 59b1923e7d0b8671db87a813cf6b4ab5 [2,0,0,0,0,0|1,0,0]=3 7668 B9R0.45 CCNCCCCCOC fc15d1f5a98279f7f6e7e0686f586bf9 [2,0,0,0,0,0|2,0,0]=4 7669 B9R0.45 CCNCCCCSCC f8cf53852eae5c1d0e62790a5b5787e1 [2,0,0,0,0,0|2,0,0]=4 7670 B9R0.45 CCNCCCOCCO 6c261c514fd28efb5350d358913fae05 [2,0,0,0,0,0|2,0,0]=4 7671 B9R0.45 CCNCCOCCCO 0587f8b538abe097ec5a15ca1741ae9c [2,0,0,0,0,0|2,0,0]=4 7672 B9R0.45 CCOCCCCCCF 1581be03b145221792da0e70f0dc7ced [2,0,0,0,0,0|2,0,0]=4 7673 B9R0.45 CCOCCCCCCS 890481a3122baa8d804b207afa67ebc3 [2,0,0,0,0,0|1,1,0]=4 7674 B9R0.45 CCOCCCNCCO 2b9ad8b94ae5a803722e62535f4291fd [2,0,0,0,0,0|2,0,0]=4 7675 B9R0.45 CCOCCNCCCO f920b2cdd5960150c1761b62d58446b4 [2,0,0,0,0,0|2,0,0]=4 7676 B9R0.45 CCOCNCCCCO 8a098d07046f425046fb40aa034ce721 [2,0,0,0,0,0|2,0,0]=4 7677 B9R0.45 CCSCCCCNCO b5317d3d243e051b414811fd9803b081 [2,0,0,0,0,0|2,0,0]=4 7678 B9R0.45 CCSCCCNCCO b73a81c9666f167eb7df0d9e4e845db9 [2,0,0,0,0,0|2,0,0]=4 7679 B9R0.45 CCSCCNCCCO d094498045f2b61ea374614f3a36e63e [2,0,0,0,0,0|2,0,0]=4 7680 B9R0.45 COCCCCCNCO bcbefdff7df1910d96b91030fdd66d71 [2,0,0,0,0,0|2,0,0]=4 7681 B9R0.45 COCCCCNCCO c64f84dda1c7e1a3b83c8677baf02563 [2,0,0,0,0,0|2,0,0]=4 7682 B9R0.45 COCCCNCCCO 80827af578dfd9221e88944d50b47203 [2,0,0,0,0,0|2,0,0]=4 7683 B9R0.45 COCCNCCCCO 98a0ba2b4e7cfdb77ca7eb5bd158bcce [2,0,0,0,0,0|2,0,0]=4 7684 B9R0.45 COCNCCCCCO 1110af8acba3f65702890e8caffb75f5 [2,0,0,0,0,0|2,0,0]=4 7685 B9R0.45 CSCCCCNCCO 71aec6063e81fccb3b9166d912cdd51e [2,0,0,0,0,0|2,0,0]=4 7686 B9R0.45 CSCCCNCCCO 28a7baa82e21352faa8b2b7ae1ad9e7c [2,0,0,0,0,0|2,0,0]=4 7687 B9R0.45 CSCCNCCCCO 62e46910418c4ce52244f7fbd91c204a [2,0,0,0,0,0|2,0,0]=4 7688 B9R0.45 CSCNCCCCCO 5bb2e7db9b994ef76c056647cef0a208 [2,0,0,0,0,0|2,0,0]=4 7689 B9R0.45 OCCCCCCNCF 9f8dd59df8b832f35306dcc311b8ba0b [2,0,0,0,0,0|2,0,0]=4 7690 B9R0.45 OCCCCCCNCO b03974d5eaea260ed44c4429a42a8efd [2,0,0,0,0,0|2,0,0]=4 7691 B9R0.45 OCCCCCNCCBr b6fe72a70aa9ee94c38953fc5fa03507 [2,0,0,0,0,0|2,0,0]=4 7692 B9R0.45 OCCCCCNCCF efe70d32a4c6133cd05e8c1bf8301a0a [2,0,0,0,0,0|2,0,0]=4 7693 B9R0.45 OCCCCCNCCI 4b343205ce8465baed90cb0f419c6c4d [2,0,0,0,0,0|2,0,0]=4 7694 B9R0.45 OCCCCCNCCO c6e0d5af126a56a449acd76dabb0d0a6 [2,0,0,0,0,0|2,0,0]=4 7695 B9R0.45 OCCCCCNCCS 81db03003d62237a4ac003bf8b7c1409 [2,0,0,0,0,0|2,0,0]=4 7696 B9R0.45 OCCCCNCCCCl 5d4dd36721e99428cdc35a6893c3e2fe [2,0,0,0,0,0|2,0,0]=4 7697 B9R0.45 OCCCCNCCCF 6f20b166a61175e5d8c115f1b02448f2 [2,0,0,0,0,0|2,0,0]=4 7698 B9R0.45 OCCCCNCCCO 5785bad1b39de5e973646d0653e00598 [2,0,0,0,0,0|2,0,0]=4 7699 B9R0.45 OCCCCNCCCS 15be786d5d00bee1f4424bf326f6da44 [2,0,0,0,0,0|2,0,0]=4 7700 B9R0.45 OCCCNCCCCCl 19919d9b789640b88d6d653b90e1be74 [2,0,0,0,0,0|2,0,0]=4 7701 B9R0.45 OCCCNCCCCF 1b694695d8d20de2554ac05a72c91dce [2,0,0,0,0,0|2,0,0]=4 7702 B9R0.45 OCCCNCCCCS 8e91b12d63d803cd106ce9f5169f8923 [2,0,0,0,0,0|2,0,0]=4 7703 B9R0.45 OCCNCCCCCCl e9f98005127c4b0d506088db3b60ee60 [2,0,0,0,0,0|2,0,0]=4 7704 B9R0.45 OCCNCCCCCF 758b4b8080a41888cab6ab1d11640066 [2,0,0,0,0,0|2,0,0]=4 7705 B9R0.45 OCNCCCCCCCl 6c66f104945205670f9512f61ea483f8 [2,0,0,0,0,0|2,0,0]=4 7706 B11R0.2 CC(O)CC(C)NCCCCF 3672692138f3307147c8898a9f88d9a6 [1,1,0,0,0,0|2,0,0]=4 7707 B11R0.2 CC(O)CC(C)NCCCCO 8e5d80aa5dd848417b49b9e78da35ee6 [1,1,0,0,0,0|2,0,0]=4 7708 B11R0.2 CC(O)CN(C)CCCCCF 7777fc333c954e606355197d4a668f42 [1,1,0,0,0,0|2,0,0]=4 7709 B11R0.2 CC(O)CN(C)CCCCCO 63bbdbc9e300f67e1e814faa9df13f9d [1,1,0,0,0,0|2,0,0]=4 7710 B11R0.2 CCCCCCC(C)NC(C)C bbf84db520f9ead3b20d7cf581813326 [1,1,0,0,0,0|2,0,0]=4 7711 B11R0.2 CCCCCCC(C)OC(C)C a0411d3293c7ba390aed6f47b01f72a2 [1,1,0,0,0,0|2,0,0]=4 7712 B11R0.2 CCCCCCN(C)CC(C)C 75381f5b030f59775455731f978dd2db [1,1,0,0,0,0|2,0,0]=4 7713 B11R0.2 CCCCCCN(C)CC(C)O a9dd09345b7ade61af05dba120ab6503 [1,1,0,0,0,0|1,0,0]=3 7714 B11R0.2 CCCCCCN(C)C[C@@H](C)O c920e3f5d8a26d97a0c4849baa4d03d2 [1,1,0,0,0,0|1,0,0]=3 7715 B11R0.2 CCCCCCN(C)C[C@H](C)O 94f3e4ffc4936f66a71ce3f1da85b272 [1,1,0,0,0,0|1,0,0]=3 7716 B11R0.2 CCCCCC[C@@H](C)NC(C)C 4dde7b7fe2584618d51d109097a757f7 [1,1,0,0,0,0|2,0,0]=4 7717 B11R0.2 CCCCCC[C@@H](C)OC(C)C 860db748912fc8f1ffde2a6de2ada311 [1,1,0,0,0,0|2,0,0]=4 7718 B11R0.2 CCCCCC[C@H](C)NC(C)C 73cdbcc3d265db5ee3796bdda47c4845 [1,1,0,0,0,0|2,0,0]=4 7719 B11R0.2 CCCCCC[C@H](C)OC(C)C f8ee870552a20b0e1cb720a73a23e127 [1,1,0,0,0,0|2,0,0]=4 7720 B11R0.2 CCCCCNC(=O)CC(C)O a7310630ee05db8507d17f6f5635f1f7 [1,1,0,0,0,0|1,0,1]=4 7721 B11R0.2 CCCCCNC(=O)C[C@@H](C)O 74bdad8f051e73e767c01c34354bb00a [1,1,0,0,0,0|1,0,1]=4 7722 B11R0.2 CCCCCNC(=O)C[C@H](C)O 0641d6521812951e3665c5f041988d44 [1,1,0,0,0,0|1,0,1]=4 7723 B11R0.2 CCCCCNC(C)CC(C)C c4740cb8d5b2eec8477f561dbc26c004 [1,1,0,0,0,0|2,0,0]=4 7724 B11R0.2 CCCCCNC(C)CC(C)O 64648d0e2e8ea3834876aee95836a97d [1,1,0,0,0,0|1,0,0]=3 7725 B11R0.2 CCCCCOC(C)CC(C)C be39f1add9f222b1159083d9fa6823a0 [1,1,0,0,0,0|2,0,0]=4 7726 B11R0.2 CCCCCO[C@@H](C)CC(C)C fb1ef9a0ecb52f623619cbd49cf4f2fa [1,1,0,0,0,0|2,0,0]=4 7727 B11R0.2 CCCCCO[C@H](C)CC(C)C 646deb2ca3d348336771ca933ec06dc5 [1,1,0,0,0,0|2,0,0]=4 7728 B11R0.2 CCCCNCC(O)CC(C)C 9c5a2908eb7036d1ddf8e000bfddbd46 [1,1,0,0,0,0|2,0,0]=4 7729 B11R0.2 CCCCOCC(C)CC(C)C b39f53b174b5333ec77dcb10c69286d7 [1,1,0,0,0,0|2,0,0]=4 7730 B11R0.2 CCCCOCN(C)CC(C)O 9995ae1df1c82eae759ca51797684644 [1,1,0,0,0,0|2,0,0]=4 7731 B11R0.2 CCCCOCN(C)C[C@H](C)O 0c5cfb2cb2207252306cc0cfac218b64 [1,1,0,0,0,0|2,0,0]=4 7732 B11R0.2 CCCOCCC(C)CC(C)C 15092825265aa22826b93c0d351d5f85 [1,1,0,0,0,0|2,0,0]=4 7733 B11R0.2 CCCOCCN(C)CC(C)O f23c5d70221d0d1defb15f038075cc52 [1,1,0,0,0,0|2,0,0]=4 7734 B11R0.2 CCCOCCN(C)C[C@H](C)O 1209b58796ccc33ccb35330d9ff70123 [1,1,0,0,0,0|2,0,0]=4 7735 B11R0.2 CCOCCCC(C)CC(C)C d2dfd4230a2e982ddf53690e84a4475a [1,1,0,0,0,0|2,0,0]=4 7736 B11R0.2 CCOCCCN(C)CC(C)O bb76177686519d4462e18cf059b4c707 [1,1,0,0,0,0|2,0,0]=4 7737 B11R0.2 CCOCCCN(C)C[C@H](C)O 99841aa1340c03c5a28c7f7cdbd23bd5 [1,1,0,0,0,0|2,0,0]=4 7738 B11R0.2 CCOCCNC(C)CC(C)O c900756b42d6c9f35031579c7b115334 [1,1,0,0,0,0|2,0,0]=4 7739 B11R0.2 CCSCCCN(C)CC(C)O cc903fe504012f18282f98d243959309 [1,1,0,0,0,0|2,0,0]=4 7740 B11R0.2 CCSCCCN(C)C[C@H](C)O 297fdb59c370a1660964bed5227bb589 [1,1,0,0,0,0|2,0,0]=4 7741 B11R0.2 CCSCCNC(C)CC(C)O d8976ca9dedfc23d760cf3402f016edb [1,1,0,0,0,0|2,0,0]=4 7742 B11R0.2 COCCCCN(C)CC(C)O d4cde7f36d8d7c2d6c56f8a54f5d9e00 [1,1,0,0,0,0|2,0,0]=4 7743 B11R0.2 COCCCCN(C)C[C@@H](C)O 7bbb8e7182389549f6d6bdaa032de74b [1,1,0,0,0,0|2,0,0]=4 7744 B11R0.2 COCCCCN(C)C[C@H](C)O d0b9992d607aa450f001c5f1cb28b9d3 [1,1,0,0,0,0|2,0,0]=4 7745 B11R0.2 COCCCNC(C)CC(C)O 0c6873843e688f65bc42b3b5c29b0c7a [1,1,0,0,0,0|2,0,0]=4 7746 B11R0.2 CSCCCNC(C)CC(C)O 0a4a6c635581c5172e1baa9eb786b56c [1,1,0,0,0,0|2,0,0]=4 7747 B11R0.2 C[C@@H](O)CN(C)CCCCCO f62f6efcf244124514a40e741ac54449 [1,1,0,0,0,0|2,0,0]=4 7748 B11R0.2 C[C@H](O)CN(C)CCCCCF 2481129104c45c7428c33db63d99b4a1 [1,1,0,0,0,0|2,0,0]=4 7749 B11R0.2 C[C@H](O)CN(C)CCCCCO dde7a92387bad64d156d97a7a261461c [1,1,0,0,0,0|2,0,0]=4 7750 B11R0.30 C=C(C)CCCNCCC(C)O 32bec6ae0f35b6923811bdaf1fce125e [1,1,0,0,0,0|1,0,1]=4 7751 B11R0.30 C=C(C)CCCNCC[C@@H](C)O e5071c108dbb56675711165aade816fe [1,1,0,0,0,0|1,0,1]=4 7752 B11R0.30 C=C(C)CCCNCC[C@H](C)O ce96cf78fa008c363474df3787aee175 [1,1,0,0,0,0|1,0,1]=4 7753 B11R0.30 C=C(C)CCNCCCC(C)O 8309aa5f3c6e80eb9e68453865f58e9f [1,1,0,0,0,0|1,0,1]=4 7754 B11R0.30 C=C(C)CNCCCCC(C)O cdbb107659f1689f6d58278690f3f7b7 [1,1,0,0,0,0|1,0,1]=4 7755 B11R0.30 C=C(C)CNCCCC[C@@H](C)O 03857abf64811fd982b8a5a262263903 [1,1,0,0,0,0|1,0,1]=4 7756 B11R0.30 CC(=O)CCCCNCC(C)O 150661f01df1b41b256186747d770382 [1,1,0,0,0,0|1,0,1]=4 7757 B11R0.30 CC(=O)CCCCNC[C@@H](C)O 877536ea410bda933fd0d11829e3f1f5 [1,1,0,0,0,0|1,0,1]=4 7758 B11R0.30 CC(=O)CCCCNC[C@H](C)O cfdd04aa9ecca29fba214bac18aab3b2 [1,1,0,0,0,0|1,0,1]=4 7759 B11R0.30 CC(=O)CCCNCCC(C)O e90fa3f64f3d5ab2f15000bb5aca15e9 [1,1,0,0,0,0|1,0,1]=4 7760 B11R0.30 CC(=O)CCCNCC[C@@H](C)O 01845a444019ef69b56595bff259c90d [1,1,0,0,0,0|1,0,1]=4 7761 B11R0.30 CC(=O)CCCNCC[C@H](C)O dbf4bbd732f1f0f607a0fcba58e3d450 [1,1,0,0,0,0|1,0,1]=4 7762 B11R0.30 CC(=O)CNCCCCC(C)O 15573be76016b8f7bd0e839b5556feb2 [1,1,0,0,0,0|1,0,1]=4 7763 B11R0.30 CC(=O)CNCCCC[C@@H](C)O 873c419bc007215fffd2c2568d78654b [1,1,0,0,0,0|1,0,1]=4 7764 B11R0.30 CC(C)CCCCCNC(C)C b7b1a298cab758d747bbe0c53696f302 [1,1,0,0,0,0|2,0,0]=4 7765 B11R0.30 CC(C)CCCCCOC(C)C 425118966041ac589394828549332fb7 [1,1,0,0,0,0|2,0,0]=4 7766 B11R0.30 CC(C)CCCCNCC(C)C 1d82e90ff9343723cb46bdd9e0855f09 [1,1,0,0,0,0|2,0,0]=4 7767 B11R0.30 CC(C)CCCCNCC(C)O 8704d92212c706148a6e70765ac52f27 [1,1,0,0,0,0|1,0,0]=3 7768 B11R0.30 CC(C)CCCCNC[C@@H](C)O d86f6a0312c2db74e8cdf28d735df9a7 [1,1,0,0,0,0|1,0,0]=3 7769 B11R0.30 CC(C)CCCCNC[C@H](C)O cd13f188463ace4221966156ccd8f1b3 [1,1,0,0,0,0|1,0,0]=3 7770 B11R0.30 CC(C)CCCCOCC(C)C 245fb1e8de5b4b0467cd206b5450e32a [1,1,0,0,0,0|2,0,0]=4 7771 B11R0.30 CC(C)CCCCOCC(C)F 07cc36e14b4c2bcbfaaa7d0010e5da21 [1,1,0,0,0,0|2,0,0]=4 7772 B11R0.30 CC(C)CCCCOCC(C)S 8c5ee4c2ba87550561f8902e3631ce96 [1,1,0,0,0,0|1,1,0]=4 7773 B11R0.30 CC(C)CCCCOC[C@@H](C)F 7de9f9e260159ccbd08a1c793c4bba5a [1,1,0,0,0,0|2,0,0]=4 7774 B11R0.30 CC(C)CCCCOC[C@H](C)F 4ac156df28fd84110a0e9ddf8c669adf [1,1,0,0,0,0|2,0,0]=4 7775 B11R0.30 CC(C)CCCNCCC(C)C 5cb402533fb17620e8956bf1b5c42b1d [1,1,0,0,0,0|2,0,0]=4 7776 B11R0.30 CC(C)CCCNCCC(C)O ecc093cdabf5ae43744a20a1e9748641 [1,1,0,0,0,0|1,0,0]=3 7777 B11R0.30 CC(C)CCCNCC[C@@H](C)O 261155fbbc30b03a09a5be2dd72e330b [1,1,0,0,0,0|1,0,0]=3 7778 B11R0.30 CC(C)CCCNCC[C@H](C)O e3b6b361add023cc7c0122c58b609b08 [1,1,0,0,0,0|1,0,0]=3 7779 B11R0.30 CC(C)CCCOCCC(C)C fd0daf3059f98c552e865915453b18b2 [1,1,0,0,0,0|2,0,0]=4 7780 B11R0.30 CC(C)CCNCCCC(C)O d655fe544ce63ff0dd9ad63903cf045c [1,1,0,0,0,0|1,0,0]=3 7781 B11R0.30 CC(C)CNCCCCC(C)O 01b37128c8ccbbd7756317e16f6e7b60 [1,1,0,0,0,0|1,0,0]=3 7782 B11R0.30 CC(C)CNCCCC[C@@H](C)O de13a5d1554e89a41f7d32444d288b81 [1,1,0,0,0,0|1,0,0]=3 7783 B11R0.30 CC(C)COCCNCC(C)O 40664ac195e568afa83148fd8af797b4 [1,1,0,0,0,0|2,0,0]=4 7784 B11R0.30 CC(C)COCCNC[C@@H](C)O 8497f2b3bee27b3496fdd5c084ab7c74 [1,1,0,0,0,0|2,0,0]=4 7785 B11R0.30 CC(C)COCCNC[C@H](C)O 42fb77a29bede55363d81531a4bfece9 [1,1,0,0,0,0|2,0,0]=4 7786 B11R0.30 CC(C)OCCCNC[C@@H](C)O a4f84cb8b1c11ea874cc1129f8af2773 [1,1,0,0,0,0|2,0,0]=4 7787 B11R0.30 CC(C)OCCCNC[C@H](C)O 84a977ca3a15b901360470743a4bc423 [1,1,0,0,0,0|2,0,0]=4 7788 B11R0.30 CC(C)OCCNCC[C@@H](C)O 796874fdcdaa0b0941f74d6c73613532 [1,1,0,0,0,0|2,0,0]=4 7789 B11R0.30 CC(C)OCCNCC[C@H](C)O 1ad6c9e3d0209da58e13c632dc9a933a [1,1,0,0,0,0|2,0,0]=4 7790 B11R0.30 CC(C)SCCCNC[C@@H](C)O d33c8c4d3c63d14f901f3669f7be0cc3 [1,1,0,0,0,0|2,0,0]=4 7791 B11R0.30 CC(C)SCCCNC[C@H](C)O 18f975585509946943b9fa427a890949 [1,1,0,0,0,0|2,0,0]=4 7792 B11R0.30 CC(C)SCCNCC[C@@H](C)O 2a7e46e58aa0af48474ccec0a68e0862 [1,1,0,0,0,0|2,0,0]=4 7793 B11R0.30 CC(C)SCCNCC[C@H](C)O fc9b585a157848354d2507f9f744b3de [1,1,0,0,0,0|2,0,0]=4 7794 B11R0.30 CC(O)CCCCNCC(C)O 67bff0d4b30261e0d539844b4f54d571 [1,1,0,0,0,0|1,0,0]=3 7795 B11R0.30 CC(O)CCCCNCC(F)F 4d2c1c87800f47c5125067da82354f73 [1,1,0,0,0,0|2,0,0]=4 7796 B11R0.30 CC(O)CCCCNC[C@@H](C)O da3dd75a2f508f72cd24db5474965b17 [1,1,0,0,0,0|1,0,0]=3 7797 B11R0.30 CC(O)CCCCNC[C@H](C)O 79286928e9dc096f182620790310dec5 [1,1,0,0,0,0|1,0,0]=3 7798 B11R0.30 CC(O)CCCNCCC(C)O db1ef15e6d02a6c884085ac2fd3e6271 [1,1,0,0,0,0|1,0,0]=3 7799 B11R0.30 CC(O)CCCNCCC(F)F 5c90973151305ea7f594c557e07961b2 [1,1,0,0,0,0|2,0,0]=4 7800 B11R0.30 CC(O)CCCNCCN(C)C 0967f56897d29fece4e95fb0c004068b [1,1,0,0,0,0|2,0,0]=4 7801 B11R0.30 CC(O)CCCNCCS(=O)C cfd9c7ff56403d1b904574dcd13a86bb [1,1,0,0,0,0|2,0,0]=4 7802 B11R0.30 CC(O)CCCNCC[C@@H](C)O 06c2bfbee420c4bd595eae0214c32656 [1,1,0,0,0,0|1,0,0]=3 7803 B11R0.30 CC(O)CCCNCC[C@H](C)O 4672dd060037f322786910438f75ab6e [1,1,0,0,0,0|1,0,0]=3 7804 B11R0.30 CC(O)CCNCCCN(C)C e8f55c5a5dd467b938c3ca9f0fd9af6d [1,1,0,0,0,0|2,0,0]=4 7805 B11R0.30 CC(O)CCNCCCS(=O)C f30c0722c43d0018e704385205f182c5 [1,1,0,0,0,0|2,0,0]=4 7806 B11R0.30 CC(O)CCNCCOC(C)C 330d1ecfefa7031b446ff6d3924a6214 [1,1,0,0,0,0|2,0,0]=4 7807 B11R0.30 CC(O)CCNCCSC(C)C 331bd9452ea8cfc6f94a8fde138afd90 [1,1,0,0,0,0|2,0,0]=4 7808 B11R0.30 CC(O)CNCCCCC(F)F 223bc463711a19b1fdb4beb7a932d61f [1,1,0,0,0,0|2,0,0]=4 7809 B11R0.30 CC(O)CNCCCCN(C)C b6d75979bdbb1d25e60b221f47ec2a2e [1,1,0,0,0,0|2,0,0]=4 7810 B11R0.30 CC(O)CNCCCC[C@@H](C)O 1780eca4125236a6324f9c4dee4d3683 [1,1,0,0,0,0|1,0,0]=3 7811 B11R0.30 CC(O)CNCCCOC(C)C 9e54ad7d4f7cd3421a1741592894aa3b [1,1,0,0,0,0|2,0,0]=4 7812 B11R0.30 CC(O)CNCCCSC(C)C 4f9014e830cd94e168961b2320f79091 [1,1,0,0,0,0|2,0,0]=4 7813 B11R0.30 C[C@@H](O)CCCCNCC(F)F 986e3d1623d0cb50c7cbc372aec3b752 [1,1,0,0,0,0|2,0,0]=4 7814 B11R0.30 C[C@@H](O)CCCCNC[C@@H](C)O fb1f7d4a43501f7330a34f8ea0469478 [1,1,0,0,0,0|1,0,0]=3 7815 B11R0.30 C[C@@H](O)CCNCCCN(C)C f2c756f850345b0d72f15448cc1b2a60 [1,1,0,0,0,0|2,0,0]=4 7816 B11R0.30 C[C@@H](O)CNCCCCC(F)F 664344a906ceb135563c52d189b3a52e [1,1,0,0,0,0|2,0,0]=4 7817 B11R0.30 C[C@@H](O)CNCCCCN(C)C ad2460079c3fc26e73ae9e5e606d8e52 [1,1,0,0,0,0|2,0,0]=4 7818 B11R0.30 C[C@H](O)CCNCCCN(C)C b10b9acefa506c03f6a397146be647d8 [1,1,0,0,0,0|2,0,0]=4 7819 B11R0.30 C[C@H](O)CNCCCCC(F)F 8c8f489e094799be0b07c3b1d7689eeb [1,1,0,0,0,0|2,0,0]=4 7820 B11R0.30 C[C@H](O)CNCCCCN(C)C 62ed0530d4b12318b6b3fe307a889eb8 [1,1,0,0,0,0|2,0,0]=4 7821 B11R0.30 C[C@H](O)CNCCCC[C@@H](C)O 72956bd0f529f7f3fb3c418f7c197d5a [1,1,0,0,0,0|1,0,0]=3 7822 B11R0.40 C#CC(C)NCCCCCCC 10f09b24e3ab090e50b402030cdd32fa [1,1,0,0,0,0|2,0,0]=4 7823 B11R0.40 C#CC(C)OCCCCCCC 4d15747cbb7eacc54ea8b8fbd7fc3ecd [1,1,0,0,0,0|2,0,0]=4 7824 B11R0.40 C#C[C@@H](C)NCCCCCCC 7d9ee7bf551cfb17ba945e8c66ca181c [1,1,0,0,0,0|2,0,0]=4 7825 B11R0.40 C#C[C@@H](C)OCCCCCCC c291c25c0791a6521d9c370522c7d624 [1,1,0,0,0,0|2,0,0]=4 7826 B11R0.40 C#C[C@H](C)NCCCCCCC fed1fb058c3f6d6930f35a774e094546 [1,1,0,0,0,0|2,0,0]=4 7827 B11R0.40 C#C[C@H](C)OCCCCCCC cf1e47bbf033ff83689373d9aa4a2bdf [1,1,0,0,0,0|2,0,0]=4 7828 B11R0.40 C=CC(C)COCCCCCC e8c550ade22d676da357de4f629df640 [1,1,0,0,0,0|2,0,0]=4 7829 B11R0.40 C=CC(C)NCCCCCCC 63a13bfaf1c25ce77bd5f05cf9652fdf [1,1,0,0,0,0|2,0,0]=4 7830 B11R0.40 C=CC(C)OCCCCCCC b0311bf4ebfcfc8b0e48448f7ef9ab9b [1,1,0,0,0,0|2,0,0]=4 7831 B11R0.40 C=CC(O)CNCCCCCC b79358333ab692d8b297775ed406ef8d [1,1,0,0,0,0|1,0,1]=4 7832 B11R0.40 C=C[C@H](C)OCCCCCCC af84f4f08edf38169cc50500eea3f0fe [1,1,0,0,0,0|2,0,0]=4 7833 B11R0.40 CC(CO)CCCNCCCF ddbe7d99f32e0f7d4d51cc773fc6f2e9 [1,1,0,0,0,0|2,0,0]=4 7834 B11R0.40 CC(CO)CCCNCCCO ffd2b30790660805af463d2d15f2df9e [1,1,0,0,0,0|2,0,0]=4 7835 B11R0.40 CC(CO)CCCNCCCS 2ce019b4493b58209655b8c14d50ea66 [1,1,0,0,0,0|2,0,0]=4 7836 B11R0.40 CC(CO)CCNCCCCCl 289e569731cc64c8baa8e03ec75c19d0 [1,1,0,0,0,0|2,0,0]=4 7837 B11R0.40 CC(CO)CCNCCCCF 6b99a3ac8ff36a413b52e537f7ddf89e [1,1,0,0,0,0|2,0,0]=4 7838 B11R0.40 CC(CO)CCNCCCCO a225f5c6c1270b65c10b665b343d9140 [1,1,0,0,0,0|2,0,0]=4 7839 B11R0.40 CC(CO)CCNCCCCS 358c7e599ea278097d674949ffd8df69 [1,1,0,0,0,0|2,0,0]=4 7840 B11R0.40 CC(CO)CNCCCCCCl ac133c3209c76689b26c47b802c1b0e2 [1,1,0,0,0,0|2,0,0]=4 7841 B11R0.40 CC(CO)CNCCCCCF 60d920ec90de3c9d76dd389ea7711f11 [1,1,0,0,0,0|2,0,0]=4 7842 B11R0.40 CC(CO)CNCCCCCO e8485944caba9dfe6d971d086ec1cdec [1,1,0,0,0,0|2,0,0]=4 7843 B11R0.40 CC(CO)NCCCCCCCl fd5fd742f59543e6437a2c159ba5da6b [1,1,0,0,0,0|2,0,0]=4 7844 B11R0.40 CC(CO)NCCCCCCF 1b89eab1a309ec2937e680f170860591 [1,1,0,0,0,0|2,0,0]=4 7845 B11R0.40 CC(CO)NCCCCCCO c98807e9b542a87bc1ef91e8dd035645 [1,1,0,0,0,0|2,0,0]=4 7846 B11R0.40 CCC(O)CNCCCCCCl 11bc1065ed3b3cfff44cf40472693893 [1,1,0,0,0,0|2,0,0]=4 7847 B11R0.40 CCC(O)CNCCCCCF cdbdd0a857800b07ac37fd8357f00a27 [1,1,0,0,0,0|2,0,0]=4 7848 B11R0.40 CCC(O)CNCCCCCO 5f93feec4e745184fa4236389c6b9cb3 [1,1,0,0,0,0|2,0,0]=4 7849 B11R0.40 CCC(O)CNCCCCOC 748df78729d775c76f98120617d2e207 [1,1,0,0,0,0|2,0,0]=4 7850 B11R0.40 CCC(O)CNCCCCSC 3f034686241ae0a15d9fd54a35586c8c [1,1,0,0,0,0|2,0,0]=4 7851 B11R0.40 CCCCCCCCN(C)C=O 60df17e7bff532b45ddfc3473c76a602 [1,1,0,0,0,0|1,0,1]=4 7852 B11R0.40 CCCCCCCCN(C)CC 70508c4ce057b69cc70f21f7c84ad582 [1,1,0,0,0,0|2,0,0]=4 7853 B11R0.40 CCCCCCCCN(C)CF db3adf26f95450df7a62d7f7ad5e9bf6 [1,1,0,0,0,0|2,0,0]=4 7854 B11R0.40 CCCCCCCCN(C)CO fae3de65e7b8918f8c44c346d84947bf [1,1,0,0,0,0|1,0,0]=3 7855 B11R0.40 CCCCCCCNC(C)C#N cbb71b8690ac168702b326145c6c97cd [1,1,0,0,0,0|2,0,0]=4 7856 B11R0.40 CCCCCCCNC(C)C=O 6f8681ae95f1d8f2d4789cffbb74dc19 [1,1,0,0,0,0|1,0,1]=4 7857 B11R0.40 CCCCCCCNC(C)CC cbf73479e36ba1e611759b8e20718943 [1,1,0,0,0,0|2,0,0]=4 7858 B11R0.40 CCCCCCCNC(C)CO 11186d32dbdc7c7240a14960e89c6d68 [1,1,0,0,0,0|1,0,0]=3 7859 B11R0.40 CCCCCCCN[C@@H](C)CC 4d47df41fb10c25db19b8d789bb0fa39 [1,1,0,0,0,0|2,0,0]=4 7860 B11R0.40 CCCCCCCN[C@@H](C)CO 2e828866cd2ec0f76bc74f9725d50eb5 [1,1,0,0,0,0|1,0,0]=3 7861 B11R0.40 CCCCCCCN[C@H](C)C=O 3ac57272b4af2f67d6e154af9f11b2cb [1,1,0,0,0,0|1,0,1]=4 7862 B11R0.40 CCCCCCCN[C@H](C)CC 14a2672f5da39dc9903f0a993d430a49 [1,1,0,0,0,0|2,0,0]=4 7863 B11R0.40 CCCCCCCN[C@H](C)CO 2ed6ae1c070d9c3e4b9dc61528b39162 [1,1,0,0,0,0|1,0,0]=3 7864 B11R0.40 CCCCCCCOC(C)C#N 9a519bc6115f67e125da5b2c27bdae38 [1,1,0,0,0,0|2,0,0]=4 7865 B11R0.40 CCCCCCCOC(C)C=O ce702fa237a479f3af9593c724616c46 [1,1,0,0,0,0|1,0,1]=4 7866 B11R0.40 CCCCCCCOC(C)CC 6f462436b85702b86a9a4948e40c840e [1,1,0,0,0,0|2,0,0]=4 7867 B11R0.40 CCCCCCCOC(C)CF d3b29487a7d9a16b483da76cbfae9baa [1,1,0,0,0,0|2,0,0]=4 7868 B11R0.40 CCCCCCCOC(C)CS 558ca5371db98ed35d92b910f3c7ea21 [1,1,0,0,0,0|1,1,0]=4 7869 B11R0.40 CCCCCCCO[C@@H](C)CC 073eaf419c183bb22e5eb4ff3e2d3471 [1,1,0,0,0,0|2,0,0]=4 7870 B11R0.40 CCCCCCCO[C@H](C)C=O 691ec2d9703b4e379442bde1f5a65178 [1,1,0,0,0,0|1,0,1]=4 7871 B11R0.40 CCCCCCCO[C@H](C)CC 18dcc9c6d5a544923dca00cfdcd1a71c [1,1,0,0,0,0|2,0,0]=4 7872 B11R0.40 CCCCCCCO[C@H](C)CS 262f2641ff5dd449dd868e37712c3e7a [1,1,0,0,0,0|1,1,0]=4 7873 B11R0.40 CCCCCCNCC(Br)CBr 88c1cb96b11594e3ea219f79e0f7c4d6 [1,1,0,0,0,0|2,0,0]=4 7874 B11R0.40 CCCCCCNCC(C)C#N 1a1aa8151294f474ee1fe8e95c9ba7c2 [1,1,0,0,0,0|2,0,0]=4 7875 B11R0.40 CCCCCCNCC(C)CC 541b7f09f955a295f497677498488eff [1,1,0,0,0,0|2,0,0]=4 7876 B11R0.40 CCCCCCNCC(C)CO cf0dea6bd5913beddb6515e445f99f79 [1,1,0,0,0,0|1,0,0]=3 7877 B11R0.40 CCCCCCNCC(C)OC 0cff621ac604a8bce9e3d9429b7785c4 [1,1,0,0,0,0|1,0,0]=3 7878 B11R0.40 CCCCCCNCC(F)CO d6a8e8760a6d8b374a472cfd73c264c4 [1,1,0,0,0,0|2,0,0]=4 7879 B11R0.40 CCCCCCNCC(O)CC 8d7147a52bf4359b8af3bb3315b09e14 [1,1,0,0,0,0|1,0,0]=3 7880 B11R0.40 CCCCCCNCC(O)CF 60bb4cfb3a08d5895213f451640b3788 [1,1,0,0,0,0|1,0,0]=3 7881 B11R0.40 CCCCCCNCC(O)CO db7d7ddc5e0415102c6ef78dcb41df40 [1,1,0,0,0,0|1,0,0]=3 7882 B11R0.40 CCCCCCNC[C@@H](C)CC 68d4edba159cbba4ff5b87a512eb6242 [1,1,0,0,0,0|2,0,0]=4 7883 B11R0.40 CCCCCCNC[C@@H](C)CO fc1cd6b385021207c9f5ddc2eb42a052 [1,1,0,0,0,0|1,0,0]=3 7884 B11R0.40 CCCCCCNC[C@@H](C)OC 7c4b121f35ac8a52cba607f05a6e7573 [1,1,0,0,0,0|1,0,0]=3 7885 B11R0.40 CCCCCCNC[C@@H](F)CO 81010159413625c27f9dcae6cec8511d [1,1,0,0,0,0|2,0,0]=4 7886 B11R0.40 CCCCCCNC[C@@H](O)CO 4631a41a8e7b23c621f4060433d7943c [1,1,0,0,0,0|1,0,0]=3 7887 B11R0.40 CCCCCCNC[C@H](C)CC 065ef90959e43fd4f4e87f8da4861551 [1,1,0,0,0,0|2,0,0]=4 7888 B11R0.40 CCCCCCNC[C@H](C)CO 6305c36cb8a89ed146b5b0f448427b56 [1,1,0,0,0,0|1,0,0]=3 7889 B11R0.40 CCCCCCNC[C@H](C)OC bf1ce180e50f8f2b920876a6b3eeeddc [1,1,0,0,0,0|1,0,0]=3 7890 B11R0.40 CCCCCCNC[C@H](F)CO 1d1b1beea0723c5dcc24dd722009e7bb [1,1,0,0,0,0|2,0,0]=4 7891 B11R0.40 CCCCCCNC[C@H](O)CC a1477a4b6223f7e58a557f5938808421 [1,1,0,0,0,0|1,0,0]=3 7892 B11R0.40 CCCCCCNC[C@H](O)CO 9bffc38446f234d6651d93db9c62cc8a [1,1,0,0,0,0|1,0,0]=3 7893 B11R0.40 CCCCCCOCC(Br)CBr a147e78afb0511d5f06c7a08bacb05e4 [1,1,0,0,0,0|2,0,0]=4 7894 B11R0.40 CCCCCCOCC(C)C#N e7d6aa5a25a58312dc794a62c21d3ac0 [1,1,0,0,0,0|2,0,0]=4 7895 B11R0.40 CCCCCCOCC(C)CC 294c1888133227e411be7da45a70fe59 [1,1,0,0,0,0|2,0,0]=4 7896 B11R0.40 CCCCCCOCC(C)OC a0fa230585bca5f2e00c13371d45b4f7 [1,1,0,0,0,0|1,0,0]=3 7897 B11R0.40 CCCCCCOCC(Cl)CCl 078a3b7279a5872d1d7cb665b3bccb3e [1,1,0,0,0,0|2,0,0]=4 7898 B11R0.40 CCCCCCOCC(O)CO ddf18778675217e7bedbbd4889e96847 [1,1,0,0,0,0|1,0,0]=3 7899 B11R0.40 CCCCCCOCC(S)CS a7a79bb999c7964a9f8ed5e23c6c3d60 [1,1,0,0,0,0|1,1,0]=4 7900 B11R0.40 CCCCCCOC[C@@H](C)CC 7a34854015376dd35c76611247837dcd [1,1,0,0,0,0|2,0,0]=4 7901 B11R0.40 CCCCCCOC[C@@H](C)OC eea6b16218526f0f26da2e08c85b1bb6 [1,1,0,0,0,0|1,0,0]=3 7902 B11R0.40 CCCCCCOC[C@@H](O)CO 4d2a9898ffd605a1a0642c3fd8b092c2 [1,1,0,0,0,0|1,0,0]=3 7903 B11R0.40 CCCCCCOC[C@H](C)CC 53fba9bfd93796feed62ca3c5d4edcf4 [1,1,0,0,0,0|2,0,0]=4 7904 B11R0.40 CCCCCCOC[C@H](C)OC 30171bb57d76d51c5ab163cee13542db [1,1,0,0,0,0|1,0,0]=3 7905 B11R0.40 CCCCCCOC[C@H](O)CO a86fe3adbba81d9c2d7853bccbcc0904 [1,1,0,0,0,0|1,0,0]=3 7906 B11R0.40 CCCCCNCCC(C)CC 7efbe37420e7d5b3a18b7f39fe4cbeaf [1,1,0,0,0,0|2,0,0]=4 7907 B11R0.40 CCCCCNCCC(C)CO 733814c2dbc4e40dc11ccb8ff86576c0 [1,1,0,0,0,0|1,0,0]=3 7908 B11R0.40 CCCCCNCCC(O)CO bb0917424ca5e15763a892df5cc68355 [1,1,0,0,0,0|1,0,0]=3 7909 B11R0.40 CCCCCNCC[C@@H](C)CO 14e8630a92053f727b05e3015c67297a [1,1,0,0,0,0|1,0,0]=3 7910 B11R0.40 CCCCCOCCC(C)CC c10d1656defe703f434023c5a1bb92ff [1,1,0,0,0,0|2,0,0]=4 7911 B11R0.40 CCCCCOCCC(C)OC 351a585c2a253ba5482a00c521169e7f [1,1,0,0,0,0|1,0,0]=3 7912 B11R0.40 CCCCCOCCC(S)CC e331296611058aa1dca14e229a74c042 [1,1,0,0,0,0|1,1,0]=4 7913 B11R0.40 CCCCCOCC[C@@H](C)CC e0884056c20e86a80ec7410fcdbe7ca3 [1,1,0,0,0,0|2,0,0]=4 7914 B11R0.40 CCCCNCCCC(C)CO cd70668888afa3bd15a67434b1530b13 [1,1,0,0,0,0|1,0,0]=3 7915 B11R0.40 CCCCOCCCC(C)CC fdc21db0a6b52d06816d039b3c2c0598 [1,1,0,0,0,0|2,0,0]=4 7916 B11R0.40 CCCCOCCC[C@@H](C)CC 469947569426a21ca95d00148d90fdb3 [1,1,0,0,0,0|2,0,0]=4 7917 B11R0.40 CCCCOCCNC(C)CO 8e2d0d9a788d13400061cc3ce5e13118 [1,1,0,0,0,0|2,0,0]=4 7918 B11R0.40 CCCCOCCN[C@@H](C)CO 86a3cef291e451ced565cca62d840204 [1,1,0,0,0,0|2,0,0]=4 7919 B11R0.40 CCCCOCCN[C@H](C)CO 47fa842d17fc37c6508735baf912d1e8 [1,1,0,0,0,0|2,0,0]=4 7920 B11R0.40 CCCCOCNCC(C)CO 7c019f3e00433a8c311da42c8fabaf69 [1,1,0,0,0,0|2,0,0]=4 7921 B11R0.40 CCCCOCNCC(O)CC d47e03d455646f1083b1673b1b146657 [1,1,0,0,0,0|2,0,0]=4 7922 B11R0.40 CCCCOCNCC(O)CO fe8bbedd03016c71d2fc8db8f301e185 [1,1,0,0,0,0|2,0,0]=4 7923 B11R0.40 CCCCOCNC[C@@H](C)OC 9770fb15987de3cef414991e1c2e08cf [1,1,0,0,0,0|2,0,0]=4 7924 B11R0.40 CCCCOCNC[C@@H](O)CO 063a7ec36084e2a11eee52fd12f32805 [1,1,0,0,0,0|2,0,0]=4 7925 B11R0.40 CCCCOCNC[C@H](C)CO f5e73f10099fcb42208500188ca09f8d [1,1,0,0,0,0|2,0,0]=4 7926 B11R0.40 CCCCOCNC[C@H](C)OC 9d472fec0db5a1b02a8d88ef452cb31a [1,1,0,0,0,0|2,0,0]=4 7927 B11R0.40 CCCCOCNC[C@H](O)CC 4f977f028d2b7f9b83a1a2d2d521a416 [1,1,0,0,0,0|2,0,0]=4 7928 B11R0.40 CCCCOCNC[C@H](O)CO 3b4b7c49146470a05630b541c7895ad0 [1,1,0,0,0,0|2,0,0]=4 7929 B11R0.40 CCCCOCOCC(C)OC 1b74680cf356cd357991f40ca3f01d69 [1,1,0,0,0,0|2,0,0]=4 7930 B11R0.40 CCCCOCOC[C@@H](C)OC 562dfc579e25e28204272bd464194ba4 [1,1,0,0,0,0|2,0,0]=4 7931 B11R0.40 CCCCOCOC[C@H](C)OC 02baec14c6191f84fc4ac60ffc74e269 [1,1,0,0,0,0|2,0,0]=4 7932 B11R0.40 CCCOCCCCC(C)CC a4fcb600c49b60d0b6063c4ec4509954 [1,1,0,0,0,0|2,0,0]=4 7933 B11R0.40 CCCOCCCC[C@@H](C)CC 97d26e78af044b2919709b8640615273 [1,1,0,0,0,0|2,0,0]=4 7934 B11R0.40 CCCOCCCNC(C)CO be630646a5be5a1756cc3a278939f3e8 [1,1,0,0,0,0|2,0,0]=4 7935 B11R0.40 CCCOCCCN[C@@H](C)CO 236556cb43c773c721a31b350b4064aa [1,1,0,0,0,0|2,0,0]=4 7936 B11R0.40 CCCOCCCN[C@H](C)CO 15212e7c250379e2ddebd27790ee72b9 [1,1,0,0,0,0|2,0,0]=4 7937 B11R0.40 CCCOCCNCC(C)CO 1331bf4e167f71f80a1d4f6582184472 [1,1,0,0,0,0|2,0,0]=4 7938 B11R0.40 CCCOCCNCC(C)OC ecf0105134625b8f2ea76ea7f419b68c [1,1,0,0,0,0|2,0,0]=4 7939 B11R0.40 CCCOCCNCC(O)CC 61a00818aa174c679bc66a7bb44e0089 [1,1,0,0,0,0|2,0,0]=4 7940 B11R0.40 CCCOCCNCC(O)CF a036f93cbf3435eb74879f0a6e1aa55f [1,1,0,0,0,0|2,0,0]=4 7941 B11R0.40 CCCOCCNCC(O)CO a6f7d499a47b8f652da1691699fb100b [1,1,0,0,0,0|2,0,0]=4 7942 B11R0.40 CCCOCCNC[C@@H](C)CO 68a300e075b4378d24f04d61a528a50d [1,1,0,0,0,0|2,0,0]=4 7943 B11R0.40 CCCOCCNC[C@@H](C)OC f0064dc6388521931f34eceb6c4710d8 [1,1,0,0,0,0|2,0,0]=4 7944 B11R0.40 CCCOCCNC[C@@H](O)CO 2d3804ee6b64e1dddfacdaa2deb5f464 [1,1,0,0,0,0|2,0,0]=4 7945 B11R0.40 CCCOCCNC[C@H](C)CO 9d94c9187763c7f3e2a431898dd70755 [1,1,0,0,0,0|2,0,0]=4 7946 B11R0.40 CCCOCCNC[C@H](C)OC d95671594eb7c0d93eeb154577608bf4 [1,1,0,0,0,0|2,0,0]=4 7947 B11R0.40 CCCOCCNC[C@H](O)CC e266c6d612325d24a86c04a5f52164ca [1,1,0,0,0,0|2,0,0]=4 7948 B11R0.40 CCCOCCNC[C@H](O)CO 01163a0e8e8b8ac2a6fb207e49dc9184 [1,1,0,0,0,0|2,0,0]=4 7949 B11R0.40 CCCOCCOCC(C)OC e856eb3b4bf0273f02906598052dd6c4 [1,1,0,0,0,0|2,0,0]=4 7950 B11R0.40 CCCOCCOCC(O)CO 8b38c02e87c91d57befc4c5f3604ebba [1,1,0,0,0,0|2,0,0]=4 7951 B11R0.40 CCCOCCOC[C@@H](C)OC 4c1414223c9dfa6efac5f415d856ef22 [1,1,0,0,0,0|2,0,0]=4 7952 B11R0.40 CCCOCCOC[C@@H](O)CO 8200a7c01d6f5011641451eed7a60597 [1,1,0,0,0,0|2,0,0]=4 7953 B11R0.40 CCCOCCOC[C@H](C)OC 25763a249d89448844231de598a4211f [1,1,0,0,0,0|2,0,0]=4 7954 B11R0.40 CCCOCCOC[C@H](O)CO 723978e4e7cc246f370ee5df95489825 [1,1,0,0,0,0|2,0,0]=4 7955 B11R0.40 CCCSCCOCC(C)OC 21693889801ffa1ca5481fab2936fd72 [1,1,0,0,0,0|2,0,0]=4 7956 B11R0.40 CCCSCCOCC(O)CO d6a064a2a50d974e69136b1b74e37730 [1,1,0,0,0,0|2,0,0]=4 7957 B11R0.40 CCCSCCOC[C@@H](C)OC da54b9a534760bf89e82c9709c04db1a [1,1,0,0,0,0|2,0,0]=4 7958 B11R0.40 CCCSCCOC[C@@H](O)CO 4b87ffd4445493ed72033fffd64103fd [1,1,0,0,0,0|2,0,0]=4 7959 B11R0.40 CCCSCCOC[C@H](C)OC 52a47e771fc3a40af8184c5b5b53f1ba [1,1,0,0,0,0|2,0,0]=4 7960 B11R0.40 CCCSCCOC[C@H](O)CO de1173ea8f3aca318e42112ecaf2d25f [1,1,0,0,0,0|2,0,0]=4 7961 B11R0.40 CCOCCCCCC(C)CC 16c8baaa4ed54d8202ffa3a03e7be5ba [1,1,0,0,0,0|2,0,0]=4 7962 B11R0.40 CCOCCCCC[C@@H](C)CC 2926b2af0298b0f410e612451c0a6338 [1,1,0,0,0,0|2,0,0]=4 7963 B11R0.40 CCOCCCNCC(C)CO 0062dde5644eb16f1f6f9749137efe7b [1,1,0,0,0,0|2,0,0]=4 7964 B11R0.40 CCOCCCNCC(C)OC 6f8686fa6ed948173910a42fd677a1aa [1,1,0,0,0,0|2,0,0]=4 7965 B11R0.40 CCOCCCNCC(O)CC 0d4fdeb43f066fa6c273906c56caa63a [1,1,0,0,0,0|2,0,0]=4 7966 B11R0.40 CCOCCCNCC(O)CF 2e95246d46f0dbd25edb1301ffb0904f [1,1,0,0,0,0|2,0,0]=4 7967 B11R0.40 CCOCCCNCC(O)CO 18fc5708531a7645e0b91aaecc05a8ca [1,1,0,0,0,0|2,0,0]=4 7968 B11R0.40 CCOCCCNC[C@@H](C)CO 1c020e7dbe7bf58c7eb9d129162d2bb4 [1,1,0,0,0,0|2,0,0]=4 7969 B11R0.40 CCOCCCNC[C@@H](C)OC b7add0430594180e51a45891401b0bfb [1,1,0,0,0,0|2,0,0]=4 7970 B11R0.40 CCOCCCNC[C@@H](O)CO 5ced41b0430407b1262bdf6ab8e69342 [1,1,0,0,0,0|2,0,0]=4 7971 B11R0.40 CCOCCCNC[C@H](C)CO 7553407c8b0f0811f54a6b9f9a665f52 [1,1,0,0,0,0|2,0,0]=4 7972 B11R0.40 CCOCCCNC[C@H](C)OC 2350c34956bd373f9006c942095b2939 [1,1,0,0,0,0|2,0,0]=4 7973 B11R0.40 CCOCCCNC[C@H](O)CC e0823e4afb32549e4d44b1514c074964 [1,1,0,0,0,0|2,0,0]=4 7974 B11R0.40 CCOCCCNC[C@H](O)CO 3424e623892f26484ba3b4f8c109bd4c [1,1,0,0,0,0|2,0,0]=4 7975 B11R0.40 CCOCCCOCC(C)OC cc47c863669c30717aef4cde8d8e6723 [1,1,0,0,0,0|2,0,0]=4 7976 B11R0.40 CCOCCCOCC(O)CO e44b0dfb0e2293a41dc6d0b91db1e785 [1,1,0,0,0,0|2,0,0]=4 7977 B11R0.40 CCOCCCOC[C@@H](C)OC cecc1e3156333686de3bb60351eaece8 [1,1,0,0,0,0|2,0,0]=4 7978 B11R0.40 CCOCCCOC[C@@H](O)CO c22dcec846bec09fe8d6927660af123a [1,1,0,0,0,0|2,0,0]=4 7979 B11R0.40 CCOCCCOC[C@H](C)OC be7cf9b4ed04f7c9533c8ad524a6775f [1,1,0,0,0,0|2,0,0]=4 7980 B11R0.40 CCOCCCOC[C@H](O)CO 976d6a1dea38d5660499f3338d014b1d [1,1,0,0,0,0|2,0,0]=4 7981 B11R0.40 CCOCCNCCC(C)CO cfbd89b05ce854fb7f8629b64d5a3650 [1,1,0,0,0,0|2,0,0]=4 7982 B11R0.40 CCOCCNCCC(O)CO 6299896585592d39da029a9edb5f0a81 [1,1,0,0,0,0|2,0,0]=4 7983 B11R0.40 CCOCCNCC[C@@H](C)CO e74319bf28b80b5b40b644a275fc1a6a [1,1,0,0,0,0|2,0,0]=4 7984 B11R0.40 CCOCCOCCC(C)OC b932fdb784586936a8fbe9fd47e78ef5 [1,1,0,0,0,0|2,0,0]=4 7985 B11R0.40 CCOCNCCCC(C)CO 66ed2b759c829b41a7741e97dd78b05f [1,1,0,0,0,0|2,0,0]=4 7986 B11R0.40 CCSCCCCNC(C)CO 68ca1cea70ff2133ffe28952fe7d74b3 [1,1,0,0,0,0|2,0,0]=4 7987 B11R0.40 CCSCCCCN[C@@H](C)CO 1dc502ab353ce9644b593019224f7d48 [1,1,0,0,0,0|2,0,0]=4 7988 B11R0.40 CCSCCCCN[C@H](C)CO 67d6a9b51f5fcd9bd69edf25fb5d14d3 [1,1,0,0,0,0|2,0,0]=4 7989 B11R0.40 CCSCCCNCC(C)CO 9144e8101ddecec55fed915ab393883f [1,1,0,0,0,0|2,0,0]=4 7990 B11R0.40 CCSCCCNCC(O)CC 3a7a4a5a4f447ed1c502fbf56142c99b [1,1,0,0,0,0|2,0,0]=4 7991 B11R0.40 CCSCCCNCC(O)CO 678a78ae49ed92e21239d35f1c13ce4c [1,1,0,0,0,0|2,0,0]=4 7992 B11R0.40 CCSCCCNC[C@@H](C)OC 5247de6c2b8119fb820679a73cb9eaf7 [1,1,0,0,0,0|2,0,0]=4 7993 B11R0.40 CCSCCCNC[C@@H](O)CO 2bd024d9731bfb923b25bb61d6d958e8 [1,1,0,0,0,0|2,0,0]=4 7994 B11R0.40 CCSCCCNC[C@H](C)CO 7d030b38384d1d69d364edfb77f0049f [1,1,0,0,0,0|2,0,0]=4 7995 B11R0.40 CCSCCCNC[C@H](C)OC a0e8446b1a7533f84566cf0364b2891d [1,1,0,0,0,0|2,0,0]=4 7996 B11R0.40 CCSCCCNC[C@H](O)CC fcfcc29560e185a747136fe09b12ca26 [1,1,0,0,0,0|2,0,0]=4 7997 B11R0.40 CCSCCCNC[C@H](O)CO 78ccd4916ec035ef95be176895fe440a [1,1,0,0,0,0|2,0,0]=4 7998 B11R0.40 CCSCCCOCC(C)OC 8343080081451baaed94336f6d399ac3 [1,1,0,0,0,0|2,0,0]=4 7999 B11R0.40 CCSCCCOCC(O)CO 8c1d7afb90db3223e57292e24bb82366 [1,1,0,0,0,0|2,0,0]=4 8000 B11R0.40 CCSCCCOC[C@@H](C)OC e0ff951915a2f8f9a6b872f520dbd5a9 [1,1,0,0,0,0|2,0,0]=4 8001 B11R0.40 CCSCCCOC[C@@H](O)CO fae3acddbf835a7fbc788de1d1a3c29d [1,1,0,0,0,0|2,0,0]=4 8002 B11R0.40 CCSCCCOC[C@H](C)OC e262e26fe091e1e105796cec5e9e628e [1,1,0,0,0,0|2,0,0]=4 8003 B11R0.40 CCSCCCOC[C@H](O)CO 3667eec6f3e597db738daf5e9bf77747 [1,1,0,0,0,0|2,0,0]=4 8004 B11R0.40 CCSCCNCCC(C)CO 337bd45ab7ede050d7217d2a383d09d3 [1,1,0,0,0,0|2,0,0]=4 8005 B11R0.40 CCSCCNCCC(O)CO 83e96b0f5bc577c5c972921b59f65919 [1,1,0,0,0,0|2,0,0]=4 8006 B11R0.40 CCSCCNCC[C@@H](C)CO b2807eba25b3b75d81bbfed94b895efe [1,1,0,0,0,0|2,0,0]=4 8007 B11R0.40 CCSCCOCCC(C)OC 27f26d952f103ad9d8f16f8bfd45551a [1,1,0,0,0,0|2,0,0]=4 8008 B11R0.40 CC[C@@H](O)CNCCCCCF fcee643423368575fbb85bfc1e7fca87 [1,1,0,0,0,0|2,0,0]=4 8009 B11R0.40 CC[C@@H](O)CNCCCCCO 3e64048a96cd997f5cd275931a6016da [1,1,0,0,0,0|2,0,0]=4 8010 B11R0.40 CC[C@@H](O)CNCCCCOC 744825c38a252ac718aa8485dbf0d21d [1,1,0,0,0,0|2,0,0]=4 8011 B11R0.40 COC(C)CCOCCCCF 33a5f53a7362320ab237004be0b67f0b [1,1,0,0,0,0|2,0,0]=4 8012 B11R0.40 COC(C)CCOCCCSC ed524859070356d118d43ee39f080619 [1,1,0,0,0,0|2,0,0]=4 8013 B11R0.40 COC(C)CNCCCCCCl f411a304e1c79983fa7ce0b1f8ba6e1c [1,1,0,0,0,0|2,0,0]=4 8014 B11R0.40 COC(C)CNCCCCCO 4bdef23e5488bc68f9a0e0dc37fc1100 [1,1,0,0,0,0|2,0,0]=4 8015 B11R0.40 COC(C)CNCCCCSC 211cc237c0cb947b4af9784e1f2d6ee5 [1,1,0,0,0,0|2,0,0]=4 8016 B11R0.40 COC(C)COCCCCCF ab8166d5417ae1187f7c005bdf3a2ee6 [1,1,0,0,0,0|2,0,0]=4 8017 B11R0.40 COC(C)COCCCCSC 39800528b387f560ff12bfa780f0d9f6 [1,1,0,0,0,0|2,0,0]=4 8018 B11R0.40 COCCCCCNC(C)CO 92fbe2dc53e10709affc4972c5ae530d [1,1,0,0,0,0|2,0,0]=4 8019 B11R0.40 COCCCCCN[C@@H](C)CO 046fcc0af758bfa13b1c8eeba1d84ec5 [1,1,0,0,0,0|2,0,0]=4 8020 B11R0.40 COCCCCCN[C@H](C)CO 52ab710fbd30db625fc485b0c6e79080 [1,1,0,0,0,0|2,0,0]=4 8021 B11R0.40 COCCCCNCC(C)CO 70d56edb5d593893548328aab3e2ae06 [1,1,0,0,0,0|2,0,0]=4 8022 B11R0.40 COCCCCNCC(C)OC 08aba8e0906700225c566c6b5f42b23d [1,1,0,0,0,0|2,0,0]=4 8023 B11R0.40 COCCCCNCC(O)CF aa0e9c36c632db97edc9f710c73dd8f6 [1,1,0,0,0,0|2,0,0]=4 8024 B11R0.40 COCCCCNCC(O)CO ae7cace52addd86c0ce0cce97fb10aa9 [1,1,0,0,0,0|2,0,0]=4 8025 B11R0.40 COCCCCNC[C@@H](C)CO a67ba9a08b0c03b45b5cb810ae375d78 [1,1,0,0,0,0|2,0,0]=4 8026 B11R0.40 COCCCCNC[C@@H](C)OC e06ce1c3d5703f149d217ab5056088f2 [1,1,0,0,0,0|2,0,0]=4 8027 B11R0.40 COCCCCNC[C@@H](O)CO 6cd087c4ab8e925db93a280f8d09bf54 [1,1,0,0,0,0|2,0,0]=4 8028 B11R0.40 COCCCCNC[C@H](C)CO 4414af0ecfa714549a4d47a3b6d8cbe2 [1,1,0,0,0,0|2,0,0]=4 8029 B11R0.40 COCCCCNC[C@H](C)OC c3248e989a016f6c649887bc65a00a3b [1,1,0,0,0,0|2,0,0]=4 8030 B11R0.40 COCCCCNC[C@H](O)CO 804cfc43aad00aa457c51ece187f8402 [1,1,0,0,0,0|2,0,0]=4 8031 B11R0.40 COCCCCOCC(C)OC 4713834f45dbbdbac750a8eaeb2078f7 [1,1,0,0,0,0|2,0,0]=4 8032 B11R0.40 COCCCCOCC(O)CO 1c62af005f57f61d97026b4d5b3c1184 [1,1,0,0,0,0|2,0,0]=4 8033 B11R0.40 COCCCCOC[C@@H](C)OC 3a3eca3693ac6c80b5a1585c54cd0b74 [1,1,0,0,0,0|2,0,0]=4 8034 B11R0.40 COCCCCOC[C@@H](O)CO 4ea9630fd57ecfc0670f94a783a11198 [1,1,0,0,0,0|2,0,0]=4 8035 B11R0.40 COCCCCOC[C@H](C)OC 3c51881db18fd6a5babb72fbe6d45cce [1,1,0,0,0,0|2,0,0]=4 8036 B11R0.40 COCCCCOC[C@H](O)CO c6f62287b8a35ead37a0937aa61f292b [1,1,0,0,0,0|2,0,0]=4 8037 B11R0.40 COCCCNCCC(C)CO 9cd5735db3fb19158e5503dce187b7ae [1,1,0,0,0,0|2,0,0]=4 8038 B11R0.40 COCCCNCCC(O)CO ad53b0ec8b41dea900544a7bbb9c45ed [1,1,0,0,0,0|2,0,0]=4 8039 B11R0.40 COCCCNCC[C@@H](C)CO 32aa6a71ee7396b532fecfaa8075afd3 [1,1,0,0,0,0|2,0,0]=4 8040 B11R0.40 COCCCOCCC(C)OC 96393d2935aaa6cb6b7dadbec14e2261 [1,1,0,0,0,0|2,0,0]=4 8041 B11R0.40 COCCNCCCC(C)CO ef68f65716570d581af48c4139636659 [1,1,0,0,0,0|2,0,0]=4 8042 B11R0.40 CO[C@@H](C)CNCCCCCCl 2700bea3b910d5a144d1f6d411935b67 [1,1,0,0,0,0|2,0,0]=4 8043 B11R0.40 CO[C@@H](C)CNCCCCCF f88ad2f99e4c00e402c60225cdb7f8a8 [1,1,0,0,0,0|2,0,0]=4 8044 B11R0.40 CO[C@@H](C)CNCCCCCO 416a381f3d436bbdbee30d1499f6bf07 [1,1,0,0,0,0|2,0,0]=4 8045 B11R0.40 CO[C@@H](C)CNCCCCSC d0e64c3b6778f8177245076872854515 [1,1,0,0,0,0|2,0,0]=4 8046 B11R0.40 CO[C@@H](C)COCCCCCF 5cdd9c30be8a7875d3b977b83870a63a [1,1,0,0,0,0|2,0,0]=4 8047 B11R0.40 CO[C@@H](C)COCCCCSC 86faf6036722aa3b569c3a7117bb9d6b [1,1,0,0,0,0|2,0,0]=4 8048 B11R0.40 CO[C@H](C)CNCCCCCCl 1e120e7f03434d5e86531b6e70efd40c [1,1,0,0,0,0|2,0,0]=4 8049 B11R0.40 CO[C@H](C)CNCCCCCF 7fe428a08fe0a89ff170336800cad231 [1,1,0,0,0,0|2,0,0]=4 8050 B11R0.40 CO[C@H](C)CNCCCCCO 2c086b8d1f52ce0d54870c3fd951733d [1,1,0,0,0,0|2,0,0]=4 8051 B11R0.40 CO[C@H](C)CNCCCCSC e0045264f25f16c1ec9ab06f3c9b610b [1,1,0,0,0,0|2,0,0]=4 8052 B11R0.40 CO[C@H](C)COCCCCCF 96a158f2cff604ab2dc804d38b1f8975 [1,1,0,0,0,0|2,0,0]=4 8053 B11R0.40 CO[C@H](C)COCCCCSC d6c678895a87acc7d8cd2608d749296d [1,1,0,0,0,0|2,0,0]=4 8054 B11R0.40 CSCCCCNCC(C)CO 43a1d51f36903b72568949c8dbf90f30 [1,1,0,0,0,0|2,0,0]=4 8055 B11R0.40 CSCCCCNCC(O)CF cc45b142648c23c06f10dbfe1e8a05f8 [1,1,0,0,0,0|2,0,0]=4 8056 B11R0.40 CSCCCCNCC(O)CO a57132f43726b99b28b49fe34d21ecee [1,1,0,0,0,0|2,0,0]=4 8057 B11R0.40 CSCCCCNC[C@@H](C)CO 4b780fb3aa4bf6891d82e89b4e629d87 [1,1,0,0,0,0|2,0,0]=4 8058 B11R0.40 CSCCCCNC[C@@H](O)CO 7449bed27874bd6de1c2236003bd65e1 [1,1,0,0,0,0|2,0,0]=4 8059 B11R0.40 CSCCCCNC[C@H](C)CO 85387b1dd7c635e9a980be2721d3f81b [1,1,0,0,0,0|2,0,0]=4 8060 B11R0.40 CSCCCCNC[C@H](O)CO 13712ae9ddebe9975ddb8429b781402c [1,1,0,0,0,0|2,0,0]=4 8061 B11R0.40 CSCCCCOCC(O)CO 34bd420c5bc0d489d2cf30303f85b3eb [1,1,0,0,0,0|2,0,0]=4 8062 B11R0.40 CSCCCCOC[C@@H](O)CO b2301cacc1abe97dd088a5f05ee80dff [1,1,0,0,0,0|2,0,0]=4 8063 B11R0.40 CSCCCCOC[C@H](O)CO c15ab2b8b07443d56e64591263ab4796 [1,1,0,0,0,0|2,0,0]=4 8064 B11R0.40 CSCCCNCCC(C)CO 82891918a82d0981840c41f65ea9ec2f [1,1,0,0,0,0|2,0,0]=4 8065 B11R0.40 CSCCCNCCC(O)CO 52cfa988972a0ab899a02b2b70f4ef65 [1,1,0,0,0,0|2,0,0]=4 8066 B11R0.40 CSCCCNCC[C@@H](C)CO a3bc3f46c28af8f959391e8c0f2f6082 [1,1,0,0,0,0|2,0,0]=4 8067 B11R0.40 CSCCNCCCC(C)CO e55ed44c5172ad015e2c2969f1fc65ba [1,1,0,0,0,0|2,0,0]=4 8068 B11R0.40 C[C@@H](CO)CCNCCCCF 89ca943df252eaca218a79b8491aede6 [1,1,0,0,0,0|2,0,0]=4 8069 B11R0.40 C[C@@H](CO)CCNCCCCO e5647a2aaf234b5e81afaa6aca903d94 [1,1,0,0,0,0|2,0,0]=4 8070 B11R0.40 C[C@@H](CO)CNCCCCCCl f8bbc3ea6bc701f054cb676a7248be0c [1,1,0,0,0,0|2,0,0]=4 8071 B11R0.40 C[C@@H](CO)CNCCCCCO aa195c64531ce5ffda9846d76c791a2e [1,1,0,0,0,0|2,0,0]=4 8072 B11R0.40 C[C@@H](CO)NCCCCCCCl 768a86b856c70db871d4cadf7a404821 [1,1,0,0,0,0|2,0,0]=4 8073 B11R0.40 C[C@@H](CO)NCCCCCCF 87019b2c37349c3eed4e131a80117fec [1,1,0,0,0,0|2,0,0]=4 8074 B11R0.40 C[C@@H](CO)NCCCCCCO 147d4d984dd02077af757124e7fa1ffe [1,1,0,0,0,0|2,0,0]=4 8075 B11R0.40 C[C@H](CO)CNCCCCCCl 411569a2766bdc09a1a694b0f7209a4d [1,1,0,0,0,0|2,0,0]=4 8076 B11R0.40 C[C@H](CO)CNCCCCCF 156c1deb655abc61828470bb0bee609f [1,1,0,0,0,0|2,0,0]=4 8077 B11R0.40 C[C@H](CO)CNCCCCCO e1dd1f6ce8c90878f88e49c0edfa5765 [1,1,0,0,0,0|2,0,0]=4 8078 B11R0.40 C[C@H](CO)NCCCCCCCl af1b56e51b952277333d4a6e426a3f4c [1,1,0,0,0,0|2,0,0]=4 8079 B11R0.40 C[C@H](CO)NCCCCCCF c6664d6e6054af36d33913b92a13645e [1,1,0,0,0,0|2,0,0]=4 8080 B11R0.40 C[C@H](CO)NCCCCCCO e2fe1e6e24fab5ab9aa14591dae14d3d [1,1,0,0,0,0|2,0,0]=4 8081 B11R0.40 OC(CF)CNCCCCCCl 1317d28d8bcfbeedfa2466c266587e08 [1,1,0,0,0,0|2,0,0]=4 8082 B11R0.40 OCC(O)CCNCCCCF 03fc2d660984f947118134e471e8d74d [1,1,0,0,0,0|2,0,0]=4 8083 B11R0.40 OCC(O)CNCCCCCCl d37867de457b23d06ede921b34a66b78 [1,1,0,0,0,0|2,0,0]=4 8084 B11R0.40 OCC(O)CNCCCCCF 63b51605ba8b821f50c3dc7251d6cfad [1,1,0,0,0,0|2,0,0]=4 8085 B11R0.40 OCCCCCNCC(O)CF f1659790eb36614ad43418628d7cb778 [1,1,0,0,0,0|2,0,0]=4 8086 B11R0.40 OCCCCCNCC(O)CO c50366106ccba004b50c9b57e2e7609c [1,1,0,0,0,0|2,0,0]=4 8087 B11R0.40 OCCCCCNC[C@@H](O)CO 01b0c5bae8d8b69d573a024d7b0fc1f7 [1,1,0,0,0,0|2,0,0]=4 8088 B11R0.40 OCCCCCNC[C@H](O)CO c0ccd98caf268ee485a631a14a7678a0 [1,1,0,0,0,0|2,0,0]=4 8089 B11R0.40 OCCCCNCCC(O)CO b69ee34c8b3a23b0c744d08a66b1572f [1,1,0,0,0,0|2,0,0]=4 8090 B11R0.40 OC[C@@H](O)CNCCCCCCl d88b2858a8cc28ff5af1c5ae7b70d260 [1,1,0,0,0,0|2,0,0]=4 8091 B11R0.40 OC[C@@H](O)CNCCCCCF 69352bd78f5e21e04697a670a895ea3e [1,1,0,0,0,0|2,0,0]=4 8092 B11R0.40 OC[C@H](O)CNCCCCCCl a276d43a4482803a1bfe55af9cb13120 [1,1,0,0,0,0|2,0,0]=4 8093 B11R0.40 OC[C@H](O)CNCCCCCF ae6b59b901a03b2389f2deeb06163507 [1,1,0,0,0,0|2,0,0]=4 8094 B11R0.42 CC(O)C(C)NCCCCCF d776853e38731a9c5f600f2e110a509f [1,1,0,0,0,0|2,0,0]=4 8095 B11R0.42 CC(O)C(C)NCCCCCO dc0ce96bf2f23a174134b5cb5901c65e [1,1,0,0,0,0|2,0,0]=4 8096 B11R0.42 CCCCCCCN(C)C(C)C 7cf81a953655f19776432c0c886e1725 [1,1,0,0,0,0|2,0,0]=4 8097 B11R0.42 CCCCCCNC(=O)C(C)O c9999e663477499f337d15f0fc5dc538 [1,1,0,0,0,0|1,0,1]=4 8098 B11R0.42 CCCCCCNC(=O)[C@@H](C)O ba2fa53987cf1c1dd463ca418a499b6b [1,1,0,0,0,0|1,0,1]=4 8099 B11R0.42 CCCCCCNC(=O)[C@H](C)O 74171bc3104db1cb9ab901270291150d [1,1,0,0,0,0|1,0,1]=4 8100 B11R0.42 CCCCCCNC(C)C(C)C 7d8337e75f3b96f5805cb77a0e1a0981 [1,1,0,0,0,0|2,0,0]=4 8101 B11R0.42 CCCCCCNC(C)C(C)O bd39996b4afe02000d135ea953aea6b6 [1,1,0,0,0,0|1,0,0]=3 8102 B11R0.42 CCCCCCN[C@@H](C)C(C)C 2eb57c4ee7f455076bc500bd38921b78 [1,1,0,0,0,0|2,0,0]=4 8103 B11R0.42 CCCCCCN[C@H](C)C(C)C f9e3306fcfc709f467f3c01f86982871 [1,1,0,0,0,0|2,0,0]=4 8104 B11R0.42 CCCCCCOC(C)C(C)C 92ec7e7fc91a2aa88641a4b033150788 [1,1,0,0,0,0|2,0,0]=4 8105 B11R0.42 CCCCCCOC(C)C(C)S 9fd7043a2cd562637f692c6e1d62b834 [1,1,0,0,0,0|1,1,0]=4 8106 B11R0.42 CCCCCCO[C@@H](C)C(C)C d8f77a28ab08c1a1ad4b14e03e7b662b [1,1,0,0,0,0|2,0,0]=4 8107 B11R0.42 CCCCCCO[C@H](C)C(C)C 96e84e2df9733338cf9779f6e523a33b [1,1,0,0,0,0|2,0,0]=4 8108 B11R0.42 CCCCCNCC(C)C(C)C ed8a8ec5bd50acd60cad1fcdafa6faf8 [1,1,0,0,0,0|2,0,0]=4 8109 B11R0.42 CCCCCNCC(O)C(C)C d8a8c846e340a4191dbc1687c8842b23 [1,1,0,0,0,0|2,0,0]=4 8110 B11R0.42 CCCCCOCC(C)C(C)C 956b3af97342df30d4c0991b5dd5ee6d [1,1,0,0,0,0|2,0,0]=4 8111 B11R0.42 CCCCOCCC(C)C(C)C 4ad421531eedcf708a48079417cbe6d2 [1,1,0,0,0,0|2,0,0]=4 8112 B11R0.42 CCCCOCNC(C)C(C)O 549b9d2d3d671f1e536f5f7e4048d878 [1,1,0,0,0,0|2,0,0]=4 8113 B11R0.42 CCCOCCNC(C)C(C)O a791bbfa123235698d4dd4d915ec459d [1,1,0,0,0,0|2,0,0]=4 8114 B11R0.42 CCOCCCNC(C)C(C)O f75d08047669dd28a39d183e5f699b31 [1,1,0,0,0,0|2,0,0]=4 8115 B11R0.42 CCSCCCNC(C)C(C)O c1c734069e59da3bfcda5eb5545e23ff [1,1,0,0,0,0|2,0,0]=4 8116 B11R0.42 COCCCCNC(C)C(C)O aed4cbe1bfd0937d0d11f58296b3c9aa [1,1,0,0,0,0|2,0,0]=4 8117 B11R0.46 CC(CCCCO)NC[C@@H](C)O 6ca4b909971d69c61de5b9a972a36fd0 [1,1,0,0,0,0|2,0,0]=4 8118 B11R0.46 CC(CCCCO)NC[C@H](C)O c448504ee2e3c344ea27d6362720f7f5 [1,1,0,0,0,0|2,0,0]=4 8119 B11R0.46 CC(O)CCN(C)CCCCF 7968bab90b894535bb2dbbb91f3d93d4 [1,1,0,0,0,0|2,0,0]=4 8120 B11R0.46 CC(O)CCN(C)CCCCO 125106fa20763a2de23c023218ae6db0 [1,1,0,0,0,0|2,0,0]=4 8121 B11R0.46 CC(O)CNC(C)CCCCO 24484be42b488732bfcb431823b480e1 [1,1,0,0,0,0|2,0,0]=4 8122 B11R0.46 CCCCCC(=O)NCC(C)O 05f56c5405c5e4ab6efccb9ccc3eb9e2 [1,1,0,0,0,0|1,0,1]=4 8123 B11R0.46 CCCCCC(=O)NC[C@@H](C)O 9ce11b18501ba715b77c5295184f797d [1,1,0,0,0,0|1,0,1]=4 8124 B11R0.46 CCCCCC(=O)NC[C@H](C)O 854c0186202639065caeea0f38f58624 [1,1,0,0,0,0|1,0,1]=4 8125 B11R0.46 CCCCCC(C)COC(C)C 9053163623355221c96e2809e8285f56 [1,1,0,0,0,0|2,0,0]=4 8126 B11R0.46 CCCCCC(C)NCC(C)C 39ccf3ed15ce629e5f9edd219d15f9f7 [1,1,0,0,0,0|2,0,0]=4 8127 B11R0.46 CCCCCC(C)NCC(C)O 8d096a163ae65b6b7900d3db60d0a95c [1,1,0,0,0,0|1,0,0]=3 8128 B11R0.46 CCCCCC(C)NC[C@@H](C)O 3522d654fea5db0a10b9d40e98d9e7ef [1,1,0,0,0,0|1,0,0]=3 8129 B11R0.46 CCCCCC(C)NC[C@H](C)O 2a4ea60fb83a2255736c97ce0a177f85 [1,1,0,0,0,0|1,0,0]=3 8130 B11R0.46 CCCCCC(C)OCC(C)C 1d18fd286cde1ceaeaa8b0abf6a93410 [1,1,0,0,0,0|2,0,0]=4 8131 B11R0.46 CCCCCC(C)OCC(C)F 8e4f0bba36166b28688d9ed0310e8237 [1,1,0,0,0,0|2,0,0]=4 8132 B11R0.46 CCCCCC(C)OCC(C)S 09c8175e61cc24152d0c3cacef3120a6 [1,1,0,0,0,0|1,1,0]=4 8133 B11R0.46 CCCCCC(C)OC[C@@H](C)F 52bc747c961c111a8b658aa38da25dc3 [1,1,0,0,0,0|2,0,0]=4 8134 B11R0.46 CCCCCC(C)OC[C@H](C)F cc2b0e6b214b7940ac9afb7b6d619398 [1,1,0,0,0,0|2,0,0]=4 8135 B11R0.46 CCCCCN(C)CCC(C)C 622a55653917583f2dcad08a870ed313 [1,1,0,0,0,0|2,0,0]=4 8136 B11R0.46 CCCCCN(C)CCC(C)O 6b55c33b8a4ddc6cc04a532cd3352f43 [1,1,0,0,0,0|1,0,0]=3 8137 B11R0.46 CCCCC[C@@H](C)OCC(C)C b96910c6949611e186b23b21e754dd80 [1,1,0,0,0,0|2,0,0]=4 8138 B11R0.46 CCCCC[C@H](C)NCC(C)C 82aac0d70d5025e82eced4e5c31da05a [1,1,0,0,0,0|2,0,0]=4 8139 B11R0.46 CCCCC[C@H](C)NCC(C)O ddf4a414a4658112aea39bd574feab88 [1,1,0,0,0,0|1,0,0]=3 8140 B11R0.46 CCCCC[C@H](C)NC[C@@H](C)O 7ac1ea2e7586982ed81575c7feb010c3 [1,1,0,0,0,0|1,0,0]=3 8141 B11R0.46 CCCCC[C@H](C)NC[C@H](C)O 16d154322fca42dff42bdb0ca7037b2d [1,1,0,0,0,0|1,0,0]=3 8142 B11R0.46 CCCCC[C@H](C)OCC(C)C 4a8ab729ca6c2eab405250dc8bc0b6c5 [1,1,0,0,0,0|2,0,0]=4 8143 B11R0.46 CCCCC[C@H](C)OCC(C)F e557ed96f2a7ca1d6757ffd266816de6 [1,1,0,0,0,0|2,0,0]=4 8144 B11R0.46 CCCCC[C@H](C)OCC(C)S fb1e7157fbb13db10a4eb85263e767fd [1,1,0,0,0,0|1,1,0]=4 8145 B11R0.46 CCCCC[C@H](C)OC[C@@H](C)F 75bebde410ac47ed34e3085c45665a06 [1,1,0,0,0,0|2,0,0]=4 8146 B11R0.46 CCCCC[C@H](C)OC[C@H](C)F 3d7dd8af7cac16578eaa95b5b4c1760d [1,1,0,0,0,0|2,0,0]=4 8147 B11R0.46 CCCCNC(=O)CCC(C)O 5b7a8f50327128a00920c1a1da593825 [1,1,0,0,0,0|1,0,1]=4 8148 B11R0.46 CCCCNC(C)CCC(C)C b7ba04217753f52812477c03d12a7295 [1,1,0,0,0,0|2,0,0]=4 8149 B11R0.46 CCCCOC(C)CCC(C)C d8318de7d22e40e8d232b26061ce0159 [1,1,0,0,0,0|2,0,0]=4 8150 B11R0.46 CCCNCC(C)CCC(C)C da70062cca3cadb06fc010503e98e93a [1,1,0,0,0,0|2,0,0]=4 8151 B11R0.46 CCCOCC(C)CCC(C)C e855aec7c315ec61ff8d51d68d0a57ed [1,1,0,0,0,0|2,0,0]=4 8152 B11R0.46 CCOCCN(C)CCC(C)O 9f47cea6dfc8af549b2550a4c4f24c56 [1,1,0,0,0,0|2,0,0]=4 8153 B11R0.46 CCSCCN(C)CCC(C)O f97329f38775bf6d5773f0a5dbad3d15 [1,1,0,0,0,0|2,0,0]=4 8154 B11R0.46 COCCCN(C)CCC(C)O 7e83c968199fc6be019731136a39ef63 [1,1,0,0,0,0|2,0,0]=4 8155 B11R0.46 CSCCCN(C)CCC(C)O d21f01f135a6443675c556f2141835e6 [1,1,0,0,0,0|2,0,0]=4 8156 B11R0.111 CC(CO)CCCNC[C@@H](C)O d2202c6c2dc8a8e216d429eea8de0024 [1,1,0,0,0,0|2,0,0]=4 8157 B11R0.111 CC(CO)CCCNC[C@H](C)O ac9a52e86afebcc503dd04648d949702 [1,1,0,0,0,0|2,0,0]=4 8158 B11R0.111 CC(CO)CCNCC[C@@H](C)O 10f55a067e242a510e5ded9ccd461b3e [1,1,0,0,0,0|2,0,0]=4 8159 B11R0.111 CC(CO)CCNCC[C@H](C)O c7cf954aac90ff1b4f42fd45f9a7b44e [1,1,0,0,0,0|2,0,0]=4 8160 B11R0.111 CC(CO)NCCCC[C@@H](C)O e620545972aba803efec9a1bcd0cb796 [1,1,0,0,0,0|2,0,0]=4 8161 B11R0.111 CC(O)CCCCNC(C)CO 57bb83d1426df0f4e915c39501780ed4 [1,1,0,0,0,0|2,0,0]=4 8162 B11R0.111 CC(O)CCCCN[C@@H](C)CO 936ae457db84873f6b08e710666e2ed3 [1,1,0,0,0,0|2,0,0]=4 8163 B11R0.111 CC(O)CCCCN[C@H](C)CO ca6428380f215616a9c36b77b36454b6 [1,1,0,0,0,0|2,0,0]=4 8164 B11R0.111 CC(O)CCCNCC(Br)CBr 1cbaded7b0aefdd3c1668a9b57ad202c [1,1,0,0,0,0|2,0,0]=4 8165 B11R0.111 CC(O)CCCNCC(C)CO ad03964c3f2a6d1a034d14985d3d9d82 [1,1,0,0,0,0|2,0,0]=4 8166 B11R0.111 CC(O)CCCNCC(F)CO 2baf6da931dff882ba8c9e2a853a78b1 [1,1,0,0,0,0|2,0,0]=4 8167 B11R0.111 CC(O)CCCNCC(O)CO fc997e6176d1d03b67cfe5f1b0ea635a [1,1,0,0,0,0|2,0,0]=4 8168 B11R0.111 CC(O)CCCNC[C@@H](F)CO 1dd844bca550a7160be8a9ea10106d6c [1,1,0,0,0,0|2,0,0]=4 8169 B11R0.111 CC(O)CCCNC[C@@H](O)CO 8d8f0086283ab34e8a6b3fa67d5d1573 [1,1,0,0,0,0|2,0,0]=4 8170 B11R0.111 CC(O)CCCNC[C@H](C)CO c3b7eec74ac99846618f70a23f66d0fc [1,1,0,0,0,0|2,0,0]=4 8171 B11R0.111 CC(O)CCCNC[C@H](F)CO 62c857962a4e69217c6c0afea6ea8ff5 [1,1,0,0,0,0|2,0,0]=4 8172 B11R0.111 CC(O)CCCNC[C@H](O)CO 0dd5f4c1dacacd693290bec607d776ab [1,1,0,0,0,0|2,0,0]=4 8173 B11R0.111 CC(O)CCNCCC(C)CO 01d411871876b4c85dabc455f0daf160 [1,1,0,0,0,0|2,0,0]=4 8174 B11R0.111 CC(O)CCNCCC(O)CO 697c166f0b8c45814f1034592c09c1ef [1,1,0,0,0,0|2,0,0]=4 8175 B11R0.111 CC(O)CCNCC[C@@H](C)CO 005425b9f25233701fefed6e6205e5fb [1,1,0,0,0,0|2,0,0]=4 8176 B11R0.111 CC(O)CNCCCC(C)CO 1fa28b1f9fdaf56b373b705e3f5e4e6e [1,1,0,0,0,0|2,0,0]=4 8177 B11R0.111 CCC(C)CCCCOC(C)C cd73cace08beb22749fb56dc12082300 [1,1,0,0,0,0|2,0,0]=4 8178 B11R0.111 CCC(C)CCCOCC(C)C 7d5c7ad3322a9df400d87e2016d7d747 [1,1,0,0,0,0|2,0,0]=4 8179 B11R0.111 CCC(C)CCNCCC(C)C 1af4a68b77c810f5ad73d410a0ce4504 [1,1,0,0,0,0|2,0,0]=4 8180 B11R0.111 CCC(C)CCNCCC(C)O 28fe7c835603a5542b8975efc21f86a2 [1,1,0,0,0,0|1,0,0]=3 8181 B11R0.111 CCC(C)CCNCC[C@@H](C)O 0ffaf6a609db917ef82527f9faf9ee72 [1,1,0,0,0,0|1,0,0]=3 8182 B11R0.111 CCC(C)CCNCC[C@H](C)O bbca6c784494d36de883d3783bf78337 [1,1,0,0,0,0|1,0,0]=3 8183 B11R0.111 CCC(C)CCOCCC(C)C c61fd7b9798138c81d47ca1788b33ad2 [1,1,0,0,0,0|2,0,0]=4 8184 B11R0.111 CCC(C)CNCCCC(C)C 3ee58f527413b23d592872d0e61ffc87 [1,1,0,0,0,0|2,0,0]=4 8185 B11R0.111 CCC(C)CNCCCC(C)O d456cc88b7259e9ad2114e5b960584ea [1,1,0,0,0,0|1,0,0]=3 8186 B11R0.111 CCC(C)COCCCC(C)C ead2b6b5ad49e559f459bed8912d32a8 [1,1,0,0,0,0|2,0,0]=4 8187 B11R0.111 CCC(C)NCCCCC(C)C 8c4f55124120e8227e5b2ff6c8b21d8e [1,1,0,0,0,0|2,0,0]=4 8188 B11R0.111 CCC(C)NCCCCC(C)O 4504267d08c37823a7ae522e87aeffd5 [1,1,0,0,0,0|1,0,0]=3 8189 B11R0.111 CCC(C)NCCCC[C@@H](C)O 9dffe1a8e446579ef38f473cac8ae266 [1,1,0,0,0,0|1,0,0]=3 8190 B11R0.111 CCC(C)OCCCCC(C)C 52f8c3ca3124c279572ea02044d2a846 [1,1,0,0,0,0|2,0,0]=4 8191 B11R0.111 CCC(O)CNCCCC(C)C a4d3d1fb1838cf33b75ab63b48615bc2 [1,1,0,0,0,0|2,0,0]=4 8192 B11R0.111 CCC(O)CNCCCC(C)O 429c49dca27f44febb276988f6f1ff8d [1,1,0,0,0,0|1,0,0]=3 8193 B11R0.111 CCC(S)CCOCCC(C)C e9d85eff7075d988c2d963ae17221321 [1,1,0,0,0,0|2,0,0]=4 8194 B11R0.111 CCN(C)CCCCCC(C)C 44ddd3a7f7f6e99b7ad01f5b88398b0d [1,1,0,0,0,0|2,0,0]=4 8195 B11R0.111 CCN(C)CCCNCC(C)O a1a960d998ce4256b86bdaf8f976bce7 [1,1,0,0,0,0|2,0,0]=4 8196 B11R0.111 CCN(C)CCCNC[C@@H](C)O fc8de4f727fa6291a758e4bf9483cb03 [1,1,0,0,0,0|2,0,0]=4 8197 B11R0.111 CCN(C)CCCNC[C@H](C)O cad13640ee0efa84f19b4a20621ea456 [1,1,0,0,0,0|2,0,0]=4 8198 B11R0.111 CCS(=O)CCNCCC(C)O 9de3cb8efc83fb61d2854c3e5adf8a22 [1,1,0,0,0,0|2,0,0]=4 8199 B11R0.111 CCS(=O)CCNCC[C@@H](C)O 51c598ee09ae463b7975b14594b2528a [1,1,0,0,0,0|2,0,0]=4 8200 B11R0.111 CCS(=O)CCNCC[C@H](C)O dfd2089fdc4868e03a42622f40b50f63 [1,1,0,0,0,0|2,0,0]=4 8201 B11R0.111 CC[C@@H](C)CNCCCC(C)C 7742e1e4fc1291248e13b62c993e4927 [1,1,0,0,0,0|2,0,0]=4 8202 B11R0.111 CC[C@@H](C)COCCCC(C)C 8194cf6375506315021b9f242827118b [1,1,0,0,0,0|2,0,0]=4 8203 B11R0.111 CC[C@@H](C)NCCCCC(C)C c2543d0388a130cd20d65a57dcb2ef51 [1,1,0,0,0,0|2,0,0]=4 8204 B11R0.111 CC[C@@H](C)NCCCCC(C)O 53644b3fd2cc6318ae659bc854603986 [1,1,0,0,0,0|1,0,0]=3 8205 B11R0.111 CC[C@@H](C)NCCCC[C@@H](C)O d57754c5f40699af431389b8b4f2c0c5 [1,1,0,0,0,0|1,0,0]=3 8206 B11R0.111 CC[C@@H](C)OCCCCC(C)C 5a656c249e49f619bfc1c777fb0dcf69 [1,1,0,0,0,0|2,0,0]=4 8207 B11R0.111 CC[C@@H](O)CNCCCC(C)C 004198814d7b05d3f2fd3f0e4525107d [1,1,0,0,0,0|2,0,0]=4 8208 B11R0.111 CC[C@@H](O)CNCCCC(C)O e167fd8c4edcdbe0219a8a0720733332 [1,1,0,0,0,0|1,0,0]=3 8209 B11R0.111 CC[C@H](C)CCCCOC(C)C 3937ce3c701b9aca634f685aff16d665 [1,1,0,0,0,0|2,0,0]=4 8210 B11R0.111 CC[C@H](C)CCCOCC(C)C f5b7b968293e2144484cc0bed0d1636b [1,1,0,0,0,0|2,0,0]=4 8211 B11R0.111 CC[C@H](C)CCOCCC(C)C 3d2890dfb5fc6b5240d11cb65efa55a2 [1,1,0,0,0,0|2,0,0]=4 8212 B11R0.111 CC[C@H](C)CNCCCC(C)C 74ae295ec501acc0766844f3c4d98b0d [1,1,0,0,0,0|2,0,0]=4 8213 B11R0.111 CC[C@H](C)CNCCCC(C)O 9f14a9c6b95940309c486882010a5bcd [1,1,0,0,0,0|1,0,0]=3 8214 B11R0.111 CC[C@H](C)COCCCC(C)C 25ccdfc6d08a91a86af000740b58e024 [1,1,0,0,0,0|2,0,0]=4 8215 B11R0.111 CC[C@H](C)NCCCCC(C)C 60833cde6160eb0ca3aca0f6085646a0 [1,1,0,0,0,0|2,0,0]=4 8216 B11R0.111 CC[C@H](C)NCCCCC(C)O 5f5fcaac05780c67c10df853b13d194b [1,1,0,0,0,0|1,0,0]=3 8217 B11R0.111 CC[C@H](C)NCCCC[C@@H](C)O 23f573b65ffc96f7499bd11a86593951 [1,1,0,0,0,0|1,0,0]=3 8218 B11R0.111 CC[C@H](C)OCCCCC(C)C 6a2252cb80607d9f5161cd6510d28388 [1,1,0,0,0,0|2,0,0]=4 8219 B11R0.111 CO[C@@H](C)CNCCCC(C)O 2b182b2882209db70396ed65825394b0 [1,1,0,0,0,0|2,0,0]=4 8220 B11R0.111 CO[C@H](C)CNCCCC(C)O 9cb5a2596abed972cdb08740427b8e81 [1,1,0,0,0,0|2,0,0]=4 8221 B11R0.111 C[C@@H](O)CCCCN[C@@H](C)CO ea8f330a6fcbd88084a987fd1094f4ff [1,1,0,0,0,0|2,0,0]=4 8222 B11R0.111 C[C@H](CO)NCCCC[C@@H](C)O 0f3681f9ef23726a91aef2e4bc53b74b [1,1,0,0,0,0|2,0,0]=4 8223 B11R0.147 CC(CCCO)NCC[C@@H](C)O abdaae1a8342d5f99b92349e8b52a660 [1,1,0,0,0,0|2,0,0]=4 8224 B11R0.147 CC(CCCO)NCC[C@H](C)O 45be1573b2f607e96be74bd014b002ce [1,1,0,0,0,0|2,0,0]=4 8225 B11R0.147 CC(O)CCCN(C)CCCO 91d718c9ce103009d0db9d2d290cace1 [1,1,0,0,0,0|2,0,0]=4 8226 B11R0.147 CC(O)CCNC(C)CCCO 97628d1fb64d02ce5704086510cbd843 [1,1,0,0,0,0|2,0,0]=4 8227 B11R0.147 CC(O)CCN[C@H](C)CCCO 6ad5d7496c6a429888eca66d268d1378 [1,1,0,0,0,0|2,0,0]=4 8228 B11R0.147 CC(O)CNC[C@H](C)CCCO 47817f510617a1192d78762fb28c1b5b [1,1,0,0,0,0|2,0,0]=4 8229 B11R0.147 CCCCC(=O)NCCC(C)O 7aaca4f02466a48e7b0e77dd77bcf92e [1,1,0,0,0,0|1,0,1]=4 8230 B11R0.147 CCCCC(=O)NCC[C@@H](C)O 51765c4fe546002974c228bb17f8fe5f [1,1,0,0,0,0|1,0,1]=4 8231 B11R0.147 CCCCC(=O)NCC[C@H](C)O 7915b6c716e2dba7440a7863ffd54996 [1,1,0,0,0,0|1,0,1]=4 8232 B11R0.147 CCCCC(C)CCOC(C)C 480e75a996c87c16368aac9d429af336 [1,1,0,0,0,0|2,0,0]=4 8233 B11R0.147 CCCCC(C)COCC(C)C 20faf149a134c42b293abe464cb70dd6 [1,1,0,0,0,0|2,0,0]=4 8234 B11R0.147 CCCCC(C)NCCC(C)C 553f480f7211b9851c219b9bd5554852 [1,1,0,0,0,0|2,0,0]=4 8235 B11R0.147 CCCCC(C)NCCC(C)O 5228767d4eae014027fcab6cbf47345b [1,1,0,0,0,0|1,0,0]=3 8236 B11R0.147 CCCCC(C)NCC[C@@H](C)O 92392685f0b98d3de410a27475b9862c [1,1,0,0,0,0|1,0,0]=3 8237 B11R0.147 CCCCC(C)NCC[C@H](C)O a65475a40409c36c47f9e4d0358a16f7 [1,1,0,0,0,0|1,0,0]=3 8238 B11R0.147 CCCCC(C)OCCC(C)C 232938eef9823a6670830c64bdfa9437 [1,1,0,0,0,0|2,0,0]=4 8239 B11R0.147 CCCCC(O)CNCC(C)C f8c552b341d3c6d0814ce11ede0c437c [1,1,0,0,0,0|2,0,0]=4 8240 B11R0.147 CCCCC(O)CNCC(C)O a3d66189769c24571be83277b3791ff4 [1,1,0,0,0,0|1,0,0]=3 8241 B11R0.147 CCCCC(O)CNC[C@@H](C)O e526b2974f0fc2e9d7a8548bbfe380ee [1,1,0,0,0,0|1,0,0]=3 8242 B11R0.147 CCCCC(O)CNC[C@H](C)O ffae387dc27e3628bdcda8b9e8d3f55e [1,1,0,0,0,0|1,0,0]=3 8243 B11R0.147 CCCCN(C)CCCC(C)C 63408163e7ea1897f163ad5c4903bcc8 [1,1,0,0,0,0|2,0,0]=4 8244 B11R0.147 CCCCN(C)CCCC(C)O 8828aaf31a48439873b0a5abdd1f9a16 [1,1,0,0,0,0|1,0,0]=3 8245 B11R0.147 CCCC[C@@H](C)NCCC(C)C 36d1207dc6a3c88d6f784cdddc1bb741 [1,1,0,0,0,0|2,0,0]=4 8246 B11R0.147 CCCC[C@@H](C)NCCC(C)O ae2f72547e0b03abd5bd9d3d09840961 [1,1,0,0,0,0|1,0,0]=3 8247 B11R0.147 CCCC[C@@H](C)OCCC(C)C 4e58f774b5c466c6d629d5b3ea57a940 [1,1,0,0,0,0|2,0,0]=4 8248 B11R0.147 CCCC[C@H](C)OCCC(C)C c3a7296c30ca74d65380df99877139c4 [1,1,0,0,0,0|2,0,0]=4 8249 B11R0.147 CCCNC(C)CCCC(C)C c3b9f8f3aaf123242312bc99ee26f3b5 [1,1,0,0,0,0|2,0,0]=4 8250 B11R0.147 CCCOC(C)CCCC(C)C 27e0039638de50cc4c3f9d16889c3880 [1,1,0,0,0,0|2,0,0]=4 8251 B11R0.147 CCOCC(O)CNCC(C)O 303a892e713b542052221ea4b310e929 [1,1,0,0,0,0|2,0,0]=4 8252 B11R0.147 CCOCC(O)CNC[C@@H](C)O f1766d94f7adbd31caedf89d0b8e85f2 [1,1,0,0,0,0|2,0,0]=4 8253 B11R0.147 CCOCC(O)CNC[C@H](C)O 63d8620f91ccd047072bcf63f91f9e5d [1,1,0,0,0,0|2,0,0]=4 8254 B11R0.147 COCCN(C)CCCC(C)O b119ce416122f0c1057c7b743974e6da [1,1,0,0,0,0|2,0,0]=4 8255 B11R0.147 CSCCN(C)CCCC(C)O 76e9f1347d672fa72528627d7e5aa2b2 [1,1,0,0,0,0|2,0,0]=4 8256 B11R0.147 C[C@H](CCCO)CNC[C@@H](C)O 051c2e9a79d38003b5aec561a14bd92a [1,1,0,0,0,0|2,0,0]=4 8257 B11R0.147 C[C@H](CCCO)CNC[C@H](C)O 4aac0e753013c3df3c2463fe29b37797 [1,1,0,0,0,0|2,0,0]=4 8258 B11R0.159 CC(C)(O)CCCNCCCCl 2b62b7ea23a9c37c9914e0749b1084f2 [1,1,0,0,0,0|2,0,0]=4 8259 B11R0.159 CC(C)(O)CCCNCCCF c2632b15d2a408195b948bccc4622774 [1,1,0,0,0,0|2,0,0]=4 8260 B11R0.159 CC(C)(O)CCCNCCCO 1a8a4d88e633865ef99dcba74335afc3 [1,1,0,0,0,0|2,0,0]=4 8261 B11R0.159 CC(C)(O)CCCNCCCS 0af541bb3f9b14d6d1676dfd266a8034 [1,1,0,0,0,0|2,0,0]=4 8262 B11R0.159 CC(C)(O)CCCOCCCF 644084046a5ae874f901d4464a806d00 [1,1,0,0,0,0|2,0,0]=4 8263 B11R0.159 CC(C)(O)CCCOCCCS 5efa20d1310963ea79990f3a289f727c [1,1,0,0,0,0|2,0,0]=4 8264 B11R0.159 CC(C)(O)CCNCCCCCl 070921cd066211416d2f279f67017b63 [1,1,0,0,0,0|2,0,0]=4 8265 B11R0.159 CC(C)(O)CCNCCCCF f29fbd90b70afa9c743800427d905b7f [1,1,0,0,0,0|2,0,0]=4 8266 B11R0.159 CC(C)(O)CCNCCCCO 91554e96873ab995b38cde31f6107a51 [1,1,0,0,0,0|2,0,0]=4 8267 B11R0.159 CC(C)(O)CCNCCCCS c889930fc61c22d74073bf1150d49cc0 [1,1,0,0,0,0|2,0,0]=4 8268 B11R0.159 CC(C)(O)CCOCCCCF 834b7178f0a246fd088cecef95a2c26c [1,1,0,0,0,0|2,0,0]=4 8269 B11R0.159 CC(C)(O)CCOCCCCS 53442672805919897536db68f1105f54 [1,1,0,0,0,0|2,0,0]=4 8270 B11R0.159 CC(C)(O)CNCCCCCCl f877f7bc2a3ed4c85069f0261093055b [1,1,0,0,0,0|2,0,0]=4 8271 B11R0.159 CC(C)(O)CNCCCCCF 620cf0c8fbbd6d7b6da479d14dd1dbbe [1,1,0,0,0,0|2,0,0]=4 8272 B11R0.159 CC(C)(O)CNCCCCCO 4d96274ec10bc0d3617d2f9dfa62437f [1,1,0,0,0,0|2,0,0]=4 8273 B11R0.159 CCCCCCCNC(C)(C)C 3c22ae7a14563090dd4d5e23cc13ed4f [1,1,0,0,0,0|2,0,0]=4 8274 B11R0.159 CCCCCCNCC(C)(C)C 9683a1046d5e7e7990c1415f39c6fb64 [1,1,0,0,0,0|2,0,0]=4 8275 B11R0.159 CCCCCCNCC(C)(C)F cc1cd38e92e9ef77c41af5ab0277022d [1,1,0,0,0,0|2,0,0]=4 8276 B11R0.159 CCCCCCNCC(C)(C)O 2aa578fdffe8a98c5a18daa33302c7d4 [1,1,0,0,0,0|1,0,0]=3 8277 B11R0.159 CCCCCCNCC(C)(F)F bd46793374da268d1cbd1d98f3e90705 [1,1,0,0,0,0|2,0,0]=4 8278 B11R0.159 CCCCCCOCC(C)(C)Br 89bb21a9a8da09354340e6bb3f03f340 [1,1,0,0,0,0|2,0,0]=4 8279 B11R0.159 CCCCCCOCC(C)(C)C d288487601f0a7690e9bb6cf3a67214e [1,1,0,0,0,0|2,0,0]=4 8280 B11R0.159 CCCCCCOCC(C)(C)F 4339a90c04b299abec436b00ac4e4c69 [1,1,0,0,0,0|2,0,0]=4 8281 B11R0.159 CCCCCCOCC(C)(C)O c0362b6df206c60f756983a4e87a83e1 [1,1,0,0,0,0|1,0,0]=3 8282 B11R0.159 CCCCCCOCC(C)(C)S 4b78857e48069ece5f9a7fd379e0fb0e [1,1,0,0,0,0|1,1,0]=4 8283 B11R0.159 CCCCCCOCC(C)(F)F bbfb8d88e665225b09c7b42bec64ca91 [1,1,0,0,0,0|2,0,0]=4 8284 B11R0.159 CCCCCNCCC(C)(C)C ae1b765c7045bc9f89e2f15bbf237ed3 [1,1,0,0,0,0|2,0,0]=4 8285 B11R0.159 CCCCCNCCC(C)(C)F 6c00802467df5f4b3d11c9b5a06f9838 [1,1,0,0,0,0|2,0,0]=4 8286 B11R0.159 CCCCCNCCC(C)(C)O 3042b95fe42d3f7092916b2c73621e5b [1,1,0,0,0,0|1,0,0]=3 8287 B11R0.159 CCCCCNCCC(C)(F)F 99adffdafc5e583b1359a75dd7b0152e [1,1,0,0,0,0|2,0,0]=4 8288 B11R0.159 CCCCCOCCC(C)(C)C d273c8aca0e74e22e56459066d29e273 [1,1,0,0,0,0|2,0,0]=4 8289 B11R0.159 CCCCCOCCC(C)(C)O 0278db2b4c87f85e7b53063af5b2967b [1,1,0,0,0,0|1,0,0]=3 8290 B11R0.159 CCCCCOCCC(C)(C)S 61a4f6fec0f98006c8386c3a71a66e0a [1,1,0,0,0,0|1,1,0]=4 8291 B11R0.159 CCCCCOCCC(C)(F)F c631c15edf1c17ac1c12c98bd5912aa7 [1,1,0,0,0,0|2,0,0]=4 8292 B11R0.159 CCCCNCCCC(C)(C)C f6d9d863d36b79939bfa55515736fa71 [1,1,0,0,0,0|2,0,0]=4 8293 B11R0.159 CCCCNCCCC(C)(C)O 9d7ac595c2f0c7b802e9232fb11c92d7 [1,1,0,0,0,0|1,0,0]=3 8294 B11R0.159 CCCCNCCCC(C)(F)F 7fc1bccafea5735b8edf564f43622920 [1,1,0,0,0,0|2,0,0]=4 8295 B11R0.159 CCCCOCCCC(C)(C)C 61986748a402e3522ec08a5e6bfb6584 [1,1,0,0,0,0|2,0,0]=4 8296 B11R0.159 CCCCOCCCC(C)(C)O 44d401817afbf731461e9f1ff64078cd [1,1,0,0,0,0|1,0,0]=3 8297 B11R0.159 CCCCOCCCC(C)(F)F 7613377b8a04bf9b09cfaf829de18e50 [1,1,0,0,0,0|2,0,0]=4 8298 B11R0.159 CCCCOCNCC(C)(C)O 1df9b6456ed9defe4ebe59f6d375d161 [1,1,0,0,0,0|2,0,0]=4 8299 B11R0.159 CCCOCCCCC(C)(C)C 7e1321c940e388b47974d02411382074 [1,1,0,0,0,0|2,0,0]=4 8300 B11R0.159 CCCOCCNCC(C)(C)O 3ab57f6587ca121e3bf965af50e98300 [1,1,0,0,0,0|2,0,0]=4 8301 B11R0.159 CCCOCCOCC(C)(C)O 52c3bcfd2414a8f8aad4af8ef400c05c [1,1,0,0,0,0|2,0,0]=4 8302 B11R0.159 CCCSCCOCC(C)(C)O 059b6fe81810bb4bab2817078b5d5bec [1,1,0,0,0,0|2,0,0]=4 8303 B11R0.159 CCOCCCNCC(C)(C)O 40277b79d44d299f1a4862b7af0edfd4 [1,1,0,0,0,0|2,0,0]=4 8304 B11R0.159 CCOCCCOCC(C)(C)O 0a7602d767549d67dfd3583eb2e1bf26 [1,1,0,0,0,0|2,0,0]=4 8305 B11R0.159 CCOCCNCCC(C)(C)O 43b26de779eae5fd30e8de2cbcbea4d8 [1,1,0,0,0,0|2,0,0]=4 8306 B11R0.159 CCOCCOCCC(C)(C)O a9b69eb9c2260452d7e06bcb8de2bada [1,1,0,0,0,0|2,0,0]=4 8307 B11R0.159 CCOCNCCCC(C)(C)O 218d4c7128170434cb01c7a20bda6395 [1,1,0,0,0,0|2,0,0]=4 8308 B11R0.159 CCSCCCNCC(C)(C)O 5fb4b8569a36701a178f7bdee74190e1 [1,1,0,0,0,0|2,0,0]=4 8309 B11R0.159 CCSCCCOCC(C)(C)O b99253b50f06e138f048abcdd77cb105 [1,1,0,0,0,0|2,0,0]=4 8310 B11R0.159 CCSCCNCCC(C)(C)O d46db14deace1f49ba01e933eec2829a [1,1,0,0,0,0|2,0,0]=4 8311 B11R0.159 CCSCCOCCC(C)(C)O c843f43ade6d61ea18b080254a12fc5b [1,1,0,0,0,0|2,0,0]=4 8312 B11R0.159 COCCCCNCC(C)(C)O 1e7d71a8acb46e19fc41e2749e1e17fa [1,1,0,0,0,0|2,0,0]=4 8313 B11R0.159 COCCCCOCC(C)(C)O 22b0e46e8774f37ac3641f75412a3569 [1,1,0,0,0,0|2,0,0]=4 8314 B11R0.159 COCCCNCCC(C)(C)O 8d4aaaea548a477d6eb320f8c16f77bd [1,1,0,0,0,0|2,0,0]=4 8315 B11R0.159 COCCCOCCC(C)(C)O b7dd4e7047a1b643f54c899f958b1ab7 [1,1,0,0,0,0|2,0,0]=4 8316 B11R0.159 COCCNCCCC(C)(C)O 5ce0890afbd5d51c7214815e901ff78d [1,1,0,0,0,0|2,0,0]=4 8317 B11R0.159 COCCOCCCC(C)(C)O 4deb0d156be4d1f2c27bc747bd9a24bc [1,1,0,0,0,0|2,0,0]=4 8318 B11R0.159 CSCCCCNCC(C)(C)O 87429c8eb63e53f92694b8b57202c2bb [1,1,0,0,0,0|2,0,0]=4 8319 B11R0.159 CSCCCCOCC(C)(C)O d111c98867944685b51e0d1fd445686c [1,1,0,0,0,0|2,0,0]=4 8320 B11R0.159 CSCCCNCCC(C)(C)O 66da1c23415ae205c651861ff97a27b6 [1,1,0,0,0,0|2,0,0]=4 8321 B11R0.159 CSCCCOCCC(C)(C)O 7affbc124953a3b3a367276779b408f9 [1,1,0,0,0,0|2,0,0]=4 8322 B11R0.159 CSCCNCCCC(C)(C)O 83f5135be8a13b9db7a80cc77dac06be [1,1,0,0,0,0|2,0,0]=4 8323 B11R0.159 CSCCOCCCC(C)(C)O da636bdad159df0c717f6147901f597a [1,1,0,0,0,0|2,0,0]=4 8324 B11R0.176 CC(O)CCCCN(C)CCF 3dcb31a7a6e840b61635052a6bcefc5a [1,1,0,0,0,0|2,0,0]=4 8325 B11R0.176 CC(O)CCCCN(C)CCO aac683f434f17277526973f4ce666277 [1,1,0,0,0,0|2,0,0]=4 8326 B11R0.176 CC(O)CCCNC(C)CCO 432a8f1558ecc4a98b69788e3ca6f2ad [1,1,0,0,0,0|2,0,0]=4 8327 B11R0.176 CC(O)CCCN[C@@H](C)CCO 8053057166ef96a5c3e2021435d12ff8 [1,1,0,0,0,0|2,0,0]=4 8328 B11R0.176 CC(O)CCCN[C@H](C)CCO df91f3a10dd51cc9c2fe9f2159f950cf [1,1,0,0,0,0|2,0,0]=4 8329 B11R0.176 CC(O)CCNCC(C)CCO e3898eeb48243b26969d11578721bb9a [1,1,0,0,0,0|2,0,0]=4 8330 B11R0.176 CC(O)CCNC[C@@H](O)CCO eda96d971ed969a9966256bcab6878fb [1,1,0,0,0,0|2,0,0]=4 8331 B11R0.176 CCCC(=O)CNCCC(C)O b72f56b2f314d16d6202ad997932347b [1,1,0,0,0,0|1,0,1]=4 8332 B11R0.176 CCCC(=O)CNCC[C@@H](C)O f4aa6314f056fc60d53d32325c6560d9 [1,1,0,0,0,0|1,0,1]=4 8333 B11R0.176 CCCC(=O)CNCC[C@H](C)O 4eb7668ba9255a3390da70d90c5df24b [1,1,0,0,0,0|1,0,1]=4 8334 B11R0.176 CCCC(C)CCCOC(C)C 4e67ae063fe600322af6e7b5cb499c37 [1,1,0,0,0,0|2,0,0]=4 8335 B11R0.176 CCCC(C)CCOCC(C)C 24b9b43e7ec029c4bd58d608f2baafb7 [1,1,0,0,0,0|2,0,0]=4 8336 B11R0.176 CCCC(C)CNCCC(C)C 22d9c31b764614257e5c7b451810e48f [1,1,0,0,0,0|2,0,0]=4 8337 B11R0.176 CCCC(C)CNCCC(C)O ab2f4999a5158b8e897c018cd358cfd8 [1,1,0,0,0,0|1,0,0]=3 8338 B11R0.176 CCCC(C)CNCC[C@@H](C)O dc89991e487d286fff7953d069965ac5 [1,1,0,0,0,0|1,0,0]=3 8339 B11R0.176 CCCC(C)CNCC[C@H](C)O 174303d10f536105779af286b4fca2ad [1,1,0,0,0,0|1,0,0]=3 8340 B11R0.176 CCCC(C)COCCC(C)C 642c71fb9d9145d111051a747da01b73 [1,1,0,0,0,0|2,0,0]=4 8341 B11R0.176 CCCC(C)NCCCC(C)C f04bfc19f42e9a7285570ee0ba396bbb [1,1,0,0,0,0|2,0,0]=4 8342 B11R0.176 CCCC(C)NCCCC(C)O 631edea0bdce64152542720db6e368b5 [1,1,0,0,0,0|1,0,0]=3 8343 B11R0.176 CCCC(C)OCCCC(C)C e3bb3c4c8fbb375bcd15bfb88c1609db [1,1,0,0,0,0|2,0,0]=4 8344 B11R0.176 CCCC(O)CNCCC(C)C 19b6c3ce40b58c37073a9cd0360bae4f [1,1,0,0,0,0|2,0,0]=4 8345 B11R0.176 CCCC(O)CNCCC(C)O 702fbf0bb40b1da0a84b4de3ca529276 [1,1,0,0,0,0|1,0,0]=3 8346 B11R0.176 CCCC(S)CCOCC(C)C 19b9eec575fab99591951cb0fcf1223b [1,1,0,0,0,0|2,0,0]=4 8347 B11R0.176 CCCN(C)CCCCC(C)C 64b7040b645e04f5cd9237794a649b32 [1,1,0,0,0,0|2,0,0]=4 8348 B11R0.176 CCCN(C)CCCCC(C)O fd4ed3a5d668a0b7cf3d1160786f2906 [1,1,0,0,0,0|1,0,0]=3 8349 B11R0.176 CCCN(C)CCCC[C@@H](C)O aacd8625fa2314f297b0e0b9dcec693a [1,1,0,0,0,0|1,0,0]=3 8350 B11R0.176 CCC[C@@H](C)OCCCC(C)C 0b786c8e8da7f8b561a35fef44b01d3d [1,1,0,0,0,0|2,0,0]=4 8351 B11R0.176 CCC[C@H](C)NCCCC(C)C 139f65992f072b653f78a5c203bdf2cc [1,1,0,0,0,0|2,0,0]=4 8352 B11R0.176 CCC[C@H](C)NCCCC(C)O 890848f965f22eb1f5f5fa5a61063d5c [1,1,0,0,0,0|1,0,0]=3 8353 B11R0.176 CCC[C@H](C)OCCCC(C)C 15284732fe8408fe58ec6d13ea3db5d1 [1,1,0,0,0,0|2,0,0]=4 8354 B11R0.176 CCOC(C)CNCCC(C)O e816276a0f8f29b6d87250960f06475e [1,1,0,0,0,0|2,0,0]=4 8355 B11R0.176 COCC(C)NCCCC(C)O 1353861cc3ce9435871226ec63be9185 [1,1,0,0,0,0|2,0,0]=4 8356 B11R0.176 COCC(O)CNCCC(C)O 84c58f423a98ba0b4eb8b5761222481d [1,1,0,0,0,0|2,0,0]=4 8357 B11R0.176 COCC(O)CNCC[C@@H](C)O fcd5fd0cb6a34b0f4e6631b569ff3166 [1,1,0,0,0,0|2,0,0]=4 8358 B11R0.176 COCC(O)CNCC[C@H](C)O 1a6a0ffbe18d15560fda02ca84fb9744 [1,1,0,0,0,0|2,0,0]=4 8359 B11R0.176 COC[C@@H](C)NCCCC(C)O 26828a7ca24764f3b6e96038a6f58f61 [1,1,0,0,0,0|2,0,0]=4 8360 B11R0.176 COC[C@@H](O)CNCCC(C)O d6c846436c6a4cb6e1357ed4f1f690ba [1,1,0,0,0,0|2,0,0]=4 8361 B11R0.176 COC[C@H](C)NCCCC(C)O 1bad7b80ea43f698bb2d596c2ea7195b [1,1,0,0,0,0|2,0,0]=4 8362 B11R0.176 C[C@@H](O)CCCCN(C)CCF b5cedd18016333e7a510d3a176d8ef6f [1,1,0,0,0,0|2,0,0]=4 8363 B11R0.176 C[C@@H](O)CCCCN(C)CCO 05e73e476aa61f0357d68c4e5f7700d7 [1,1,0,0,0,0|2,0,0]=4 8364 B11R0.176 C[C@@H](O)CCNC[C@@H](O)CCO 1a76fcf676b75adb2c77b29e1c03ec4f [1,1,0,0,0,0|2,0,0]=4 8365 B11R0.176 C[C@H](O)CCNC[C@@H](O)CCO 9a01fe96f98e5fb15fa7a25b7a110092 [1,1,0,0,0,0|2,0,0]=4 8366 B11R0.3 C#CCCCCCCCOCC 84ce53283c4b9755ed2326be390434c8 [1,1,0,0,0,0|0,0,2]=4 8367 B11R0.3 C#CCCCCCCNCCC 02da07847a079ff299b9865ceb96b409 [1,1,0,0,0,0|0,0,2]=4 8368 B11R0.3 C#CCCCCCCNCCO c5a8bfe9e32ff36a691ad368da424c8a [1,1,0,0,0,0|0,0,2]=4 8369 B11R0.3 C#CCCCCCCOCCC cfdd8580ef8f82280382a14788d2344e [1,1,0,0,0,0|0,0,2]=4 8370 B11R0.3 C#CCCCCCNCCCC 317388423a1cee18f11a7bca718dd97c [1,1,0,0,0,0|0,0,2]=4 8371 B11R0.3 C#CCCCCCNCCCO 1eba49163862adb40420a43efadeacd2 [1,1,0,0,0,0|0,0,2]=4 8372 B11R0.3 C#CCCCCCOCCCC a6767e3572e039246806d7c1f4ab452e [1,1,0,0,0,0|0,0,2]=4 8373 B11R0.3 C#CCCCCNCCCCC 0310083451d131dce1267280bc7baa38 [1,1,0,0,0,0|0,0,2]=4 8374 B11R0.3 C#CCCCCNCCCCO 6c3da295e8357724cc114ba02e8018b0 [1,1,0,0,0,0|0,0,2]=4 8375 B11R0.3 C#CCCCCOCCCCC ba6b4fc782757cd8d61e8f834b449a1f [1,1,0,0,0,0|0,0,2]=4 8376 B11R0.3 C#CCCCNCCCCCC 531b173f97d1ee6660bf9138ec42ec62 [1,1,0,0,0,0|0,0,2]=4 8377 B11R0.3 C#CCCCNCCCCCO 7d62c9df2fa373b4cccdfaacd97ac426 [1,1,0,0,0,0|0,0,2]=4 8378 B11R0.3 C#CCCCOCCCCCC dcee40ff53ac67443eba7b05c5d90c94 [1,1,0,0,0,0|0,0,2]=4 8379 B11R0.3 C#CCCNCCCCCCC 4e70e9fe06a7b5399ee0c8f864839780 [1,1,0,0,0,0|0,0,2]=4 8380 B11R0.3 C#CCCNCCCCCCO 6f45d4aa381edc6c1d3b395c3773375d [1,1,0,0,0,0|0,0,2]=4 8381 B11R0.3 C#CCCOCCCCCCC b9739655913e528f6ed1685dee2f31af [1,1,0,0,0,0|0,0,2]=4 8382 B11R0.3 C#CCNCCCCCCCC 6db1cd8462905f563e8ab10b0421f056 [1,1,0,0,0,0|0,0,2]=4 8383 B11R0.3 C#CCNCCCCCCCO fa8996f465fb9c7e22bfb363507ec6e0 [1,1,0,0,0,0|0,0,2]=4 8384 B11R0.3 C#CCOCCCCCCCC a677fe3a66a8bcd20ef936d9631eff5c [1,1,0,0,0,0|0,0,2]=4 8385 B11R0.3 C/C=C/CCCOCCCCC 14c1074a961f91af4aaf5acad9119f1f [1,1,0,0,0,0|0,0,2]=4 8386 B11R0.3 C/C=C/CCOCCCCCC 8c3ad0457a3e830872c3530027a04f1e [1,1,0,0,0,0|0,0,2]=4 8387 B11R0.3 C/C=C/CNCCCCCCC af0fdf38ebb307486bc264784ccd3c83 [1,1,0,0,0,0|0,0,2]=4 8388 B11R0.3 C/C=C/CNCCCCCCO cdf0d52a075ece1bb240a0814bfd9729 [1,1,0,0,0,0|0,0,2]=4 8389 B11R0.3 C/C=C/COCCCCCCC 67d80454e207dd5a1825d1eef2cf7e69 [1,1,0,0,0,0|0,0,2]=4 8390 B11R0.3 C/C=C\CCCNCCCCC 5e500be2c9b395f6ca28a4341df00076 [1,1,0,0,0,0|0,0,2]=4 8391 B11R0.3 C/C=C\CCCNCCCCO 5dacd7c8214b914449a51fec0c6766c5 [1,1,0,0,0,0|0,0,2]=4 8392 B11R0.3 C/C=C\CCCOCCCCC 568202d36daaca9382cf0b6e7e3d1686 [1,1,0,0,0,0|0,0,2]=4 8393 B11R0.3 C/C=C\CNCCCCCCC 9dd75a327d2457b018c6d50d1310b411 [1,1,0,0,0,0|0,0,2]=4 8394 B11R0.3 C/C=C\CNCCCCCCO 42e28273b98b0f681dc90950a5c4c0ac [1,1,0,0,0,0|0,0,2]=4 8395 B11R0.3 C/C=C\COCCCCCCC 48c8f8426fdc5f9bef7e34a4312ddd6d [1,1,0,0,0,0|0,0,2]=4 8396 B11R0.3 C=CCCCCCCCOCC ed14b0620af6de10a0e50df9aa44f9c3 [1,1,0,0,0,0|0,0,2]=4 8397 B11R0.3 C=CCCCCCCNCCC a40bb91c630069b9a44746e8fb1ba5be [1,1,0,0,0,0|0,0,2]=4 8398 B11R0.3 C=CCCCCCCNCCO 2c9abafa186d2b5691cddaec3db0e98a [1,1,0,0,0,0|0,0,2]=4 8399 B11R0.3 C=CCCCCCCOCCC af0fc2056d78c68262c9655cb905d458 [1,1,0,0,0,0|0,0,2]=4 8400 B11R0.3 C=CCCCCCNCCCC 009368897ac39b99fc20760d8f7a7a77 [1,1,0,0,0,0|0,0,2]=4 8401 B11R0.3 C=CCCCCCNCCCO 96e9a84a1f13802799f12ff9218c17fe [1,1,0,0,0,0|0,0,2]=4 8402 B11R0.3 C=CCCCCCOCCCC 580bca9ccc39bf087cb9fbf52b121e2d [1,1,0,0,0,0|0,0,2]=4 8403 B11R0.3 C=CCCCCNCCCCC c38c9382edb4f72ed2fe2f11cb49092f [1,1,0,0,0,0|0,0,2]=4 8404 B11R0.3 C=CCCCCNCCCCO 5dd011111637e0f5e3ce1284d3335035 [1,1,0,0,0,0|0,0,2]=4 8405 B11R0.3 C=CCCCCOCCCCC 8b612cdb52ccc179804553965ee56419 [1,1,0,0,0,0|0,0,2]=4 8406 B11R0.3 C=CCCCNCCCCCC 76af61b3540584ce9d68dfdb439ae738 [1,1,0,0,0,0|0,0,2]=4 8407 B11R0.3 C=CCCCNCCCCCO ed7a1c0d1a7ad4c234f4ec30bd6073b5 [1,1,0,0,0,0|0,0,2]=4 8408 B11R0.3 C=CCCCOCCCCCC 7b128642b816d84d36be162dfb6b66f7 [1,1,0,0,0,0|0,0,2]=4 8409 B11R0.3 C=CCCNCCCCCCC ce62f32ebc0ff4d7c79abb8227eba886 [1,1,0,0,0,0|0,0,2]=4 8410 B11R0.3 C=CCCNCCCCCCO eac0a933f6408e6c89b8d8d5b327ef77 [1,1,0,0,0,0|0,0,2]=4 8411 B11R0.3 C=CCCOCCCCCCC 8d06e26ebbdf8e7dffb8f7a6170401d7 [1,1,0,0,0,0|0,0,2]=4 8412 B11R0.3 C=CCNCCCCCCCC bfc9a2fcdb2e10a56b8cbe225faaa255 [1,1,0,0,0,0|0,0,2]=4 8413 B11R0.3 C=CCNCCCCCCCO b42362915ec5348648478b7195305a17 [1,1,0,0,0,0|0,0,2]=4 8414 B11R0.3 C=CCOCCCCCCCC 49a99e47fdc5a48a8387d42d9cb8bfc1 [1,1,0,0,0,0|0,0,2]=4 8415 B11R0.3 CC#CCCCOCCCCC b04ddcf4209faadf54008a4e9c0369f6 [1,1,0,0,0,0|0,0,2]=4 8416 B11R0.3 CC#CCCOCCCCCC 4df9256e5313b82d3da19c215c9e28d8 [1,1,0,0,0,0|0,0,2]=4 8417 B11R0.3 CC#CCNCCCCCCC 5a8887c12be23d4badf5fa372603b5a1 [1,1,0,0,0,0|0,0,2]=4 8418 B11R0.3 CC#CCNCCCCCCO 30c38fa7a3c88ab5355c65d700faf304 [1,1,0,0,0,0|0,0,2]=4 8419 B11R0.3 CC#CCOCCCCCCC 0c7eb975d774cd474d54b4a54ee269c6 [1,1,0,0,0,0|0,0,2]=4 8420 B11R0.3 CC/C=C/CCOCCCCC b53d7a6c46eb728d1471fa5f092df813 [1,1,0,0,0,0|0,0,2]=4 8421 B11R0.3 CC/C=C/CNCCCCCC 4ea6a89a67bd880060b4122692e295c2 [1,1,0,0,0,0|0,0,2]=4 8422 B11R0.3 CC/C=C/CNCCCCCO 11c74b6eec366a8c158ee3c9d35eee5f [1,1,0,0,0,0|0,0,2]=4 8423 B11R0.3 CC/C=C/COCCCCCC eb90121bb3484ddc510c42f4817c7d41 [1,1,0,0,0,0|0,0,2]=4 8424 B11R0.3 CC/C=C\CCCCCOCC 3fcd157868f9d6a02a7d59a5bad0c445 [1,1,0,0,0,0|0,0,2]=4 8425 B11R0.3 CC/C=C\CCCCOCCC b91b66aedbd8d3f44f429a8b1d860578 [1,1,0,0,0,0|0,0,2]=4 8426 B11R0.3 CC/C=C\CCCOCCCC 4cdaf8803428e2d9f645148af5a0d0b2 [1,1,0,0,0,0|0,0,2]=4 8427 B11R0.3 CC/C=C\CCNCCCCC ca3a0d15ea7c79f615890d56cab14290 [1,1,0,0,0,0|0,0,2]=4 8428 B11R0.3 CC/C=C\CCNCCCCO 8f9446d6f8c1d403a5239feba0633bcf [1,1,0,0,0,0|0,0,2]=4 8429 B11R0.3 CC/C=C\CCOCCCCC 26ad29cfc366b08d786d9b655a0964e4 [1,1,0,0,0,0|0,0,2]=4 8430 B11R0.3 CC/C=C\COCCCCCC 9755557f3f5961e4b7217afb6d53fd2f [1,1,0,0,0,0|0,0,2]=4 8431 B11R0.3 CC=CCCCOCCCCC 150b13ec9b2c10d3b11289990257ead7 [1,1,0,0,0,0|0,0,2]=4 8432 B11R0.3 CC=CCNCCCCCCC 7008f5a91daa02e914ed344aafa7e9d0 [1,1,0,0,0,0|0,0,2]=4 8433 B11R0.3 CC=CCNCCCCCCO b6c163168cc55e521125c84438b2a121 [1,1,0,0,0,0|0,0,2]=4 8434 B11R0.3 CC=CCOCCCCCCC 46a2177b7fee8ebd05148c40489b256d [1,1,0,0,0,0|0,0,2]=4 8435 B11R0.3 CCC#CCCOCCCCC ea61c9e9f51ccb19ef08c5d6ca6a7377 [1,1,0,0,0,0|0,0,2]=4 8436 B11R0.3 CCC#CCNCCCCCC 0e5483b41653e63137eb42e7d9552a55 [1,1,0,0,0,0|0,0,2]=4 8437 B11R0.3 CCC#CCNCCCCCO 397b954fe1eab79f99ec4f6bdc83fdd2 [1,1,0,0,0,0|0,0,2]=4 8438 B11R0.3 CCC#CCOCCCCCC 2489a158ff607aa0b713ab2111e23770 [1,1,0,0,0,0|0,0,2]=4 8439 B11R0.3 CCC/C=C/CCCOCCC dae1775eca5913317c5cd584ee8751c6 [1,1,0,0,0,0|0,0,2]=4 8440 B11R0.3 CCC/C=C/CNCCCCC 220ba6cf6d3871bb7347038a1b74977c [1,1,0,0,0,0|0,0,2]=4 8441 B11R0.3 CCC/C=C/CNCCCCO 639a07255e680188f68832595d43e1a1 [1,1,0,0,0,0|0,0,2]=4 8442 B11R0.3 CCC/C=C/COCCCCC 376fd1605555eb7afa40e728bdf19f2d [1,1,0,0,0,0|0,0,2]=4 8443 B11R0.3 CCC/C=C\CCCOCCC 9d2652818f4292c6bd7658d96bf7fce0 [1,1,0,0,0,0|0,0,2]=4 8444 B11R0.3 CCC/C=C\CCOCCCC 9e74787723b6c36b8e5fff0d11977396 [1,1,0,0,0,0|0,0,2]=4 8445 B11R0.3 CCC/C=C\CNCCCCC 019a7c473a2da7ebbb424bd7efd3e588 [1,1,0,0,0,0|0,0,2]=4 8446 B11R0.3 CCC/C=C\CNCCCCO 47755699a15979b55acc95b06960b519 [1,1,0,0,0,0|0,0,2]=4 8447 B11R0.3 CCC/C=C\COCCCCC d379d1a8be0c42f6be0ab331a41b2209 [1,1,0,0,0,0|0,0,2]=4 8448 B11R0.3 CCC=CCCCCCOCC acb4ebc5d4b9da3999d78f72f192ac9b [1,1,0,0,0,0|0,0,2]=4 8449 B11R0.3 CCCC#CCCOCCCC 5dd77899fa2630c12a317b7aa0e40741 [1,1,0,0,0,0|0,0,2]=4 8450 B11R0.3 CCCC#CCOCCCCC 294532da1ff01764bd0073793a3e09a3 [1,1,0,0,0,0|0,0,2]=4 8451 B11R0.3 CCCC/C=C/CNCCCC 45a1595a8cd26e56275e1f00dfa303c5 [1,1,0,0,0,0|0,0,2]=4 8452 B11R0.3 CCCC/C=C/CNCCCO 6e288c24cf84e42add1dd01ee687f60f [1,1,0,0,0,0|0,0,2]=4 8453 B11R0.3 CCCC/C=C/COCCCC 82dc9ab35de47f0095fadba26ee4655b [1,1,0,0,0,0|0,0,2]=4 8454 B11R0.3 CCCC/C=C\CCOCCC 1a8844975936e052ac905af32c23beeb [1,1,0,0,0,0|0,0,2]=4 8455 B11R0.3 CCCC/C=C\CNCCCC 7f1816742bbcb8773089cbe2feaac39f [1,1,0,0,0,0|0,0,2]=4 8456 B11R0.3 CCCC/C=C\CNCCCO 75c1dab82f49ecf823b1d57baf05848a [1,1,0,0,0,0|0,0,2]=4 8457 B11R0.3 CCCC/C=C\COCCCC a469df223d2e13d6d1c593a861913433 [1,1,0,0,0,0|0,0,2]=4 8458 B11R0.3 CCCCC#CCCOCCC 30aff69ed8d572e55b86add46927c905 [1,1,0,0,0,0|0,0,2]=4 8459 B11R0.3 CCCCC#CCOCCCC c37a33db3e7c309c6e390eb3aaebf07d [1,1,0,0,0,0|0,0,2]=4 8460 B11R0.3 CCCCC/C=C/COCCC 0cc4eeb3dd9ed1acd28a102ef946cd8f [1,1,0,0,0,0|0,0,2]=4 8461 B11R0.3 CCCCC/C=C\CCOCC 9bbd94ef19d1e094626d984ac326c15e [1,1,0,0,0,0|0,0,2]=4 8462 B11R0.3 CCCCCC#CCCOCC bf50964cdd5d1e4cdbf4b0ccb340846c [1,1,0,0,0,0|0,0,2]=4 8463 B11R0.3 CCCCCC#CCOCCC ea66505486efb96849999eb79293bb02 [1,1,0,0,0,0|0,0,2]=4 8464 B11R0.3 CCCCCC/C=C/COCC 1d564dbe762cb9f190a747403312f838 [1,1,0,0,0,0|0,0,2]=4 8465 B11R0.3 CCCCCC/C=C\COCC 5a8a881f07f8a5e19b54364067beb581 [1,1,0,0,0,0|0,0,2]=4 8466 B11R0.3 CCCCCCC#CCOCC 66416f698d2466e906aa210fab2adadb [1,1,0,0,0,0|0,0,2]=4 8467 B11R0.3 CCCCCCCCCNC#N 6b046d3912028b93959cb4e452afd1ae [1,1,0,0,0,0|1,0,1]=4 8468 B11R0.3 CCCCCCCCCNC=O 450ec7c17222bfa50b1bec9a4e76d3ac [1,1,0,0,0,0|0,0,2]=4 8469 B11R0.3 CCCCCCCCCNCC b6539dc308d63bc638f757291d8ebf84 [1,1,0,0,0,0|0,0,0]=2 8470 B11R0.3 CCCCCCCCCNCF 43bd644c8c480de2fb259821f0ab90b3 [1,1,0,0,0,0|1,0,0]=3 8471 B11R0.3 CCCCCCCCCNCO cabb056dd32239ed577df722d85b0dd4 [1,1,0,0,0,0|0,0,0]=2 8472 B11R0.3 CCCCCCCCCOCC 2da72f808296172141d037a9a0e922cc [1,1,0,0,0,0|0,0,0]=2 8473 B11R0.3 CCCCCCCCCOCF c4f834bdcd233b73d7c8d340364a980d [1,1,0,0,0,0|1,0,0]=3 8474 B11R0.3 CCCCCCCCNCC#N e1e1fda8b8bfebd20bf6e7275805690a [1,1,0,0,0,0|1,0,1]=4 8475 B11R0.3 CCCCCCCCNCC=O d9ced648acece07efb5d33c320d8dadf [1,1,0,0,0,0|0,0,2]=4 8476 B11R0.3 CCCCCCCCNCCBr 124dad0af09f96099c60b552aee5a73e [1,1,0,0,0,0|1,0,0]=3 8477 B11R0.3 CCCCCCCCNCCC 5c5d2b2d5b77701c078b7890315f6ed4 [1,1,0,0,0,0|0,0,0]=2 8478 B11R0.3 CCCCCCCCNCCF 2e0818a402ab846cf4daf1ebdd30c4d5 [1,1,0,0,0,0|1,0,0]=3 8479 B11R0.3 CCCCCCCCNCCI f2e870159bc574809ce3c7c46c194254 [1,1,0,0,0,0|1,0,0]=3 8480 B11R0.3 CCCCCCCCNCCO 66f15a321d735f67e99bb8bf0677de73 [1,1,0,0,0,0|0,0,0]=2 8481 B11R0.3 CCCCCCCCNCCS 9963fd311d7de210a2e1fa6fd8d2fe1f [1,1,0,0,0,0|0,1,0]=3 8482 B11R0.3 CCCCCCCCNCOC e4b94b479e34a7870530ff5432c0561c [1,1,0,0,0,0|1,0,0]=3 8483 B11R0.3 CCCCCCCCNCSC 362d682105cf82dab99b537514fd044b [1,1,0,0,0,0|1,0,0]=3 8484 B11R0.3 CCCCCCCCOCC#N 34434fafb1978e779020a7eb19fa5664 [1,1,0,0,0,0|1,0,1]=4 8485 B11R0.3 CCCCCCCCOCC=O 4b7128d965398d7a6aa7d6d1f071599b [1,1,0,0,0,0|0,0,2]=4 8486 B11R0.3 CCCCCCCCOCCC 5c55f182a5e0d29dd20e8f79767e7a77 [1,1,0,0,0,0|0,0,0]=2 8487 B11R0.3 CCCCCCCCOCCF e0dea6108899e149ace708160dd5e19a [1,1,0,0,0,0|1,0,0]=3 8488 B11R0.3 CCCCCCCCOCCS 51f3fbaf4c38beeef65f454daef36ed1 [1,1,0,0,0,0|0,1,0]=3 8489 B11R0.3 CCCCCCCCOCOC 7ef1d4d105bdb76da628aa577a4e9370 [1,1,0,0,0,0|1,0,0]=3 8490 B11R0.3 CCCCCCCCOCSC d725b23a00487d8000b0509a053a76b7 [1,1,0,0,0,0|1,0,0]=3 8491 B11R0.3 CCCCCCCNC/C=C\O 68625962180e5c7cd6474c4bc6a5cb81 [1,1,0,0,0,0|0,0,2]=4 8492 B11R0.3 CCCCCCCNCCC#N b0447ed3ec330f598048ce2912e32794 [1,1,0,0,0,0|1,0,1]=4 8493 B11R0.3 CCCCCCCNCCC=O 89a048b0cb7fedfdc94b7b98d38db122 [1,1,0,0,0,0|0,0,2]=4 8494 B11R0.3 CCCCCCCNCCCC 36a5fecc81cda5ee533584053ef52c12 [1,1,0,0,0,0|0,0,0]=2 8495 B11R0.3 CCCCCCCNCCCCl f8ee8ff116da89d7af5396839da83b0c [1,1,0,0,0,0|1,0,0]=3 8496 B11R0.3 CCCCCCCNCCCF 906b08ea9b84bc278513d70a1bf0318f [1,1,0,0,0,0|1,0,0]=3 8497 B11R0.3 CCCCCCCNCCCO 15d41c00a29a7860828561fb02e66224 [1,1,0,0,0,0|0,0,0]=2 8498 B11R0.3 CCCCCCCNCCCS ecfb391744e4cf619ddb1431239249a3 [1,1,0,0,0,0|0,1,0]=3 8499 B11R0.3 CCCCCCCNCCOC 69cf410dbcae6250fa43ef62a2e446b9 [1,1,0,0,0,0|1,0,0]=3 8500 B11R0.3 CCCCCCCNCCON f930113a4574fbb3a759a5d6a5f56fb3 [1,1,0,0,0,0|1,0,0]=3 8501 B11R0.3 CCCCCCCNCCSC f2bda9ff673c32e61a51af258486ce04 [1,1,0,0,0,0|1,0,0]=3 8502 B11R0.3 CCCCCCCNCOCC 6085cc928a8612c71e1d4d6b1a7edbd3 [1,1,0,0,0,0|1,0,0]=3 8503 B11R0.3 CCCCCCCOCCC#N 2388aa86a539f8b7a76d16bb5de46da1 [1,1,0,0,0,0|1,0,1]=4 8504 B11R0.3 CCCCCCCOCCC=O 5cfef64155cbae6dbc467da4dd4c8b26 [1,1,0,0,0,0|0,0,2]=4 8505 B11R0.3 CCCCCCCOCCCC fa9669fb11a16db471e00134e33ec65d [1,1,0,0,0,0|0,0,0]=2 8506 B11R0.3 CCCCCCCOCCCF dc30ed190709942ca9892214ca06d346 [1,1,0,0,0,0|1,0,0]=3 8507 B11R0.3 CCCCCCCOCCCS 94ae84f911d880b1b60e67d5fe9456f9 [1,1,0,0,0,0|0,1,0]=3 8508 B11R0.3 CCCCCCCOCCOC da632fd4c8dbaa7e736986371e70812f [1,1,0,0,0,0|1,0,0]=3 8509 B11R0.3 CCCCCCCOCCSC 5d28dcb16e772f4082853bfc4000554e [1,1,0,0,0,0|1,0,0]=3 8510 B11R0.3 CCCCCCCOCOCC 79bd364aab6610fe1fe6d0e85e5d8630 [1,1,0,0,0,0|1,0,0]=3 8511 B11R0.3 CCCCCCNCC#CCO 2fb41be1cd187e5757a836763c6927e8 [1,1,0,0,0,0|0,0,2]=4 8512 B11R0.3 CCCCCCNCCCC#N 6450adec55a2d1c5eb37d2630fc1a8de [1,1,0,0,0,0|1,0,1]=4 8513 B11R0.3 CCCCCCNCCCC=O 30f6c36223cd033769b129f975d8cef5 [1,1,0,0,0,0|0,0,2]=4 8514 B11R0.3 CCCCCCNCCCCC 49296b0c254283861aea5ee041198391 [1,1,0,0,0,0|0,0,0]=2 8515 B11R0.3 CCCCCCNCCCCCl c3c1177d24b9e0eb9ac340c3d5d2e01b [1,1,0,0,0,0|1,0,0]=3 8516 B11R0.3 CCCCCCNCCCCF 848e11d8bf36fce980201576831556b2 [1,1,0,0,0,0|1,0,0]=3 8517 B11R0.3 CCCCCCNCCCCO 5685819b9fdb19d77b1eb89b122e386d [1,1,0,0,0,0|0,0,0]=2 8518 B11R0.3 CCCCCCNCCCCS 7732486ecc35b82a80124c607ae7d41e [1,1,0,0,0,0|0,1,0]=3 8519 B11R0.3 CCCCCCNCCCOC bde578c8d9647d5e2aa98bc1bfc21a23 [1,1,0,0,0,0|1,0,0]=3 8520 B11R0.3 CCCCCCNCCCSC fc46d58af1e179cb34e9472ac483e123 [1,1,0,0,0,0|1,0,0]=3 8521 B11R0.3 CCCCCCNCCOCC 742e1d719e7bb4c2babe34eeefcd2441 [1,1,0,0,0,0|1,0,0]=3 8522 B11R0.3 CCCCCCNCCSCC 0a52927d0b06e6fdc29929d5c3f1e34e [1,1,0,0,0,0|1,0,0]=3 8523 B11R0.3 CCCCCCOCCCC#N 8b95e943d69c5b284df97a18edf37768 [1,1,0,0,0,0|1,0,1]=4 8524 B11R0.3 CCCCCCOCCCC=O 30a74e5ed2ff3a69b75905a761317e27 [1,1,0,0,0,0|0,0,2]=4 8525 B11R0.3 CCCCCCOCCCCC b4a731a4f44998aaa50eb10174d909fa [1,1,0,0,0,0|0,0,0]=2 8526 B11R0.3 CCCCCCOCCCCF 3b92ad47d9a4134451da9c78fd137d31 [1,1,0,0,0,0|1,0,0]=3 8527 B11R0.3 CCCCCCOCCCCS 50e196097c995a826b03c4a2c09a8f26 [1,1,0,0,0,0|0,1,0]=3 8528 B11R0.3 CCCCCCOCCCOC dc5eb90e321eb6669467912229a368ab [1,1,0,0,0,0|1,0,0]=3 8529 B11R0.3 CCCCCCOCCCSC e0ec46f8980185e6f6c90003593ede81 [1,1,0,0,0,0|1,0,0]=3 8530 B11R0.3 CCCCCCOCCOCC b30cb0c340af407e0ea99dea3465c010 [1,1,0,0,0,0|1,0,0]=3 8531 B11R0.3 CCCCCCOCCOCF 0b35ab31df5814af01719c9472e98535 [1,1,0,0,0,0|2,0,0]=4 8532 B11R0.3 CCCCCCOCCSCC 372c890bd26b1016f7be8971144c7fa4 [1,1,0,0,0,0|1,0,0]=3 8533 B11R0.3 CCCCCNCCCCC#N eb4135188e2d680585d29cce5b56439d [1,1,0,0,0,0|1,0,1]=4 8534 B11R0.3 CCCCCNCCCCC=O ea129e49922b9d9682c373f7b912d205 [1,1,0,0,0,0|0,0,2]=4 8535 B11R0.3 CCCCCNCCCCCCl 8783a25d6d8306abaf43939f196da13e [1,1,0,0,0,0|1,0,0]=3 8536 B11R0.3 CCCCCNCCCCCF 13994f1eacfc3326220fe95f954366d9 [1,1,0,0,0,0|1,0,0]=3 8537 B11R0.3 CCCCCNCCCCCO 25d0eeb8faa7e77d0c7bc79c155084c3 [1,1,0,0,0,0|0,0,0]=2 8538 B11R0.3 CCCCCNCCCCOC 1ef55758759e7ac820d731e56ffe4a29 [1,1,0,0,0,0|1,0,0]=3 8539 B11R0.3 CCCCCNCCCCON 968b80605571535120584fa7e4f227ef [1,1,0,0,0,0|1,0,0]=3 8540 B11R0.3 CCCCCNCCCCSC 0e86bbf15c8e0b3c51d16bee56db84ad [1,1,0,0,0,0|1,0,0]=3 8541 B11R0.3 CCCCCNCCCOCC a1b38d8814819ddd88ad7e357f0539ab [1,1,0,0,0,0|1,0,0]=3 8542 B11R0.3 CCCCCNCCCSCC 6880dfdd42608112a8766448c64b5d7f [1,1,0,0,0,0|1,0,0]=3 8543 B11R0.3 CCCCCNCCOCCC 6590964a411046132458fdf2cb5c7ecf [1,1,0,0,0,0|1,0,0]=3 8544 B11R0.3 CCCCCNCCOCCO fe9162f54b5101a557bba86a31ce07e5 [1,1,0,0,0,0|1,0,0]=3 8545 B11R0.3 CCCCCNCCOCCS 52a6f8a0f3dadcc0d16bdf1fe0b53a2a [1,1,0,0,0,0|1,1,0]=4 8546 B11R0.3 CCCCCNCCOCOC 4b4c3c9890d79c9e5ab577b787db127a [1,1,0,0,0,0|2,0,0]=4 8547 B11R0.3 CCCCCNCCSCCO 7d0503daebc22b82247020334837979c [1,1,0,0,0,0|1,0,0]=3 8548 B11R0.3 CCCCCNCOCCCC 081ac8ceb579e9a15ccbe2c4b744ee08 [1,1,0,0,0,0|1,0,0]=3 8549 B11R0.3 CCCCCNCOCCOC 31103413105b8409b2d74111aec1513f [1,1,0,0,0,0|2,0,0]=4 8550 B11R0.3 CCCCCOCCCCC#N f774131c704fd02fd207b4ec8d1ef232 [1,1,0,0,0,0|1,0,1]=4 8551 B11R0.3 CCCCCOCCCCC=O be490e978aa800d48e6bb71673802e8a [1,1,0,0,0,0|0,0,2]=4 8552 B11R0.3 CCCCCOCCCCCF 755ae0a673d39bfc480773c3054368e3 [1,1,0,0,0,0|1,0,0]=3 8553 B11R0.3 CCCCCOCCCCOC 77f881265088d5fcfbbfeeadfcdedbe3 [1,1,0,0,0,0|1,0,0]=3 8554 B11R0.3 CCCCCOCCCCSC e423c097bc9500af43acd216c26ed988 [1,1,0,0,0,0|1,0,0]=3 8555 B11R0.3 CCCCCOCCCOCC 8f415b136edee3dd18226f52cdfec746 [1,1,0,0,0,0|1,0,0]=3 8556 B11R0.3 CCCCCOCCCOCF c33bd518a5f215807b3b35c7ab0d2ca8 [1,1,0,0,0,0|2,0,0]=4 8557 B11R0.3 CCCCCOCCCSCC d152f0f24c87dfe3226edda7a393a099 [1,1,0,0,0,0|1,0,0]=3 8558 B11R0.3 CCCCCOCCOCCC d4de75a36e1b8e5b9990549c6c49ae3d [1,1,0,0,0,0|1,0,0]=3 8559 B11R0.3 CCCCCOCCOCCF d790705a0911d720a268deceea2719d3 [1,1,0,0,0,0|2,0,0]=4 8560 B11R0.3 CCCCCOCCOCCS 7f0c3084b1dfb5c617457c70637aba0b [1,1,0,0,0,0|1,1,0]=4 8561 B11R0.3 CCCCCOCCOCOC 98ce6174e9a56db04ba48aa3e92b800d [1,1,0,0,0,0|2,0,0]=4 8562 B11R0.3 CCCCCOCCOCSC e56b5d2d5148cac9562af6f95b02eb28 [1,1,0,0,0,0|2,0,0]=4 8563 B11R0.3 CCCCCOCCSCCC 21bdcee15ce66355f7e953e9a5281f3b [1,1,0,0,0,0|1,0,0]=3 8564 B11R0.3 CCCCCOCOCCCC 86472914284346b0726a97759e9dbdaa [1,1,0,0,0,0|1,0,0]=3 8565 B11R0.3 CCCCCOCOCCOC a861a36e793c668e1d429babe837739c [1,1,0,0,0,0|2,0,0]=4 8566 B11R0.3 CCCCNCCCCCC#N 0b58e470868dddf2978a6494ab4f0fc0 [1,1,0,0,0,0|1,0,1]=4 8567 B11R0.3 CCCCNCCCCCC=O 80098dd3accdff0dd2fb7e04b95bf055 [1,1,0,0,0,0|0,0,2]=4 8568 B11R0.3 CCCCNCCCCCCCl 3bdcfd90cd17bd199a4e9bcc6247866f [1,1,0,0,0,0|1,0,0]=3 8569 B11R0.3 CCCCNCCCCCCF 792221cff14901f03892dd5847f325ff [1,1,0,0,0,0|1,0,0]=3 8570 B11R0.3 CCCCNCCCCCCO 18d6e73a0410fdb75fe54fc241b9d145 [1,1,0,0,0,0|0,0,0]=2 8571 B11R0.3 CCCCNCCCCCOC 39dd48d6a9a161764daafb8fcb68720b [1,1,0,0,0,0|1,0,0]=3 8572 B11R0.3 CCCCNCCCCSCC d8057eb68ff4e6b1bad58785e39559a5 [1,1,0,0,0,0|1,0,0]=3 8573 B11R0.3 CCCCNCCCOCCC a8e094ffbc04acf2b37fcc10a222ad6f [1,1,0,0,0,0|1,0,0]=3 8574 B11R0.3 CCCCNCCCOCCO 32850fa71b14884181218189c49377fe [1,1,0,0,0,0|1,0,0]=3 8575 B11R0.3 CCCCNCCOCCCC 4097b86ff9dbcff8e0e0e2c01bfdae73 [1,1,0,0,0,0|1,0,0]=3 8576 B11R0.3 CCCCNCCOCCCO eab03d027dc4b54efeffdb94ff865b0b [1,1,0,0,0,0|1,0,0]=3 8577 B11R0.3 CCCCNCCOCCOC 472419cef473adbd9ebb816fafb87734 [1,1,0,0,0,0|2,0,0]=4 8578 B11R0.3 CCCCNCCOCCON ed385b228fc2de38f4cf6608d1580d1d [1,1,0,0,0,0|2,0,0]=4 8579 B11R0.3 CCCCNCCSSCCO 4d885374aa42249993a9c2a9851be368 [1,1,0,0,0,0|2,0,0]=4 8580 B11R0.3 CCCCOCCCCCC#N 14326dc401f4384d520a1d249b9ed9e3 [1,1,0,0,0,0|1,0,1]=4 8581 B11R0.3 CCCCOCCCCCC=O ab5f42922e3122d7a63b27a5b77b4744 [1,1,0,0,0,0|0,0,2]=4 8582 B11R0.3 CCCCOCCCCCCF e6318e3fdcb569518cd3fe082761a6a1 [1,1,0,0,0,0|1,0,0]=3 8583 B11R0.3 CCCCOCCCCCCS fa2178b537fd8baeb81a0372c65e968c [1,1,0,0,0,0|0,1,0]=3 8584 B11R0.3 CCCCOCCCCCOC c4be7294b2a58faf58d44793b81a4f41 [1,1,0,0,0,0|1,0,0]=3 8585 B11R0.3 CCCCOCCCNCCC eec5f12f47b8d62e22170a01b43a0a36 [1,1,0,0,0,0|1,0,0]=3 8586 B11R0.3 CCCCOCCCNCCF fc3ee668f79739b27fa11ac840921091 [1,1,0,0,0,0|2,0,0]=4 8587 B11R0.3 CCCCOCCCNCCO 1b728ab01da5a5273aeb7ba49c7ed3e1 [1,1,0,0,0,0|1,0,0]=3 8588 B11R0.3 CCCCOCCCNCCS e6c9cca9157bb6e9111d463275ea145e [1,1,0,0,0,0|1,1,0]=4 8589 B11R0.3 CCCCOCCCNCOC 2d388fa6cd20f8fd5188171dca327978 [1,1,0,0,0,0|2,0,0]=4 8590 B11R0.3 CCCCOCCCNCSC baceca8843f0773833b1ece84aca39b3 [1,1,0,0,0,0|2,0,0]=4 8591 B11R0.3 CCCCOCCCOCCC 0e267ba7f302ce88de7473ef8eb67ac5 [1,1,0,0,0,0|1,0,0]=3 8592 B11R0.3 CCCCOCCCOCCF 475b892af5ff9e41110c151d7802e1dc [1,1,0,0,0,0|2,0,0]=4 8593 B11R0.3 CCCCOCCCOCCS ae5d9247445e5789d7d69b591a7f9ea9 [1,1,0,0,0,0|1,1,0]=4 8594 B11R0.3 CCCCOCCCOCOC 85b6440b2979c846fcccda16b109f66e [1,1,0,0,0,0|2,0,0]=4 8595 B11R0.3 CCCCOCCCOCSC e84908c8ce207436fef01373238ef0ec [1,1,0,0,0,0|2,0,0]=4 8596 B11R0.3 CCCCOCCNCCCCl a573b69ca5064c03014f54fb74cde8f6 [1,1,0,0,0,0|2,0,0]=4 8597 B11R0.3 CCCCOCCNCCCF d2b22aff81922f1c8a6044f83ab6adf6 [1,1,0,0,0,0|2,0,0]=4 8598 B11R0.3 CCCCOCCNCCCO 5340adda7912922acbc1b94ebf3c67dd [1,1,0,0,0,0|1,0,0]=3 8599 B11R0.3 CCCCOCCNCCCS 2ca5bb7f1984922c14cda7718d1dc207 [1,1,0,0,0,0|1,1,0]=4 8600 B11R0.3 CCCCOCCNCCOC 21e7c6f132ed5d6625561fe1215c92e3 [1,1,0,0,0,0|2,0,0]=4 8601 B11R0.3 CCCCOCCNCCON 84fee37f480966a5588a913d54dc6279 [1,1,0,0,0,0|2,0,0]=4 8602 B11R0.3 CCCCOCCNCCSC d061fd1455585b3ddc85bb56e7708145 [1,1,0,0,0,0|2,0,0]=4 8603 B11R0.3 CCCCOCCNCOCC 7e5434f0986eb951dfbb826d86726bf5 [1,1,0,0,0,0|2,0,0]=4 8604 B11R0.3 CCCCOCCOCCCC 88ee9046b462e34e38ad1fa133d32a9f [1,1,0,0,0,0|1,0,0]=3 8605 B11R0.3 CCCCOCCOCCCF 67a8b9f90f61c5b696c0e769e1650ee3 [1,1,0,0,0,0|2,0,0]=4 8606 B11R0.3 CCCCOCCOCCCS 8ab0046d0bc1b4753b456e54748a35fb [1,1,0,0,0,0|1,1,0]=4 8607 B11R0.3 CCCCOCCOCCOC 923922a189376a515952b31891623c1e [1,1,0,0,0,0|2,0,0]=4 8608 B11R0.3 CCCCOCCOCCSC 6604f7a0b6a290748961ba63d789af97 [1,1,0,0,0,0|2,0,0]=4 8609 B11R0.3 CCCCOCCOCOCC f82e6865445c9337c364f9a4f514fb7d [1,1,0,0,0,0|2,0,0]=4 8610 B11R0.3 CCCCOCCSCCCC 19ce1b75291094b8e50f1ed55e16a1aa [1,1,0,0,0,0|1,0,0]=3 8611 B11R0.3 CCCCOCNCCCCCl 2083d1f6a01d3bbeb19583d2ac06cf3e [1,1,0,0,0,0|2,0,0]=4 8612 B11R0.3 CCCCOCNCCCCO 70ef0ffa58df078c8e0d364ca5d503e8 [1,1,0,0,0,0|1,0,0]=3 8613 B11R0.3 CCCCOCNCCCCS d9ad9735824628eb14477f107a521ad7 [1,1,0,0,0,0|1,1,0]=4 8614 B11R0.3 CCCCOCNCCCOC bbcad5319992154d570147bcb94bc228 [1,1,0,0,0,0|2,0,0]=4 8615 B11R0.3 CCCCOCNCCCSC 5beec60a377e386c670de898128ff041 [1,1,0,0,0,0|2,0,0]=4 8616 B11R0.3 CCCCOCNCCOCC 2a391b47dfa3dda3891e9d0ea1f90e0b [1,1,0,0,0,0|2,0,0]=4 8617 B11R0.3 CCCCOCNCCSCC 1ddab26a0b967a95f1e37e10e1845100 [1,1,0,0,0,0|2,0,0]=4 8618 B11R0.3 CCCCOCOCCCCF 8a3f7db58a0d7fc59a42a0b63bf0cd46 [1,1,0,0,0,0|2,0,0]=4 8619 B11R0.3 CCCCOCOCCCCS 82d4bbf28ed192aac2700a45952c3bfa [1,1,0,0,0,0|1,1,0]=4 8620 B11R0.3 CCCCOCOCCCOC a8db1f776d3a406aa0dbda6d3dbbf77c [1,1,0,0,0,0|2,0,0]=4 8621 B11R0.3 CCCCOCOCCCSC ab3731fc3f8e0d7432fbe164c1856906 [1,1,0,0,0,0|2,0,0]=4 8622 B11R0.3 CCCCOCOCCOCC 0c321a4cf0739ae4f240c3159fa215bb [1,1,0,0,0,0|2,0,0]=4 8623 B11R0.3 CCCCOCOCCSCC e73c02b10b04ed5d1b1d1a047c182161 [1,1,0,0,0,0|2,0,0]=4 8624 B11R0.3 CCCCSCCOCCCF df5cde64992cb7020d157be2237c7440 [1,1,0,0,0,0|2,0,0]=4 8625 B11R0.3 CCCCSCCOCCCS ef7b60ce538d96620cd7e228ba9d4bbb [1,1,0,0,0,0|1,1,0]=4 8626 B11R0.3 CCCCSCCOCCOC 674bddb10bd38c518ddd8f984d38b6e3 [1,1,0,0,0,0|2,0,0]=4 8627 B11R0.3 CCCCSCCOCCSC 7b00428115bce5dc4a4966853868cd71 [1,1,0,0,0,0|2,0,0]=4 8628 B11R0.3 CCCCSCCOCOCC f08d74cf071e53504960bc65842cfeb5 [1,1,0,0,0,0|2,0,0]=4 8629 B11R0.3 CCCNCCCCCCC#N 4a03a665874c81a396d2599457d6ffb2 [1,1,0,0,0,0|1,0,1]=4 8630 B11R0.3 CCCNCCCCCCC=O c21851ba291c00a5db0d5d6b91dbd36c [1,1,0,0,0,0|0,0,2]=4 8631 B11R0.3 CCCNCCCCCCCO b9bdd5d4ba49cb40d08e76ab3ff5907d [1,1,0,0,0,0|0,0,0]=2 8632 B11R0.3 CCCNCCCCCCOC 4cc724ecdc92cad169e909d861e0a8d7 [1,1,0,0,0,0|1,0,0]=3 8633 B11R0.3 CCCNCCCCSCCC 1bd349d17770da69cd8537cdf810b463 [1,1,0,0,0,0|1,0,0]=3 8634 B11R0.3 CCCNCCCCSCCO d04bddeaa2a1cf092556151ae569625c [1,1,0,0,0,0|1,0,0]=3 8635 B11R0.3 CCCNCCCOCCCO cc7c88677b085dca732d7c038ed7b397 [1,1,0,0,0,0|1,0,0]=3 8636 B11R0.3 CCCNCCCOCCOC 21a2b60576f7180e2609bc7903a80cb8 [1,1,0,0,0,0|2,0,0]=4 8637 B11R0.3 CCCNCCCOCCSC 6db91c6065de8432960aceeb2e22237b [1,1,0,0,0,0|2,0,0]=4 8638 B11R0.3 CCCNCCOCCOCC dd01d37482fc2261d9be247d1bf7d59c [1,1,0,0,0,0|2,0,0]=4 8639 B11R0.3 CCCOCCCCCCC#N 9024856da22e90c6fcb02d47a521883e [1,1,0,0,0,0|1,0,1]=4 8640 B11R0.3 CCCOCCCCCCC=O 94f0c4ecacac557229497fd5ef55ea31 [1,1,0,0,0,0|0,0,2]=4 8641 B11R0.3 CCCOCCCCCCOC d862a222b60c44ec0327d3c88d0db06b [1,1,0,0,0,0|1,0,0]=3 8642 B11R0.3 CCCOCCCNCCCCl 976d3429ea4df947928c7ec1c1a430bd [1,1,0,0,0,0|2,0,0]=4 8643 B11R0.3 CCCOCCCNCCCF beea6336dde30ae40faae0d1baeff597 [1,1,0,0,0,0|2,0,0]=4 8644 B11R0.3 CCCOCCCNCCCO 9d72e4e1d93e2950c3cbfe802f41f5a8 [1,1,0,0,0,0|1,0,0]=3 8645 B11R0.3 CCCOCCCNCCCS 933cc42ed43e7f3ac653e313cf636742 [1,1,0,0,0,0|1,1,0]=4 8646 B11R0.3 CCCOCCCNCCOC 09006f22053a9473dd2ecf0faf9d1dbb [1,1,0,0,0,0|2,0,0]=4 8647 B11R0.3 CCCOCCCNCCON c9a4b13d4dd12809441a8d4787416d8b [1,1,0,0,0,0|2,0,0]=4 8648 B11R0.3 CCCOCCCNCCSC 4eb2d7e30d95ef7b7dfa4401388d2765 [1,1,0,0,0,0|2,0,0]=4 8649 B11R0.3 CCCOCCCNCOCC a2657cb1a38530b8919b9a9363091457 [1,1,0,0,0,0|2,0,0]=4 8650 B11R0.3 CCCOCCCOCCCF fead04536b98d0ec4d60d151baedfaed [1,1,0,0,0,0|2,0,0]=4 8651 B11R0.3 CCCOCCCOCCCS 2058ea52a314c12677dd46ae3c5161bb [1,1,0,0,0,0|1,1,0]=4 8652 B11R0.3 CCCOCCCOCCOC b45c1c8965f57a40eddaa52ae89db535 [1,1,0,0,0,0|2,0,0]=4 8653 B11R0.3 CCCOCCCOCCSC f02e1b253d8498cfb3dd746638cfb211 [1,1,0,0,0,0|2,0,0]=4 8654 B11R0.3 CCCOCCNCCCCCl 162ef68df9b6a388f8012ad60d45ac2a [1,1,0,0,0,0|2,0,0]=4 8655 B11R0.3 CCCOCCNCCCCF 3f4b9d990390bad3a82446661ed6d2bf [1,1,0,0,0,0|2,0,0]=4 8656 B11R0.3 CCCOCCNCCCCO 70b00fa7cf8b30f826b13f431dd86bf5 [1,1,0,0,0,0|1,0,0]=3 8657 B11R0.3 CCCOCCNCCCCS c66f176f4ef5162f1ec149782e4860d5 [1,1,0,0,0,0|1,1,0]=4 8658 B11R0.3 CCCOCCNCCCOC b3e51a32642c68fe9c9befe1452fd528 [1,1,0,0,0,0|2,0,0]=4 8659 B11R0.3 CCCOCCNCCCSC 164549f6be69e6f2663fdcd523037d69 [1,1,0,0,0,0|2,0,0]=4 8660 B11R0.3 CCCOCCNCCOCC 6dba694f2c2223ae97909267404230d2 [1,1,0,0,0,0|2,0,0]=4 8661 B11R0.3 CCCOCCNCCSCC e2fa629f3db323e9363c7537880a72bc [1,1,0,0,0,0|2,0,0]=4 8662 B11R0.3 CCCOCCOCCCCF c7a9069dfd50ce52e3c8b784baccee2d [1,1,0,0,0,0|2,0,0]=4 8663 B11R0.3 CCCOCCOCCCCS d760be8e31e1485f79c7e0241dfbe160 [1,1,0,0,0,0|1,1,0]=4 8664 B11R0.3 CCCOCCOCCCOC 94a3518c2624d66b851b16c19c06851d [1,1,0,0,0,0|2,0,0]=4 8665 B11R0.3 CCCOCCOCCCSC 5a4b14f13da6370d7cc78906f36d8910 [1,1,0,0,0,0|2,0,0]=4 8666 B11R0.3 CCCOCCOCCOCC 216199852210171a852cee3ed24f0cd9 [1,1,0,0,0,0|2,0,0]=4 8667 B11R0.3 CCCOCCOCCSCC 69568cd4359f040168ba8a11aa36263c [1,1,0,0,0,0|2,0,0]=4 8668 B11R0.3 CCCSCCCCNCCF af91762c76d0fd7db6e68eef4ebc6cfa [1,1,0,0,0,0|2,0,0]=4 8669 B11R0.3 CCCSCCCCNCCO 3b0b75358eae887295526550355e7be4 [1,1,0,0,0,0|1,0,0]=3 8670 B11R0.3 CCCSCCCCNCCS 9d655333043426788303b5a0cf5a4883 [1,1,0,0,0,0|1,1,0]=4 8671 B11R0.3 CCCSCCCCNCOC b1f1458df9b9b017f6ba159f69c56340 [1,1,0,0,0,0|2,0,0]=4 8672 B11R0.3 CCCSCCCCNCSC c8eadedb0a0dd3ff4357ef8b5cfdc505 [1,1,0,0,0,0|2,0,0]=4 8673 B11R0.3 CCCSCCOCCCCF 0f749b58d82b95fb3c028431be70133d [1,1,0,0,0,0|2,0,0]=4 8674 B11R0.3 CCCSCCOCCCOC 25d46a14a7f6e4679d7def9488b4cac6 [1,1,0,0,0,0|2,0,0]=4 8675 B11R0.3 CCCSCCOCCCSC 1b6b02389424efbd8c409790507a9b51 [1,1,0,0,0,0|2,0,0]=4 8676 B11R0.3 CCCSCCOCCOCC dfddf07b0ffcfb1fe4e06738a0bf8f0a [1,1,0,0,0,0|2,0,0]=4 8677 B11R0.3 CCCSCCOCCSCC 55e4c1503103e5cc6a5b31ffc4df388f [1,1,0,0,0,0|2,0,0]=4 8678 B11R0.3 CCNCCCCCCCCO c4c346164b321e06a97af679d071f408 [1,1,0,0,0,0|0,0,0]=2 8679 B11R0.3 CCNCCCCOCCOC 3ca0e5ea4c8eb0fa45b4a07e1fe0ea11 [1,1,0,0,0,0|2,0,0]=4 8680 B11R0.3 CCNCCOCCOCCO 18283c7c776bf848293f2c6f0ee76794 [1,1,0,0,0,0|2,0,0]=4 8681 B11R0.3 CCOCCCNCCCCCl 3c5cc3cadf4481f330f05cef849b3d8b [1,1,0,0,0,0|2,0,0]=4 8682 B11R0.3 CCOCCCNCCCCF fd61b3c356fe6fb3d5a32826b87bdb72 [1,1,0,0,0,0|2,0,0]=4 8683 B11R0.3 CCOCCCNCCCCO 5344e4c8236b7eda1a4068b527b5b268 [1,1,0,0,0,0|1,0,0]=3 8684 B11R0.3 CCOCCCNCCCCS 800cd6b86dd5aae04a941012cf94d624 [1,1,0,0,0,0|1,1,0]=4 8685 B11R0.3 CCOCCCNCCCOC 6240eb140c1834a6e47d307313bfb851 [1,1,0,0,0,0|2,0,0]=4 8686 B11R0.3 CCOCCCNCCCSC 982ab3bceb8f8173d5b13789a6abaa85 [1,1,0,0,0,0|2,0,0]=4 8687 B11R0.3 CCOCCCNCCOCC 5d287b0d76773211050b1421c12da649 [1,1,0,0,0,0|2,0,0]=4 8688 B11R0.3 CCOCCCNCCSCC 21dac26fa0359d05272cb998e9fce472 [1,1,0,0,0,0|2,0,0]=4 8689 B11R0.3 CCOCCCOCCCCF 3271ee24b75a7a7849d69fe84142dfd2 [1,1,0,0,0,0|2,0,0]=4 8690 B11R0.3 CCOCCCOCCCCS 44e0897e9fc7f97388381f9de6e05e6d [1,1,0,0,0,0|1,1,0]=4 8691 B11R0.3 CCOCCCOCCCOC 40182d05191b497fff008d827a9d32f2 [1,1,0,0,0,0|2,0,0]=4 8692 B11R0.3 CCOCCCOCCCSC 0f83e1119c68104926e8ec44720da875 [1,1,0,0,0,0|2,0,0]=4 8693 B11R0.3 CCOCCCOCCOCC 3b74ed71e97167ba2616a8fefee021c4 [1,1,0,0,0,0|2,0,0]=4 8694 B11R0.3 CCOCCCOCCSCC 5f71b4605e4476d14c8e844089a8fc57 [1,1,0,0,0,0|2,0,0]=4 8695 B11R0.3 CCOCCNCCCCCCl 2c628e5cf4f5fde13611b6640e927c10 [1,1,0,0,0,0|2,0,0]=4 8696 B11R0.3 CCOCCNCCCCCF 708d1a165774c22e31411aeab335b2d2 [1,1,0,0,0,0|2,0,0]=4 8697 B11R0.3 CCOCCNCCCCCO 27b36f1102de2cdc4a6ba0f3ebe9da1f [1,1,0,0,0,0|1,0,0]=3 8698 B11R0.3 CCOCCNCCCCOC 17260e50e2d37a1eeb8b7ef1b4744651 [1,1,0,0,0,0|2,0,0]=4 8699 B11R0.3 CCOCCNCCCCON dad64507791237ca11e7671a8b4f985f [1,1,0,0,0,0|2,0,0]=4 8700 B11R0.3 CCOCCNCCCCSC 4353f20b3bc2a33712c4f0000fd690d0 [1,1,0,0,0,0|2,0,0]=4 8701 B11R0.3 CCOCCNCCCSCC 9da5695d5cb7f8091db5f8df520bebf3 [1,1,0,0,0,0|2,0,0]=4 8702 B11R0.3 CCOCCNCCOCCO 8bc1e5bb9969b577b4b49921e8ee345d [1,1,0,0,0,0|2,0,0]=4 8703 B11R0.3 CCOCCNCCSCCO 7298151a296c100ce5b9f5e57ceeebb9 [1,1,0,0,0,0|2,0,0]=4 8704 B11R0.3 CCOCCOCCCCCF 9d685e8165aff605209a936844c31f52 [1,1,0,0,0,0|2,0,0]=4 8705 B11R0.3 CCOCCOCCCCOC d48c9952f9e6a97996c51898e03bbbe8 [1,1,0,0,0,0|2,0,0]=4 8706 B11R0.3 CCOCCOCCCCSC d536f941d8362407f26baf6febd9b15f [1,1,0,0,0,0|2,0,0]=4 8707 B11R0.3 CCOCCOCCCSCC 199e5695527247a2dde4b82b56782bc8 [1,1,0,0,0,0|2,0,0]=4 8708 B11R0.3 CCOCCOCCNCCO 87b75d27129c9aace282c7eed254fa19 [1,1,0,0,0,0|2,0,0]=4 8709 B11R0.3 CCOCNCCCCCCCl 108a52c9a3428f0fdb9342255d3755df [1,1,0,0,0,0|2,0,0]=4 8710 B11R0.3 CCOCNCCCCCCO 4835c13118ef3e10b732a77116c06de2 [1,1,0,0,0,0|1,0,0]=3 8711 B11R0.3 CCOCNCCCCCOC ee559d0336c8b617557672a6342acf19 [1,1,0,0,0,0|2,0,0]=4 8712 B11R0.3 CCOCNCCCCSCC 0307b138ac181199ee9faf28945100ed [1,1,0,0,0,0|2,0,0]=4 8713 B11R0.3 CCOCNCCCOCCO 8ce231c0bb79b38c38ca2ae26362ee07 [1,1,0,0,0,0|2,0,0]=4 8714 B11R0.3 CCOCNCCOCCCO 6a7e06ae7ee08b831d3b65d9f063c2f2 [1,1,0,0,0,0|2,0,0]=4 8715 B11R0.3 CCOCOCCCCCCF da3ccda5898c5ff5a7fd36c036ea136b [1,1,0,0,0,0|2,0,0]=4 8716 B11R0.3 CCOCOCCCCCCS 76b3989c316783ec373f2b83c7a231a1 [1,1,0,0,0,0|1,1,0]=4 8717 B11R0.3 CCSCCCCNCCCF 174fe0af7b3a24ed6f8218929e8991cf [1,1,0,0,0,0|2,0,0]=4 8718 B11R0.3 CCSCCCCNCCCO 5108aa514b949963955e6eabedae88db [1,1,0,0,0,0|1,0,0]=3 8719 B11R0.3 CCSCCCCNCCCS 8f7b9d1fcb442355929f66defcb05e49 [1,1,0,0,0,0|1,1,0]=4 8720 B11R0.3 CCSCCCCNCCOC 5017177987dfdcb29c18aad55825b8de [1,1,0,0,0,0|2,0,0]=4 8721 B11R0.3 CCSCCCCNCCSC d89b07d196e76ff10a493dda4edd13a0 [1,1,0,0,0,0|2,0,0]=4 8722 B11R0.3 CCSCCCNCCCCCl 53d3fa8b098aef9955bc3138718932d6 [1,1,0,0,0,0|2,0,0]=4 8723 B11R0.3 CCSCCCNCCCCO 3f45715406f57e5f60f30a201316f03c [1,1,0,0,0,0|1,0,0]=3 8724 B11R0.3 CCSCCCNCCCCS 4f738c1480fe783f3a0ab15adaf3cc78 [1,1,0,0,0,0|1,1,0]=4 8725 B11R0.3 CCSCCCNCCCOC 649a1f9ea7c5a4098c2dd31a7d1ce47b [1,1,0,0,0,0|2,0,0]=4 8726 B11R0.3 CCSCCCNCCCSC 0173f7cfc52002c7de76d6a0fb502fd2 [1,1,0,0,0,0|2,0,0]=4 8727 B11R0.3 CCSCCCNCCSCC 94a517e3aed6ecb86342b5cbdcda04e4 [1,1,0,0,0,0|2,0,0]=4 8728 B11R0.3 CCSCCCOCCCCF 377874639339be73bce6d9bd8a563987 [1,1,0,0,0,0|2,0,0]=4 8729 B11R0.3 CCSCCCOCCCCS 85f63a92aeb2475bacfe44fe435e1b1f [1,1,0,0,0,0|1,1,0]=4 8730 B11R0.3 CCSCCCOCCCOC 61f946ed070d067f58774f47c5427ef0 [1,1,0,0,0,0|2,0,0]=4 8731 B11R0.3 CCSCCCOCCCSC 889ca8c82ca2f4946c44e5f9fce097a8 [1,1,0,0,0,0|2,0,0]=4 8732 B11R0.3 CCSCCCOCCSCC 61c9206b8867585fb48fcbc126635161 [1,1,0,0,0,0|2,0,0]=4 8733 B11R0.3 CCSCCNCCCCCCl 5ad8b16006a9d2b4257ce7e64f24fa65 [1,1,0,0,0,0|2,0,0]=4 8734 B11R0.3 CCSCCNCCCCCF 617fd8f8b7607eac2b15cc64dcd72128 [1,1,0,0,0,0|2,0,0]=4 8735 B11R0.3 CCSCCNCCCCCO c237c5e88849ade6744fbc610974bc9c [1,1,0,0,0,0|1,0,0]=3 8736 B11R0.3 CCSCCNCCCCOC b2bc63701a7a4de60507e833007d8552 [1,1,0,0,0,0|2,0,0]=4 8737 B11R0.3 CCSCCNCCCCON fec4f3333743b2c09801f006620a8067 [1,1,0,0,0,0|2,0,0]=4 8738 B11R0.3 CCSCCNCCCCSC 899507c73125cb19b9decdc1e56eb2e8 [1,1,0,0,0,0|2,0,0]=4 8739 B11R0.3 CCSCCNCCOCCO 88d133afa277b61df3c13ddb7aa094da [1,1,0,0,0,0|2,0,0]=4 8740 B11R0.3 CCSCCNCCSCCO 4568bcac9c4204a71fc0d3d8257a66d0 [1,1,0,0,0,0|2,0,0]=4 8741 B11R0.3 CCSCCOCCCCCF 1e35344b6f7f81019a0a58c1847e7ca1 [1,1,0,0,0,0|2,0,0]=4 8742 B11R0.3 CCSCCOCCCCOC 45721489c9dbc6702653b5c114e9fd50 [1,1,0,0,0,0|2,0,0]=4 8743 B11R0.3 CCSCCOCCCCSC 19a57dd16e0c2584fe21798ed5140e5c [1,1,0,0,0,0|2,0,0]=4 8744 B11R0.3 COCCCCCCNCCBr 086e4cef0bb60111a718996f4b1c7979 [1,1,0,0,0,0|2,0,0]=4 8745 B11R0.3 COCCCCCCNCCF f820df48575d617cde70ec0ab3e8fac8 [1,1,0,0,0,0|2,0,0]=4 8746 B11R0.3 COCCCCCCNCCI bedf8cbe397828764ba0c38c4b1bbd45 [1,1,0,0,0,0|2,0,0]=4 8747 B11R0.3 COCCCCCCNCCO dc0846fae655ca426b0f0faf9c3bd2cb [1,1,0,0,0,0|1,0,0]=3 8748 B11R0.3 COCCCCCCNCCS d266b24707412722b9116b45b726de82 [1,1,0,0,0,0|1,1,0]=4 8749 B11R0.3 COCCCCCCOCCF 926dfd4d23a90e9f4d09925353f205ce [1,1,0,0,0,0|2,0,0]=4 8750 B11R0.3 COCCCCCCOCCS 53553bdfabf38e0812614173f739cc28 [1,1,0,0,0,0|1,1,0]=4 8751 B11R0.3 COCCCCCCOCOC 55b1b5a53aa01a60b8e8f83f9d3f2f1e [1,1,0,0,0,0|2,0,0]=4 8752 B11R0.3 COCCCCCCOCSC 2b2ccef6b327669bc8339d38fa70cba9 [1,1,0,0,0,0|2,0,0]=4 8753 B11R0.3 COCCCCCNCCCCl 0805fce347c9d99addd29ece536cc048 [1,1,0,0,0,0|2,0,0]=4 8754 B11R0.3 COCCCCCNCCCF 87a89127100c4f74832188aa87c449fd [1,1,0,0,0,0|2,0,0]=4 8755 B11R0.3 COCCCCCNCCCO fbd1ff608f55b41ca56f5aac36b457c4 [1,1,0,0,0,0|1,0,0]=3 8756 B11R0.3 COCCCCCNCCCS 8b8e8a231593321e4e5ce6f92bce34bb [1,1,0,0,0,0|1,1,0]=4 8757 B11R0.3 COCCCCCNCCOC 00518996005f7fdf2b4da5fbfcfef00b [1,1,0,0,0,0|2,0,0]=4 8758 B11R0.3 COCCCCCNCCON 549c89cb5978aeb7dc4047e69474f708 [1,1,0,0,0,0|2,0,0]=4 8759 B11R0.3 COCCCCCNCCSC 713f5e7341fb53e7bc2f148d88f18f57 [1,1,0,0,0,0|2,0,0]=4 8760 B11R0.3 COCCCCCOCCCF 902e1780f14ffb3e81c78f20d2f302a6 [1,1,0,0,0,0|2,0,0]=4 8761 B11R0.3 COCCCCCOCCCS 56668d5d554d73624d3313f15e475ffa [1,1,0,0,0,0|1,1,0]=4 8762 B11R0.3 COCCCCCOCCOC c5a5b4c7a76488e6eb9713fb8b50997a [1,1,0,0,0,0|2,0,0]=4 8763 B11R0.3 COCCCCCOCCSC 7529523b00836f5486ad9b330e783a38 [1,1,0,0,0,0|2,0,0]=4 8764 B11R0.3 COCCCCNCCCCCl 3ec64085b5ecc4dc8bded727b2c19651 [1,1,0,0,0,0|2,0,0]=4 8765 B11R0.3 COCCCCNCCCCF d0ffc027d9bd680e79466e6a81103f75 [1,1,0,0,0,0|2,0,0]=4 8766 B11R0.3 COCCCCNCCCCO 26d966c5b17e730d4323185dce89b754 [1,1,0,0,0,0|1,0,0]=3 8767 B11R0.3 COCCCCNCCCCS 3382028f1c48b0c37e158535d128651f [1,1,0,0,0,0|1,1,0]=4 8768 B11R0.3 COCCCCNCCCOC d68aa085309c72d39f1fe0a8507d8bb4 [1,1,0,0,0,0|2,0,0]=4 8769 B11R0.3 COCCCCNCCCSC abccb8707d017aec350c74f4c3b7cf26 [1,1,0,0,0,0|2,0,0]=4 8770 B11R0.3 COCCCCOCCCCF 10a1ee1e00b076cb4b21e7dc6073be29 [1,1,0,0,0,0|2,0,0]=4 8771 B11R0.3 COCCCCOCCCCS a184c313f94ac4f21e1688c1f5f859b9 [1,1,0,0,0,0|1,1,0]=4 8772 B11R0.3 COCCCCOCCCOC c52e5a6cb0ebc7dead591809feea9760 [1,1,0,0,0,0|2,0,0]=4 8773 B11R0.3 COCCCCOCCCSC 53fed3fdeda439d0b8e349222ff25f1e [1,1,0,0,0,0|2,0,0]=4 8774 B11R0.3 COCCCNCCCCCCl 2d2dd06dee1747745261a094617b7cfd [1,1,0,0,0,0|2,0,0]=4 8775 B11R0.3 COCCCNCCCCCF bd1c8c13d33e0b4965aeb9246b90d3c1 [1,1,0,0,0,0|2,0,0]=4 8776 B11R0.3 COCCCNCCCCCO c903e9482376dcb34b33b629df4bc140 [1,1,0,0,0,0|1,0,0]=3 8777 B11R0.3 COCCCNCCCCON 8d99d825d8bdfa0eb7bec3f58c31182e [1,1,0,0,0,0|2,0,0]=4 8778 B11R0.3 COCCCNCCCCSC e6d7a01efae43bee2f37f47bdad11a44 [1,1,0,0,0,0|2,0,0]=4 8779 B11R0.3 COCCCNCCOCCO a5c00f271146bed3cc2171d2535699dc [1,1,0,0,0,0|2,0,0]=4 8780 B11R0.3 COCCCNCCSCCO b173e28afb6b56188f37cfc0cc631ef5 [1,1,0,0,0,0|2,0,0]=4 8781 B11R0.3 COCCCOCCCCCF d70a2032399079e91d919f3b89c2db2d [1,1,0,0,0,0|2,0,0]=4 8782 B11R0.3 COCCCOCCCCSC 5740e23f74c6e43e7b7338c8c0638c77 [1,1,0,0,0,0|2,0,0]=4 8783 B11R0.3 COCCNCCCCCCCl ded7dcceec5f6a776846b9057e8258a6 [1,1,0,0,0,0|2,0,0]=4 8784 B11R0.3 COCCNCCCCCCF 7122ce4819c706fc94c246c08664df2c [1,1,0,0,0,0|2,0,0]=4 8785 B11R0.3 COCCNCCCCCCO 67b29718a05c587fececfbf75e6878e5 [1,1,0,0,0,0|1,0,0]=3 8786 B11R0.3 COCCNCCCOCCO da83a4169b265cf05b4075f3eb38a991 [1,1,0,0,0,0|2,0,0]=4 8787 B11R0.3 COCCNCCOCCCO fd75372f4b16e1343333a5b08ac7ed8b [1,1,0,0,0,0|2,0,0]=4 8788 B11R0.3 COCCOCCCCCCF 2335b1c819b29028000587f8a469db87 [1,1,0,0,0,0|2,0,0]=4 8789 B11R0.3 COCCOCCCCCCS 7096f857c8a8b57294e2d1eaf01a80c7 [1,1,0,0,0,0|1,1,0]=4 8790 B11R0.3 COCCOCCCCNCO b886c367e13390dc3a51b360c62b0154 [1,1,0,0,0,0|2,0,0]=4 8791 B11R0.3 COCCOCCCNCCO ca3b6902a11e1dd8292896309d8871b8 [1,1,0,0,0,0|2,0,0]=4 8792 B11R0.3 COCCOCCNCCCO 3c268b6e47d4b619ad86b2227d6a8d99 [1,1,0,0,0,0|2,0,0]=4 8793 B11R0.3 COCCOCNCCCCO 41a7c3429d22cab1838f670e0fab89f5 [1,1,0,0,0,0|2,0,0]=4 8794 B11R0.3 COCNCCCCCCCO e800d535ea51f07a03291d8a1e306e8b [1,1,0,0,0,0|1,0,0]=3 8795 B11R0.3 COCNCCCCSCCO 8e549e2ad51d3adb304e77a4c3570834 [1,1,0,0,0,0|2,0,0]=4 8796 B11R0.3 COCNCCCOCCCO e7a4c6441d16aa633b707ddf7b5bace3 [1,1,0,0,0,0|2,0,0]=4 8797 B11R0.3 COCOCCNCCCCO 8a7c46074ca9d7822065b29ee095ef91 [1,1,0,0,0,0|2,0,0]=4 8798 B11R0.3 CSCCCCNCCCCF 186208e94dc7385d1285b75975fff09a [1,1,0,0,0,0|2,0,0]=4 8799 B11R0.3 CSCCCCNCCCCO 7d5faf407297d4593213b3157ce5c772 [1,1,0,0,0,0|1,0,0]=3 8800 B11R0.3 CSCCCCNCCCSC 61a2176130c54446b5ea7bc6f7daa585 [1,1,0,0,0,0|2,0,0]=4 8801 B11R0.3 CSCCCCOCCCCF 17f802799f9b09ef8e200f69853ecf5d [1,1,0,0,0,0|2,0,0]=4 8802 B11R0.3 CSCCCCOCCCSC 679bb20bfa56a89ca119039dd4ebb941 [1,1,0,0,0,0|2,0,0]=4 8803 B11R0.3 CSCCCNCCCCCCl 59458e7c12e9357e6c0fa1b39622818f [1,1,0,0,0,0|2,0,0]=4 8804 B11R0.3 CSCCCNCCCCCF 4921a4e5ba231828ef012d6a154bce21 [1,1,0,0,0,0|2,0,0]=4 8805 B11R0.3 CSCCCNCCCCCO 8058bc5d242d8649b080d2dc4ab6b9c0 [1,1,0,0,0,0|1,0,0]=3 8806 B11R0.3 CSCCCNCCCCON e2da17a5cdde256d1d7e82d802044286 [1,1,0,0,0,0|2,0,0]=4 8807 B11R0.3 CSCCCNCCOCCO 04f30fd2b64b5fccace945abc634d38e [1,1,0,0,0,0|2,0,0]=4 8808 B11R0.3 CSCCCNCCSCCO 2e243ea1949cc389138db12bbe857fd7 [1,1,0,0,0,0|2,0,0]=4 8809 B11R0.3 CSCCCOCCCCCF 24979f7f2d4a94b05056c86f88a2ed92 [1,1,0,0,0,0|2,0,0]=4 8810 B11R0.3 CSCCNCCCCCCCl 882f63cd187a02f55a7b9efe953a8526 [1,1,0,0,0,0|2,0,0]=4 8811 B11R0.3 CSCCNCCCCCCF 5c0300e43b0e01cabad78968401e6a03 [1,1,0,0,0,0|2,0,0]=4 8812 B11R0.3 CSCCNCCCCCCO 95f4b666b2e83bf0f2463dd55512f7de [1,1,0,0,0,0|1,0,0]=3 8813 B11R0.3 CSCCNCCCOCCO b3ddee309c5d1ad4f063e7404a8f1ab8 [1,1,0,0,0,0|2,0,0]=4 8814 B11R0.3 CSCCNCCOCCCO b3abaf74c1a448762f724a92daf273dc [1,1,0,0,0,0|2,0,0]=4 8815 B11R0.3 CSCCOCCCCCCF 9fc846c15af2505341f2c7ba105e10b1 [1,1,0,0,0,0|2,0,0]=4 8816 B11R0.3 CSCCOCCCCCCS 137dc4fd1b3017ebfa61f46b29486a24 [1,1,0,0,0,0|1,1,0]=4 8817 B11R0.3 CSCCOCCCNCCO 8093ccde24df191eb9310bf31204ae4a [1,1,0,0,0,0|2,0,0]=4 8818 B11R0.3 CSCNCCCCCCCO 89cf90ea90f8f14f163e4e4086945c39 [1,1,0,0,0,0|1,0,0]=3 8819 B11R0.3 CSCNCCCCSCCO ef53cf7df27704c36abb2a6b53f26590 [1,1,0,0,0,0|2,0,0]=4 8820 B11R0.3 CSCNCCCOCCCO 5be496d637e8aa78b3d7309ee25778b3 [1,1,0,0,0,0|2,0,0]=4 8821 B11R0.3 FCCCCCCNCCCCl 5d27590680706d0a19a6bbe6e8572803 [1,1,0,0,0,0|2,0,0]=4 8822 B11R0.3 FCCCCCCOCCCF c703367db84392421c3718576f202890 [1,1,0,0,0,0|2,0,0]=4 8823 B11R0.3 FCCCCCCOCCCS 87488260d56782ca393e3a9d0fba9192 [1,1,0,0,0,0|1,1,0]=4 8824 B11R0.3 FCCCCCNCCCCCl 79595c37404256a436570c913ae5c72e [1,1,0,0,0,0|2,0,0]=4 8825 B11R0.3 FCCCCCNCCCCS cc603041419ad7257c4f98c3ab983b19 [1,1,0,0,0,0|1,1,0]=4 8826 B11R0.3 FCCCCCOCCCCF 64402fa647737470d07cdeef07303978 [1,1,0,0,0,0|2,0,0]=4 8827 B11R0.3 FCCCCCOCCCCS 3d1c6d8abc4b2d50396deb16ee6eb45b [1,1,0,0,0,0|1,1,0]=4 8828 B11R0.3 FCCCCNCCCCCCl 0501ba90f804b0c4c41424d92177b799 [1,1,0,0,0,0|2,0,0]=4 8829 B11R0.3 FCCCNCCCCCCCl 6143d97b44b04968f0c89d76187840ae [1,1,0,0,0,0|2,0,0]=4 8830 B11R0.3 FCCCOCCCCCCS d804242ab0187adf2d24276c9e542c95 [1,1,0,0,0,0|1,1,0]=4 8831 B11R0.3 N#CCCCCCCNCCO 1017059008a04fab526b2bf8d105bad8 [1,1,0,0,0,0|1,0,1]=4 8832 B11R0.3 N#CCCCCCNCCCO 4413e7f43900c28342374df8282bc3de [1,1,0,0,0,0|1,0,1]=4 8833 B11R0.3 N#CCCCCNCCCCO 4ae134edd83bb24c104cbb77adf9ddc7 [1,1,0,0,0,0|1,0,1]=4 8834 B11R0.3 N#CCCCNCCCCCO f728f94bf17b68b4e859ff3a47d25560 [1,1,0,0,0,0|1,0,1]=4 8835 B11R0.3 N#CCCNCCCCCCO cc2c939a78aaf4db642388a35b650b98 [1,1,0,0,0,0|1,0,1]=4 8836 B11R0.3 N#CCNCCCCCCCO bf64867869682f11f2c0bdc1bb7c1948 [1,1,0,0,0,0|1,0,1]=4 8837 B11R0.3 N#CNCCCCCCCCO e935dfecc00bdf521dfb4566b5b15ce5 [1,1,0,0,0,0|1,0,1]=4 8838 B11R0.3 NOCCCCNCCCCCl 5d1992a1296b9c037442c6474846125b [1,1,0,0,0,0|2,0,0]=4 8839 B11R0.3 NOCCCCNCCCCO 02431fe0e09e4f4d292a22a990e05ba8 [1,1,0,0,0,0|2,0,0]=4 8840 B11R0.3 NOCCCCNCCCCS 499411f19da8434db2b4da67be534943 [1,1,0,0,0,0|2,0,0]=4 8841 B11R0.3 NOCCNCCCCCCF cef900d6fc955739e7290a6dea96d41a [1,1,0,0,0,0|2,0,0]=4 8842 B11R0.3 NOCCNCCCCCCO bf1cf867ac53eda508b242e7e762384c [1,1,0,0,0,0|2,0,0]=4 8843 B11R0.3 O=CCCCCCCNCCO 4563f4506bdfa0337439838ef55d1213 [1,1,0,0,0,0|1,0,1]=4 8844 B11R0.3 O=CCCCCCNCCCO e8f48db490ac35989365ee24a0ce8127 [1,1,0,0,0,0|1,0,1]=4 8845 B11R0.3 O=CCCCCNCCCCO d03a813a710533d213d33230de522737 [1,1,0,0,0,0|1,0,1]=4 8846 B11R0.3 O=CCCCNCCCCCO 0241d2422a23be3107c4c8915a44c5bf [1,1,0,0,0,0|1,0,1]=4 8847 B11R0.3 O=CCCNCCCCCCO 114ae78e85061f9b979d8a595a972955 [1,1,0,0,0,0|1,0,1]=4 8848 B11R0.3 O=CCNCCCCCCCO 584c0678248808764029f11ce9b0f73a [1,1,0,0,0,0|1,0,1]=4 8849 B11R0.3 O=CNCCCCCCCCO ade378c7a1493dc87ce2ee94a0465e75 [1,1,0,0,0,0|1,0,1]=4 8850 B11R0.3 OCCCCCCCCNCF 0d872b98b2a95c92875278182a108b5b [1,1,0,0,0,0|1,0,0]=3 8851 B11R0.3 OCCCCCCCCNCO 06ea9db5cc8e1a7686a5ffeb8c34217c [1,1,0,0,0,0|1,0,0]=3 8852 B11R0.3 OCCCCCCCNCCBr 5611383d2817db033c2a42ecf3109ca3 [1,1,0,0,0,0|1,0,0]=3 8853 B11R0.3 OCCCCCCCNCCF 588f628bb4b6ff12f54feab307c9e507 [1,1,0,0,0,0|1,0,0]=3 8854 B11R0.3 OCCCCCCCNCCI 93735c976611dbc665ceec62cf2a2558 [1,1,0,0,0,0|1,0,0]=3 8855 B11R0.3 OCCCCCCCNCCO 302bd45cae4e6eb65d2fde13385cf644 [1,1,0,0,0,0|1,0,0]=3 8856 B11R0.3 OCCCCCCCNCCS e8c395c63130862d2a8b782bb312c8a7 [1,1,0,0,0,0|1,0,0]=3 8857 B11R0.3 OCCCCCCNCCCCl 23d295f39ea25d0bdc260c4e1006bd41 [1,1,0,0,0,0|1,0,0]=3 8858 B11R0.3 OCCCCCCNCCCF da44f47d03b2652ab4412e2f352645ad [1,1,0,0,0,0|1,0,0]=3 8859 B11R0.3 OCCCCCCNCCCO e12ee56ee8434bc57b960b5baf0d446a [1,1,0,0,0,0|1,0,0]=3 8860 B11R0.3 OCCCCCCNCCCS 4bf30050fb3735094c8d990b216227bd [1,1,0,0,0,0|1,0,0]=3 8861 B11R0.3 OCCCCCNCCCCCl 8127214bbb3398b72b02fc719e3caff7 [1,1,0,0,0,0|1,0,0]=3 8862 B11R0.3 OCCCCCNCCCCF 5b53447ba67bb20b7fe6faa9cbcbc1b3 [1,1,0,0,0,0|1,0,0]=3 8863 B11R0.3 OCCCCCNCCCCO 2cec7b546a19f647fa8f919c7f56a16f [1,1,0,0,0,0|1,0,0]=3 8864 B11R0.3 OCCCCCNCCCCS 2131849f28716e0ebdf5c0664c87c6d4 [1,1,0,0,0,0|1,0,0]=3 8865 B11R0.3 OCCCCNCCCCCCl 0f0f19f6f26da1ba278dd2a9e2523412 [1,1,0,0,0,0|1,0,0]=3 8866 B11R0.3 OCCCCNCCCCCF 34c6a656754cccefee3315dd9f216833 [1,1,0,0,0,0|1,0,0]=3 8867 B11R0.3 OCCCCNCCOCCO f24a21ab6aae71b9a259b45a29057e85 [1,1,0,0,0,0|2,0,0]=4 8868 B11R0.3 OCCCCNCCOCCS 8f886f79161c248f597fc25e9577397e [1,1,0,0,0,0|2,0,0]=4 8869 B11R0.3 OCCCCNCCSCCO d354afd97ed9a277e579f0e522f68500 [1,1,0,0,0,0|2,0,0]=4 8870 B11R0.3 OCCCNCCCCCCCl 9a9e2739daba9096f745b79fbe0e7ffc [1,1,0,0,0,0|1,0,0]=3 8871 B11R0.3 OCCCNCCCCCCF 7a0ff36abe9facd5d6f6591b47f70472 [1,1,0,0,0,0|1,0,0]=3 8872 B11R0.3 OCCCNCCCOCCO dc9b9099ef237801105438bc55533422 [1,1,0,0,0,0|2,0,0]=4 8873 B11R0.3 OCCCNCCOCCCO 84c7efdef98fc9cbe4d33a81d95ec947 [1,1,0,0,0,0|2,0,0]=4 8874 B11R0.3 OCCCOCCCNCCBr b97f8b716f9953232d9c19e770fa34c6 [1,1,0,0,0,0|2,0,0]=4 8875 B11R0.3 OCCCOCCCNCCF cd16f411a15d55b6627fcc54933cfd87 [1,1,0,0,0,0|2,0,0]=4 8876 B11R0.3 OCCCOCCCNCCI 0b6a1c9d4975989805114788432897e8 [1,1,0,0,0,0|2,0,0]=4 8877 B11R0.3 OCCCOCCCNCCO b959e5e46a857ff4c84fee347fedfd6c [1,1,0,0,0,0|2,0,0]=4 8878 B11R0.3 OCCCOCCCNCCS 223a6ea11d661bf821cad4da59f85db5 [1,1,0,0,0,0|2,0,0]=4 8879 B11R0.3 OCCCOCCNCCCF e05b870c074a5c908e93cdd50f4d99c1 [1,1,0,0,0,0|2,0,0]=4 8880 B11R0.3 OCCCOCCNCCCS b5b7e6970fc8c394bad1c657443752cf [1,1,0,0,0,0|2,0,0]=4 8881 B11R0.3 OCCNCCCCSCCO 703cb36484df0f00ed0aff3c8011cf87 [1,1,0,0,0,0|2,0,0]=4 8882 B11R0.3 OCCOCCCNCCCF 5873cf297f4ec030d97182a306d8ca0a [1,1,0,0,0,0|2,0,0]=4 8883 B11R0.3 OCCOCCCNCCCS 53a7d0a5e9cd774cbc81225a15473019 [1,1,0,0,0,0|2,0,0]=4 8884 B11R0.3 OCCOCCNCCCCCl c1d51b75972152aaa31342a611568735 [1,1,0,0,0,0|2,0,0]=4 8885 B11R0.3 OCCOCCNCCCCF 420a8c294517dc6742683104faa1a442 [1,1,0,0,0,0|2,0,0]=4 8886 B11R0.3 OCCOCCNCCCCS 410d8fe4bf1e6beba43a457738ffbae5 [1,1,0,0,0,0|2,0,0]=4 8887 B11R0.3 OCCSCCCCNCCF bcf4f26deec2b7c0db6171e2546d7c0a [1,1,0,0,0,0|2,0,0]=4 8888 B11R0.3 OCCSCCCCNCCS 573741b3d80f7f60d481a64f8b6ba497 [1,1,0,0,0,0|2,0,0]=4 8889 B11R0.3 OCCSCCNCCCCF 26471c381bcde5487f4440a169746abb [1,1,0,0,0,0|2,0,0]=4 8890 B11R0.3 SCCCCCCOCCCS 73575d5752e0cce9ba8d51bed17d670f [1,1,0,0,0,0|1,1,0]=4 8891 B11R0.3 SCCCNCCCCCCCl 595fb3b67ec2e05540ca323fd810239e [1,1,0,0,0,0|1,1,0]=4 8892 B11R0.4 CC(CCO)CNCCCCF 7947b7c05449194cb64969d3c1ee6802 [1,1,0,0,0,0|2,0,0]=4 8893 B11R0.4 CC(CCO)CNCCCCO 5059202a05992fcf8c04db8e860e2004 [1,1,0,0,0,0|2,0,0]=4 8894 B11R0.4 CC(CCO)NCCCCCCl 121d3d37fbfad5bcfc31aa4ce07be760 [1,1,0,0,0,0|2,0,0]=4 8895 B11R0.4 CC(CCO)NCCCCCF 5d2d070165685beaee5790948ecd3fe3 [1,1,0,0,0,0|2,0,0]=4 8896 B11R0.4 CC(CCO)NCCCCCO e6b2f342beb2df5b08f55cde4b467ab2 [1,1,0,0,0,0|2,0,0]=4 8897 B11R0.4 CCCC(=O)CNCCCCO ad77a490abf61282724383d41a85bcf1 [1,1,0,0,0,0|1,0,1]=4 8898 B11R0.4 CCCC(=O)NCCCCCO a305ba074b2c53f5334878718cbd2dcc [1,1,0,0,0,0|1,0,1]=4 8899 B11R0.4 CCCC(C)CCCOCCF 5e54f689e9da370fc0980ed79bd439e7 [1,1,0,0,0,0|2,0,0]=4 8900 B11R0.4 CCCC(C)CCCOCCS ed4895a98c09bc0934091d2055d8862d [1,1,0,0,0,0|1,1,0]=4 8901 B11R0.4 CCCC(C)CCCOCOC 6d153c4b7e65f6a81dfd2193583fa6f8 [1,1,0,0,0,0|2,0,0]=4 8902 B11R0.4 CCCC(C)CCCOCSC 29ce8a62266bcc8fbd76e4f7a6ce78fe [1,1,0,0,0,0|2,0,0]=4 8903 B11R0.4 CCCC(C)CCOCCCF 5124dc58198000224065e030fa0a9dbb [1,1,0,0,0,0|2,0,0]=4 8904 B11R0.4 CCCC(C)CCOCCCS 2bd8f211a8e93727e3f0905a4c42df15 [1,1,0,0,0,0|1,1,0]=4 8905 B11R0.4 CCCC(C)CCOCCOC 6fbb44e4d7391613ed8cc69b14c2061a [1,1,0,0,0,0|2,0,0]=4 8906 B11R0.4 CCCC(C)CCOCCSC 100e9e719da55ff2612ad47e780bb070 [1,1,0,0,0,0|2,0,0]=4 8907 B11R0.4 CCCC(C)CCOCOCC ecac84d2e97a9625ab40417a028c68a7 [1,1,0,0,0,0|2,0,0]=4 8908 B11R0.4 CCCC(C)CNCCCCCl b88ddf586b2fbbb868d258405f94eef3 [1,1,0,0,0,0|2,0,0]=4 8909 B11R0.4 CCCC(C)CNCCCCO 16ed810509952b5802a91fffe7eb7616 [1,1,0,0,0,0|1,0,0]=3 8910 B11R0.4 CCCC(C)CNCCCCS 5bb254c924c5a3e3dbda995831cd1ed8 [1,1,0,0,0,0|1,1,0]=4 8911 B11R0.4 CCCC(C)CNCCCOC a293d0b39a251f5bbcc300329fa5dcac [1,1,0,0,0,0|2,0,0]=4 8912 B11R0.4 CCCC(C)CNCCCSC 358a8c44df9baa2c860bf4091fe0e1af [1,1,0,0,0,0|2,0,0]=4 8913 B11R0.4 CCCC(C)CNCCOCC 2086cdc276f604ad6008cb2c5cbd4dd8 [1,1,0,0,0,0|2,0,0]=4 8914 B11R0.4 CCCC(C)CNCCSCC fd9af2d1c3a3a6637aae882336dec41a [1,1,0,0,0,0|2,0,0]=4 8915 B11R0.4 CCCC(C)COCCCCF cd4af7ff3f0bc959fcf9ebbcc893455f [1,1,0,0,0,0|2,0,0]=4 8916 B11R0.4 CCCC(C)COCCCCS f1f042c93c44cf15ce9c2d9836136df7 [1,1,0,0,0,0|1,1,0]=4 8917 B11R0.4 CCCC(C)COCCCOC b2e306e547636908e0692db0879af42d [1,1,0,0,0,0|2,0,0]=4 8918 B11R0.4 CCCC(C)COCCCSC 6ae2050a146f0b80da2ad16c1aa6f6c3 [1,1,0,0,0,0|2,0,0]=4 8919 B11R0.4 CCCC(C)COCCOCC e0ed2c5ed8daf98da0dd4135fda901c7 [1,1,0,0,0,0|2,0,0]=4 8920 B11R0.4 CCCC(C)COCCSCC ee0c3dcb868faf17bb2edfd25f3fc94f [1,1,0,0,0,0|2,0,0]=4 8921 B11R0.4 CCCC(C)NCCCCCCl 33ab14a058e1fcef505e067708d53a82 [1,1,0,0,0,0|2,0,0]=4 8922 B11R0.4 CCCC(C)NCCCCCF 7e37d4d8d8ebc575a7c6db7941f6ab9f [1,1,0,0,0,0|2,0,0]=4 8923 B11R0.4 CCCC(C)NCCCCCO 42022f2d2382cced620bf4dacd7724d2 [1,1,0,0,0,0|1,0,0]=3 8924 B11R0.4 CCCC(C)NCCCCOC 934ef2763cda7c5fece951ace8f4829f [1,1,0,0,0,0|2,0,0]=4 8925 B11R0.4 CCCC(C)NCCCCSC 4266871fed6295ebdbb3f579393bc35a [1,1,0,0,0,0|2,0,0]=4 8926 B11R0.4 CCCC(C)NCCCOCC df05e9177587024561c74ae1a3207ada [1,1,0,0,0,0|2,0,0]=4 8927 B11R0.4 CCCC(C)NCCCSCC 5ed3ec64e5893ad83461ead76da5ccf5 [1,1,0,0,0,0|2,0,0]=4 8928 B11R0.4 CCCC(C)NCCOCCO 7608e9f9676082b4d0341c2bfbef636f [1,1,0,0,0,0|2,0,0]=4 8929 B11R0.4 CCCC(C)NCCSCCO a56e6bd7cd1c006280bafea7ac0b2feb [1,1,0,0,0,0|2,0,0]=4 8930 B11R0.4 CCCC(C)OCCCCCF 4da4ce03e76be5a5169cbc6bf5161b81 [1,1,0,0,0,0|2,0,0]=4 8931 B11R0.4 CCCC(C)OCCCCOC 623038ded2cd908bf44b18471915e504 [1,1,0,0,0,0|2,0,0]=4 8932 B11R0.4 CCCC(C)OCCCCSC 7e09152fdbbfecdc423fd28ee6f4342f [1,1,0,0,0,0|2,0,0]=4 8933 B11R0.4 CCCC(C)OCCCOCC 01c338ca32fc1899c11db4908d4e8a0f [1,1,0,0,0,0|2,0,0]=4 8934 B11R0.4 CCCC(C)OCCCSCC c67e99144cb2114dfb09b937310057f9 [1,1,0,0,0,0|2,0,0]=4 8935 B11R0.4 CCCC(O)CNCCCCF cd932467cdae7a3b0dd59466774f84c3 [1,1,0,0,0,0|2,0,0]=4 8936 B11R0.4 CCCC(O)CNCCCCO 40865fc06a718807fd947253975681ea [1,1,0,0,0,0|1,0,0]=3 8937 B11R0.4 CCCC(O)CNCCCOC 197a37669d872c1a4f1efb739e9bf1d9 [1,1,0,0,0,0|2,0,0]=4 8938 B11R0.4 CCCC(O)CNCCCSC 98abd138fe943ecbb20ec0f47ce3497c [1,1,0,0,0,0|2,0,0]=4 8939 B11R0.4 CCCC(O)CNCCOCC 1d803b843d39ce54f6aedd8dc4a2b80c [1,1,0,0,0,0|2,0,0]=4 8940 B11R0.4 CCCC(O)CNCCSCC b5038a31b1dc66dad17dd75230106076 [1,1,0,0,0,0|2,0,0]=4 8941 B11R0.4 CCCC(S)CCOCCCF 808968ea732b51e35bc55770740a36c7 [1,1,0,0,0,0|2,0,0]=4 8942 B11R0.4 CCCC(S)CCOCCCS 0b556a2ddb4eedf9d401722bf7a6902b [1,1,0,0,0,0|1,1,0]=4 8943 B11R0.4 CCCC(S)CCOCCOC 8d61c73af6e3279d67dc574b9c498451 [1,1,0,0,0,0|2,0,0]=4 8944 B11R0.4 CCCC(S)CCOCCSC ae6b62ff6133dd0fd49c986831c45085 [1,1,0,0,0,0|2,0,0]=4 8945 B11R0.4 CCCC(S)CCOCOCC d84bb84353930f3815dbdf24ba692855 [1,1,0,0,0,0|2,0,0]=4 8946 B11R0.4 CCCCCCCC(C)OCC 55dc2743b0b446cf9a6056de2b74c617 [1,1,0,0,0,0|1,0,0]=3 8947 B11R0.4 CCCCCCCC(C)OCF 3fba61538d49d98b37b9f07a88c7f983 [1,1,0,0,0,0|2,0,0]=4 8948 B11R0.4 CCCCCCCN(C)CCC 42b62aaf36e74de6c1558dc7962934ed [1,1,0,0,0,0|1,0,0]=3 8949 B11R0.4 CCCCCCCN(C)CCF db1f8e1b926d439bcb75670beb422b85 [1,1,0,0,0,0|2,0,0]=4 8950 B11R0.4 CCCCCCCN(C)CCO 4b82b57c2e27ee478b4db099376fba2f [1,1,0,0,0,0|1,0,0]=3 8951 B11R0.4 CCCCCCCN(C)CCS b2240761ced255748476441b558b3f51 [1,1,0,0,0,0|1,1,0]=4 8952 B11R0.4 CCCCCCCN(C)COC 6b1c941d11ed516810c29fb4806a97a3 [1,1,0,0,0,0|2,0,0]=4 8953 B11R0.4 CCCCCCCN(C)CSC a84e5e75c29c0638a1a45b4c73f7b981 [1,1,0,0,0,0|2,0,0]=4 8954 B11R0.4 CCCCCCC[C@H](C)NCC c7f8f4e0349dda9a4d6df587a3a48118 [1,1,0,0,0,0|1,0,0]=3 8955 B11R0.4 CCCCCCC[C@H](C)NCF 368f59e933291764ad1c7e2846e804c0 [1,1,0,0,0,0|2,0,0]=4 8956 B11R0.4 CCCCCCC[C@H](C)NCO b897aee6051defb04f5f6cf3c8a31ab5 [1,1,0,0,0,0|1,0,0]=3 8957 B11R0.4 CCCCCCNC(=O)CCC 86ff0f5e9c808359785c4d555716a0c6 [1,1,0,0,0,0|1,0,1]=4 8958 B11R0.4 CCCCCCNC(=O)CCO c087b3675c7cb5dcfde9fa6dcbdb3e38 [1,1,0,0,0,0|1,0,1]=4 8959 B11R0.4 CCCCCCNC(C)CCC e15b64efeec077d5146a1ed68ae5a97c [1,1,0,0,0,0|1,0,0]=3 8960 B11R0.4 CCCCCCNC(C)CCO 3c37ba78238e6b6e509c763f65a89e15 [1,1,0,0,0,0|1,0,0]=3 8961 B11R0.4 CCCCCCNC(C)COC b30472eb7a71a526e25a1657ace844a6 [1,1,0,0,0,0|2,0,0]=4 8962 B11R0.4 CCCCCCN[C@@H](C)CCC 9e551837f3d2e34034ae13f2ada41469 [1,1,0,0,0,0|1,0,0]=3 8963 B11R0.4 CCCCCCN[C@@H](C)CCO ef20604c1d13846f7a5ae7f726081f93 [1,1,0,0,0,0|1,0,0]=3 8964 B11R0.4 CCCCCCN[C@@H](C)COC af42f1ac714ecf475c2cc8e369f95e1d [1,1,0,0,0,0|2,0,0]=4 8965 B11R0.4 CCCCCCN[C@H](C)CCO d0862c4bfa9c321df31f29a6ac758d6b [1,1,0,0,0,0|1,0,0]=3 8966 B11R0.4 CCCCCCN[C@H](C)COC 43fd59b6b2050599d7c77580a72b29e0 [1,1,0,0,0,0|2,0,0]=4 8967 B11R0.4 CCCCCCOC(=S)CCC ebc5344eafa6dd48024f5c5c5e052730 [1,1,0,0,0,0|1,0,1]=4 8968 B11R0.4 CCCCCCOC(C)CCC cea4e96bc53eba73e0ac0d9156eceb52 [1,1,0,0,0,0|1,0,0]=3 8969 B11R0.4 CCCCCCOC(C)COC 0a2c46151a842c0a8316d557e607046e [1,1,0,0,0,0|2,0,0]=4 8970 B11R0.4 CCCCCCOC(C)CSC fe4e3dcaf8f7e4380a9442a63453b639 [1,1,0,0,0,0|2,0,0]=4 8971 B11R0.4 CCCCCCO[C@@H](C)CCC cefe966dfbc957ea180b07a37145634e [1,1,0,0,0,0|1,0,0]=3 8972 B11R0.4 CCCCCCO[C@@H](C)COC ad5ca165c625a8d30ea6f3b7e3544f87 [1,1,0,0,0,0|2,0,0]=4 8973 B11R0.4 CCCCCCO[C@H](C)CCC 383ab7bdac9ecd3e781dc6eb08bc1705 [1,1,0,0,0,0|1,0,0]=3 8974 B11R0.4 CCCCCCO[C@H](C)COC 00df1469b8da9a805d5461f42fa6023c [1,1,0,0,0,0|2,0,0]=4 8975 B11R0.4 CCCCCNCC(=O)CCC 5c0a36c9da6990262983584768700e06 [1,1,0,0,0,0|1,0,1]=4 8976 B11R0.4 CCCCCNCC(C)CCC 6d31555560d55039d0b3f1326793fe29 [1,1,0,0,0,0|1,0,0]=3 8977 B11R0.4 CCCCCNCC(C)CCO e616c0d83429131bb679051a47b6be08 [1,1,0,0,0,0|1,0,0]=3 8978 B11R0.4 CCCCCNCC(C)OCC 80310c21a43275ed4a5101fa3df20ec3 [1,1,0,0,0,0|2,0,0]=4 8979 B11R0.4 CCCCCNCC(O)CCC 6fb3e4f64de8bdbce13ab483fc3e7540 [1,1,0,0,0,0|1,0,0]=3 8980 B11R0.4 CCCCCNCC(O)COC 0e0e9052b1492e70629bf047509802a8 [1,1,0,0,0,0|2,0,0]=4 8981 B11R0.4 CCCCCNC[C@@H](O)CCO bdfd88a3d4ff55c01c5cfc1f5bba32b4 [1,1,0,0,0,0|1,0,0]=3 8982 B11R0.4 CCCCCNC[C@H](O)COC b6289c37a683c4930d21e58655f2c609 [1,1,0,0,0,0|2,0,0]=4 8983 B11R0.4 CCCCCOCC(=O)CCC 8262177c32a9450a29113f02c3e40c8e [1,1,0,0,0,0|1,0,1]=4 8984 B11R0.4 CCCCCOCC(C)CCC 1f36716bae62124915274758b1ca904a [1,1,0,0,0,0|1,0,0]=3 8985 B11R0.4 CCCCCOCC(C)OCC 83f87eb48f216a550822e2968f3bab11 [1,1,0,0,0,0|2,0,0]=4 8986 B11R0.4 CCCCCOC[C@@H](O)CCO 3968df4237b71e64b4f9295c1d148fbc [1,1,0,0,0,0|1,0,0]=3 8987 B11R0.4 CCCCNCCN(C)CCO 7b48eb574e74735944f950248a22b0af [1,1,0,0,0,0|2,0,0]=4 8988 B11R0.4 CCCCOCCC(C)CCC 418b690c6d2fa614cbcb46958f840609 [1,1,0,0,0,0|1,0,0]=3 8989 B11R0.4 CCCCOCCC(S)CCC fced6969366cebe3ae9b1440202c0c65 [1,1,0,0,0,0|1,0,0]=3 8990 B11R0.4 CCCCOCCN(C)CCC 27d76c00867eab3ac8a5b5b688fbe418 [1,1,0,0,0,0|2,0,0]=4 8991 B11R0.4 CCCCOCCN(C)CCO a37f620faa64d7bf80b2a73a3a97ae6f [1,1,0,0,0,0|2,0,0]=4 8992 B11R0.4 CCCCOCNC(C)CCC 185c7cbc311f48390b42bd1068d66d9e [1,1,0,0,0,0|2,0,0]=4 8993 B11R0.4 CCCCOCNC(C)CCO 86ffd541637c5e3583f9e072027bc1a0 [1,1,0,0,0,0|2,0,0]=4 8994 B11R0.4 CCCCOCN[C@@H](C)CCC 0e22b32d8d5a9ad843e0b3ba7d6f7683 [1,1,0,0,0,0|2,0,0]=4 8995 B11R0.4 CCCCOCN[C@@H](C)CCO 694918313d67be79e101035a45a11f15 [1,1,0,0,0,0|2,0,0]=4 8996 B11R0.4 CCCCOCN[C@H](C)CCO 8a0698739042eaac6bc44e533ac8a8e5 [1,1,0,0,0,0|2,0,0]=4 8997 B11R0.4 CCCCOCOC(C)CCC 0a4bb62dbc4cfedab12fd971dbe21ee1 [1,1,0,0,0,0|2,0,0]=4 8998 B11R0.4 CCCCOCO[C@@H](C)CCC 3ae7f2326c6dcb1799bf845878cdbc74 [1,1,0,0,0,0|2,0,0]=4 8999 B11R0.4 CCCCOCO[C@H](C)CCC 4c7bf02695cb84868576521334a48dd0 [1,1,0,0,0,0|2,0,0]=4 9000 B11R0.4 CCCN(C)CCCCCCF a601c857b4403d63cc5d582bc896bcaa [1,1,0,0,0,0|2,0,0]=4 9001 B11R0.4 CCCN(C)CCCCCCO 7b2e6e9a2805e1f19dc02fa5859816c2 [1,1,0,0,0,0|1,0,0]=3 9002 B11R0.4 CCCN(C)CCCCCOC 17a2722347627b071daca0384c1b1f44 [1,1,0,0,0,0|2,0,0]=4 9003 B11R0.4 CCCNCCCN(C)CCO a5d245cfa34cd116203e74caba449b17 [1,1,0,0,0,0|2,0,0]=4 9004 B11R0.4 CCCOCCCC(C)CCC a53b5c18543174a41f05c1546d98d86e [1,1,0,0,0,0|1,0,0]=3 9005 B11R0.4 CCCOCCCN(C)CCC 902a46893d5befbfbf4388d5ee902c10 [1,1,0,0,0,0|2,0,0]=4 9006 B11R0.4 CCCOCCCN(C)CCO bbf9d23ff20931ecb275eab548ab8334 [1,1,0,0,0,0|2,0,0]=4 9007 B11R0.4 CCCOCCNC(C)CCC 31e8d7c8653fe82d02ce2954b5bcd9ab [1,1,0,0,0,0|2,0,0]=4 9008 B11R0.4 CCCOCCNC(C)CCO f72e45236175384a5d3740f1134d3dcc [1,1,0,0,0,0|2,0,0]=4 9009 B11R0.4 CCCOCCN[C@@H](C)CCC d1698bdebe5ab6544c48057e9e0adf00 [1,1,0,0,0,0|2,0,0]=4 9010 B11R0.4 CCCOCCN[C@@H](C)CCO b2d47b9874332c1c01e88f37cb4160d2 [1,1,0,0,0,0|2,0,0]=4 9011 B11R0.4 CCCOCCN[C@H](C)CCO 8fc31915ba4a10bfefb003f281c36a79 [1,1,0,0,0,0|2,0,0]=4 9012 B11R0.4 CCCOCCOC(C)CCC 0718f8788045b926ec65216173e53bce [1,1,0,0,0,0|2,0,0]=4 9013 B11R0.4 CCCOCCO[C@@H](C)CCC 42bbc03cca2630aa13580adad71d1be6 [1,1,0,0,0,0|2,0,0]=4 9014 B11R0.4 CCCOCCO[C@H](C)CCC 28ee10e8884a7bb06ea5329ce5b20582 [1,1,0,0,0,0|2,0,0]=4 9015 B11R0.4 CCCSCCOC(C)CCC 17743df72a9dba4df426cc8297e4d5b2 [1,1,0,0,0,0|2,0,0]=4 9016 B11R0.4 CCC[C@@H](C)OCCCCCF 59e159490da5ab17ab8d2a0f32480be8 [1,1,0,0,0,0|2,0,0]=4 9017 B11R0.4 CCC[C@@H](C)OCCCCOC 629efafb6735378a7f4ed1f3be5e2919 [1,1,0,0,0,0|2,0,0]=4 9018 B11R0.4 CCC[C@@H](C)OCCCOCC 1e53ecf5115d81f9df80c3e1d1926c21 [1,1,0,0,0,0|2,0,0]=4 9019 B11R0.4 CCC[C@@H](C)OCCCSCC cd562550a503eed8476b3f81d5633369 [1,1,0,0,0,0|2,0,0]=4 9020 B11R0.4 CCC[C@H](C)NCCCCCF 2bbe48de21957a7e0abb89e304291bbe [1,1,0,0,0,0|2,0,0]=4 9021 B11R0.4 CCC[C@H](C)NCCCCCO 9145428cec86525735d1e0f47d1ced44 [1,1,0,0,0,0|1,0,0]=3 9022 B11R0.4 CCC[C@H](C)NCCCCOC 9833bb351d8689497c469a9016668ef3 [1,1,0,0,0,0|2,0,0]=4 9023 B11R0.4 CCC[C@H](C)NCCCOCC 0d95e53020889f27f221de40f41e5453 [1,1,0,0,0,0|2,0,0]=4 9024 B11R0.4 CCC[C@H](C)NCCCSCC 18cc66a8ba46586d83e512575401b552 [1,1,0,0,0,0|2,0,0]=4 9025 B11R0.4 CCC[C@H](C)NCCOCCO e43cab5518151f81c4b426d8fd6c35d1 [1,1,0,0,0,0|2,0,0]=4 9026 B11R0.4 CCC[C@H](C)OCCCCCF cab5e6c0db3ebbd4ff89649a43a82ddd [1,1,0,0,0,0|2,0,0]=4 9027 B11R0.4 CCC[C@H](C)OCCCCOC bd1318dc989f36034fec620f437bf532 [1,1,0,0,0,0|2,0,0]=4 9028 B11R0.4 CCC[C@H](C)OCCCOCC a00fa3182be3ac26a6996d18666edffa [1,1,0,0,0,0|2,0,0]=4 9029 B11R0.4 CCC[C@H](C)OCCCSCC 391aa571532fdb69042ce571d91e647d [1,1,0,0,0,0|2,0,0]=4 9030 B11R0.4 CCNCCCCS(=O)CCO 76bcafe4a552308121ef9178c2962f25 [1,1,0,0,0,0|2,0,0]=4 9031 B11R0.4 CCOC(C)CNCCCCO cb1a19ee3c38d0691b3599eb3da299ba [1,1,0,0,0,0|2,0,0]=4 9032 B11R0.4 CCOCCCNC(C)CCO d3596ca593f0eaeecaed024e085c156f [1,1,0,0,0,0|2,0,0]=4 9033 B11R0.4 CCOCCCN[C@@H](C)CCO 93018d5eab6df836b32d0d2dfad3a7cb [1,1,0,0,0,0|2,0,0]=4 9034 B11R0.4 CCOCCCN[C@H](C)CCO 41a5c680286dc361f125ecf59186311f [1,1,0,0,0,0|2,0,0]=4 9035 B11R0.4 CCOCCNCC(C)CCO 408213befb1a8aaa40062c020bb254fd [1,1,0,0,0,0|2,0,0]=4 9036 B11R0.4 CCOCCNC[C@@H](O)CCO 4e4f5d83f0d57909dcbdf38d45af1a87 [1,1,0,0,0,0|2,0,0]=4 9037 B11R0.4 CCOCCOC[C@@H](O)CCO 173de864a12ced675685b084a46a7080 [1,1,0,0,0,0|2,0,0]=4 9038 B11R0.4 CCSCCCNC(C)CCO 83c40ea7dd5a4a92a4a29be1ff60285b [1,1,0,0,0,0|2,0,0]=4 9039 B11R0.4 CCSCCCN[C@@H](C)CCO b3416b3a7c2f2a2f25823432d3940776 [1,1,0,0,0,0|2,0,0]=4 9040 B11R0.4 CCSCCCN[C@H](C)CCO 5bc46850d21f8bb64cf11ca15d8f4c8b [1,1,0,0,0,0|2,0,0]=4 9041 B11R0.4 CCSCCNCC(C)CCO 825f89490c15772ef62b957abe80e445 [1,1,0,0,0,0|2,0,0]=4 9042 B11R0.4 CCSCCNC[C@@H](O)CCO 6d4571fb57b9a168318fce1b16d001fd [1,1,0,0,0,0|2,0,0]=4 9043 B11R0.4 CCSCCOC[C@@H](O)CCO acbb4e1399abdef5f94c7e61abbdc893 [1,1,0,0,0,0|2,0,0]=4 9044 B11R0.4 CN(CCF)CCCCCCO f32b25f91949e9fdcc4fbeda268c66ae [1,1,0,0,0,0|2,0,0]=4 9045 B11R0.4 CN(CCO)CCCCCCF a08a89e01ce8b3814022c2a1d79d13a2 [1,1,0,0,0,0|2,0,0]=4 9046 B11R0.4 CN(CCO)CCCCCCO 6e9070cbf29f2f1322b7cd280d229e6e [1,1,0,0,0,0|2,0,0]=4 9047 B11R0.4 CN(CCS)CCCCCCO ad7954ff932586338cff1fa7e86dfcc7 [1,1,0,0,0,0|2,0,0]=4 9048 B11R0.4 COCC(C)NCCCCCO 351fdc29b278e8c45344438bd8d6ff61 [1,1,0,0,0,0|2,0,0]=4 9049 B11R0.4 COCC(O)CNCCCCO 148ec3286708d1423551fa09c82d2605 [1,1,0,0,0,0|2,0,0]=4 9050 B11R0.4 COCCCCCN(C)CCO 49334197499d654294aa73d6988abb50 [1,1,0,0,0,0|2,0,0]=4 9051 B11R0.4 COCCCCNC(C)CCO b12573803a8fd44450d23c03dc91074b [1,1,0,0,0,0|2,0,0]=4 9052 B11R0.4 COCCCCN[C@@H](C)CCO 1607139999798676d65bdc55de114f58 [1,1,0,0,0,0|2,0,0]=4 9053 B11R0.4 COCCCCN[C@H](C)CCO 5a184eae06764b15e41a2c1b898af0b6 [1,1,0,0,0,0|2,0,0]=4 9054 B11R0.4 COCCCNCC(C)CCO c49e178b16cc5d0e24172a55a3e399cd [1,1,0,0,0,0|2,0,0]=4 9055 B11R0.4 COCCCNC[C@@H](O)CCO ef207f705d85f7b639c9e695bc6fd41c [1,1,0,0,0,0|2,0,0]=4 9056 B11R0.4 COCCCOC[C@@H](O)CCO c12958134b062e9b6e54d7090772ee44 [1,1,0,0,0,0|2,0,0]=4 9057 B11R0.4 COCN(C)CCCCCCO d939137a290e58050eb06597b27a6716 [1,1,0,0,0,0|2,0,0]=4 9058 B11R0.4 COC[C@@H](C)NCCCCCO 2b34e2a3b96422b7024dbfc29f7d8950 [1,1,0,0,0,0|2,0,0]=4 9059 B11R0.4 COC[C@@H](O)CNCCCCO 1abb1175f404e0f20e136e81cf3c2a3b [1,1,0,0,0,0|2,0,0]=4 9060 B11R0.4 COC[C@H](C)NCCCCCO 072f4bd3615ad86129e011e6b0c9f5fb [1,1,0,0,0,0|2,0,0]=4 9061 B11R0.4 CSCCCCNC(C)CCO 0c0f3d875b40c13216db688c5b60aa07 [1,1,0,0,0,0|2,0,0]=4 9062 B11R0.4 CSCCCNCC(C)CCO 84a454bd3c7eea1c34c7ae1b3c080a58 [1,1,0,0,0,0|2,0,0]=4 9063 B11R0.4 CSCCCOC[C@@H](O)CCO 15c7f8d6f7bdecdcab79f003a4ce7526 [1,1,0,0,0,0|2,0,0]=4 9064 B11R0.4 CSCN(C)CCCCCCO 4e2304d55cce84bd3404c37d6989d1c2 [1,1,0,0,0,0|2,0,0]=4 9065 B11R0.4 C[C@@H](CCO)NCCCCCF 2766bb93b1d6dbd5417ee37f628c02ef [1,1,0,0,0,0|2,0,0]=4 9066 B11R0.4 C[C@@H](CCO)NCCCCCO efc6222a2077fd3d9124ab4a2ec2fa67 [1,1,0,0,0,0|2,0,0]=4 9067 B11R0.4 C[C@H](CCO)NCCCCCF 9fb28f740f09c7700798af921db78cc9 [1,1,0,0,0,0|2,0,0]=4 9068 B11R0.4 C[C@H](CCO)NCCCCCO 41ad5bba2174a445b08b4067ce00adf2 [1,1,0,0,0,0|2,0,0]=4 9069 B11R0.4 OCCCCNC[C@@H](O)CCO a42a0db4f6235ad304ab27f42b34426d [1,1,0,0,0,0|2,0,0]=4 9070 B11R0.4 OCC[C@H](O)CNCCCCCl c8f7795d200b29659abfec986d949707 [1,1,0,0,0,0|2,0,0]=4 9071 B11R0.4 OCC[C@H](O)CNCCCCS 5eab9369cc27988839e04012b0c48eee [1,1,0,0,0,0|2,0,0]=4 9072 B11R0.4 OCC[C@H](O)COCCCCF 8cca0f4cb85cea784836b944f8f8c41a [1,1,0,0,0,0|2,0,0]=4 9073 B11R0.4 OCC[C@H](O)COCCCCS 1906065dcf4d839c365112a60a30255f [1,1,0,0,0,0|2,0,0]=4 9074 B11R0.81 CC(CCCO)NCCCCCl 6146a771ddd13d85b3f9c412151611df [1,1,0,0,0,0|2,0,0]=4 9075 B11R0.81 CC(CCCO)NCCCCF ba0457576eefa0c5f7cc601d9ce914a6 [1,1,0,0,0,0|2,0,0]=4 9076 B11R0.81 CC(CCCO)NCCCCO b7b0729758b09aa3e843e0e7b7e520a6 [1,1,0,0,0,0|2,0,0]=4 9077 B11R0.81 CC(CCCO)NCCCCS 2f01361cce1185ffe65970f680b13d04 [1,1,0,0,0,0|2,0,0]=4 9078 B11R0.81 CCCCC(=O)NCCCCO fa42fcd441c7069b7e8d15f43c375c64 [1,1,0,0,0,0|1,0,1]=4 9079 B11R0.81 CCCCC(C)CCOCCC d754160f5aff175f763be994f3b87c75 [1,1,0,0,0,0|1,0,0]=3 9080 B11R0.81 CCCCC(C)CCOCCF cddae7a1127d00adab96e5227fb41672 [1,1,0,0,0,0|2,0,0]=4 9081 B11R0.81 CCCCC(C)CCOCCS ebd8a809f5dbaab148a1579a964aaea4 [1,1,0,0,0,0|1,1,0]=4 9082 B11R0.81 CCCCC(C)CCOCOC ab62cf84cc93bf6a7179afae0e3cb407 [1,1,0,0,0,0|2,0,0]=4 9083 B11R0.81 CCCCC(C)CCOCSC 9694d72c8aa77b7774f783d38599e1e8 [1,1,0,0,0,0|2,0,0]=4 9084 B11R0.81 CCCCC(C)COCCCF 4ac382e676bec7d89b2e7758648bd06c [1,1,0,0,0,0|2,0,0]=4 9085 B11R0.81 CCCCC(C)COCCCS 6eebefdebb71889456265cf1558691e0 [1,1,0,0,0,0|1,1,0]=4 9086 B11R0.81 CCCCC(C)COCCOC 6d23d9c4d787a4a6d5d794086aab0abd [1,1,0,0,0,0|2,0,0]=4 9087 B11R0.81 CCCCC(C)COCCSC 96bb25546dadee6d84d5d09d0f07b4a4 [1,1,0,0,0,0|2,0,0]=4 9088 B11R0.81 CCCCC(C)COCOCC a4da04f4859d5c8793c09764b4f806f4 [1,1,0,0,0,0|2,0,0]=4 9089 B11R0.81 CCCCC(C)NCCCCCl a7a1a6f4abb2ed1be14c6169a3070107 [1,1,0,0,0,0|2,0,0]=4 9090 B11R0.81 CCCCC(C)NCCCCF 518bdc0da03273deef42676da7db3bbe [1,1,0,0,0,0|2,0,0]=4 9091 B11R0.81 CCCCC(C)NCCCCO 9f29a105dee7b4bf1e952c699c8fa561 [1,1,0,0,0,0|1,0,0]=3 9092 B11R0.81 CCCCC(C)NCCCCS 481c477f791c82450030b7d6914ef3a2 [1,1,0,0,0,0|1,1,0]=4 9093 B11R0.81 CCCCC(C)NCCCOC 30691d42b709ba79b73ac95339c0ffcc [1,1,0,0,0,0|2,0,0]=4 9094 B11R0.81 CCCCC(C)NCCCSC 56677dca48f76630282998fe0121c12b [1,1,0,0,0,0|2,0,0]=4 9095 B11R0.81 CCCCC(C)NCCOCC 81d6fc5fda8652fd8ec0eeb33ec6694f [1,1,0,0,0,0|2,0,0]=4 9096 B11R0.81 CCCCC(C)NCCSCC 3a33001843504e2238d3ce22eae04194 [1,1,0,0,0,0|2,0,0]=4 9097 B11R0.81 CCCCC(C)OCCCCF 4eb0d7c022c2c0cd59c21a4a30bf589c [1,1,0,0,0,0|2,0,0]=4 9098 B11R0.81 CCCCC(C)OCCCCS 2b860579f8f8d90f74790350351557b3 [1,1,0,0,0,0|1,1,0]=4 9099 B11R0.81 CCCCC(C)OCCCOC 5fd16314a9f42f2ed09d5b7e6e648d65 [1,1,0,0,0,0|2,0,0]=4 9100 B11R0.81 CCCCC(C)OCCCSC 50420dc208f0b069e60256ebb2f626c2 [1,1,0,0,0,0|2,0,0]=4 9101 B11R0.81 CCCCC(C)OCCOCC dbba43750acd2575431f76bcf49c2b77 [1,1,0,0,0,0|2,0,0]=4 9102 B11R0.81 CCCCC(C)OCCSCC 00fec32fbad71cf764d7828b6e17dc07 [1,1,0,0,0,0|2,0,0]=4 9103 B11R0.81 CCCCC(O)CNCCCF 7d9a2aeb218ef6058d10fbe787a74afd [1,1,0,0,0,0|2,0,0]=4 9104 B11R0.81 CCCCC(O)CNCCCO 83fd5fe175405563fa5052ff53e1ba21 [1,1,0,0,0,0|1,0,0]=3 9105 B11R0.81 CCCCC(O)CNCCCS 50320e20aa632580f1b7f975bdc14d69 [1,1,0,0,0,0|1,1,0]=4 9106 B11R0.81 CCCCC(O)CNCCOC 2542fca11ccc30f45e5c6dc18148afec [1,1,0,0,0,0|2,0,0]=4 9107 B11R0.81 CCCCC(O)CNCCSC 38c82802ea8a204542dd8690327f564b [1,1,0,0,0,0|2,0,0]=4 9108 B11R0.81 CCCCC(O)CNCOCC 8e8329c98d4f2d47475a75b0aee23d64 [1,1,0,0,0,0|2,0,0]=4 9109 B11R0.81 CCCCCCC(=O)NCCC 87d8790730f902707f59eb54172a1efa [1,1,0,0,0,0|1,0,1]=4 9110 B11R0.81 CCCCCCC(=O)NCCO f49bad3fe55d361225eacdb6b24aebd1 [1,1,0,0,0,0|1,0,1]=4 9111 B11R0.81 CCCCCCC(C)COCC 77f334f632b571e05de48ea67149c2d4 [1,1,0,0,0,0|1,0,0]=3 9112 B11R0.81 CCCCCCC(C)COCF 9e97cf89ae569a7fdc534cbfe6861c48 [1,1,0,0,0,0|2,0,0]=4 9113 B11R0.81 CCCCCCC(C)NCCBr 09a5fcbfd09ad16a6795115e42ad2ed8 [1,1,0,0,0,0|2,0,0]=4 9114 B11R0.81 CCCCCCC(C)NCCC 673986824879f3e79ccf765f60ced912 [1,1,0,0,0,0|1,0,0]=3 9115 B11R0.81 CCCCCCC(C)NCCF 5004e673c1294dace9a9adbd8a5016c7 [1,1,0,0,0,0|2,0,0]=4 9116 B11R0.81 CCCCCCC(C)NCCI 31eff6be312c748fb75da5b3ecb85712 [1,1,0,0,0,0|2,0,0]=4 9117 B11R0.81 CCCCCCC(C)NCCO f38668e54c52cfb1a95ef21269912c88 [1,1,0,0,0,0|1,0,0]=3 9118 B11R0.81 CCCCCCC(C)NCCS 67931e347aad1ad9f4c2e811e5854a88 [1,1,0,0,0,0|1,1,0]=4 9119 B11R0.81 CCCCCCC(C)NCOC 515c5adb0c46e28da2ae36dd4e21933b [1,1,0,0,0,0|2,0,0]=4 9120 B11R0.81 CCCCCCC(C)NCSC 94ec72d5741c4686c48741b394741708 [1,1,0,0,0,0|2,0,0]=4 9121 B11R0.81 CCCCCCC(C)OCCC ba224077acd3b740d8e3fb9b4d425b85 [1,1,0,0,0,0|1,0,0]=3 9122 B11R0.81 CCCCCCC(C)OCCF 4029c11da063a889235fa4189e927d2c [1,1,0,0,0,0|2,0,0]=4 9123 B11R0.81 CCCCCCC(C)OCCS 8480a7d1dac28cbecd276cfd7d327c97 [1,1,0,0,0,0|1,1,0]=4 9124 B11R0.81 CCCCCCC(C)OCOC 06f3fa4a03b800a6ed03a325da232f19 [1,1,0,0,0,0|2,0,0]=4 9125 B11R0.81 CCCCCCC(C)OCSC 0ce08d2ad40e1d3e2328da6bf608dda4 [1,1,0,0,0,0|2,0,0]=4 9126 B11R0.81 CCCCCCN(C)CCCC 68edc7b90c1a605cb81ae90468df06f8 [1,1,0,0,0,0|1,0,0]=3 9127 B11R0.81 CCCCCCN(C)CCCF 583474e4b7560d3427b50323904bfdf4 [1,1,0,0,0,0|2,0,0]=4 9128 B11R0.81 CCCCCCN(C)CCCO 2aef5358383be552dd30ac8ca9e5f873 [1,1,0,0,0,0|1,0,0]=3 9129 B11R0.81 CCCCCCN(C)CCCS 37c2fe9c9b56afed7f06f42013189e6a [1,1,0,0,0,0|1,1,0]=4 9130 B11R0.81 CCCCCCN(C)CCOC aee48fbcbffa16ff63420a04725f1cc8 [1,1,0,0,0,0|2,0,0]=4 9131 B11R0.81 CCCCCCN(C)CCSC c3dbb3b0530a270c42e2199568426497 [1,1,0,0,0,0|2,0,0]=4 9132 B11R0.81 CCCCCCN(C)COCC 4256dc792678229268def9256538aa89 [1,1,0,0,0,0|2,0,0]=4 9133 B11R0.81 CCCCCC[C@@H](C)NCCC 7405a222267b08859e40d01e337c8630 [1,1,0,0,0,0|1,0,0]=3 9134 B11R0.81 CCCCCC[C@@H](C)NCCF d2c2bf31456d95d43bb273b682730221 [1,1,0,0,0,0|2,0,0]=4 9135 B11R0.81 CCCCCC[C@@H](C)NCCO 58aca5a2be6637938056556584adf0c5 [1,1,0,0,0,0|1,0,0]=3 9136 B11R0.81 CCCCCC[C@@H](C)NCCS d10c0e471289bbefd3c096768b171113 [1,1,0,0,0,0|1,1,0]=4 9137 B11R0.81 CCCCCC[C@@H](C)NCOC e181feaa5d5ad0448f83ffdde990a1ea [1,1,0,0,0,0|2,0,0]=4 9138 B11R0.81 CCCCCC[C@@H](C)NCSC 9c8d7d153c774776c7e9d40279c62f8e [1,1,0,0,0,0|2,0,0]=4 9139 B11R0.81 CCCCCC[C@@H](C)OCCC 2e5a993043dda8cbe04b4c5a7ec49973 [1,1,0,0,0,0|1,0,0]=3 9140 B11R0.81 CCCCCC[C@@H](C)OCCF b6467c74c9589cf5fb41339589cc2368 [1,1,0,0,0,0|2,0,0]=4 9141 B11R0.81 CCCCCC[C@@H](C)OCCS 3754d26fdd954c90f1c6f32ccfc437fc [1,1,0,0,0,0|1,1,0]=4 9142 B11R0.81 CCCCCC[C@@H](C)OCOC c4f6ce6ce697e0f7c254cbe51e7b0e91 [1,1,0,0,0,0|2,0,0]=4 9143 B11R0.81 CCCCCC[C@@H](C)OCSC 9f514d0333870d7a5b338269c3a53dcb [1,1,0,0,0,0|2,0,0]=4 9144 B11R0.81 CCCCCC[C@H](C)NCCC be780c73d2e2093087ff3f7aa1472464 [1,1,0,0,0,0|1,0,0]=3 9145 B11R0.81 CCCCCC[C@H](C)NCCF ea4a8bf41df67c76a8fb00f888898aa7 [1,1,0,0,0,0|2,0,0]=4 9146 B11R0.81 CCCCCC[C@H](C)NCCO 8fbbf3b644301d85f6bafefddb099f7d [1,1,0,0,0,0|1,0,0]=3 9147 B11R0.81 CCCCCC[C@H](C)NCCS 5ab1cd6602eb2dbf852fb25475c98599 [1,1,0,0,0,0|1,1,0]=4 9148 B11R0.81 CCCCCC[C@H](C)NCOC 240a56e35c96a621a7bf50242dbe6d97 [1,1,0,0,0,0|2,0,0]=4 9149 B11R0.81 CCCCCC[C@H](C)NCSC ce4750a5c2344189593632ceefecd724 [1,1,0,0,0,0|2,0,0]=4 9150 B11R0.81 CCCCCC[C@H](C)OCCC d12d50ac24407591cb230f2d190f19fa [1,1,0,0,0,0|1,0,0]=3 9151 B11R0.81 CCCCCC[C@H](C)OCCF 8df5cfe0970d2ffe80cceac0dc1218aa [1,1,0,0,0,0|2,0,0]=4 9152 B11R0.81 CCCCCC[C@H](C)OCCS 97e92c77de3d8a6ecd62ad2a46c3ab4f [1,1,0,0,0,0|1,1,0]=4 9153 B11R0.81 CCCCCC[C@H](C)OCOC 0d2245dbcd4d44496373623bc1bbc23a [1,1,0,0,0,0|2,0,0]=4 9154 B11R0.81 CCCCCC[C@H](C)OCSC c88ec367c5134901cf2852a687aee963 [1,1,0,0,0,0|2,0,0]=4 9155 B11R0.81 CCCCCNC(=O)CCCC a06834419102a1558a19fb3a1406cfb0 [1,1,0,0,0,0|1,0,1]=4 9156 B11R0.81 CCCCCNC(C)CCCC b51643b11e90e217951ac49e9c0fa8df [1,1,0,0,0,0|1,0,0]=3 9157 B11R0.81 CCCCCNC(C)CCCO 406073321f0839fe6087b998442feca1 [1,1,0,0,0,0|1,0,0]=3 9158 B11R0.81 CCCCCN[C@H](C)CCCC a88e430f1a54dc3ca544448f280d28fd [1,1,0,0,0,0|1,0,0]=3 9159 B11R0.81 CCCCCN[C@H](C)CCCO 7315223bb4b33e83083e6a29b9477bde [1,1,0,0,0,0|1,0,0]=3 9160 B11R0.81 CCCCCOC(C)CCCC c7acc1e25061124a677e93a98c4880c3 [1,1,0,0,0,0|1,0,0]=3 9161 B11R0.81 CCCCCOC(C)CCOC 3555ff59923511d754322ff7e4637c44 [1,1,0,0,0,0|2,0,0]=4 9162 B11R0.81 CCCCCOC(C)CCSC 21797afa09805aa2e8c90995e7cc52f9 [1,1,0,0,0,0|2,0,0]=4 9163 B11R0.81 CCCCCOC(C)COCC 80662504cc64bf3b17cddbdf417cd303 [1,1,0,0,0,0|2,0,0]=4 9164 B11R0.81 CCCCCO[C@@H](C)CCCC a39e9f1d5c06f929dc091d3b55f09321 [1,1,0,0,0,0|1,0,0]=3 9165 B11R0.81 CCCCCO[C@H](C)CCCC f537dfc938a1fd068dc349c4b7b77c37 [1,1,0,0,0,0|1,0,0]=3 9166 B11R0.81 CCCCN(C)CCCCCF 4d14758e62814a91ca9260401d3fd5e4 [1,1,0,0,0,0|2,0,0]=4 9167 B11R0.81 CCCCN(C)CCCCCO c5675d46ea3544a800eca8dfc876b4c2 [1,1,0,0,0,0|1,0,0]=3 9168 B11R0.81 CCCCN(C)CCCCOC d1a49086e35fed83caddb81e23dd5e5c [1,1,0,0,0,0|2,0,0]=4 9169 B11R0.81 CCCCN(C)CCCNCC 6e61cd18b0252f2f209015d25156d134 [1,1,0,0,0,0|2,0,0]=4 9170 B11R0.81 CCCCN(C)CCCNCO a152fbf2b8d31143a4ace281743fb47f [1,1,0,0,0,0|2,0,0]=4 9171 B11R0.81 CCCCN(C)CCCOCC 7c044657e095600ce23589d50b73987e [1,1,0,0,0,0|2,0,0]=4 9172 B11R0.81 CCCCN(C)CCCSCC ce98f45dd349d541817d370bcf2f009a [1,1,0,0,0,0|2,0,0]=4 9173 B11R0.81 CCCCN(C)CCNCCC f26241bd65ebe7441e242827753a91d9 [1,1,0,0,0,0|2,0,0]=4 9174 B11R0.81 CCCCN(C)CCNCCO 9c558c414ea2879ce3fc34aec6940ab4 [1,1,0,0,0,0|2,0,0]=4 9175 B11R0.81 CCCCN(C)CCOCCC 6d0636061ab64a8f235e12af4f565931 [1,1,0,0,0,0|2,0,0]=4 9176 B11R0.81 CCCCN(C)CCOCCO 1ef8c7ec2bad253c49051d242e35778e [1,1,0,0,0,0|2,0,0]=4 9177 B11R0.81 CCCCNCC(O)CCCC fead52412d0cf6070e098352c1c7fba2 [1,1,0,0,0,0|1,0,0]=3 9178 B11R0.81 CCCCNCC(O)COCC 242e8e2cac1bc4ae89e6dc3b4eac0183 [1,1,0,0,0,0|2,0,0]=4 9179 B11R0.81 CCCCNC[C@H](C)CCCO 0fc13b38840d250bb93148c460e32459 [1,1,0,0,0,0|1,0,0]=3 9180 B11R0.81 CCCCOCC(C)CCCC 3db2ee05274ae0f68ed9b24f1b358565 [1,1,0,0,0,0|1,0,0]=3 9181 B11R0.81 CCCCOCC(C)COCC 69f46e00c6b95ff6f5f3ead63c458eaa [1,1,0,0,0,0|2,0,0]=4 9182 B11R0.81 CCCCOCC(C)OCCC 8b31d479727942f0ab31a8163b4f1efe [1,1,0,0,0,0|2,0,0]=4 9183 B11R0.81 CCCCOCN(C)CCCC 31a402937162b9c42c35cc8c301fe9fa [1,1,0,0,0,0|2,0,0]=4 9184 B11R0.81 CCCCOCN(C)CCCO 7b8256c566dc2bf6af0a9809f0b8e420 [1,1,0,0,0,0|2,0,0]=4 9185 B11R0.81 CCCC[C@@H](C)NCCCCF 85b70c7807765ffdeb617717191a2396 [1,1,0,0,0,0|2,0,0]=4 9186 B11R0.81 CCCC[C@@H](C)NCCCCO 09767edc918506fb3bfb78bd2e9f817b [1,1,0,0,0,0|1,0,0]=3 9187 B11R0.81 CCCC[C@@H](C)NCCCOC c878c253711af33456a049aedaca55f3 [1,1,0,0,0,0|2,0,0]=4 9188 B11R0.81 CCCC[C@@H](C)NCCCSC e95df964c06c195601a9bd1802fa7062 [1,1,0,0,0,0|2,0,0]=4 9189 B11R0.81 CCCC[C@@H](C)NCCOCC ede3c764745d319bf3325bb3f8115922 [1,1,0,0,0,0|2,0,0]=4 9190 B11R0.81 CCCC[C@@H](C)NCCSCC 54189f3f8b21ad036bc8c5cf5fc6af4e [1,1,0,0,0,0|2,0,0]=4 9191 B11R0.81 CCCC[C@@H](C)OCCCCF 7f52bac65ec8084338763b2d0a554303 [1,1,0,0,0,0|2,0,0]=4 9192 B11R0.81 CCCC[C@@H](C)OCCCOC 28fefcc2bee75d3de0b11f5b06669b07 [1,1,0,0,0,0|2,0,0]=4 9193 B11R0.81 CCCC[C@@H](C)OCCCSC 5e928d830a74530968f07864c4e685d3 [1,1,0,0,0,0|2,0,0]=4 9194 B11R0.81 CCCC[C@@H](C)OCCOCC 9a42cd4b604e33cac23cd89ad4684f1d [1,1,0,0,0,0|2,0,0]=4 9195 B11R0.81 CCCC[C@@H](C)OCCSCC 0c7bacedbf026662c629335f79703299 [1,1,0,0,0,0|2,0,0]=4 9196 B11R0.81 CCCC[C@H](C)OCCCCF 66a1103ee6962fc029cef451704ff0a9 [1,1,0,0,0,0|2,0,0]=4 9197 B11R0.81 CCCC[C@H](C)OCCCOC 2e326035fbc44d4a5717b5e254201a67 [1,1,0,0,0,0|2,0,0]=4 9198 B11R0.81 CCCC[C@H](C)OCCCSC b6252492b952dcea5c33941eff732fa8 [1,1,0,0,0,0|2,0,0]=4 9199 B11R0.81 CCCC[C@H](C)OCCOCC 9d1ae575c5f34c17b77ad89ca30fa091 [1,1,0,0,0,0|2,0,0]=4 9200 B11R0.81 CCCC[C@H](C)OCCSCC 924d4d546c762bc8b477026685ab3bb0 [1,1,0,0,0,0|2,0,0]=4 9201 B11R0.81 CCCNC(=O)CCCCCO a7c6a98522f11fc91ddc59d3a1df544e [1,1,0,0,0,0|1,0,1]=4 9202 B11R0.81 CCCOCCN(C)CCCO 14d40287242118a355b52df6ecfdf802 [1,1,0,0,0,0|2,0,0]=4 9203 B11R0.81 CCOCC(O)CNCCCO 66b71d647a0a0caba3ef433919db12e7 [1,1,0,0,0,0|2,0,0]=4 9204 B11R0.81 CCOCCCN(C)CCCO d898280d3de793667ff60e92c9103be0 [1,1,0,0,0,0|2,0,0]=4 9205 B11R0.81 CCOCCNC(C)CCCO d4c248ec7ecf4eae7fc0a903630dd691 [1,1,0,0,0,0|2,0,0]=4 9206 B11R0.81 CCOCCN[C@H](C)CCCO e6b3d1c720a5c30e5cb30dcdfbc250e4 [1,1,0,0,0,0|2,0,0]=4 9207 B11R0.81 CCOCN(C)CCCCCO 7048ac7c54f2f91913bbba8e81d4af9c [1,1,0,0,0,0|2,0,0]=4 9208 B11R0.81 CCOCNC[C@H](C)CCCO 81f41ee6a424458bf94b05ee9458aafd [1,1,0,0,0,0|2,0,0]=4 9209 B11R0.81 CCSCCCN(C)CCCO 88a988c274cb90a00125aabc06e5b896 [1,1,0,0,0,0|2,0,0]=4 9210 B11R0.81 CCSCCNC(C)CCCO 4f4ed8f2924cf231a3fc816104b9d2c2 [1,1,0,0,0,0|2,0,0]=4 9211 B11R0.81 CCSCCN[C@H](C)CCCO 611bd191d837444b30900f1aa052ead2 [1,1,0,0,0,0|2,0,0]=4 9212 B11R0.81 CN(CCCF)CCCCCO 0182ffec7107b05a21248031f1546c8e [1,1,0,0,0,0|2,0,0]=4 9213 B11R0.81 CN(CCCO)CCCCCF 1f5ce404ad556a7dbc61e37c93949c3b [1,1,0,0,0,0|2,0,0]=4 9214 B11R0.81 CN(CCCO)CCCCCO a0812194ae2d4b2e93c7877c25f5b26d [1,1,0,0,0,0|2,0,0]=4 9215 B11R0.81 CN(CCCS)CCCCCO 9855517f75ae9b851bb6e79bea69647d [1,1,0,0,0,0|2,0,0]=4 9216 B11R0.81 COCCCCN(C)CCCO f12f9f453324334ff6bea94f50dbdb0e [1,1,0,0,0,0|2,0,0]=4 9217 B11R0.81 COCCCNC(C)CCCO 8c93a8dd780d647de5eebb8cb2822355 [1,1,0,0,0,0|2,0,0]=4 9218 B11R0.81 COCCCN[C@H](C)CCCO 74b1d8adb7a86c7b81ae91d8bd4526fa [1,1,0,0,0,0|2,0,0]=4 9219 B11R0.81 COCCN(C)CCCCCO 66500174138868ca4b06b4dd6e2566e2 [1,1,0,0,0,0|2,0,0]=4 9220 B11R0.81 COCCNC[C@H](C)CCCO 15cc39b13bff3dc57a7eb5d2d7c49965 [1,1,0,0,0,0|2,0,0]=4 9221 B11R0.81 CSCCCNC(C)CCCO 176cce3f243f14380711b0eca417ad14 [1,1,0,0,0,0|2,0,0]=4 9222 B11R0.81 CSCCCN[C@H](C)CCCO a2b938909fb7317658cf016f00c4106a [1,1,0,0,0,0|2,0,0]=4 9223 B11R0.81 CSCCN(C)CCCCCO 5bf0c44b05edba802738605407c92603 [1,1,0,0,0,0|2,0,0]=4 9224 B11R0.81 CSCCNC[C@H](C)CCCO b336c98d808bbf7e4d173e94f23f0d21 [1,1,0,0,0,0|2,0,0]=4 9225 B11R0.81 C[C@H](CCCO)CNCCCF 0c0ffbe0a9a8955fb6a91cf70d563833 [1,1,0,0,0,0|2,0,0]=4 9226 B11R0.81 C[C@H](CCCO)CNCCCO 9bbec62a452196d520c519841a322a20 [1,1,0,0,0,0|2,0,0]=4 9227 B11R0.81 C[C@H](CCCO)CNCCCS 13cd4fee98f957ee615d65aebef03c55 [1,1,0,0,0,0|2,0,0]=4 9228 B11R0.81 C[C@H](CCCO)NCCCCF de1013082eaf69cd8ba0576f2a476e4c [1,1,0,0,0,0|2,0,0]=4 9229 B11R0.81 C[C@H](CCCO)NCCCCO 9f33a2f9d1dd1cbe3495a38d74ceb490 [1,1,0,0,0,0|2,0,0]=4 9230 B11R0.140 CC(CCCCO)NCCCCl c4521997c7375c9b36379e0667f8c45c [1,1,0,0,0,0|2,0,0]=4 9231 B11R0.140 CC(CCCCO)NCCCO 8b6f99ce1ae5015d05ffe5e8cbcdaef7 [1,1,0,0,0,0|2,0,0]=4 9232 B11R0.140 CCCCCC(=O)CNCCC fd232b76e9f9bbb3d7db54487f370b06 [1,1,0,0,0,0|1,0,1]=4 9233 B11R0.140 CCCCCC(=O)CNCCO c5d05f98699f342415f344c3b79de128 [1,1,0,0,0,0|1,0,1]=4 9234 B11R0.140 CCCCCC(=O)COCCC cb320e50d7832de1cd1f91018c6e947e [1,1,0,0,0,0|1,0,1]=4 9235 B11R0.140 CCCCCC(=O)NCCCC 8be837e1d42ad87c18e70b4bc1ddd96f [1,1,0,0,0,0|1,0,1]=4 9236 B11R0.140 CCCCCC(=O)NCCCO f8b52b861e5b967b7710b4587a208b00 [1,1,0,0,0,0|1,0,1]=4 9237 B11R0.140 CCCCCC(C)COCCC e611647d8511f40641ce15108dbc184c [1,1,0,0,0,0|1,0,0]=3 9238 B11R0.140 CCCCCC(C)COCCF 9c93c489ac8f71ad7c00da7795c505ad [1,1,0,0,0,0|2,0,0]=4 9239 B11R0.140 CCCCCC(C)COCCS 429b7290aef38d64b0d126c93c8fecae [1,1,0,0,0,0|1,1,0]=4 9240 B11R0.140 CCCCCC(C)COCOC a876db46dc7c22a9ddfbaba218876d1f [1,1,0,0,0,0|2,0,0]=4 9241 B11R0.140 CCCCCC(C)COCSC 9e9473f910cc17d934b84d6b85904a53 [1,1,0,0,0,0|2,0,0]=4 9242 B11R0.140 CCCCCC(C)NCCCC 9cf51aeb7bb493ad3dd8f6014e839675 [1,1,0,0,0,0|1,0,0]=3 9243 B11R0.140 CCCCCC(C)NCCCCl 213b8604b34558a2465dd7f4561c52bd [1,1,0,0,0,0|2,0,0]=4 9244 B11R0.140 CCCCCC(C)NCCCF 89b81dd327f265743bf9e5f18c3e333c [1,1,0,0,0,0|2,0,0]=4 9245 B11R0.140 CCCCCC(C)NCCCO 6ce8b1ff6fc28b8f96fcabf18f1f4835 [1,1,0,0,0,0|1,0,0]=3 9246 B11R0.140 CCCCCC(C)NCCCS 990672f0a8283534c1e1f957ef909830 [1,1,0,0,0,0|1,1,0]=4 9247 B11R0.140 CCCCCC(C)NCCOC b9a41d07284af229c8d3ffaa7956e984 [1,1,0,0,0,0|2,0,0]=4 9248 B11R0.140 CCCCCC(C)NCCSC e27eaa6c5a2ec3e1184e22e7525a8573 [1,1,0,0,0,0|2,0,0]=4 9249 B11R0.140 CCCCCC(C)NCOCC 741e2b0bd6a926f03c46ffe258a7a0e7 [1,1,0,0,0,0|2,0,0]=4 9250 B11R0.140 CCCCCC(C)OCCCC 8a76446f0e285bd36a48a8d4c0c453d8 [1,1,0,0,0,0|1,0,0]=3 9251 B11R0.140 CCCCCC(C)OCCCF af3c9d7ac023d74404e5924b271ad6a1 [1,1,0,0,0,0|2,0,0]=4 9252 B11R0.140 CCCCCC(C)OCCCS 64e43f0c4600cdbeda7011f6ac422054 [1,1,0,0,0,0|1,1,0]=4 9253 B11R0.140 CCCCCC(C)OCCOC fe2352d541dfe6afb562c5239062c49c [1,1,0,0,0,0|2,0,0]=4 9254 B11R0.140 CCCCCC(C)OCCSC ad005d5bb77c3394b16814bde151db6c [1,1,0,0,0,0|2,0,0]=4 9255 B11R0.140 CCCCCN(C)CCCCC 0dab6e2b91abba48f221038b801f3e1f [1,1,0,0,0,0|1,0,0]=3 9256 B11R0.140 CCCCCN(C)CCCCF 6bb3274f80ef6608ce7c1b60f5ee59ee [1,1,0,0,0,0|2,0,0]=4 9257 B11R0.140 CCCCCN(C)CCCCO c1bda2d7c23ebff2ff15e9d21aa7f778 [1,1,0,0,0,0|1,0,0]=3 9258 B11R0.140 CCCCCN(C)CCCOC 7e278de42d4eb9c9f876ef14dc97c126 [1,1,0,0,0,0|2,0,0]=4 9259 B11R0.140 CCCCCN(C)CCCSC 841b1c3d5932711b07081d229371e5ec [1,1,0,0,0,0|2,0,0]=4 9260 B11R0.140 CCCCCN(C)CCOCC 6a3ee0dcd8dbea1498d511ddaaa3892e [1,1,0,0,0,0|2,0,0]=4 9261 B11R0.140 CCCCCN(C)CCSCC 4142d1ff41069c040d4c2adc29bab99f [1,1,0,0,0,0|2,0,0]=4 9262 B11R0.140 CCCCC[C@@H](C)OCCCC e4672e1cdf0741af9395631f9acfa8ae [1,1,0,0,0,0|1,0,0]=3 9263 B11R0.140 CCCCC[C@@H](C)OCCCF 947a200163ddd103689858af03c8fa82 [1,1,0,0,0,0|2,0,0]=4 9264 B11R0.140 CCCCC[C@@H](C)OCCCS f8f162d02601cdcdbf5406c55d35334f [1,1,0,0,0,0|1,1,0]=4 9265 B11R0.140 CCCCC[C@@H](C)OCCOC a1e09d1892506018d0d3ba1d7bccfcb4 [1,1,0,0,0,0|2,0,0]=4 9266 B11R0.140 CCCCC[C@@H](C)OCCSC 4672d3bd14f2fc2d8e5f9d73df823b8b [1,1,0,0,0,0|2,0,0]=4 9267 B11R0.140 CCCCC[C@H](C)NCCCC 44052af2bf03dfdfdd8813c66ebb23ff [1,1,0,0,0,0|1,0,0]=3 9268 B11R0.140 CCCCC[C@H](C)NCCCCl eca3abef46f82ea34efc5c65f000a418 [1,1,0,0,0,0|2,0,0]=4 9269 B11R0.140 CCCCC[C@H](C)NCCCF 44d05d58f4fe96443d012ef8f32d55c3 [1,1,0,0,0,0|2,0,0]=4 9270 B11R0.140 CCCCC[C@H](C)NCCCO f42f4f5af4e85d656812f8de0a549128 [1,1,0,0,0,0|1,0,0]=3 9271 B11R0.140 CCCCC[C@H](C)NCCCS b9f0335a2443baff56fae2feb119fa9e [1,1,0,0,0,0|1,1,0]=4 9272 B11R0.140 CCCCC[C@H](C)NCCOC a73310a53211c572a3d6b34d838651a9 [1,1,0,0,0,0|2,0,0]=4 9273 B11R0.140 CCCCC[C@H](C)NCCSC c78c43026640a050f9c91afae13393f5 [1,1,0,0,0,0|2,0,0]=4 9274 B11R0.140 CCCCC[C@H](C)NCOCC bd2629791c8cccce6b739b3ec894b67f [1,1,0,0,0,0|2,0,0]=4 9275 B11R0.140 CCCCC[C@H](C)OCCCC 364f0fd5e9c64b042cb4e7a98c79d828 [1,1,0,0,0,0|1,0,0]=3 9276 B11R0.140 CCCCC[C@H](C)OCCCF 3a9219a69c14b20f09b1d58065125e23 [1,1,0,0,0,0|2,0,0]=4 9277 B11R0.140 CCCCC[C@H](C)OCCCS 9ad2cb2cfbf28b2ad6f675b606fd325a [1,1,0,0,0,0|1,1,0]=4 9278 B11R0.140 CCCCC[C@H](C)OCCOC ec21f6e9d45788a089670d7a49b9ac50 [1,1,0,0,0,0|2,0,0]=4 9279 B11R0.140 CCCCC[C@H](C)OCCSC 0111ad70432ee4950251dc7169d7e139 [1,1,0,0,0,0|2,0,0]=4 9280 B11R0.140 CCCCNC(=O)CCCCO 593f5d52babede557c322fbd8e084dab [1,1,0,0,0,0|1,0,1]=4 9281 B11R0.140 CCCCNC(C)CCCCO 53bd565484070c606e01dec30c2a1081 [1,1,0,0,0,0|1,0,0]=3 9282 B11R0.140 CCCCOC(C)COCCC 605a87a976b02b2b9e805fbdea0660ac [1,1,0,0,0,0|2,0,0]=4 9283 B11R0.140 CCCOCC(C)COCCC faa2af5bc7589bad6579109d39f8cdd4 [1,1,0,0,0,0|2,0,0]=4 9284 B11R0.140 CCOCCN(C)CCCCO 93fc8216cc3b8b772e0d5b812a6f4262 [1,1,0,0,0,0|2,0,0]=4 9285 B11R0.140 CCSCCN(C)CCCCO cfdd482e626a6977012467a956ce571b [1,1,0,0,0,0|2,0,0]=4 9286 B11R0.140 CN(CCCCO)CCCCF a446e83b47ca92999dd81d294a14f316 [1,1,0,0,0,0|2,0,0]=4 9287 B11R0.140 CN(CCCCO)CCCCO b95a86a2de56ecdc743827a39350b05b [1,1,0,0,0,0|2,0,0]=4 9288 B11R0.140 COCCCN(C)CCCCO e6ac46e7474efa97a48e36bba4779360 [1,1,0,0,0,0|2,0,0]=4 9289 B11R0.140 COCCNC(C)CCCCO dade5e3d29bed29ef4a6e83744249744 [1,1,0,0,0,0|2,0,0]=4 9290 B11R0.140 CSCCCN(C)CCCCO bd837ad2107bba1deef881e80b85ad58 [1,1,0,0,0,0|2,0,0]=4 9291 B11R0.140 CSCCNC(C)CCCCO c93d4954cefdbe1541d127fa9e92ee23 [1,1,0,0,0,0|2,0,0]=4 9292 B13R0.62 C#CC(CC(C)C)OCCCCCC 40ab7d98eb5c1ff7b7e6d07cf780243a [0,2,0,0,0,0|2,0,0]=4 9293 B13R0.62 C=CC(CC(C)C)OCCCCCC f983d4d5a99d6246d891100da5f43dc5 [0,2,0,0,0,0|2,0,0]=4 9294 B13R0.62 C=CC(CCCCCCC)OC(C)C e0951e07a0a1c5154dba4c6f790105e7 [0,2,0,0,0,0|2,0,0]=4 9295 B13R0.62 CCCCCCCC(CC)OC(C)C 67d065337927ca1ec5cfccdfb768dd54 [0,2,0,0,0,0|2,0,0]=4 9296 B13R0.62 CCCCCCCN(CC)CC(C)C 469ad56ec08dfdc79d930ea9e0df6c40 [0,2,0,0,0,0|2,0,0]=4 9297 B13R0.62 CCCCCCCN(CC)CC(C)O a4d0fe952638b0e9ef6c62c178922489 [0,2,0,0,0,0|1,0,0]=3 9298 B13R0.62 CCCCCCCN(CC)C[C@@H](C)O 10ec27a7d5461b26a87959bf3d065d7c [0,2,0,0,0,0|1,0,0]=3 9299 B13R0.62 CCCCCCCN(CC)C[C@H](C)O 1933feb3d839159c191b6d8a92747b07 [0,2,0,0,0,0|1,0,0]=3 9300 B13R0.62 CCCCCCNC(C#N)CC(C)C 91a0fbc18e7df92a05f740b61439de3b [0,2,0,0,0,0|2,0,0]=4 9301 B13R0.62 CCCCCCNC(CO)CC(C)C 47d87a23469393fdc47a26913c27c681 [0,2,0,0,0,0|2,0,0]=4 9302 B13R0.62 CCCCCCN[C@@H](CO)CC(C)C 14cc7531b65a66726daa29b84eecd18f [0,2,0,0,0,0|2,0,0]=4 9303 B13R0.62 CCCCCCN[C@H](CO)CC(C)C b76292d2caaec83a82c402077319e165 [0,2,0,0,0,0|2,0,0]=4 9304 B13R0.62 CCCCCCOC(C#N)CC(C)C 33480de857c8c44299dd5ed9dd3a3269 [0,2,0,0,0,0|2,0,0]=4 9305 B13R0.62 CCCCCNCC(C#N)CC(C)C db7c123a5b2da4abf2fd23c9da04eda5 [0,2,0,0,0,0|2,0,0]=4 9306 B13R0.62 CCCCCNCC(CO)CC(C)C b0232fd108d468bca580f51818b73fd9 [0,2,0,0,0,0|2,0,0]=4 9307 B13R0.62 CCCCCOCC(C#N)CC(C)C b425f3697b03c0d8cc41e0d706e170e6 [0,2,0,0,0,0|2,0,0]=4 9308 B13R0.62 CCCCCOCC(CC)CC(C)C 93ccf22c502c756df77e06a8dee9f6d9 [0,2,0,0,0,0|2,0,0]=4 9309 B13R0.62 CCCCOCCN(CC)CC(C)O 7177b18b525229db0ae18a6383e0354e [0,2,0,0,0,0|2,0,0]=4 9310 B13R0.62 CCCCOCCN(CC)C[C@H](C)O 7576685a5dda8a239e29db81ca4d45a1 [0,2,0,0,0,0|2,0,0]=4 9311 B13R0.62 CCCOCCCN(CC)CC(C)O 964d14117cf94ae9d1dae8cd12e03bd6 [0,2,0,0,0,0|2,0,0]=4 9312 B13R0.62 CCCOCCCN(CC)C[C@H](C)O 006f13e57fe7cb9433273884eb7ddd34 [0,2,0,0,0,0|2,0,0]=4 9313 B13R0.62 CCN(CCCCCCF)CC(C)O fb6944bcc8d8227ebeae0d04e9ae8f9b [0,2,0,0,0,0|2,0,0]=4 9314 B13R0.62 CCN(CCCCCCF)C[C@H](C)O 674e633a2874c08f32074a97d3aa79f4 [0,2,0,0,0,0|2,0,0]=4 9315 B13R0.62 CCN(CCCCCCO)CC(C)O c9ff6ec2da28c8a422157e1d5ffb4e9e [0,2,0,0,0,0|2,0,0]=4 9316 B13R0.62 CCN(CCCCCCO)C[C@H](C)O 30e27565cdba7dc70abf9987a7602dcf [0,2,0,0,0,0|2,0,0]=4 9317 B13R0.62 CCN(CCCCCOC)CC(C)O a33a6e2ed2b02aae29dea9653b9626e2 [0,2,0,0,0,0|2,0,0]=4 9318 B13R0.62 CCN(CCCCCOC)C[C@H](C)O db97f3b4c1b30d5cf9557f3bd4f578c9 [0,2,0,0,0,0|2,0,0]=4 9319 B13R0.115 CCCCC(C)COC(C)CC(C)C 7bd13f92b9dac170969b5063bbd1c6d9 [0,2,0,0,0,0|2,0,0]=4 9320 B13R0.115 CCCCC(C)NCC(O)CC(C)C 4ddca6fa6c6dce740bdeecb8228d0090 [0,2,0,0,0,0|2,0,0]=4 9321 B13R0.115 CCCCC(C)OCC(C)CC(C)C a5129e30905dd670c264e879056d39ee [0,2,0,0,0,0|2,0,0]=4 9322 B13R0.115 CCCCC(O)CNC(=O)CC(C)O 905f55345fadfbcac2a6f39b5cee6c0b [0,2,0,0,0,0|1,0,1]=4 9323 B13R0.115 CCCCC(O)CNC(=O)C[C@@H](C)O 68eedd4b4c997d059a8d78c04356e2ac [0,2,0,0,0,0|1,0,1]=4 9324 B13R0.115 CCCCC(O)CNC(=O)C[C@H](C)O d6df94b19f43f0093894a37880639778 [0,2,0,0,0,0|1,0,1]=4 9325 B13R0.115 CCCCC(O)CNC(C)CC(C)C b6b83aca3892a9dc249c1c30f67778ba [0,2,0,0,0,0|2,0,0]=4 9326 B13R0.178 CC(=O)CCCCCN(C)CC(C)O 0edc76576b3392f1e74613cc9baf9742 [0,2,0,0,0,0|1,0,1]=4 9327 B13R0.178 CC(=O)CCCCCN(C)C[C@H](C)O 6132689e5c71bdaee126331400579592 [0,2,0,0,0,0|1,0,1]=4 9328 B13R0.178 CC(=O)CCCCNC(C)CC(C)O fef82890bfabc13183c2583400184a49 [0,2,0,0,0,0|1,0,1]=4 9329 B13R0.178 CC(C)CC(C)NCCCCC(C)O 304693f12a89fb72082ea9fd883409c2 [0,2,0,0,0,0|1,0,0]=3 9330 B13R0.178 CC(C)CC(C)NCCCC[C@@H](C)O d0d9fae249295a063cbd9b877945b5b1 [0,2,0,0,0,0|1,0,0]=3 9331 B13R0.178 CC(C)CC(O)CNCCCC(C)O 2262ae4333b952dde0f38fdb5e1adbc1 [0,2,0,0,0,0|1,0,0]=3 9332 B13R0.178 CC(C)CCCCCN(C)CC(C)C 92c112aef84c9c1269e3d72ff31a3e51 [0,2,0,0,0,0|2,0,0]=4 9333 B13R0.178 CC(C)CCCCCN(C)CC(C)O d28e69ce9e3c46cd3cde07b83029770c [0,2,0,0,0,0|1,0,0]=3 9334 B13R0.178 CC(C)CCCCCN(C)C[C@H](C)O 70cec1ef1824f2e54c501cad4cec1c84 [0,2,0,0,0,0|1,0,0]=3 9335 B13R0.178 CC(C)CCCCNC(C)CC(C)C 883ee4d7867d00652d3e60716172e212 [0,2,0,0,0,0|2,0,0]=4 9336 B13R0.178 CC(C)CCCCNC(C)CC(C)O 7c090ce579979e59847775dba4023424 [0,2,0,0,0,0|1,0,0]=3 9337 B13R0.178 CC(C)CCCCOC(C)CC(C)C ceef71776604afacbaa54311567b0386 [0,2,0,0,0,0|2,0,0]=4 9338 B13R0.178 CC(C)CCCCO[C@@H](C)CC(C)C 6f5b875513444c1564cb429b54410561 [0,2,0,0,0,0|2,0,0]=4 9339 B13R0.178 CC(C)CCCCO[C@H](C)CC(C)C 2f3b9f66f15338f2cd57298d433141cc [0,2,0,0,0,0|2,0,0]=4 9340 B13R0.178 CC(C)CCCNCC(O)CC(C)C 5fbbf318c30d8bada904919353c58cd2 [0,2,0,0,0,0|2,0,0]=4 9341 B13R0.178 CC(C)CCCOCC(C)CC(C)C c9ca6d8b33b79b0d4f43b9f1bb779551 [0,2,0,0,0,0|2,0,0]=4 9342 B13R0.178 CC(C)CCOCCC(C)CC(C)C 97591f8a2b31194fd218b200a48bd50b [0,2,0,0,0,0|2,0,0]=4 9343 B13R0.178 CC(C)COCCCC(C)CC(C)C 273663b3074b60fa80d4c2db38fe1e5c [0,2,0,0,0,0|2,0,0]=4 9344 B13R0.178 CC(C)COCCNC(C)CC(C)O fc28ea1a5e3dcf1e5623600f19ef06f4 [0,2,0,0,0,0|2,0,0]=4 9345 B13R0.178 CC(CN(C)C)NCCCC[C@@H](C)O 90e3df10440a2ee601c976a9b134ba4a [0,2,0,0,0,0|2,0,0]=4 9346 B13R0.178 CC(O)CC(C)NCCCCN(C)C 61b6c777c4f8f04add17040d7f00a75d [0,2,0,0,0,0|2,0,0]=4 9347 B13R0.178 CC(O)CC(C)NCCCC[C@@H](C)O 94af1683968b157645796ba698d00c9e [0,2,0,0,0,0|1,0,0]=3 9348 B13R0.178 CC(O)CCCCNC(C)CC(C)O 5e2b287f7044f420fbc0d8c562643800 [0,2,0,0,0,0|1,0,0]=3 9349 B13R0.178 CC(O)CCCCNC(C)CN(C)C cf8c63a63ae86c23761b94855ad46815 [0,2,0,0,0,0|2,0,0]=4 9350 B13R0.178 CC(O)CCCCN[C@@H](C)CN(C)C 812aabb3983bd69cb19033ea7d47e2b7 [0,2,0,0,0,0|2,0,0]=4 9351 B13R0.178 CC(O)CCCCN[C@H](C)CN(C)C d2a101939373ea51a0cec62c15c035e5 [0,2,0,0,0,0|2,0,0]=4 9352 B13R0.178 CC(O)CCCNCC(C)CN(C)C 09b0f65b7a334c9c7eb357bd72bc80ea [0,2,0,0,0,0|2,0,0]=4 9353 B13R0.178 CC(O)CCCNCC(O)CN(C)C 4b0ab084bd5ec41c28a7ef69fb93cada [0,2,0,0,0,0|2,0,0]=4 9354 B13R0.178 CC(O)CN(C)CCCCCC(F)F 5a34b999ccaebaf3c154255a79acd499 [0,2,0,0,0,0|2,0,0]=4 9355 B13R0.178 C[C@@H](O)CCCCN[C@@H](C)CN(C)C 9fd8b649673cf4950813033edc2f83e5 [0,2,0,0,0,0|2,0,0]=4 9356 B13R0.178 C[C@H](CN(C)C)NCCCC[C@@H](C)O 9847d960d9da55186de5300e3d2e2d49 [0,2,0,0,0,0|2,0,0]=4 9357 B13R0.178 C[C@H](O)CN(C)CCCCCC(F)F 407717d373e28e2fe26ed054e6bc4373 [0,2,0,0,0,0|2,0,0]=4 9358 B13R0.198 CCC(=O)CCCCN(C)CC(C)O 37a40f146867fb3812c764864249f3e6 [0,2,0,0,0,0|1,0,1]=4 9359 B13R0.198 CCC(=O)CCCCN(C)C[C@H](C)O 3170a8169e70cdcf15a6e6e2c20621d1 [0,2,0,0,0,0|1,0,1]=4 9360 B13R0.198 CCC(C)CCCOC(C)CC(C)C b5be43ab8a106ed9f3d5b4f0256d633f [0,2,0,0,0,0|2,0,0]=4 9361 B13R0.198 CCC(C)CCNCC(O)CC(C)C 63daf04668fd8a80310fbcac81007454 [0,2,0,0,0,0|2,0,0]=4 9362 B13R0.198 CCC(C)CCOCC(C)CC(C)C 6830c6a9fc6eef5969c49d0e8b940fa3 [0,2,0,0,0,0|2,0,0]=4 9363 B13R0.198 CCC(C)COCCC(C)CC(C)C 4007395f385286e48bb9e13d5d13128d [0,2,0,0,0,0|2,0,0]=4 9364 B13R0.198 CCC(C)OCCCC(C)CC(C)C 2686435efd20a62aa726b242b3a735a0 [0,2,0,0,0,0|2,0,0]=4 9365 B13R0.198 CC[C@@H](C)COCCC(C)CC(C)C ad8122f0d5f75695997733603d1cb50d [0,2,0,0,0,0|2,0,0]=4 9366 B13R0.198 CC[C@H](C)CCCOC(C)CC(C)C 8c3e3cb28d5adc326d08e3f00ef4f594 [0,2,0,0,0,0|2,0,0]=4 9367 B13R0.198 CC[C@H](C)COCCC(C)CC(C)C 88cd8f25edcd94b9a2f12488b8a3aafb [0,2,0,0,0,0|2,0,0]=4 9368 B13R0.274 C#CC(C)N[C@@H](C)CCCCCCC 6dce6b11f9a06eb1b506fd9c091276e5 [0,2,0,0,0,0|2,0,0]=4 9369 B13R0.274 C#CC(C)OC(C)CCCCCCC c09d10ea235858db1c2c4d82e674d645 [0,2,0,0,0,0|2,0,0]=4 9370 B13R0.274 C=CC(C)N[C@@H](C)CCCCCCC 51c03555ceddc3cf0c8bfdbfa30e3f51 [0,2,0,0,0,0|2,0,0]=4 9371 B13R0.274 C=CC(C)OC(C)CCCCCCC 4b49fa03d815299929634ac8eff826c2 [0,2,0,0,0,0|2,0,0]=4 9372 B13R0.274 CC(CO)CN(C)CCCCCCF 44d4cd6f8e43f8f96a094718cc01d928 [0,2,0,0,0,0|2,0,0]=4 9373 B13R0.274 CC(CO)CN(C)CCCCCCO 0e0bfe69a8bb520814480b6242c71c3d [0,2,0,0,0,0|2,0,0]=4 9374 B13R0.274 CCC(O)CN(C)CCCCCCF 0b71bb268820b6d22b1976e57067fe48 [0,2,0,0,0,0|2,0,0]=4 9375 B13R0.274 CCC(O)CN(C)CCCCCCO eba0415ab05000ca8224dfc329c5c489 [0,2,0,0,0,0|2,0,0]=4 9376 B13R0.274 CCC(O)CN(C)CCCCCOC 0e17efc2419770061bcdb78fed1760a6 [0,2,0,0,0,0|2,0,0]=4 9377 B13R0.274 CCCCCCCC(=O)NC(C)CO 2935afc85cc697da5660b681a090468e [0,2,0,0,0,0|1,0,1]=4 9378 B13R0.274 CCCCCCCC(=O)N[C@@H](C)CO 9ff65fde3e64e6a13751e052124bc124 [0,2,0,0,0,0|1,0,1]=4 9379 B13R0.274 CCCCCCCC(=O)N[C@H](C)CO ffcecaadd8b19d3f0fa83682015865c1 [0,2,0,0,0,0|1,0,1]=4 9380 B13R0.274 CCCCCCCC(C)OC(C)C#N 1c44cc80a2992e285ba4435eb225d880 [0,2,0,0,0,0|2,0,0]=4 9381 B13R0.274 CCCCCCCC(C)OC(C)C=O d10720729886235ba78c04b5535de7d6 [0,2,0,0,0,0|1,0,1]=4 9382 B13R0.274 CCCCCCCC(C)OC(C)CC c41792d0db7d6bf3c83a220b5de0d882 [0,2,0,0,0,0|2,0,0]=4 9383 B13R0.274 CCCCCCCC(C)O[C@H](C)C=O 6dd67248476570c62b149c023a321a44 [0,2,0,0,0,0|1,0,1]=4 9384 B13R0.274 CCCCCCCN(C)CC(C)C#N 16eb5e191fb2e556cab2ebc6aee46f2e [0,2,0,0,0,0|2,0,0]=4 9385 B13R0.274 CCCCCCCN(C)CC(C)CC cbb7dca375b38586bcc1d3fafcbf5cbf [0,2,0,0,0,0|2,0,0]=4 9386 B13R0.274 CCCCCCCN(C)CC(C)CO 33bc4f6c1fd720bde1e830943a5d7ae6 [0,2,0,0,0,0|1,0,0]=3 9387 B13R0.274 CCCCCCCN(C)CC(C)OC 707ea9233fd298e6114b8e4f54f55e47 [0,2,0,0,0,0|1,0,0]=3 9388 B13R0.274 CCCCCCCN(C)CC(O)CC d539ae149bdce3e22e7af0ba9084d8d3 [0,2,0,0,0,0|1,0,0]=3 9389 B13R0.274 CCCCCCCN(C)CC(O)CF b5ce06485f0d1f12b121267d193f3c71 [0,2,0,0,0,0|1,0,0]=3 9390 B13R0.274 CCCCCCCN(C)CC(O)CO 572ed784e718d1cce4773f481c0016ac [0,2,0,0,0,0|1,0,0]=3 9391 B13R0.274 CCCCCCCN(C)C[C@@H](C)CC 635526dcbce85bbf35b7a6e803043dc2 [0,2,0,0,0,0|2,0,0]=4 9392 B13R0.274 CCCCCCCN(C)C[C@@H](C)CO 51ed8bceb04796e36043729f62d635f2 [0,2,0,0,0,0|1,0,0]=3 9393 B13R0.274 CCCCCCCN(C)C[C@@H](C)OC ccc7ac6a1bb237082cd5b29a14490ae6 [0,2,0,0,0,0|1,0,0]=3 9394 B13R0.274 CCCCCCCN(C)C[C@@H](O)CO d4a7da7835905946f054c4800b5beef7 [0,2,0,0,0,0|1,0,0]=3 9395 B13R0.274 CCCCCCCN(C)C[C@H](C)CC 6789061d8b923b24d3ef3bc1f603c78c [0,2,0,0,0,0|2,0,0]=4 9396 B13R0.274 CCCCCCCN(C)C[C@H](C)CO 140d133b72007d9834533300d9f61b66 [0,2,0,0,0,0|1,0,0]=3 9397 B13R0.274 CCCCCCCN(C)C[C@H](C)OC 4ba5de5dda5f13b4a9d25c46733b995d [0,2,0,0,0,0|1,0,0]=3 9398 B13R0.274 CCCCCCCN(C)C[C@H](O)CO 977783a0a7d2a8a6869a6707e60df81f [0,2,0,0,0,0|1,0,0]=3 9399 B13R0.274 CCCCCCC[C@H](C)NC(C)C#N 78a2ddd801519026d97dba13831d7a1f [0,2,0,0,0,0|2,0,0]=4 9400 B13R0.274 CCCCCCC[C@H](C)NC(C)C=O a5d01e66e5d3507465374afa8c68affa [0,2,0,0,0,0|1,0,1]=4 9401 B13R0.274 CCCCCCC[C@H](C)NC(C)CC df862f1e6e394c56d73eb5fff6560a1f [0,2,0,0,0,0|2,0,0]=4 9402 B13R0.274 CCCCCCC[C@H](C)NC(C)CO ca76fc2a9b45277729631ba1422ad171 [0,2,0,0,0,0|1,0,0]=3 9403 B13R0.274 CCCCCCC[C@H](C)N[C@@H](C)CO 0df6637377365e3caf7f5eda1b499af9 [0,2,0,0,0,0|1,0,0]=3 9404 B13R0.274 CCCCCCC[C@H](C)N[C@H](C)C=O 64f131703ddd40ffaaabadc629480d49 [0,2,0,0,0,0|1,0,1]=4 9405 B13R0.274 CCCCCCC[C@H](C)N[C@H](C)CO d9bd6fa1f939218433a3eb6d5c5c711f [0,2,0,0,0,0|1,0,0]=3 9406 B13R0.274 CCCCCCNC(=O)CC(C)OC 575f2ed93e3db2059ba508060f00b034 [0,2,0,0,0,0|1,0,1]=4 9407 B13R0.274 CCCCCCNC(=O)CC(O)CC cb2115466282998f057b73bf82c8dffb [0,2,0,0,0,0|1,0,1]=4 9408 B13R0.274 CCCCCCNC(=O)C[C@@H](O)CC 8616f6d786b7010b17fb94c940b6854e [0,2,0,0,0,0|1,0,1]=4 9409 B13R0.274 CCCCCCNC(=O)C[C@H](O)CC 3bce6c42f7cd25a1b188dc70d5e2c7e8 [0,2,0,0,0,0|1,0,1]=4 9410 B13R0.274 CCCCCCNC(C)CC(C)CC edc70abfef74aec03e5ba1aa92b6a32f [0,2,0,0,0,0|2,0,0]=4 9411 B13R0.274 CCCCCCOC(C)CC(C)OC e51b48ccd4698686955f24393c3dfc76 [0,2,0,0,0,0|1,0,0]=3 9412 B13R0.274 CCCCOCCN(C)CC(C)CO 86bfb4fa0ab3ce6bb73e1f05ebfcd8ef [0,2,0,0,0,0|2,0,0]=4 9413 B13R0.274 CCCCOCCN(C)CC(O)CC 5e7134662336bc10ed49bf196a02dab2 [0,2,0,0,0,0|2,0,0]=4 9414 B13R0.274 CCCCOCCN(C)CC(O)CO 734dea35b996793f02a3548165ed3033 [0,2,0,0,0,0|2,0,0]=4 9415 B13R0.274 CCCCOCOC(C)CC(C)OC c643d4fd720dae5c1b27f2ae6130d033 [0,2,0,0,0,0|2,0,0]=4 9416 B13R0.274 CCCOCCCN(C)CC(C)CO bb4d3d8ca8165319115d6eb2b4924c83 [0,2,0,0,0,0|2,0,0]=4 9417 B13R0.274 CCCOCCCN(C)CC(O)CC 64343aca23b42499e7b8ff75f0468ff3 [0,2,0,0,0,0|2,0,0]=4 9418 B13R0.274 CCCOCCCN(C)CC(O)CO fddb61234327a139cbdad328b6ec5f9e [0,2,0,0,0,0|2,0,0]=4 9419 B13R0.274 CCCOCCOC(C)CC(C)OC b89e2a97638c8ec4f6d9823d1a4472fd [0,2,0,0,0,0|2,0,0]=4 9420 B13R0.274 CCOCCCOC(C)CC(C)OC 7a6ee359e2d26e4e6e53418447a5dabf [0,2,0,0,0,0|2,0,0]=4 9421 B13R0.274 CCSCCCOC(C)CC(C)OC 13aa0b9880d617b13d94b374a55c195b [0,2,0,0,0,0|2,0,0]=4 9422 B13R0.274 CN(CCCCCCF)CC(O)CO cbeb6901667e74f50556c4db8206e5d9 [0,2,0,0,0,0|2,0,0]=4 9423 B13R0.274 CN(CCCCCCO)CC(O)CF 08f7e4eb895defe6f15c176a160cf655 [0,2,0,0,0,0|2,0,0]=4 9424 B13R0.274 CN(CCCCCCO)CC(O)CO 7ac965f5df50ffb00f2c41eeb381d4ac [0,2,0,0,0,0|2,0,0]=4 9425 B13R0.274 CN(CCCCCCO)C[C@@H](O)CO 167d35fe061bd9d02c162afcd724fc5f [0,2,0,0,0,0|2,0,0]=4 9426 B13R0.274 CN(CCCCCCO)C[C@H](O)CO 790cf49e6d6c7e69833f5fcbcaf3ffec [0,2,0,0,0,0|2,0,0]=4 9427 B13R0.274 COC(C)CC(C)OCCCCCF 678ff94c3a2f231850645d3ab1ded68c [0,2,0,0,0,0|2,0,0]=4 9428 B13R0.274 COC(C)CN(C)CCCCCCO 543b969b29d9568c394559f89ef2a997 [0,2,0,0,0,0|2,0,0]=4 9429 B13R0.274 COCCCCCN(C)CC(C)CO 050b6cfce3071d5bbc45dd83b41c101a [0,2,0,0,0,0|2,0,0]=4 9430 B13R0.274 COCCCCCN(C)CC(O)CO a15047666fea02d9419ba7ba59771c3b [0,2,0,0,0,0|2,0,0]=4 9431 B13R0.274 COCCCCOC(C)CC(C)OC d1d2b34fa2127ccef50fcb83c91116b5 [0,2,0,0,0,0|2,0,0]=4 9432 B13R0.274 CO[C@@H](C)CN(C)CCCCCCO 3da72a581edef2d4409aa7e654f712e9 [0,2,0,0,0,0|2,0,0]=4 9433 B13R0.274 CO[C@H](C)CN(C)CCCCCCO bbf2500d8853d70690a5cf135671a028 [0,2,0,0,0,0|2,0,0]=4 9434 B13R0.274 C[C@@H](CO)CN(C)CCCCCCO 28104350f51a5e1a29796e73589b1d17 [0,2,0,0,0,0|2,0,0]=4 9435 B13R0.274 C[C@H](CO)CN(C)CCCCCCO a1184c0c24cb9ef79de038d581dfe7ce [0,2,0,0,0,0|2,0,0]=4 9436 B13R0.286 CC(C)(O)CC(O)CNCCCCCl 2bfaa0be980e451af90a71e1561f9b79 [0,2,0,0,0,0|2,0,0]=4 9437 B13R0.286 CC(C)(O)CC(O)CNCCCCO 9e30ac702d77c0223cac330bdf04bcff [0,2,0,0,0,0|2,0,0]=4 9438 B13R0.286 CC(C)(O)CC(O)CNCCCCS 133598850d33375af450071484ec5441 [0,2,0,0,0,0|2,0,0]=4 9439 B13R0.286 CC(C)(O)CC(O)COCCCCF 185bffae25ea4dd76193f7e53ad335f3 [0,2,0,0,0,0|2,0,0]=4 9440 B13R0.286 CC(C)(O)CC(O)COCCCCS 4de6700da92fa772401d6462ee410bce [0,2,0,0,0,0|2,0,0]=4 9441 B13R0.286 CCCCCCCN(C)CC(C)(C)C c09dd2fdc7254b1ea2fdab2fe5eea60f [0,2,0,0,0,0|2,0,0]=4 9442 B13R0.286 CCCCCCCN(C)CC(C)(C)F d4be4235a4a4775c82faf470cc6bb976 [0,2,0,0,0,0|2,0,0]=4 9443 B13R0.286 CCCCCCCN(C)CC(C)(C)O 4d525d8829952aff6f9dbc4512ae4359 [0,2,0,0,0,0|1,0,0]=3 9444 B13R0.286 CCCCCCCN(C)CC(C)(F)F 2a33d4c2595c2624463c47e05825868b [0,2,0,0,0,0|2,0,0]=4 9445 B13R0.286 CCCCCCNC(=O)CC(C)(C)O fbf2d3b47eed5d47a21f8de809d5a785 [0,2,0,0,0,0|1,0,1]=4 9446 B13R0.286 CCCCCCOC(C)CC(C)(C)C d711e7120344903a7294f3b396dc6d83 [0,2,0,0,0,0|2,0,0]=4 9447 B13R0.286 CCCCCCOC(C)CC(C)(C)S 8543e5b965d6498d027817c0696e9e64 [0,2,0,0,0,0|1,1,0]=4 9448 B13R0.286 CCCCCNCC(O)CC(C)(C)O 8fdbccdc3c6aa7da1fea069210f51d30 [0,2,0,0,0,0|1,0,0]=3 9449 B13R0.286 CCCCCOCC(C)CC(C)(C)C 8e839a75f5b4ed814cea4b613869efef [0,2,0,0,0,0|2,0,0]=4 9450 B13R0.286 CCCCCOCC(O)CC(C)(C)O 5300cc1e848780826231a6f4720b9bd5 [0,2,0,0,0,0|1,0,0]=3 9451 B13R0.286 CCCCOCCC(C)CC(C)(C)C 1762f683c17586da85691ae6470b2181 [0,2,0,0,0,0|2,0,0]=4 9452 B13R0.286 CCCCOCCN(C)CC(C)(C)O 1adb1626513917e88194d96b08dd1425 [0,2,0,0,0,0|2,0,0]=4 9453 B13R0.286 CCCOCCCN(C)CC(C)(C)O b44d058ae5aef218bcdd0ec140635338 [0,2,0,0,0,0|2,0,0]=4 9454 B13R0.286 CCOCCNCC(O)CC(C)(C)O 0b2ddfc4a6abf6bf13cf34c3ad3caaac [0,2,0,0,0,0|2,0,0]=4 9455 B13R0.286 CCOCCOCC(O)CC(C)(C)O 9061fd81ff349ad29d7d2cea4aea689d [0,2,0,0,0,0|2,0,0]=4 9456 B13R0.286 CCSCCNCC(O)CC(C)(C)O 41289324c113858c8c8772ca871f7e50 [0,2,0,0,0,0|2,0,0]=4 9457 B13R0.286 CCSCCOCC(O)CC(C)(C)O 01b66d778a75c5b56383230103e71e28 [0,2,0,0,0,0|2,0,0]=4 9458 B13R0.286 CN(CCCCCCF)CC(C)(C)O 4e42167f6b706f2616f282c9fce2bfc9 [0,2,0,0,0,0|2,0,0]=4 9459 B13R0.286 CN(CCCCCCO)CC(C)(C)O f5881c298f68a6e8d9a73d06903b18ff [0,2,0,0,0,0|2,0,0]=4 9460 B13R0.286 COCCCCCN(C)CC(C)(C)O 3a1475b7a4a5c41141f1cd015f39d66c [0,2,0,0,0,0|2,0,0]=4 9461 B13R0.286 COCCCNCC(O)CC(C)(C)O 0c5084a0009df6af3de65f323b84ceb6 [0,2,0,0,0,0|2,0,0]=4 9462 B13R0.286 COCCCOCC(O)CC(C)(C)O b4286aa04e299a1ea8332730bfc51702 [0,2,0,0,0,0|2,0,0]=4 9463 B13R0.286 CSCCCNCC(O)CC(C)(C)O 36e34d96e1b64a62de643af04bdf90d5 [0,2,0,0,0,0|2,0,0]=4 9464 B13R0.286 CSCCCOCC(O)CC(C)(C)O 3525b14330d1c8c14613a5c9459604fd [0,2,0,0,0,0|2,0,0]=4 9465 B13R0.332 CCCC(C)CCOC(C)CC(C)C f87991bc8af31b307921d84d83dd367d [0,2,0,0,0,0|2,0,0]=4 9466 B13R0.332 CCCC(C)CNCC(O)CC(C)C cd7236ecadf31a949c2d1bf55f8268ec [0,2,0,0,0,0|2,0,0]=4 9467 B13R0.332 CCCC(C)COCC(C)CC(C)C 964d7a49d007b9039df4ffb3d25a8378 [0,2,0,0,0,0|2,0,0]=4 9468 B13R0.332 CCCC(C)OCCC(C)CC(C)C fd27eb1d8e3c75883a94abb5589aad42 [0,2,0,0,0,0|2,0,0]=4 9469 B13R0.332 CCCC(S)CCOC(C)CC(C)C 5a7dcf1e3e69fc4d60a386852aa71690 [0,2,0,0,0,0|2,0,0]=4 9470 B13R0.333 CC(O)CC(C)NC(C)CCCCO a83492b8e943f98b929357b8e5ee1798 [0,2,0,0,0,0|2,0,0]=4 9471 B13R0.333 CCCCCC(=O)CN(C)CC(C)O 9cce47df9c90646dc1561fdd7ecd8679 [0,2,0,0,0,0|1,0,1]=4 9472 B13R0.333 CCCCCC(=O)CN(C)C[C@H](C)O 49308835f1fdbf19dc94f316e26302ca [0,2,0,0,0,0|1,0,1]=4 9473 B13R0.333 CCCCCC(=O)NC(C)CC(C)O 75e280b3b216497aaa44039683e5354a [0,2,0,0,0,0|1,0,1]=4 9474 B13R0.333 CCCCCC(C)NC(=O)CC(C)O 4a50b8948920f938a86e79659ded9475 [0,2,0,0,0,0|1,0,1]=4 9475 B13R0.333 CCCCCC(C)NC(=O)C[C@@H](C)O 46f3262e0f3d4b0102a6d84f6d88e541 [0,2,0,0,0,0|1,0,1]=4 9476 B13R0.333 CCCCCC(C)NC(=O)C[C@H](C)O 2b43b186485050bf751e1589f54080a6 [0,2,0,0,0,0|1,0,1]=4 9477 B13R0.333 CCCCCC(C)NC(C)CC(C)C e0ee10284baa6ae56eda94c7159b4822 [0,2,0,0,0,0|2,0,0]=4 9478 B13R0.333 CCCCCC(C)NC(C)CC(C)O 53e713d4d838efda602beda773fe9fdc [0,2,0,0,0,0|1,0,0]=3 9479 B13R0.333 CCCCCC(C)OC(C)CC(C)C 29b32f4ac4d8132dbb2039e49feb64a7 [0,2,0,0,0,0|2,0,0]=4 9480 B13R0.333 CCCCCC(C)O[C@@H](C)CC(C)C 494198755a3ab4d788147cf567ed35fd [0,2,0,0,0,0|2,0,0]=4 9481 B13R0.333 CCCCCC(C)O[C@H](C)CC(C)C 70ee67d8da28e42b5ba25e93ec250a93 [0,2,0,0,0,0|2,0,0]=4 9482 B13R0.333 CCCCC[C@@H](C)OC(C)CC(C)C f58f2673b3e4cc1ea30688014ddcbedb [0,2,0,0,0,0|2,0,0]=4 9483 B13R0.333 CCCCC[C@H](C)NC(=O)CC(C)O aeb99f3ade4ba7d339cd47fd2e43da1b [0,2,0,0,0,0|1,0,1]=4 9484 B13R0.333 CCCCC[C@H](C)NC(=O)C[C@@H](C)O fa74cb5d63b0ed497aad7db9f61fbf0f [0,2,0,0,0,0|1,0,1]=4 9485 B13R0.333 CCCCC[C@H](C)NC(=O)C[C@H](C)O 8b501ae537aa0ef70a8ed6bf8bf7d90a [0,2,0,0,0,0|1,0,1]=4 9486 B13R0.333 CCCCC[C@H](C)NC(C)CC(C)C 2f03bf8989571ee8fdc7a90f1801679e [0,2,0,0,0,0|2,0,0]=4 9487 B13R0.333 CCCCC[C@H](C)NC(C)CC(C)O b9435f970682263f74dd068cc6c080fd [0,2,0,0,0,0|1,0,0]=3 9488 B13R0.333 CCCCC[C@H](C)OC(C)CC(C)C 9d0136cb381382d8ab3b6b1c4239e195 [0,2,0,0,0,0|2,0,0]=4 9489 B13R0.333 CCCCC[C@H](C)O[C@@H](C)CC(C)C b814101dbaaf6f13e38a341560ad1af5 [0,2,0,0,0,0|2,0,0]=4 9490 B13R0.333 CCCCC[C@H](C)O[C@H](C)CC(C)C daa37bc61cf1e4d04c5acbf8b90381f5 [0,2,0,0,0,0|2,0,0]=4 9491 B13R0.333 CCCCOC(C)CC(C)CC(C)C 3f5838adead91b4002dfa7231b29d8e8 [0,2,0,0,0,0|2,0,0]=4 9492 B13R0.335 C#CCCCCCCN(C)CC(C)O 3bbeb0db1345609dfd374d2c42349ead [0,2,0,0,0,0|0,0,2]=4 9493 B13R0.335 C#CCCCCCCN(C)C[C@H](C)O f6467712b5341bb2a7e5e7a220c26b15 [0,2,0,0,0,0|0,0,2]=4 9494 B13R0.335 C#CCCCCCNC(C)CC(C)O 7513d33614f4bde009750a0fc2438324 [0,2,0,0,0,0|0,0,2]=4 9495 B13R0.335 C=C(C)CN(C)CCCCCCCC 2653d116112eca7e59032628642d2bf3 [0,2,0,0,0,0|1,0,1]=4 9496 B13R0.335 C=CCCCCCCN(C)CC(C)O 97354497231e40efae334e2cafc7b19f [0,2,0,0,0,0|0,0,2]=4 9497 B13R0.335 C=CCCCCCCN(C)C[C@@H](C)O 38e036fc6d18ca5d98ef97884182f408 [0,2,0,0,0,0|0,0,2]=4 9498 B13R0.335 C=CCCCCCCN(C)C[C@H](C)O 2dfe6776d8704c58c58f1fd5da9b3c09 [0,2,0,0,0,0|0,0,2]=4 9499 B13R0.335 C=CCCCCCNC(C)CC(C)O 22a77aa011b8053ff28368d4f23b21fd [0,2,0,0,0,0|0,0,2]=4 9500 B13R0.335 CC(C)CC(C)CCCOCCCF a530bd768e939ea0dc535e3aca02e8cc [0,2,0,0,0,0|2,0,0]=4 9501 B13R0.335 CC(C)CC(C)CCCOCCCS a691ac430eef1675d26ad0844e17c4df [0,2,0,0,0,0|2,0,0]=4 9502 B13R0.335 CC(C)CC(C)CCOCCCCF 286dad402368d40857fdc8efb9b3a87c [0,2,0,0,0,0|2,0,0]=4 9503 B13R0.335 CC(C)CC(C)COCCCCCF 5b9a43d0995813727d0cc4f5c145b065 [0,2,0,0,0,0|2,0,0]=4 9504 B13R0.335 CC(C)CC(C)NCCCCCCCl 9c94f81f80de36b5f126e26faad2c725 [0,2,0,0,0,0|2,0,0]=4 9505 B13R0.335 CC(C)CC(C)NCCCCCCF 517c2e33b364b550dfaecc0aa7aa2cc6 [0,2,0,0,0,0|2,0,0]=4 9506 B13R0.335 CC(C)CC(C)NCCCCCCO 7865d5bdf77243f158a0bbe3618e77a3 [0,2,0,0,0,0|2,0,0]=4 9507 B13R0.335 CC(C)CC(C)OCCCCCCF fc4466b999041d27995565b1aff6b182 [0,2,0,0,0,0|2,0,0]=4 9508 B13R0.335 CC(C)CC(C)OCCCCCCS a1232ac20ea9f3655cfe729979ac807f [0,2,0,0,0,0|2,0,0]=4 9509 B13R0.335 CC(C)CC(O)CNCCCCCF 6aaeb1dde6f5c878a79b4777e48095a1 [0,2,0,0,0,0|2,0,0]=4 9510 B13R0.335 CC(C)CC(O)CNCCCCCO 375bfabaf6531e4a3dfe2852a9084264 [0,2,0,0,0,0|2,0,0]=4 9511 B13R0.335 CC(C)CN(C)CCCCCCCO 77d27a3feb16010c91e635ec6b69b543 [0,2,0,0,0,0|2,0,0]=4 9512 B13R0.335 CC(C)C[C@@H](C)OCCCCCCF 302f7cb8807b569011045caceb009b85 [0,2,0,0,0,0|2,0,0]=4 9513 B13R0.335 CC(C)C[C@H](C)OCCCCCCF 7d0b8a7e9ad437c63712ea4ce3228d8c [0,2,0,0,0,0|2,0,0]=4 9514 B13R0.335 CC(O)CC(=O)NCCCCCCCl 825c8fecc29fa0da729259020970af22 [0,2,0,0,0,0|1,0,1]=4 9515 B13R0.335 CC(O)CC(=O)NCCCCCCO ce1b8bdbc3b8c53df7de9d179ad8e6b3 [0,2,0,0,0,0|1,0,1]=4 9516 B13R0.335 CC(O)CC(C)NCCCCCC#N 23682d278891ca419a477b71111ec647 [0,2,0,0,0,0|1,0,1]=4 9517 B13R0.335 CC(O)CC(C)NCCCCCC=O fa7d88b9a971a5792b4fe9fdfce5226d [0,2,0,0,0,0|1,0,1]=4 9518 B13R0.335 CC(O)CC(C)NCCCCCCF 55f19d3f00168f4ce5264208ade44f95 [0,2,0,0,0,0|1,0,0]=3 9519 B13R0.335 CC(O)CC(C)NCCCCCCO 71b5a559590e1d6f11847b42d15b0432 [0,2,0,0,0,0|1,0,0]=3 9520 B13R0.335 CC(O)CN(C)CCCCCCC#N 63d65d1b6809544f20190f7653e7331b [0,2,0,0,0,0|1,0,1]=4 9521 B13R0.335 CC(O)CN(C)CCCCCCC=O e8947eae2d6f00cae7eae83006e8ea69 [0,2,0,0,0,0|1,0,1]=4 9522 B13R0.335 CC(O)CN(C)CCCCCCCO b0b68620168327b6dea7201fadd0faed [0,2,0,0,0,0|1,0,0]=3 9523 B13R0.335 CC(O)CN(C)CCCOCCCO bb0b6ad5129064e414c8d8afd468821b [0,2,0,0,0,0|2,0,0]=4 9524 B13R0.335 CCCC/C=C/CNC(C)CC(C)O 467dcecfbe8d1a428e4e553e953b790b [0,2,0,0,0,0|0,0,2]=4 9525 B13R0.335 CCCC/C=C\CNC(C)CC(C)O d1d32401b9c56e9b1b8cf2c47cc99b33 [0,2,0,0,0,0|0,0,2]=4 9526 B13R0.335 CCCCCCCCC(C)NC(=O)C 329b53071b7bd75bff2f9d2678bdae11 [0,2,0,0,0,0|0,0,2]=4 9527 B13R0.335 CCCCCCCCC(C)NC(C)C 62348ae65fc16505f485e7ae09e647f3 [0,2,0,0,0,0|1,0,0]=3 9528 B13R0.335 CCCCCCCCC(C)OC(C)C 109309e895ff87d2a69169eb301d31e7 [0,2,0,0,0,0|1,0,0]=3 9529 B13R0.335 CCCCCCCCN(C)CC(=O)O 2509cae4848afb8cc8fdf123eaa8b2ec [0,2,0,0,0,0|1,0,1]=4 9530 B13R0.335 CCCCCCCCN(C)CC(C)C 5ef05e838a6dfe40d45742f306221197 [0,2,0,0,0,0|1,0,0]=3 9531 B13R0.335 CCCCCCCCN(C)CC(C)O 3e35fd517ad6104457c4e25e9653e832 [0,2,0,0,0,0|0,0,0]=2 9532 B13R0.335 CCCCCCCCN(C)CC(F)F a1209ab000e3d81e30f4c592f8a144f2 [0,2,0,0,0,0|2,0,0]=4 9533 B13R0.335 CCCCCCCCN(C)CN(C)C a2ad3da0c4c04d786e70aa95a6c8bd78 [0,2,0,0,0,0|2,0,0]=4 9534 B13R0.335 CCCCCCCCN(C)C[C@@H](C)O 639b97e107ff18408fdb3f91493ff448 [0,2,0,0,0,0|0,0,0]=2 9535 B13R0.335 CCCCCCCCN(C)C[C@H](C)O 99c061e2cde8b53292b2fdca51eb4bc0 [0,2,0,0,0,0|0,0,0]=2 9536 B13R0.335 CCCCCCCC[C@@H](C)OC(C)C 3288a24578bbcacc38344d4421b069c3 [0,2,0,0,0,0|1,0,0]=3 9537 B13R0.335 CCCCCCCNC(=O)CC(C)C d4f5eb9f42843cf497fb74b1ffbc3675 [0,2,0,0,0,0|1,0,1]=4 9538 B13R0.335 CCCCCCCNC(=O)CC(C)O 8e9e2cb02e99869e2acf4d3b9d7445f7 [0,2,0,0,0,0|0,0,1]=3 9539 B13R0.335 CCCCCCCNC(=O)C[C@@H](C)O 47466de886acdfd84f8894d18b9038fb [0,2,0,0,0,0|0,0,1]=3 9540 B13R0.335 CCCCCCCNC(=O)C[C@H](C)O 76d3ed10a3459596bd6af11187a622b6 [0,2,0,0,0,0|0,0,1]=3 9541 B13R0.335 CCCCCCCNC(C)CC(=O)O b14f86f38320cfd6a27a70ecc828b328 [0,2,0,0,0,0|1,0,1]=4 9542 B13R0.335 CCCCCCCNC(C)CC(C)C 40446644e7540195167d50f2b51770e2 [0,2,0,0,0,0|1,0,0]=3 9543 B13R0.335 CCCCCCCNC(C)CC(C)O 48d4b721ce66f4337dd5214af74624ce [0,2,0,0,0,0|0,0,0]=2 9544 B13R0.335 CCCCCCCNC(C)CN(C)C 8af9e857cd430768b18a440814f6105a [0,2,0,0,0,0|2,0,0]=4 9545 B13R0.335 CCCCCCCN[C@@H](C)CC(=O)O 78ec7b16ffd03697bbf4e1dfd2517334 [0,2,0,0,0,0|1,0,1]=4 9546 B13R0.335 CCCCCCCN[C@@H](C)CN(C)C 3c6aba2e8981201695dfaa3a951619c4 [0,2,0,0,0,0|2,0,0]=4 9547 B13R0.335 CCCCCCCN[C@H](C)CC(=O)O de678031e40027065fc300037f2163d3 [0,2,0,0,0,0|1,0,1]=4 9548 B13R0.335 CCCCCCCN[C@H](C)CN(C)C 5d5271a493d276e22a337bba04e4235a [0,2,0,0,0,0|2,0,0]=4 9549 B13R0.335 CCCCCCCOC(C)CC(=O)O 896a0faad7673db8e793bbaca96e9a30 [0,2,0,0,0,0|1,0,1]=4 9550 B13R0.335 CCCCCCCOC(C)CC(C)C fe671017d60cb34ff51f5bdd4c92c3ad [0,2,0,0,0,0|1,0,0]=3 9551 B13R0.335 CCCCCCCOC(C)CN(C)C 4c2217aa3d09fad12fbd55e32b14d51c [0,2,0,0,0,0|2,0,0]=4 9552 B13R0.335 CCCCCCCO[C@@H](C)CC(=O)O 5d628766a2b37860feeb3d9f9441d028 [0,2,0,0,0,0|1,0,1]=4 9553 B13R0.335 CCCCCCCO[C@@H](C)CC(C)C f30d7ba71c67e773ea98ab8b4fc3f5d1 [0,2,0,0,0,0|1,0,0]=3 9554 B13R0.335 CCCCCCCO[C@@H](C)CN(C)C b902794827fdb7e2376e66755b123afd [0,2,0,0,0,0|2,0,0]=4 9555 B13R0.335 CCCCCCCO[C@H](C)CC(=O)O 28335f982a345dc6cf4998321a8e3b28 [0,2,0,0,0,0|1,0,1]=4 9556 B13R0.335 CCCCCCCO[C@H](C)CC(C)C 8aff04ae87e68a65ce19746b6a31737a [0,2,0,0,0,0|1,0,0]=3 9557 B13R0.335 CCCCCCCO[C@H](C)CN(C)C a96b7a2dff32b3b74dd5c1e2ad18be19 [0,2,0,0,0,0|2,0,0]=4 9558 B13R0.335 CCCCCCNCC(=O)CC(C)C 7624e86be1e974b837400b5be14967f5 [0,2,0,0,0,0|1,0,1]=4 9559 B13R0.335 CCCCCCNCC(C)CN(C)C 31ff2cb3afbc01c44c20b3c6c1715e35 [0,2,0,0,0,0|2,0,0]=4 9560 B13R0.335 CCCCCCNCC(O)CC(=O)O 1d0810503fa4f352f884ebc35c4d553a [0,2,0,0,0,0|1,0,1]=4 9561 B13R0.335 CCCCCCNCC(O)CC(C)C 41ddd67a0e1ce83f6cb0afeb3a3d7b9a [0,2,0,0,0,0|1,0,0]=3 9562 B13R0.335 CCCCCCNCC(O)CN(C)C 18878bef14d5ffe27b4961f24a4b1957 [0,2,0,0,0,0|2,0,0]=4 9563 B13R0.335 CCCCCCNC[C@@H](O)CC(=O)O e37747d748d2c2f8294493b265704a8a [0,2,0,0,0,0|1,0,1]=4 9564 B13R0.335 CCCCCCNC[C@H](O)CC(=O)O 5b8dc34dad5b0d42e516cebeaa364b02 [0,2,0,0,0,0|1,0,1]=4 9565 B13R0.335 CCCCCCOCC(=O)CC(C)C 1af3c8cad488da9da8ef03e201b6e227 [0,2,0,0,0,0|1,0,1]=4 9566 B13R0.335 CCCCCCOCC(C)CC(C)C c0031e159b7abfc2d0e4144def925a2b [0,2,0,0,0,0|1,0,0]=3 9567 B13R0.335 CCCCCCOCC(C)CN(C)C 7c328a72311ee27dae214e195a534591 [0,2,0,0,0,0|2,0,0]=4 9568 B13R0.335 CCCCCCOC[C@@H](C)CN(C)C 959fce846bf3e43da0a5a3c079ffae52 [0,2,0,0,0,0|2,0,0]=4 9569 B13R0.335 CCCCCCOC[C@H](C)CN(C)C e69588c17996b0952ad96202d2829e54 [0,2,0,0,0,0|2,0,0]=4 9570 B13R0.335 CCCCCNCCC(C)CC(=O)O 7c6b067f3313121e17e3f0e5160bc55f [0,2,0,0,0,0|1,0,1]=4 9571 B13R0.335 CCCCCOCCC(C)CC(=O)O 13de2c50606febe249aea52e03e3fe18 [0,2,0,0,0,0|1,0,1]=4 9572 B13R0.335 CCCCCOCCC(C)CC(C)C 211c7c6c13a99e57b4266ad8896facdb [0,2,0,0,0,0|1,0,0]=3 9573 B13R0.335 CCCCOCCCC(C)CC(C)C e865eafea5516186ccc93cc2a9b32d03 [0,2,0,0,0,0|1,0,0]=3 9574 B13R0.335 CCCCOCCNC(=O)CC(C)O d2f3f00c7d48f8124fcd4b646a4c7d25 [0,2,0,0,0,0|1,0,1]=4 9575 B13R0.335 CCCCOCCNC(=O)C[C@@H](C)O 6c5852ad7baeb1549f97fd87986cd6e4 [0,2,0,0,0,0|1,0,1]=4 9576 B13R0.335 CCCCOCCNC(=O)C[C@H](C)O e5543760cb8ba88c8e83d27c0c0e4c89 [0,2,0,0,0,0|1,0,1]=4 9577 B13R0.335 CCCCOCCNC(C)CC(C)C ec39b6fea7b6c31341fddc9ef1768083 [0,2,0,0,0,0|2,0,0]=4 9578 B13R0.335 CCCCOCCNC(C)CC(C)O d73b034eb04468799e4cee39a34fdf56 [0,2,0,0,0,0|1,0,0]=3 9579 B13R0.335 CCCCOCCOC(C)CC(C)C 576d8a41c2a9f871626bb67f4209e4de [0,2,0,0,0,0|2,0,0]=4 9580 B13R0.335 CCCCOCCO[C@@H](C)CC(C)C 0757fa8d7b1d97a91f595b2046e0cba9 [0,2,0,0,0,0|2,0,0]=4 9581 B13R0.335 CCCCOCCO[C@H](C)CC(C)C e4b4531b527f134947ad3c8a5e9de966 [0,2,0,0,0,0|2,0,0]=4 9582 B13R0.335 CCCCOCNCC(O)CC(C)C 1beca2e0cb4fc64c92008689aeeb808e [0,2,0,0,0,0|2,0,0]=4 9583 B13R0.335 CCCCOCOCC(C)CC(C)C 8f05020c7a0eb10e58af2a63eebc11fd [0,2,0,0,0,0|2,0,0]=4 9584 B13R0.335 CCCCSCCOC(C)CC(C)C 1542b8aa58a593cd162a1291ad126761 [0,2,0,0,0,0|2,0,0]=4 9585 B13R0.335 CCCOCCCNC(=O)CC(C)O 8ab48a0d5d9d9b98a1acf8633f2e2cf9 [0,2,0,0,0,0|1,0,1]=4 9586 B13R0.335 CCCOCCCNC(=O)C[C@@H](C)O 2d609be6675652ed3fbe72b9011069ca [0,2,0,0,0,0|1,0,1]=4 9587 B13R0.335 CCCOCCCNC(=O)C[C@H](C)O c4c551e2613900d142cc71de100cd9e5 [0,2,0,0,0,0|1,0,1]=4 9588 B13R0.335 CCCOCCCNC(C)CC(C)C 4b2332a76fb9b8cf7c3ee0a5ae6bb16e [0,2,0,0,0,0|2,0,0]=4 9589 B13R0.335 CCCOCCCNC(C)CC(C)O 36f9fc7423958fff3ced3868a6d42bde [0,2,0,0,0,0|1,0,0]=3 9590 B13R0.335 CCCOCCCOC(C)CC(C)C fcbec2d8d98e981c658c8823555f4510 [0,2,0,0,0,0|2,0,0]=4 9591 B13R0.335 CCCOCCCO[C@@H](C)CC(C)C d8c7c060213b7ff4a541ac4698989957 [0,2,0,0,0,0|2,0,0]=4 9592 B13R0.335 CCCOCCCO[C@H](C)CC(C)C 5d39c32e39f915885971e18a7f2c25cb [0,2,0,0,0,0|2,0,0]=4 9593 B13R0.335 CCCOCCNCC(O)CC(C)C 0720c5ca47cda55ffc69e048f405d1f4 [0,2,0,0,0,0|2,0,0]=4 9594 B13R0.335 CCCOCCOCC(C)CC(C)C a65c39a6093e3ae13bd72831be93047e [0,2,0,0,0,0|2,0,0]=4 9595 B13R0.335 CCOCCCNCC(O)CC(C)C 59f2a2c7a91dbc95c62877b41d2ff669 [0,2,0,0,0,0|2,0,0]=4 9596 B13R0.335 CCOCCCOCC(C)CC(C)C a50acebbfb2533f2d51f27b63eb2383e [0,2,0,0,0,0|2,0,0]=4 9597 B13R0.335 CCOCCOCCC(C)CC(C)C 193fa4f3695d04b6fbb43eb07c76eb2d [0,2,0,0,0,0|2,0,0]=4 9598 B13R0.335 CCOCCOCCN(C)CC(C)O 5414caabf5295164269b1b04871aa429 [0,2,0,0,0,0|2,0,0]=4 9599 B13R0.335 CCOCCOCCN(C)C[C@@H](C)O 0383e9c9a5869a293ceb56662ca19d48 [0,2,0,0,0,0|2,0,0]=4 9600 B13R0.335 CCOCCOCCN(C)C[C@H](C)O 1c7f124a14bbce6f7782eeacc10ff78d [0,2,0,0,0,0|2,0,0]=4 9601 B13R0.335 CCOCOCCCC(C)CC(C)C baf198023544c425864458b2f05ea829 [0,2,0,0,0,0|2,0,0]=4 9602 B13R0.335 CCSCCCCNC(=O)CC(C)O 84b100f93dc9b660e9f332134ff2bc7e [0,2,0,0,0,0|1,0,1]=4 9603 B13R0.335 CCSCCCCNC(=O)C[C@@H](C)O 1be3acfa7862715a1b1a1f72c0835961 [0,2,0,0,0,0|1,0,1]=4 9604 B13R0.335 CCSCCCCNC(=O)C[C@H](C)O 42757667ca6316bad13f418635fdde1b [0,2,0,0,0,0|1,0,1]=4 9605 B13R0.335 CCSCCCCNC(C)CC(C)C a33853991a3c3e9d736655ca20ea24e9 [0,2,0,0,0,0|2,0,0]=4 9606 B13R0.335 CCSCCCNCC(O)CC(C)C 757d717740b506ea943833ea0cdd3774 [0,2,0,0,0,0|2,0,0]=4 9607 B13R0.335 CCSCCCOCC(C)CC(C)C fcc575d8901cfa3e45651c732a641304 [0,2,0,0,0,0|2,0,0]=4 9608 B13R0.335 CCSCCOCCC(C)CC(C)C 52069991541b0403fff00e8751cd08fc [0,2,0,0,0,0|2,0,0]=4 9609 B13R0.335 COCCCCCCN(C)CC(C)C a5b738be048b35d187fd4f492c5b328e [0,2,0,0,0,0|2,0,0]=4 9610 B13R0.335 COCCCCCCN(C)CC(C)O e1f061591214e2ee7b9471a03cd4443d [0,2,0,0,0,0|1,0,0]=3 9611 B13R0.335 COCCCCCCN(C)C[C@H](C)O 4b0a35f788af0951205f0cdb0515996d [0,2,0,0,0,0|1,0,0]=3 9612 B13R0.335 COCCCCCNC(=O)CC(C)O 777804c3448f720f3ea53922045ef111 [0,2,0,0,0,0|1,0,1]=4 9613 B13R0.335 COCCCCCNC(=O)C[C@@H](C)O d36b6bf5a3f5f57164990580f467feeb [0,2,0,0,0,0|1,0,1]=4 9614 B13R0.335 COCCCCCNC(=O)C[C@H](C)O e03fae1361a259e0c4d2077ffa094beb [0,2,0,0,0,0|1,0,1]=4 9615 B13R0.335 COCCCCCNC(C)CC(C)C 696c3e0bb22f76c3556562075ad3214e [0,2,0,0,0,0|2,0,0]=4 9616 B13R0.335 COCCCCCNC(C)CC(C)O 8fbd3bd788cf78186d98a7e855080097 [0,2,0,0,0,0|1,0,0]=3 9617 B13R0.335 COCCCCCOC(C)CC(C)C 4f294e843302989fc045c2c448798677 [0,2,0,0,0,0|2,0,0]=4 9618 B13R0.335 COCCCCCO[C@@H](C)CC(C)C 604ad6c514f1ead0d948ad1eb41e5756 [0,2,0,0,0,0|2,0,0]=4 9619 B13R0.335 COCCCCCO[C@H](C)CC(C)C 784642629eeb71c8c43928bceaecf3ee [0,2,0,0,0,0|2,0,0]=4 9620 B13R0.335 COCCCCNCC(O)CC(C)C 982f63301b6e78273e263afd1c4f54a6 [0,2,0,0,0,0|2,0,0]=4 9621 B13R0.335 COCCCCOCC(C)CC(C)C 032ceb99c7014b6563d34df581738772 [0,2,0,0,0,0|2,0,0]=4 9622 B13R0.335 COCCCOCCC(C)CC(C)C dedd131192262dd531fbf6ef0343d59c [0,2,0,0,0,0|2,0,0]=4 9623 B13R0.335 COCCOCCCC(C)CC(C)C e63d91ca054e6a47ce901469f8be6d96 [0,2,0,0,0,0|2,0,0]=4 9624 B13R0.335 COCCOCCCN(C)CC(C)O d79b533df15164880f453ceec4a9470b [0,2,0,0,0,0|2,0,0]=4 9625 B13R0.335 COCCOCCCN(C)C[C@H](C)O 87e77382680c353da12824f15f8adad6 [0,2,0,0,0,0|2,0,0]=4 9626 B13R0.335 COCCOCCNC(C)CC(C)O c599d14ca79adb973944068360eb64c4 [0,2,0,0,0,0|2,0,0]=4 9627 B13R0.335 CSCCCOCCC(C)CC(C)C 09eb32c517828a032074dd262d1f0ac4 [0,2,0,0,0,0|2,0,0]=4 9628 B13R0.335 CSCCOCCCC(C)CC(C)C 0a58cab0589b0b9b7ed3f7cf926c7f1b [0,2,0,0,0,0|2,0,0]=4 9629 B13R0.335 C[C@@H](O)CC(=O)NCCCCCCCl a10d5276a402b8e410f2fbc5dc774a8c [0,2,0,0,0,0|1,0,1]=4 9630 B13R0.335 C[C@@H](O)CC(=O)NCCCCCCO 27aebd0573dafd98aec2c1543412f409 [0,2,0,0,0,0|1,0,1]=4 9631 B13R0.335 C[C@H](O)CC(=O)NCCCCCCCl e8ce8aeaff9be499285d2f2a78e912f2 [0,2,0,0,0,0|1,0,1]=4 9632 B13R0.335 C[C@H](O)CC(=O)NCCCCCCO c7715246c5e7e9cfc6081241b322f2e2 [0,2,0,0,0,0|1,0,1]=4 9633 B13R0.335 C[C@H](O)CN(C)CCCCCCC#N fec4a6a35176dfb7611f5514faf7e8fc [0,2,0,0,0,0|1,0,1]=4 9634 B13R0.335 C[C@H](O)CN(C)CCCCCCC=O 6bed4e71bd865c9765102d16380588b6 [0,2,0,0,0,0|1,0,1]=4 9635 B13R0.335 C[C@H](O)CN(C)CCCCCCCO 1e1f5faa72af85561bf79d9acc2c188b [0,2,0,0,0,0|1,0,0]=3 9636 B13R0.335 C[C@H](O)CN(C)CCCOCCCO ccff31ca2afeb2327e44dac9f997ed06 [0,2,0,0,0,0|2,0,0]=4 9637 B13R0.337 CCCCCCCN(C)C(=O)C(C)O ab761315d6321421ddbdb1cd4f91f290 [0,2,0,0,0,0|1,0,1]=4 9638 B13R0.337 CCCCCCCN(C)C(=O)[C@@H](C)O e025c6e18783325a016eba5b844f7be5 [0,2,0,0,0,0|1,0,1]=4 9639 B13R0.337 CCCCCCCN(C)C(=O)[C@H](C)O 10eb4a4a3a138604e9292d9ed0eeb1ac [0,2,0,0,0,0|1,0,1]=4 9640 B13R0.337 CCCCCCCN(C)C(C)C(C)C e32d6f6ad0974d7f3d125e646f61df8b [0,2,0,0,0,0|2,0,0]=4 9641 B13R0.337 CCCCCCNC(=O)[C@@H](O)[C@@H](C)O 87ed726c945d491b205df3aa61b1a299 [0,2,0,0,0,0|1,0,1]=4 9642 B13R0.438 CC(O)CC(C)N(C)CCCCCF 97c80e5faa54fa07c293719b8f992a07 [0,2,0,0,0,0|2,0,0]=4 9643 B13R0.438 CC(O)CC(C)N(C)CCCCCO 5504a9ecba3a9aea6540534af73e614f [0,2,0,0,0,0|2,0,0]=4 9644 B13R0.438 CCCCCCC(=O)N(C)CC(C)O 43a571789d28d561bdf1ec1cff1a4d0b [0,2,0,0,0,0|1,0,1]=4 9645 B13R0.438 CCCCCCC(=O)N(C)C[C@H](C)O d16a8e9fa3b0665dc1c72c02610b3b4a [0,2,0,0,0,0|1,0,1]=4 9646 B13R0.438 CCCCCCC(C)N(C)CC(C)C e31e575fe40e1f55bbeaa4d076d5050e [0,2,0,0,0,0|2,0,0]=4 9647 B13R0.438 CCCCCCC(C)N(C)CC(C)O bda55b1d02fdc2f88b4358d73a5a979e [0,2,0,0,0,0|1,0,0]=3 9648 B13R0.438 CCCCCCC(C)N(C)C[C@H](C)O 20c6f43625049acd38a53c68a652de3b [0,2,0,0,0,0|1,0,0]=3 9649 B13R0.438 CCCCCCN(C)C(=O)CC(C)O 6b1586b1083cffc12eb5ca09b141eaa6 [0,2,0,0,0,0|1,0,1]=4 9650 B13R0.438 CCCCCCN(C)C(=O)C[C@@H](C)O 6175f6a7d7d837c44f7deb903855d917 [0,2,0,0,0,0|1,0,1]=4 9651 B13R0.438 CCCCCCN(C)C(=O)C[C@H](C)O 608a16fa979616c393380e56fbb3c756 [0,2,0,0,0,0|1,0,1]=4 9652 B13R0.438 CCCCCCN(C)C(C)CC(C)C 0f6ac2b147314b5b5912719a98da36b9 [0,2,0,0,0,0|2,0,0]=4 9653 B13R0.438 CCCCCCN(C)C(C)CC(C)O 55a45feea3f8aacf295536343500f1f9 [0,2,0,0,0,0|1,0,0]=3 9654 B13R0.438 CCCCCNC(C)C(O)CC(C)C a3218e9dfc03edaf5727b59fe5bfdaa0 [0,2,0,0,0,0|2,0,0]=4 9655 B13R0.438 CCCCOCN(C)C(C)CC(C)O a303b356be400adf0647ea4226294d2f [0,2,0,0,0,0|2,0,0]=4 9656 B13R0.438 CCCOCCN(C)C(C)CC(C)O d439fff4f685da206b756bf7939ef844 [0,2,0,0,0,0|2,0,0]=4 9657 B13R0.438 CCOCCCN(C)C(C)CC(C)O 9d5c3ca90e61d9dabb5cbc234ed8cfb4 [0,2,0,0,0,0|2,0,0]=4 9658 B13R0.438 CCSCCCN(C)C(C)CC(C)O af1652b6e1806c768c80d9d5ce03557c [0,2,0,0,0,0|2,0,0]=4 9659 B13R0.438 COCCCCN(C)C(C)CC(C)O e387e5e65feb5bb139518f15c31024ff [0,2,0,0,0,0|2,0,0]=4 9660 B13R0.71 CC(CO)CN(C)CCCC[C@@H](C)O 61e7457234c94fd54ea050a24a61f378 [0,2,0,0,0,0|2,0,0]=4 9661 B13R0.71 CC(O)CCCCN(C)CC(C)CO 72842a47fc8c7c3c19ed390464805ef0 [0,2,0,0,0,0|2,0,0]=4 9662 B13R0.71 CC(O)CCCCN(C)CC(O)CO 9a4e724ef21928cb897921ef3c20a998 [0,2,0,0,0,0|2,0,0]=4 9663 B13R0.71 CCC(C)CC(C)NCCCC(C)C 4b113c9e364448d2e56e57c6ef25e5f0 [0,2,0,0,0,0|2,0,0]=4 9664 B13R0.71 CCC(C)CC(C)NCCCC(C)O 7aa8e2afad1fb30752a7d3512bbf690e [0,2,0,0,0,0|1,0,0]=3 9665 B13R0.71 CCC(O)CN(C)CCCCC(C)C 1995b036f1ab3e2b37ea718a9ad36fec [0,2,0,0,0,0|2,0,0]=4 9666 B13R0.71 CCC(O)CN(C)CCCCC(C)O 145db62551674a13b6cb8661bfe7c594 [0,2,0,0,0,0|1,0,0]=3 9667 B13R0.71 CCC(O)CN(C)CCCC[C@@H](C)O 6a16efd75a63a907e263b25800e4cff1 [0,2,0,0,0,0|1,0,0]=3 9668 B13R0.71 CCN(C)CC(C)CNCCC(C)O d8a86ae86ecc9d3c8ddc435bc41fbb3f [0,2,0,0,0,0|2,0,0]=4 9669 B13R0.71 C[C@@H](O)CCCCN(C)CC(O)CO 206c4d43b04ff194edd2ec15dec6c837 [0,2,0,0,0,0|2,0,0]=4 9670 B13R0.113 CC(CO)CCCNC(C)CCCO 8d7a0423382a95b8e733f3858291392a [0,2,0,0,0,0|2,0,0]=4 9671 B13R0.113 CC(CO)CCNC[C@H](C)CCCO c962493dc870a0903573a4df82bca167 [0,2,0,0,0,0|2,0,0]=4 9672 B13R0.113 CCCCC(=O)NCCCC(C)CO de12ed87ba690523ed1f7068d4f5d8d0 [0,2,0,0,0,0|1,0,1]=4 9673 B13R0.113 CCCCC(C)CCOCC(C)C#N 984a8f1867c35d1f7736ace69292f7d8 [0,2,0,0,0,0|2,0,0]=4 9674 B13R0.113 CCCCC(C)CCOCC(C)CC a13c3af333d2fdd5a62c76d4f138abd0 [0,2,0,0,0,0|2,0,0]=4 9675 B13R0.113 CCCCC(C)CCOCC(C)OC bf892f20ec61544ea376a23fa5ace736 [0,2,0,0,0,0|1,0,0]=3 9676 B13R0.113 CCCCC(C)CCOCC(O)CO 8824591560c52bd0e4cdc9171061a8fe [0,2,0,0,0,0|1,0,0]=3 9677 B13R0.113 CCCCC(C)CCOC[C@@H](C)CC c82048217d4422a28d7e188a2dfd4fa7 [0,2,0,0,0,0|2,0,0]=4 9678 B13R0.113 CCCCC(C)CCOC[C@@H](C)OC 2d88406bc220127445de0d7591d198ef [0,2,0,0,0,0|1,0,0]=3 9679 B13R0.113 CCCCC(C)CCOC[C@@H](O)CO f87a5210009403f18056e23720885be0 [0,2,0,0,0,0|1,0,0]=3 9680 B13R0.113 CCCCC(C)CCOC[C@H](C)CC 240479a10e05b4e07a03bcdfb140ab75 [0,2,0,0,0,0|2,0,0]=4 9681 B13R0.113 CCCCC(C)CCOC[C@H](C)OC 87fd7787cdd743c50481ef33e905912c [0,2,0,0,0,0|1,0,0]=3 9682 B13R0.113 CCCCC(C)CCOC[C@H](O)CO d2318f2d50f0452b55dbb677f0d1eec5 [0,2,0,0,0,0|1,0,0]=3 9683 B13R0.113 CCCCC(C)COCCC(C)CC d8c85c86a0e218c0767e55dd1acd8eda [0,2,0,0,0,0|2,0,0]=4 9684 B13R0.113 CCCCC(C)NCCCC(C)CO 8edcc45ea8bd9012617594dfd03074e8 [0,2,0,0,0,0|1,0,0]=3 9685 B13R0.113 CCCCC(C)OCCCC(C)CC bc1603955037d4ec9233e0d8fb281f0f [0,2,0,0,0,0|2,0,0]=4 9686 B13R0.113 CCCCC(C)OCCC[C@@H](C)CC 2bf3c14348ae0eb8568041daf2cef368 [0,2,0,0,0,0|2,0,0]=4 9687 B13R0.113 CCCCC(O)CNCCC(C)CC 347438de2980b0cca62ebc38e9012a69 [0,2,0,0,0,0|2,0,0]=4 9688 B13R0.113 CCCCC(O)CNCCC(C)CO 1f784d06e1e14a17652fa7d60ae394c9 [0,2,0,0,0,0|1,0,0]=3 9689 B13R0.113 CCCCN(C)CCCNC(C)CO d041eea1cf1533dbfd0bb3290333511f [0,2,0,0,0,0|2,0,0]=4 9690 B13R0.113 CCCCN(C)CCCN[C@@H](C)CO c5f1bf940e8d19919a8073fdb8bfe7e2 [0,2,0,0,0,0|2,0,0]=4 9691 B13R0.113 CCCCN(C)CCCN[C@H](C)CO d29e0395613a5375fd237d50fdad24e5 [0,2,0,0,0,0|2,0,0]=4 9692 B13R0.113 CCCCN(C)CCNCC(C)CO d4b9298f6cf00ca43b6b68979f9dbe58 [0,2,0,0,0,0|2,0,0]=4 9693 B13R0.113 CCCCN(C)CCNCC(C)OC 6e19253d767c9d3c0e6af8aa715c148e [0,2,0,0,0,0|2,0,0]=4 9694 B13R0.113 CCCCN(C)CCNCC(O)CC fa7e34dde5b023e1e43f712bb58fb0ef [0,2,0,0,0,0|2,0,0]=4 9695 B13R0.113 CCCCN(C)CCNCC(O)CF ce97c2a905838fd62ef2abde9db59a84 [0,2,0,0,0,0|2,0,0]=4 9696 B13R0.113 CCCCN(C)CCNCC(O)CO 7d5494db11f167b6d078bfee62e1c861 [0,2,0,0,0,0|2,0,0]=4 9697 B13R0.113 CCCCN(C)CCNC[C@@H](C)CO f9893f30ad5e3920a6e62197b4d1272f [0,2,0,0,0,0|2,0,0]=4 9698 B13R0.113 CCCCN(C)CCNC[C@@H](C)OC 037a2f53c6a5fdcbc133050512feaae1 [0,2,0,0,0,0|2,0,0]=4 9699 B13R0.113 CCCCN(C)CCNC[C@@H](O)CO 6db79aece9ae834a3a2c57f1e8f4737a [0,2,0,0,0,0|2,0,0]=4 9700 B13R0.113 CCCCN(C)CCNC[C@H](C)CO 6096cb48418655541a6d02cd27785668 [0,2,0,0,0,0|2,0,0]=4 9701 B13R0.113 CCCCN(C)CCNC[C@H](C)OC b7b4a65f2654aea9c7135b7ff6878eae [0,2,0,0,0,0|2,0,0]=4 9702 B13R0.113 CCCCN(C)CCNC[C@H](O)CO 71075d1a3502c7ad382f2fdf25699196 [0,2,0,0,0,0|2,0,0]=4 9703 B13R0.113 CCOCC(O)CNCCC(C)CO 8d365ba7b0b439d20c6af1bfe3cb85b6 [0,2,0,0,0,0|2,0,0]=4 9704 B13R0.117 CCCCC(C)CCOC(C)C(C)C a877a335bed28f364e7c8c5f813e17d2 [0,2,0,0,0,0|2,0,0]=4 9705 B13R0.117 CCCCC(C)COCC(C)C(C)C 8517dd1df0ccaa912a67a0622cf30a5f [0,2,0,0,0,0|2,0,0]=4 9706 B13R0.117 CCCCC(C)OCCC(C)C(C)C 8869359f94f6f70363f2366db17294e4 [0,2,0,0,0,0|2,0,0]=4 9707 B13R0.117 CCCCC(O)CNCC(C)C(C)C 881911ff717717144943d785244d102e [0,2,0,0,0,0|2,0,0]=4 9708 B13R0.124 CC(CCCO)NCCCC(C)(C)O 5ad8fd78f83e1707db9d38cbf457feb6 [0,2,0,0,0,0|2,0,0]=4 9709 B13R0.124 CCCCC(=O)NCCCC(C)(C)O f96e84a39163c06ee381c6b0bfb4a7ed [0,2,0,0,0,0|1,0,1]=4 9710 B13R0.124 CCCCC(C)CCOCC(C)(C)C a1b4290e801da6130494c3dcb37fd698 [0,2,0,0,0,0|2,0,0]=4 9711 B13R0.124 CCCCC(C)CCOCC(C)(C)F 26c2b2499b17d1e40cf9c45b01195857 [0,2,0,0,0,0|2,0,0]=4 9712 B13R0.124 CCCCC(C)CCOCC(C)(C)O 2d6772f2f0b673aaf3f1e720aa3e4d83 [0,2,0,0,0,0|1,0,0]=3 9713 B13R0.124 CCCCC(C)CCOCC(C)(F)F 8a299a76dac639c536a76ecab9ff19fb [0,2,0,0,0,0|2,0,0]=4 9714 B13R0.124 CCCCC(C)COCCC(C)(C)C f9af6f2f96bfea6918a6ee2bd5831c9e [0,2,0,0,0,0|2,0,0]=4 9715 B13R0.124 CCCCC(C)COCCC(C)(C)O 1fa9b5afcdb48cc012bfeda44b484be1 [0,2,0,0,0,0|1,0,0]=3 9716 B13R0.124 CCCCC(C)COCCC(C)(F)F 7463b1b09df1dab74a06610f846a98b2 [0,2,0,0,0,0|2,0,0]=4 9717 B13R0.124 CCCCC(C)NCCCC(C)(C)C 666689bff1824240aecd99146a59907f [0,2,0,0,0,0|2,0,0]=4 9718 B13R0.124 CCCCC(C)NCCCC(C)(C)O 3826c5bed5ae72cd947a245ee3207e98 [0,2,0,0,0,0|1,0,0]=3 9719 B13R0.124 CCCCC(C)NCCCC(C)(F)F f128816584a77d48d992a43b9d839e83 [0,2,0,0,0,0|2,0,0]=4 9720 B13R0.124 CCCCC(C)OCCCC(C)(C)C d1c65a3fe000b11c454f8572dff000d9 [0,2,0,0,0,0|2,0,0]=4 9721 B13R0.124 CCCCC(C)OCCCC(C)(C)O db2d6ba3b52221ba4ac414b18e9159de [0,2,0,0,0,0|1,0,0]=3 9722 B13R0.124 CCCCC(C)OCCCC(C)(F)F cad2b58985168c479735e9a7cb659bb7 [0,2,0,0,0,0|2,0,0]=4 9723 B13R0.124 CCCCC(O)CNCCC(C)(C)C 1cccace939bc67d11f977dd4d69b6faf [0,2,0,0,0,0|2,0,0]=4 9724 B13R0.124 CCCCC(O)CNCCC(C)(C)O 3baf28612c43e844160df3b366c31f28 [0,2,0,0,0,0|1,0,0]=3 9725 B13R0.124 CCCCC(O)CNCCC(C)(F)F e64cebf1928ca64bf323d034fb7facda [0,2,0,0,0,0|2,0,0]=4 9726 B13R0.124 CCCCN(C)CCNCC(C)(C)O 814854623d48d876404a27dfe0d97f69 [0,2,0,0,0,0|2,0,0]=4 9727 B13R0.124 CCCC[C@@H](C)NCCCC(C)(C)O 6922ec5045dd28eef9ed1add7121e553 [0,2,0,0,0,0|1,0,0]=3 9728 B13R0.124 CCCC[C@@H](C)NCCCC(C)(F)F 50173c775f02b1e3c00a7d4611814451 [0,2,0,0,0,0|2,0,0]=4 9729 B13R0.124 CCCC[C@@H](C)OCCCC(C)(C)O b6439f7c509ea794bb3e0d63598dcc50 [0,2,0,0,0,0|1,0,0]=3 9730 B13R0.124 CCCC[C@@H](C)OCCCC(C)(F)F a25d024aa5067423b291c1537425b9f3 [0,2,0,0,0,0|2,0,0]=4 9731 B13R0.124 CCCC[C@H](C)OCCCC(C)(C)O 412bebec839c61daadcf54596a5740d9 [0,2,0,0,0,0|1,0,0]=3 9732 B13R0.124 CCCC[C@H](C)OCCCC(C)(F)F f9dadbe3b85581efcb392f7d228d6d2b [0,2,0,0,0,0|2,0,0]=4 9733 B13R0.124 CCOCC(C)COCCC(C)(C)O 973f13b166b051a8125fe387e3536910 [0,2,0,0,0,0|2,0,0]=4 9734 B13R0.124 CCOCC(C)OCCCC(C)(C)O 4f0dde90bfb156c779a2071b8e7c005d [0,2,0,0,0,0|2,0,0]=4 9735 B13R0.124 CCOCC(O)CNCCC(C)(C)O 7bfcf51b9b7a4fd92697458da2f1861e [0,2,0,0,0,0|2,0,0]=4 9736 B13R0.124 COCCC(C)OCCCC(C)(C)O cd991cecb9e47a3f2036d8d320d8b7fc [0,2,0,0,0,0|2,0,0]=4 9737 B13R0.124 CSCCC(C)OCCCC(C)(C)O a9ab81c36c0b28b4e929ffec95917040 [0,2,0,0,0,0|2,0,0]=4 9738 B13R0.124 C[C@H](CCCO)CNCCC(C)(C)O 79fe04a0a118f405fe863b0530ea0c33 [0,2,0,0,0,0|2,0,0]=4 9739 B13R0.124 C[C@H](CCCO)NCCCC(C)(C)O 3ffb8a2437819da7bdfca0c652e00eb4 [0,2,0,0,0,0|2,0,0]=4 9740 B13R0.172 CCCCC(C)CC(=O)NCC(C)O fd8a1a6ec6e0e275cc78f07bc2cf78eb [0,2,0,0,0,0|1,0,1]=4 9741 B13R0.172 CCCCC(C)CC(=O)NC[C@@H](C)O 4e6bcc68737e4f58901fea2163831739 [0,2,0,0,0,0|1,0,1]=4 9742 B13R0.172 CCCCC(C)CC(=O)NC[C@H](C)O dd941e6b3f7cab3b6e5708f777d86582 [0,2,0,0,0,0|1,0,1]=4 9743 B13R0.172 CCCCC(C)NC(=O)CCC(C)O c612ddb372d6732b40e183cfb670fff8 [0,2,0,0,0,0|1,0,1]=4 9744 B13R0.172 CCCCC(C)NC(C)CCC(C)C 7b8b519a5506bf4fb54d09bafd1e6656 [0,2,0,0,0,0|2,0,0]=4 9745 B13R0.172 CCCCC(C)OC(C)CCC(C)C 93e78db9685a31d77fb74ed8a90245e9 [0,2,0,0,0,0|2,0,0]=4 9746 B13R0.172 CCCCC(O)CC(=O)NCC(C)O cb1d62eb4bb153713875e07d0bb7577e [0,2,0,0,0,0|1,0,1]=4 9747 B13R0.172 CCCCC(O)CC(=O)NC[C@@H](C)O 16a7696145ccf2e3ba41a05c32e6a5f1 [0,2,0,0,0,0|1,0,1]=4 9748 B13R0.172 CCCCC(O)CC(=O)NC[C@H](C)O e5740e9e767f480af8cf63f2ef9d9012 [0,2,0,0,0,0|1,0,1]=4 9749 B13R0.172 CCCCN(C)CC(C)CCC(C)C af3b66520d10d9e694bb00826e883ce4 [0,2,0,0,0,0|2,0,0]=4 9750 B13R0.172 CCCC[C@@H](C)CC(=O)NCC(C)O df1d06f50e4b0d8132222a54f48d855f [0,2,0,0,0,0|1,0,1]=4 9751 B13R0.172 CCCC[C@@H](C)CC(=O)NC[C@@H](C)O 1727c883e7d97bd562279f28934d09fa [0,2,0,0,0,0|1,0,1]=4 9752 B13R0.172 CCCC[C@@H](C)CC(=O)NC[C@H](C)O 671453ff5ce843a23c27a8a0eaeb9ff7 [0,2,0,0,0,0|1,0,1]=4 9753 B13R0.172 CCCC[C@@H](C)NC(=O)CCC(C)O 44e07eb9a668e8e88514a1baef4a0944 [0,2,0,0,0,0|1,0,1]=4 9754 B13R0.172 CCCC[C@@H](C)NC(C)CCC(C)C d2f82868fa010ea3137f604358d2ef66 [0,2,0,0,0,0|2,0,0]=4 9755 B13R0.172 CCCC[C@@H](C)OC(C)CCC(C)C e80bc505bb2b1586a68a98ccaf276550 [0,2,0,0,0,0|2,0,0]=4 9756 B13R0.172 CCCC[C@H](C)CC(=O)NCC(C)O f983127f98b5f7f4202cd166343c8c9c [0,2,0,0,0,0|1,0,1]=4 9757 B13R0.172 CCCC[C@H](C)CC(=O)NC[C@@H](C)O f1c9d44659ea2adf099859a0d4410057 [0,2,0,0,0,0|1,0,1]=4 9758 B13R0.172 CCCC[C@H](C)CC(=O)NC[C@H](C)O b4be4dcea11a6d6bd3e62cbd02380a65 [0,2,0,0,0,0|1,0,1]=4 9759 B13R0.172 CCCC[C@H](C)OC(C)CCC(C)C 6e16501d26f168de44b26481b31afcd4 [0,2,0,0,0,0|2,0,0]=4 9760 B13R0.172 CCSCC(O)CN(C)CCC(C)O f8895cdf73fdf7b97443f3b17986ceb2 [0,2,0,0,0,0|2,0,0]=4 9761 B13R0.172 CSCCC(O)CN(C)CCC(C)O 39d2160bec90d8eed9baeca08fd35f19 [0,2,0,0,0,0|2,0,0]=4 9762 B13R0.182 CC(=O)CCCCN(C)CCC(C)O 6899bd17484a69da7ffd69f84f5fd05a [0,2,0,0,0,0|1,0,1]=4 9763 B13R0.182 CC(C)CCC(C)CNCCC(C)O 9c45370fbf444d1c436e460b5cb3914a [0,2,0,0,0,0|1,0,0]=3 9764 B13R0.182 CC(C)CCC(C)CNCC[C@@H](C)O bebbd923c3c22eacfda88628071a38a5 [0,2,0,0,0,0|1,0,0]=3 9765 B13R0.182 CC(C)CCC(C)CNCC[C@H](C)O 5372ce90cf45e9ec2458db68ff487912 [0,2,0,0,0,0|1,0,0]=3 9766 B13R0.182 CC(C)CCC(C)NCCCC(C)O 10ca27ca1de257de640fe1b106fc0033 [0,2,0,0,0,0|1,0,0]=3 9767 B13R0.182 CC(C)CCCCC(=O)NCC(C)O 024bba247514070b8aba9769eba9c353 [0,2,0,0,0,0|1,0,1]=4 9768 B13R0.182 CC(C)CCCCC(=O)NC[C@@H](C)O d44b0dbf686aa16ce4efd65b880563e4 [0,2,0,0,0,0|1,0,1]=4 9769 B13R0.182 CC(C)CCCCC(=O)NC[C@H](C)O b99f737e68dfc6972515fc44dc7fb58a [0,2,0,0,0,0|1,0,1]=4 9770 B13R0.182 CC(C)CCCCN(C)CCC(C)C fbeef7208b82b6f68175e2b04946464a [0,2,0,0,0,0|2,0,0]=4 9771 B13R0.182 CC(C)CCCCN(C)CCC(C)O 4822b9443af9e108d340ed9131bdfeef [0,2,0,0,0,0|1,0,0]=3 9772 B13R0.182 CC(C)CCCNC(=O)CCC(C)O b7785b87c2c56402a0ff88c11623a165 [0,2,0,0,0,0|1,0,1]=4 9773 B13R0.182 CC(C)CCCNC(C)CCC(C)C 15bf5f3cedafc108e4fba7913a6d60c1 [0,2,0,0,0,0|2,0,0]=4 9774 B13R0.182 CC(C)CCCOC(C)CCC(C)C 633948334acb95d21c64b659f0027f29 [0,2,0,0,0,0|2,0,0]=4 9775 B13R0.182 CC(C)CCN(C)CCCCC(C)O 3df1f7771c8759a1f1fb4c5cd500d61e [0,2,0,0,0,0|1,0,0]=3 9776 B13R0.182 CC(C)CCN(C)CCCC[C@@H](C)O 202a169e3336f1e18ed0a859127ec2e9 [0,2,0,0,0,0|1,0,0]=3 9777 B13R0.182 CC(C)CCNCC(C)CCC(C)C c42a8d047207b1837f7fdd387c8044e3 [0,2,0,0,0,0|2,0,0]=4 9778 B13R0.182 CC(C)CCOCC(C)CCC(C)C bf3a068fcdb14a41e9c48be3f9fe8372 [0,2,0,0,0,0|2,0,0]=4 9779 B13R0.182 CC(C)COCCN(C)CCC(C)O b382d149c4453dc9f645a3d78df88b97 [0,2,0,0,0,0|2,0,0]=4 9780 B13R0.182 CC(O)CCCCN(C)CCC(C)O 40d3cb5b994897db9f0e3930d9f47b18 [0,2,0,0,0,0|1,0,0]=3 9781 B13R0.182 CC(O)CCCCN(C)CCC(F)F a89136a7e621f89449643794633fad33 [0,2,0,0,0,0|2,0,0]=4 9782 B13R0.182 CC(O)CCCCN(C)CCN(C)C cc4652edeb8407f6997c6d32bfa920fc [0,2,0,0,0,0|2,0,0]=4 9783 B13R0.182 CC(O)CCCNC(C)CCN(C)C 041c399f585281d0a7fc615b2788947f [0,2,0,0,0,0|2,0,0]=4 9784 B13R0.182 CC(O)CCCN[C@@H](C)CCN(C)C 18f0fbec0cbae9b54e6c4cb3c07f468e [0,2,0,0,0,0|2,0,0]=4 9785 B13R0.182 CC(O)CCCN[C@H](C)CCN(C)C fbd8938070b2bb99d0b178a837fcca8e [0,2,0,0,0,0|2,0,0]=4 9786 B13R0.182 CC(O)CCN(C)CCCCN(C)C 1bcd3b709828f0d8e44f8cd20b172905 [0,2,0,0,0,0|2,0,0]=4 9787 B13R0.182 CC(O)CCN(C)CCCC[C@@H](C)O 8ff81500a517c8f9dcd708116b8bccb5 [0,2,0,0,0,0|1,0,0]=3 9788 B13R0.182 CC(O)CCNCC(O)COC(C)C 9d7ab9a214141e583e85577ef025fd7c [0,2,0,0,0,0|2,0,0]=4 9789 B13R0.182 C[C@@H](O)CCCCN(C)CCC(F)F 66781534329e9fb2daf11d30a3a1ea71 [0,2,0,0,0,0|2,0,0]=4 9790 B13R0.182 C[C@@H](O)CCCCN(C)CCN(C)C 16ecf50021fdc4fa53ef591ee95c6fae [0,2,0,0,0,0|2,0,0]=4 9791 B13R0.188 C=C(C)CCCNC(C)CCCCC c82ec5a961f0d2325d21edaa179628d4 [0,2,0,0,0,0|1,0,1]=4 9792 B13R0.188 C=C(C)CCCN[C@@H](C)CCCCC 32c73a7095569b1a39b5fd437a60764e [0,2,0,0,0,0|1,0,1]=4 9793 B13R0.188 C=C(C)CCCOC(C)CCCCC ae19ba2ecaae0c63a0343b3d60084033 [0,2,0,0,0,0|1,0,1]=4 9794 B13R0.188 C=C(C)CCCO[C@@H](C)CCCCC 05258e618e0401e8639c5b666184f488 [0,2,0,0,0,0|1,0,1]=4 9795 B13R0.188 C=C(C)CCCO[C@H](C)CCCCC 162ec7dadd75466b6ca72c30a39ad481 [0,2,0,0,0,0|1,0,1]=4 9796 B13R0.188 C=C(C)CCOCC(C)CCCCC 67c1343bf48db171ed27b334498aa799 [0,2,0,0,0,0|1,0,1]=4 9797 B13R0.188 C=CCCCN(C)CCCCC(C)O 8999de3e45029dbcbaa8d9a8bfc9e124 [0,2,0,0,0,0|0,0,2]=4 9798 B13R0.188 C=CCCCN(C)CCCC[C@@H](C)O 112e9c3cea14dad971eac68c7ac3ddc1 [0,2,0,0,0,0|0,0,2]=4 9799 B13R0.188 CC(C)CCCCN(C)CCCCO f5fb07b09ca9198e94b3363b836bcb2f [0,2,0,0,0,0|2,0,0]=4 9800 B13R0.188 CC(C)CCCNC(C)CCCCO 496f0b0991fc4dd454803ce691587102 [0,2,0,0,0,0|2,0,0]=4 9801 B13R0.188 CC(O)CCCCN(C)CCCCO 14967e747fada4a38ca31b4a84130b99 [0,2,0,0,0,0|1,0,0]=3 9802 B13R0.188 CCCCCC(=O)CNCCC(C)C 5aca070763f12c010ff178d481c8e4da [0,2,0,0,0,0|1,0,1]=4 9803 B13R0.188 CCCCCC(=O)CNCCC(C)O 319c7a0688561107dc384d529146a984 [0,2,0,0,0,0|0,0,1]=3 9804 B13R0.188 CCCCCC(=O)CNCC[C@@H](C)O 27428a87e6bcceb8ef1080408c0df151 [0,2,0,0,0,0|0,0,1]=3 9805 B13R0.188 CCCCCC(=O)CNCC[C@H](C)O d3d5575f9847c7dbf201ad57443c2e69 [0,2,0,0,0,0|0,0,1]=3 9806 B13R0.188 CCCCCC(=O)COCCC(C)C 771bc6c7265aebc6704f5f11a68fbf06 [0,2,0,0,0,0|1,0,1]=4 9807 B13R0.188 CCCCCC(=O)NCCCC(C)C da6853998e253b25213494087745a239 [0,2,0,0,0,0|1,0,1]=4 9808 B13R0.188 CCCCCC(=O)OCNCC(C)O cdd26008a78e887dcfcd305d1f69c1a9 [0,2,0,0,0,0|1,0,1]=4 9809 B13R0.188 CCCCCC(=O)OCNC[C@@H](C)O 291ded296e1483146c44b82895a456cf [0,2,0,0,0,0|1,0,1]=4 9810 B13R0.188 CCCCCC(=O)OCNC[C@H](C)O ff07beb86019c957103ea2b091706ff5 [0,2,0,0,0,0|1,0,1]=4 9811 B13R0.188 CCCCCC(C)COCCC(=O)C c5006be8bd236b047129ff716c443988 [0,2,0,0,0,0|0,0,2]=4 9812 B13R0.188 CCCCCC(C)COCCC(=O)O f2dcde8cd3125b9901e3d41fcd39a123 [0,2,0,0,0,0|1,0,1]=4 9813 B13R0.188 CCCCCC(C)COCCC(C)C 2935f3e4e67a505810c027b59c01cdda [0,2,0,0,0,0|1,0,0]=3 9814 B13R0.188 CCCCCC(C)COCCN(C)C f4f24b9ab7c052bb4297abbe02b326e2 [0,2,0,0,0,0|2,0,0]=4 9815 B13R0.188 CCCCCC(C)COCCS(=O)C cda888b2ab69a4313399914a60d7f7db [0,2,0,0,0,0|1,0,1]=4 9816 B13R0.188 CCCCCC(C)COCOC(C)C aadd6e52ee0a380f72f49ac8c9670d70 [0,2,0,0,0,0|2,0,0]=4 9817 B13R0.188 CCCCCC(C)NCCCC(=O)C 4a264ab245e959da91842ea191bca009 [0,2,0,0,0,0|0,0,2]=4 9818 B13R0.188 CCCCCC(C)NCCCC(C)C 780a4be6074fc03c34df7f4036215400 [0,2,0,0,0,0|1,0,0]=3 9819 B13R0.188 CCCCCC(C)NCCCC(C)O 435d730e867452fe5dc8ca32f82ec98f [0,2,0,0,0,0|0,0,0]=2 9820 B13R0.188 CCCCCC(C)NCCCN(C)C d405d0a47463e604ec0440b1f56a1410 [0,2,0,0,0,0|2,0,0]=4 9821 B13R0.188 CCCCCC(C)NCCOC(C)C d1cbabcefe63977785da1861142e40e9 [0,2,0,0,0,0|2,0,0]=4 9822 B13R0.188 CCCCCC(C)NCCSC(C)C 85ed7dcfe09e1d4a9ec747be86b25948 [0,2,0,0,0,0|2,0,0]=4 9823 B13R0.188 CCCCCC(C)OCCCC(=O)C 81ec1aebbe304cfde3bce7cedbc12885 [0,2,0,0,0,0|0,0,2]=4 9824 B13R0.188 CCCCCC(C)OCCCC(C)C 578821dbbef98fd655a398fb7271b3fa [0,2,0,0,0,0|1,0,0]=3 9825 B13R0.188 CCCCCC(C)OCCCN(C)C 857bf359f9f48dd21ecc2585847f9af4 [0,2,0,0,0,0|2,0,0]=4 9826 B13R0.188 CCCCCC(C)OCCOC(C)C 938c12098fd46cbd9cbb97e1a5cb9108 [0,2,0,0,0,0|2,0,0]=4 9827 B13R0.188 CCCCCC(C)OCCSC(C)C a523923c7b580e40284c5aab2df201a0 [0,2,0,0,0,0|2,0,0]=4 9828 B13R0.188 CCCCCN(C)CCCCC(=O)C aa879f4ee91eba680cc5f938e7fac91b [0,2,0,0,0,0|0,0,2]=4 9829 B13R0.188 CCCCCN(C)CCCCC(=O)O 5a6fba36257fb22c191571da0a40ce25 [0,2,0,0,0,0|1,0,1]=4 9830 B13R0.188 CCCCCN(C)CCCCC(C)C ad39c2a47e76077fa28c11e7ae1352bf [0,2,0,0,0,0|1,0,0]=3 9831 B13R0.188 CCCCCN(C)CCCCC(C)O 1a7c7a6d5986970eeb8d36b9e8ee7eeb [0,2,0,0,0,0|0,0,0]=2 9832 B13R0.188 CCCCCN(C)CCCCN(C)C 9e612ef7ccb0f3f4afae67bab16d4d1c [0,2,0,0,0,0|2,0,0]=4 9833 B13R0.188 CCCCCN(C)CCCC[C@@H](C)O da758c54b01bb7173f0ad855a9e8d25e [0,2,0,0,0,0|0,0,0]=2 9834 B13R0.188 CCCCCN(C)CCOCC(C)C 7b0dc2cd5aeefc3d84042a4b926212ad [0,2,0,0,0,0|2,0,0]=4 9835 B13R0.188 CCCCC[C@@H](C)OCCCC(=O)C 9cb388bd451b42f8bcf7630d45874f48 [0,2,0,0,0,0|0,0,2]=4 9836 B13R0.188 CCCCC[C@@H](C)OCCCC(C)C f2c56d29ce913ed5712c6995c6708b7d [0,2,0,0,0,0|1,0,0]=3 9837 B13R0.188 CCCCC[C@@H](C)OCCCN(C)C 4a5f1ad4b508cdf267952f85f52f7c70 [0,2,0,0,0,0|2,0,0]=4 9838 B13R0.188 CCCCC[C@@H](C)OCCOC(C)C f1201f2603917fe8c37f245a0d403329 [0,2,0,0,0,0|2,0,0]=4 9839 B13R0.188 CCCCC[C@@H](C)OCCSC(C)C 0d56f9417afdc3231ddd953de3f2b4ac [0,2,0,0,0,0|2,0,0]=4 9840 B13R0.188 CCCCC[C@H](C)NCCCC(=O)C 4229a4e438cc2911bbe908f02b71616e [0,2,0,0,0,0|0,0,2]=4 9841 B13R0.188 CCCCC[C@H](C)NCCCC(C)C 30df577255e666807ee479588f318e0d [0,2,0,0,0,0|1,0,0]=3 9842 B13R0.188 CCCCC[C@H](C)NCCCC(C)O 86340c4cf6e1407a5f2320079af5d86b [0,2,0,0,0,0|0,0,0]=2 9843 B13R0.188 CCCCC[C@H](C)NCCCN(C)C 2d96cb26dfff299b9605c080f22dad4b [0,2,0,0,0,0|2,0,0]=4 9844 B13R0.188 CCCCC[C@H](C)NCCCS(=O)C 45d753f133b3be47c9c69851f365d781 [0,2,0,0,0,0|1,0,1]=4 9845 B13R0.188 CCCCC[C@H](C)NCCOC(C)C b1bef1714a8bf6ece404e187ec5fa127 [0,2,0,0,0,0|2,0,0]=4 9846 B13R0.188 CCCCC[C@H](C)NCCSC(C)C 3be1714729f32e8fd85f46a8036538dd [0,2,0,0,0,0|2,0,0]=4 9847 B13R0.188 CCCCC[C@H](C)OCCCC(=O)C cb63b0ee494983df2acf55692a72ca6b [0,2,0,0,0,0|0,0,2]=4 9848 B13R0.188 CCCCC[C@H](C)OCCCC(C)C fd5c2be69f41903d83d778ac98eea87b [0,2,0,0,0,0|1,0,0]=3 9849 B13R0.188 CCCCC[C@H](C)OCCCN(C)C 3824cd59b664a23759ac4cd58c9065dd [0,2,0,0,0,0|2,0,0]=4 9850 B13R0.188 CCCCC[C@H](C)OCCOC(C)C e436d06237b05d70112a2e813c0063c3 [0,2,0,0,0,0|2,0,0]=4 9851 B13R0.188 CCCCC[C@H](C)OCCSC(C)C 77c11ace5d348f0ba37e3490d8091104 [0,2,0,0,0,0|2,0,0]=4 9852 B13R0.188 CCCCNC(=O)CCCCC(C)C bca06eced566018f923d5c414da7cb2b [0,2,0,0,0,0|1,0,1]=4 9853 B13R0.188 CCCCNC(=O)CNCCC(C)O 3e6102112bcf5a5e1fb32ebffb72b8bd [0,2,0,0,0,0|1,0,1]=4 9854 B13R0.188 CCCCNC(=O)CNCC[C@@H](C)O f1f7e691bc56b13bccfce1ea4581c928 [0,2,0,0,0,0|1,0,1]=4 9855 B13R0.188 CCCCNC(=O)CNCC[C@H](C)O eb4a8436e44ff7df97a33818cb551809 [0,2,0,0,0,0|1,0,1]=4 9856 B13R0.188 CCCCOC(=O)CNCCC(C)O 39af9f2a42c5d96040c74b31196fc441 [0,2,0,0,0,0|1,0,1]=4 9857 B13R0.188 CCCCOC(=O)CNCC[C@@H](C)O 893ed0840ad54767a7bf9b99c099b965 [0,2,0,0,0,0|1,0,1]=4 9858 B13R0.188 CCCCOC(=O)CNCC[C@H](C)O e4ae329333e32e2ee6c205c261304bb8 [0,2,0,0,0,0|1,0,1]=4 9859 B13R0.188 CCCOCC(C)COCCC(C)C 3b1af5101aabc28b5ab92dc176b8dd48 [0,2,0,0,0,0|2,0,0]=4 9860 B13R0.188 CCCOCC(C)OCCCC(C)C eaba04ed04d8482a1b77be2e93391b1a [0,2,0,0,0,0|2,0,0]=4 9861 B13R0.188 CCOCCN(C)CCCCC(C)C 41682943d57ac3f21d11b213aaf4bdea [0,2,0,0,0,0|2,0,0]=4 9862 B13R0.188 CCOCCN(C)CCCCC(C)O ecaa19bb82973d706dbf1f31aa9fef46 [0,2,0,0,0,0|1,0,0]=3 9863 B13R0.188 CCOCCN(C)CCCC[C@@H](C)O e3c6127870a1706cbf060f3f7e629c4e [0,2,0,0,0,0|1,0,0]=3 9864 B13R0.188 COCCCN(C)CCCCC(C)C f973219b261ffd6e4c842a1b17068085 [0,2,0,0,0,0|2,0,0]=4 9865 B13R0.188 COCCCN(C)CCCCC(C)O 5d3911b89a9904ff75ebd1188bb58227 [0,2,0,0,0,0|1,0,0]=3 9866 B13R0.188 COCCCN(C)CCCC[C@@H](C)O 3199f032a0c0bd73c8b8f884b0b35a4d [0,2,0,0,0,0|1,0,0]=3 9867 B13R0.188 C[C@@H](O)CCCCN(C)CCCCO 7357bd142d7e23d917770158e54fc673 [0,2,0,0,0,0|1,0,0]=3 9868 B13R0.261 CC(CCO)N(C)CCCC[C@@H](C)O bbe88efac4fc70e09bd82a3893f87ba8 [0,2,0,0,0,0|2,0,0]=4 9869 B13R0.261 CC(O)CCCCN(C)C(C)CCO 191ed86c7580b41b33f8a19b8b9bad1d [0,2,0,0,0,0|2,0,0]=4 9870 B13R0.261 CC(O)CCCCN(C)[C@@H](C)CCO 6faba8306366a040a3d6f4597ab44572 [0,2,0,0,0,0|2,0,0]=4 9871 B13R0.261 C[C@@H](O)CCCCN(C)[C@@H](C)CCO 2c4b5fc3b188ffff17e4a5daf2fb8f85 [0,2,0,0,0,0|2,0,0]=4 9872 B13R0.300 C#CC(CCCC)OCCCC(C)C 912181647b69cfec6a11c5620f9e7e5d [0,2,0,0,0,0|2,0,0]=4 9873 B13R0.300 C=CC(CCCC)OCCCC(C)C bcfd60846e5dd00493d809fd242febe3 [0,2,0,0,0,0|2,0,0]=4 9874 B13R0.300 CC(O)CCCNC(CO)CCCO 91ee69bfeb93c96b9d89cbbe79708781 [0,2,0,0,0,0|2,0,0]=4 9875 B13R0.300 CCCCC(CC)CCCOC(C)C 6644f15cc66b859c432ef8ee3bf93be1 [0,2,0,0,0,0|2,0,0]=4 9876 B13R0.300 CCCCC(CC)CCOCC(C)C 94fd52ff7fa906a6e931cc549733ca34 [0,2,0,0,0,0|2,0,0]=4 9877 B13R0.300 CCCCC(CC)CNCCC(C)C a6e114b1a09ded84750365b818798df0 [0,2,0,0,0,0|2,0,0]=4 9878 B13R0.300 CCCCC(CC)CNCCC(C)O 5d7a5a36121bed525775ed5f6c7ab9be [0,2,0,0,0,0|1,0,0]=3 9879 B13R0.300 CCCCC(CC)CNCC[C@@H](C)O 1bea66d774d67545fb8f9c02c0ce128f [0,2,0,0,0,0|1,0,0]=3 9880 B13R0.300 CCCCC(CC)CNCC[C@H](C)O bc9b61c92b2c7d996f3b317d1ba44805 [0,2,0,0,0,0|1,0,0]=3 9881 B13R0.300 CCCCC(CC)COCCC(C)C c63330e9d283c5ca86abf1f7cd744081 [0,2,0,0,0,0|2,0,0]=4 9882 B13R0.300 CCCCC(CC)NCCCC(C)C 476145a89872ee85cd0705cbefb21a20 [0,2,0,0,0,0|2,0,0]=4 9883 B13R0.300 CCCCC(CC)OCCCC(C)C 594085722df6e3eca95c8a1e0f1271d7 [0,2,0,0,0,0|2,0,0]=4 9884 B13R0.300 CCCCC(CO)NCCCC(C)C ec2b64380e04780ce9fc0c72b4ff83c2 [0,2,0,0,0,0|2,0,0]=4 9885 B13R0.300 CCCCC(CO)NCCCC(C)O 1fb97dc6204ba09571f274f9999e8766 [0,2,0,0,0,0|1,0,0]=3 9886 B13R0.300 CCCCN(CC)CCCCC(C)C 534ca98148aa99b42888290ed8400c48 [0,2,0,0,0,0|2,0,0]=4 9887 B13R0.300 CCCCN(CC)CCCCC(C)O b7dac4849f05f07d952c14dc50fc922f [0,2,0,0,0,0|1,0,0]=3 9888 B13R0.300 CCCCN(CC)CCCC[C@@H](C)O b1c243ce799bf240cdb9d52ef28bbdff [0,2,0,0,0,0|1,0,0]=3 9889 B13R0.300 CCCCN(CC)CCNCC(C)O 8595f8688269621476e47179e17e99b2 [0,2,0,0,0,0|2,0,0]=4 9890 B13R0.300 CCCCN(CC)CCNC[C@@H](C)O 34c6f1f5938d8465a754bf8737b85f29 [0,2,0,0,0,0|2,0,0]=4 9891 B13R0.300 CCCCN(CC)CCNC[C@H](C)O 7b0c8c8e43997b55da3f634471c9200c [0,2,0,0,0,0|2,0,0]=4 9892 B13R0.300 CCCC[C@@H](CC)CNCCC(C)C fbc67b5ef9e594be2dde5aa1c4013f7e [0,2,0,0,0,0|2,0,0]=4 9893 B13R0.300 CCCC[C@@H](CC)CNCCC(C)O 45420206810934ca4a893d4526344fe3 [0,2,0,0,0,0|1,0,0]=3 9894 B13R0.300 CCCC[C@@H](CC)CNCC[C@@H](C)O 3087c9530499557a442593b63cf8dc70 [0,2,0,0,0,0|1,0,0]=3 9895 B13R0.300 CCCC[C@@H](CC)CNCC[C@H](C)O ac8d84da140768ae2e0b5ef7e2234bac [0,2,0,0,0,0|1,0,0]=3 9896 B13R0.300 CCCC[C@@H](CC)COCCC(C)C c771dd38e08f4d6b86677fba2d1b1af7 [0,2,0,0,0,0|2,0,0]=4 9897 B13R0.300 CCCC[C@@H](CO)NCCCC(C)C 549554e6160fe2f24ed664dd8837f04d [0,2,0,0,0,0|2,0,0]=4 9898 B13R0.300 CCCC[C@@H](CO)NCCCC(C)O 78dc9bd119b6353fe71652f4654c4dbb [0,2,0,0,0,0|1,0,0]=3 9899 B13R0.300 CCCC[C@H](CO)NCCCC(C)C 42feeb9d6cfaae8c3d584042e2764fa6 [0,2,0,0,0,0|2,0,0]=4 9900 B13R0.300 CCCC[C@H](CO)NCCCC(C)O cfabd21a18800921148badbde7d759ed [0,2,0,0,0,0|1,0,0]=3 9901 B13R0.300 CCN(CCCCC(C)O)CCOC 55274204c4d05075bfb43f6d6f7fb038 [0,2,0,0,0,0|2,0,0]=4 9902 B13R0.300 CCN(CCCC[C@@H](C)O)CCOC 7d4050bbd30a71d61f156d49525edd88 [0,2,0,0,0,0|2,0,0]=4 9903 B13R0.300 CCN(CCCO)CCCCC(C)O 6173d0f78ac6f752f6edaf47515a83ff [0,2,0,0,0,0|2,0,0]=4 9904 B13R0.300 CCN(CCCO)CCCC[C@@H](C)O b3ed80a3a5ffd9dd6ced189ba5745e89 [0,2,0,0,0,0|2,0,0]=4 9905 B13R0.300 CSCCC(CO)CNCCC(C)O dd33a29b1383cbb2d5a0180630352d29 [0,2,0,0,0,0|2,0,0]=4 9906 B13R0.300 CSCCC(CO)NCCCC(C)O c2f212306ff39b7140492c5396940606 [0,2,0,0,0,0|2,0,0]=4 9907 B13R0.300 CSCC[C@@H](CO)NCCCC(C)O c45b64ba533ddc8461b81086437d153d [0,2,0,0,0,0|2,0,0]=4 9908 B13R0.300 CSCC[C@H](CO)NCCCC(C)O 0cd8a68164b71571a4c624a412b87683 [0,2,0,0,0,0|2,0,0]=4 9909 B13R0.345 CCCCC(O)C(=O)NCCC(C)O 30a1a48f67064f9c52fc643459b3523f [0,2,0,0,0,0|1,0,1]=4 9910 B13R0.345 CCCCC(O)C(=O)NCC[C@@H](C)O 925a7e68c1f05ac10b4f646cd4b66c4e [0,2,0,0,0,0|1,0,1]=4 9911 B13R0.345 CCCCC(O)C(=O)NCC[C@H](C)O 59d9cf2a613e51f294f46a6620ca286a [0,2,0,0,0,0|1,0,1]=4 9912 B13R0.345 CCCC[C@@H](O)C(=O)NCCC(C)O 4afb05a329d55ad54dfa61d92d1823c4 [0,2,0,0,0,0|1,0,1]=4 9913 B13R0.345 CCCC[C@@H](O)C(=O)NCC[C@@H](C)O 72db1160a251d756e7bf12e2205adab1 [0,2,0,0,0,0|1,0,1]=4 9914 B13R0.345 CCCC[C@@H](O)C(=O)NCC[C@H](C)O 6d629fb4e03f758c9025d6c4cbcab66a [0,2,0,0,0,0|1,0,1]=4 9915 B13R0.345 CCCC[C@H](O)C(=O)NCCC(C)O e931def5b3d1914dc5ca94614d921afa [0,2,0,0,0,0|1,0,1]=4 9916 B13R0.345 CCCC[C@H](O)C(=O)NCC[C@@H](C)O 1ee59b09db7f3496d13a5aabd0c4ccb8 [0,2,0,0,0,0|1,0,1]=4 9917 B13R0.345 CCCC[C@H](O)C(=O)NCC[C@H](C)O 86f42e1ac4fd0937c7ae3137d3b078a9 [0,2,0,0,0,0|1,0,1]=4 9918 B13R0.456 CC(O)CCCNC(C)(C)CCCO ffdf2cc875090466f45665987def6c71 [0,2,0,0,0,0|2,0,0]=4 9919 B13R0.456 CCOCC(C)(C)CNCCC(C)O 49d085081ca8d07d6d220d4f4a0fbfcb [0,2,0,0,0,0|2,0,0]=4 9920 B13R0.456 CCOCC(C)(C)NCCCC(C)O 811ce9025b8e6e15f24e49ac29856866 [0,2,0,0,0,0|2,0,0]=4 9921 B13R0.456 CCSCC(C)(C)NCCCC(C)O 7b3cbcd70e8d116ea3949ba451074d5d [0,2,0,0,0,0|2,0,0]=4 9922 B13R0.456 CSCCC(C)(C)NCCCC(C)O a8ac96e961ec29d468f9bc8e4637cf78 [0,2,0,0,0,0|2,0,0]=4 9923 B13R0.21 CC(C)(O)CCCNC[C@@H](O)CCO 9f3468499a893a627687e21ad71772f5 [0,2,0,0,0,0|2,0,0]=4 9924 B13R0.21 CC(CCO)CNCCCC(C)(C)O 78d3067d9d8e9b396b01d652608df968 [0,2,0,0,0,0|2,0,0]=4 9925 B13R0.21 CCCC(=O)CNCCCC(C)(C)O e4a695ebe6655bf6931d5f4a7d9f9a17 [0,2,0,0,0,0|1,0,1]=4 9926 B13R0.21 CCCC(C)CCCOCC(C)(C)C b887754c5906b07c6df8349ad6b842a9 [0,2,0,0,0,0|2,0,0]=4 9927 B13R0.21 CCCC(C)CCCOCC(C)(C)F df7acfd91e495f510008a06fd03faf5a [0,2,0,0,0,0|2,0,0]=4 9928 B13R0.21 CCCC(C)CCCOCC(C)(C)O 2692fea1c9eb168a46e9b6b266646b40 [0,2,0,0,0,0|1,0,0]=3 9929 B13R0.21 CCCC(C)CCCOCC(C)(F)F 09056b86c2edbbfc7f74069f6ad5dd3d [0,2,0,0,0,0|2,0,0]=4 9930 B13R0.21 CCCC(C)CCOCCC(C)(C)C 0113a0a2cdb0c22421937171062867f7 [0,2,0,0,0,0|2,0,0]=4 9931 B13R0.21 CCCC(C)CCOCCC(C)(C)O ab7ada8f1953d86f0f90f4d53c6fb96e [0,2,0,0,0,0|1,0,0]=3 9932 B13R0.21 CCCC(C)CCOCCC(C)(F)F 82c94864dfa13e8c95446e5fabc267d9 [0,2,0,0,0,0|2,0,0]=4 9933 B13R0.21 CCCC(C)CNCCCC(C)(C)C 5f1f2fc94e0c312a4e3490974e9eb553 [0,2,0,0,0,0|2,0,0]=4 9934 B13R0.21 CCCC(C)CNCCCC(C)(C)O 1dc558129b4eb9de4bc9e0d23b834ed4 [0,2,0,0,0,0|1,0,0]=3 9935 B13R0.21 CCCC(C)COCCCC(C)(C)C 4bfb90508b6e0748270c6065c8eca011 [0,2,0,0,0,0|2,0,0]=4 9936 B13R0.21 CCCC(C)COCCCC(C)(C)O 82fcc1e31848f6653f833a64a3da3bde [0,2,0,0,0,0|1,0,0]=3 9937 B13R0.21 CCCC(C)COCCCC(C)(F)F 5e418d6e916e8953b465f2760c7db9df [0,2,0,0,0,0|2,0,0]=4 9938 B13R0.21 CCCC(C)OCCCCC(C)(C)C bc79b4d22fd7f14442561ce5f4101a09 [0,2,0,0,0,0|2,0,0]=4 9939 B13R0.21 CCCC(O)CNCCCC(C)(C)O 2aaf0c0d5e3f5e3465d729f9434f24ca [0,2,0,0,0,0|1,0,0]=3 9940 B13R0.21 CCCC(O)CNCCCC(C)(F)F 4b08ca4319adbd350b92c42d309e0614 [0,2,0,0,0,0|2,0,0]=4 9941 B13R0.21 CCCC(S)CCOCCC(C)(C)C 6f9ab49a64a553e266ca6089d675ead5 [0,2,0,0,0,0|2,0,0]=4 9942 B13R0.21 CCCC(S)CCOCCC(C)(C)O e999db0d245f3d7ff3006fa5cd5bfe7c [0,2,0,0,0,0|1,0,0]=3 9943 B13R0.21 CCCC(S)CCOCCC(C)(F)F 401fd358d93cd42672f0f8c6a0fa7bd9 [0,2,0,0,0,0|2,0,0]=4 9944 B13R0.21 CCCN(C)CCCCCC(C)(C)O 88c294b542b289626a63aed44ceecfa1 [0,2,0,0,0,0|1,0,0]=3 9945 B13R0.21 CCOC(C)CNCCCC(C)(C)O 7af51563eb2520793ed2243ab6d5ec87 [0,2,0,0,0,0|2,0,0]=4 9946 B13R0.21 CCOC(C)COCCCC(C)(C)O dc566d6fe2f95c631116f0b2e2ebd66c [0,2,0,0,0,0|2,0,0]=4 9947 B13R0.21 CN(CCF)CCCCCC(C)(C)O e0409d5e6ee87e9fbd61e1436c516c57 [0,2,0,0,0,0|2,0,0]=4 9948 B13R0.21 CN(CCO)CCCCCC(C)(C)O 5e35ac393f7f3802c42f45885d82c3ac [0,2,0,0,0,0|2,0,0]=4 9949 B13R0.21 COCC(C)COCCCC(C)(C)O 3b20100b664375e14ae17b5784997321 [0,2,0,0,0,0|2,0,0]=4 9950 B13R0.21 COCC(O)CNCCCC(C)(C)O 3d7123b26fe153977afd24033e52f6b7 [0,2,0,0,0,0|2,0,0]=4 9951 B13R0.21 COC[C@@H](O)CNCCCC(C)(C)O 22f55e044461fa5ce1230eba0878ceb7 [0,2,0,0,0,0|2,0,0]=4 9952 B13R0.21 COC[C@H](C)COCCCC(C)(C)O 7c83e261c5b796423e4553d315fcd74e [0,2,0,0,0,0|2,0,0]=4 9953 B13R0.57 CC(C)(O)C(O)CNCCCCCF 5718289e18a4eb7ad934cc6901734fb0 [0,2,0,0,0,0|2,0,0]=4 9954 B13R0.57 CC(C)(O)C(O)CNCCCCCO 0b464ffc7c7f2497ac2a314d0a002e57 [0,2,0,0,0,0|2,0,0]=4 9955 B13R0.57 CC(C)(O)[C@@H](F)CNCCCCCF 337eff7267c5ab238c026542d4952c7a [0,2,0,0,0,0|2,0,0]=4 9956 B13R0.57 CC(C)(O)[C@@H](F)CNCCCCCO 91a94d0e7611086dcac9c38896832b12 [0,2,0,0,0,0|2,0,0]=4 9957 B13R0.57 CC(C)(O)[C@H](F)CNCCCCCF 8742eb6845f0d408ddaadaa540d74079 [0,2,0,0,0,0|2,0,0]=4 9958 B13R0.57 CC(C)(O)[C@H](F)CNCCCCCO 7bf981138fbc1088d8ccd408c710254d [0,2,0,0,0,0|2,0,0]=4 9959 B13R0.57 CC(NCCCCCCCl)C(C)(C)O dca6354b5ec4d929d156f9c4c8236efa [0,2,0,0,0,0|2,0,0]=4 9960 B13R0.57 CC(NCCCCCCF)C(C)(C)O 6a9d7ed5ce8f2824ece4aa93bfcb4674 [0,2,0,0,0,0|2,0,0]=4 9961 B13R0.57 CC(NCCCCCCO)C(C)(C)O e584f1fc3a1d22eed14f6bbd46fc7971 [0,2,0,0,0,0|2,0,0]=4 9962 B13R0.57 CC(OCCCCCCF)C(C)(C)O b1efc785193b1ea6bdd4ec67daac75ec [0,2,0,0,0,0|2,0,0]=4 9963 B13R0.57 CC(OCCCCCCS)C(C)(C)O be7a1cea69983793c7b8df97e6f4144f [0,2,0,0,0,0|2,0,0]=4 9964 B13R0.57 CCCCCCCCN(C)C(C)(C)C 2d5da10ba13b9b69902d5f643251926f [0,2,0,0,0,0|2,0,0]=4 9965 B13R0.57 CCCCCCCNC(C)C(C)(C)C b1cb117af901849e0db24da0d632c285 [0,2,0,0,0,0|2,0,0]=4 9966 B13R0.57 CCCCCCCNC(C)C(C)(C)O 987f5e08487596a673f41146838478d6 [0,2,0,0,0,0|1,0,0]=3 9967 B13R0.57 CCCCCCCN[C@@H](C)C(C)(C)C 2d1cfd2445c87f5972826fd3dfb8275f [0,2,0,0,0,0|2,0,0]=4 9968 B13R0.57 CCCCCCCN[C@@H](C)C(C)(C)O e74b824f4310840937b85214d36f3284 [0,2,0,0,0,0|1,0,0]=3 9969 B13R0.57 CCCCCCCN[C@H](C)C(C)(C)C 1823e9d61e6ff8262c94d0e634c8ca8e [0,2,0,0,0,0|2,0,0]=4 9970 B13R0.57 CCCCCCCN[C@H](C)C(C)(C)O e7fce99469cd7d7a977da042b5d95b4b [0,2,0,0,0,0|1,0,0]=3 9971 B13R0.57 CCCCCCCOC(C)C(C)(C)O 75c34d1314741a413c6cdfb7d9096abc [0,2,0,0,0,0|1,0,0]=3 9972 B13R0.57 CCCCCCNCC(=O)C(C)(C)O 1fa3338f0f11c771248f2b2a453a0e22 [0,2,0,0,0,0|1,0,1]=4 9973 B13R0.57 CCCCCCNCC(O)C(C)(C)C 8c26f41d4a8541deb38b6c52c9f37881 [0,2,0,0,0,0|2,0,0]=4 9974 B13R0.57 CCCCCCNCC(O)C(C)(C)O 8c2f235c1465a8ff515e2bd643ad6c9c [0,2,0,0,0,0|1,0,0]=3 9975 B13R0.57 CCCCCCNC[C@@H](F)C(C)(C)O ab385ebd0bbd321be7e687c11714e2ad [0,2,0,0,0,0|1,0,0]=3 9976 B13R0.57 CCCCCCNC[C@H](F)C(C)(C)O f5882b5607bfb384278e17cef08b8772 [0,2,0,0,0,0|1,0,0]=3 9977 B13R0.57 CCCCCCOCC(=O)C(C)(C)O 3bb674180b4c0668fd57aee80badb5b7 [0,2,0,0,0,0|1,0,1]=4 9978 B13R0.57 CCCCCCOCC(C)C(C)(C)C 5b102fdde789577015fe045be20c1888 [0,2,0,0,0,0|2,0,0]=4 9979 B13R0.57 CCCCOCCNC(C)C(C)(C)O 9462eaee163db47788fccb86c2c1c328 [0,2,0,0,0,0|2,0,0]=4 9980 B13R0.57 CCCCOCCN[C@@H](C)C(C)(C)O 099d6de1de37155db3235231b045f2dc [0,2,0,0,0,0|2,0,0]=4 9981 B13R0.57 CCCCOCCN[C@H](C)C(C)(C)O 481bb634fdf70381613b173bdb0f37fc [0,2,0,0,0,0|2,0,0]=4 9982 B13R0.57 CCCCOCCOC(C)C(C)(C)O 72da08b824484708e288610e8f6b53ae [0,2,0,0,0,0|2,0,0]=4 9983 B13R0.57 CCCCOCNCC(O)C(C)(C)O d19d646bf2b866fab7fb18e246c3cf8d [0,2,0,0,0,0|2,0,0]=4 9984 B13R0.57 CCCCOCNC[C@@H](F)C(C)(C)O 9eabe503b862dcfe4372f041c503202b [0,2,0,0,0,0|2,0,0]=4 9985 B13R0.57 CCCCOCNC[C@H](F)C(C)(C)O ff2a2026da088e3cf6e94aa4b31cb8a8 [0,2,0,0,0,0|2,0,0]=4 9986 B13R0.57 CCCCSCCOC(C)C(C)(C)O ba11d9effe1c37f018523d4fd91c0f25 [0,2,0,0,0,0|2,0,0]=4 9987 B13R0.57 CCCOCCCNC(C)C(C)(C)O 25e85c40d03472223941d2b0a752144c [0,2,0,0,0,0|2,0,0]=4 9988 B13R0.57 CCCOCCCN[C@@H](C)C(C)(C)O cc0be171e39adfa4f4ed491b0e2a2147 [0,2,0,0,0,0|2,0,0]=4 9989 B13R0.57 CCCOCCCN[C@H](C)C(C)(C)O 3961d887b85cc68a02bd8b2b211bf999 [0,2,0,0,0,0|2,0,0]=4 9990 B13R0.57 CCCOCCNCC(O)C(C)(C)O 8114e9901025dab63b3537a1f9140779 [0,2,0,0,0,0|2,0,0]=4 9991 B13R0.57 CCCOCCNC[C@@H](F)C(C)(C)O b10e913803a87c16292f1823f0deb711 [0,2,0,0,0,0|2,0,0]=4 9992 B13R0.57 CCCOCCNC[C@H](F)C(C)(C)O d86585b0d26d66e164dc4754900d9640 [0,2,0,0,0,0|2,0,0]=4 9993 B13R0.57 CCOCCCNCC(O)C(C)(C)O 368fd2eda3578dfd735ce6c289324dc9 [0,2,0,0,0,0|2,0,0]=4 9994 B13R0.57 CCOCCCNC[C@@H](F)C(C)(C)O 5f0e28fc42c0f16f2b433fd3e25c9baa [0,2,0,0,0,0|2,0,0]=4 9995 B13R0.57 CCOCCCNC[C@H](F)C(C)(C)O 499b9b969343cd37125e06c8d0e723b3 [0,2,0,0,0,0|2,0,0]=4 9996 B13R0.57 CCSCCCCNC(C)C(C)(C)O 0fd5d59acca73004a544d4fd1d32eefa [0,2,0,0,0,0|2,0,0]=4 9997 B13R0.57 CCSCCCNCC(O)C(C)(C)O 5649cc7706169cf1f9e6369375bb2c57 [0,2,0,0,0,0|2,0,0]=4 9998 B13R0.57 CCSCCCNC[C@@H](F)C(C)(C)O 843c6cab866cf6dea45ef80346433d23 [0,2,0,0,0,0|2,0,0]=4 9999 B13R0.57 CCSCCCNC[C@H](F)C(C)(C)O b21b29d8377976532eb0b6314c0e785c [0,2,0,0,0,0|2,0,0]=4 10000 B13R0.57 COCCCCCNC(C)C(C)(C)O b1a7e743d6f97ac9fd3303e262c50d83 [0,2,0,0,0,0|2,0,0]=4 10001 B13R0.57 COCCCCCN[C@@H](C)C(C)(C)O c7946e0d80b64456b65bf7b012797f43 [0,2,0,0,0,0|2,0,0]=4 10002 B13R0.57 COCCCCCN[C@H](C)C(C)(C)O 3e77880fed6e03ca715eba923cb8c060 [0,2,0,0,0,0|2,0,0]=4 10003 B13R0.57 COCCCCNCC(O)C(C)(C)O b95acdbf10441b15cf1b15b8e5929470 [0,2,0,0,0,0|2,0,0]=4 10004 B13R0.57 COCCCCNC[C@@H](F)C(C)(C)O 9572fbb315bcea8f6900fea4e6e68494 [0,2,0,0,0,0|2,0,0]=4 10005 B13R0.57 COCCCCNC[C@H](F)C(C)(C)O d5660cc9a69795b14f7ffdfd715ea941 [0,2,0,0,0,0|2,0,0]=4 10006 B13R0.57 C[C@@H](NCCCCCCF)C(C)(C)O 4605d636feb67b815671e203e3c14a1b [0,2,0,0,0,0|2,0,0]=4 10007 B13R0.57 C[C@@H](NCCCCCCO)C(C)(C)O 16469c4ba5934da962b1860a85f7ef74 [0,2,0,0,0,0|2,0,0]=4 10008 B13R0.57 C[C@H](NCCCCCCF)C(C)(C)O 0fcfbd3aa468b7f61165184f551169c2 [0,2,0,0,0,0|2,0,0]=4 10009 B13R0.57 C[C@H](NCCCCCCO)C(C)(C)O bd8744f0a6456e3cd48b49ece7a87060 [0,2,0,0,0,0|2,0,0]=4 10010 B13R0.196 CC(CCCCO)NCCC(C)(C)O 2b35ee18030e349e7864d92f466e07af [0,2,0,0,0,0|2,0,0]=4 10011 B13R0.196 CCCCCC(=O)CNCC(C)(C)O bca98c9d168f2502e86c48dbfbce3569 [0,2,0,0,0,0|1,0,1]=4 10012 B13R0.196 CCCCCC(=O)NCCC(C)(C)O 53256cb7225c29b0717246a1cd17fce7 [0,2,0,0,0,0|1,0,1]=4 10013 B13R0.196 CCCCCC(C)COCC(C)(C)C 775cffb370f255aafeabb9fe4abfd6bc [0,2,0,0,0,0|2,0,0]=4 10014 B13R0.196 CCCCCC(C)COCC(C)(C)F 871b37d8fb37963dd410f4dbf957e820 [0,2,0,0,0,0|2,0,0]=4 10015 B13R0.196 CCCCCC(C)COCC(C)(C)O 2cf6ad5b0653d548c8bbc4151b108fd3 [0,2,0,0,0,0|1,0,0]=3 10016 B13R0.196 CCCCCC(C)COCC(C)(F)F c2676a24f378857c376d1c5a6150b074 [0,2,0,0,0,0|2,0,0]=4 10017 B13R0.196 CCCCCC(C)NCCC(C)(C)C 46cf343777c2eeea24a894a22ba43a14 [0,2,0,0,0,0|2,0,0]=4 10018 B13R0.196 CCCCCC(C)NCCC(C)(C)O 4d8b373b6bdd2a6b656100ba3f601751 [0,2,0,0,0,0|1,0,0]=3 10019 B13R0.196 CCCCCC(C)NCCC(C)(F)F 6282b53c426030959fba1c13820a18a6 [0,2,0,0,0,0|2,0,0]=4 10020 B13R0.196 CCCCCC(C)OCCC(C)(C)C 3503e5043e1cd7e517696b2f1f56e611 [0,2,0,0,0,0|2,0,0]=4 10021 B13R0.196 CCCCCC(C)OCCC(C)(C)O f3c304a5db75b3d85fefb8c5f65bff74 [0,2,0,0,0,0|1,0,0]=3 10022 B13R0.196 CCCCCC(C)OCCC(C)(C)S 5ade350b27605671086b37adb9de3203 [0,2,0,0,0,0|1,1,0]=4 10023 B13R0.196 CCCCCC(C)OCCC(C)(F)F 69df0b61553d0fd211f530d190346c82 [0,2,0,0,0,0|2,0,0]=4 10024 B13R0.196 CCCCCN(C)CCCC(C)(C)O b8c1fbb8cb11426d64737fb271842b2f [0,2,0,0,0,0|1,0,0]=3 10025 B13R0.196 CCCCCN(C)CCCC(C)(F)F bdef1cf31e1d3eb877282d39b1826a07 [0,2,0,0,0,0|2,0,0]=4 10026 B13R0.196 CCCCC[C@@H](C)OCCC(C)(C)C 20c9254c12d95540a463950f2e849c37 [0,2,0,0,0,0|2,0,0]=4 10027 B13R0.196 CCCCC[C@@H](C)OCCC(C)(C)O 561ed036162ae15aad26361967e3cfa1 [0,2,0,0,0,0|1,0,0]=3 10028 B13R0.196 CCCCC[C@@H](C)OCCC(C)(F)F 71aee7263c20aaff4b517e5fc1798b46 [0,2,0,0,0,0|2,0,0]=4 10029 B13R0.196 CCCCC[C@H](C)NCCC(C)(C)C 17b32dc81fe9e947033063a2bd2ce69b [0,2,0,0,0,0|2,0,0]=4 10030 B13R0.196 CCCCC[C@H](C)NCCC(C)(C)F 2ce31145d9432b3310daccca30c4adb6 [0,2,0,0,0,0|2,0,0]=4 10031 B13R0.196 CCCCC[C@H](C)NCCC(C)(C)O d9accc628eea1a280e04009319c39d53 [0,2,0,0,0,0|1,0,0]=3 10032 B13R0.196 CCCCC[C@H](C)NCCC(C)(F)F a297ae2b8e6348b85f1985b66b0359da [0,2,0,0,0,0|2,0,0]=4 10033 B13R0.196 CCCCC[C@H](C)OCCC(C)(C)C f5ba1a222c625759e5c9a6d0c7d8b3d5 [0,2,0,0,0,0|2,0,0]=4 10034 B13R0.196 CCCCC[C@H](C)OCCC(C)(C)O 59684c99f722c681410086a0e8a3bf42 [0,2,0,0,0,0|1,0,0]=3 10035 B13R0.196 CCCCC[C@H](C)OCCC(C)(C)S cae8692618305233fd5475ecc93ccc69 [0,2,0,0,0,0|1,1,0]=4 10036 B13R0.196 CCCCC[C@H](C)OCCC(C)(F)F 71c72dc0dd0bdcb7d8de9f443db47bb5 [0,2,0,0,0,0|2,0,0]=4 10037 B13R0.196 CCCOCC(C)OCCC(C)(C)O cb7e00cdfd481313eb2336ae332de288 [0,2,0,0,0,0|2,0,0]=4 10038 B13R0.196 CCOCCN(C)CCCC(C)(C)O 628909ed54e20cc629e23acfb7fd5817 [0,2,0,0,0,0|2,0,0]=4 10039 B13R0.196 CN(CCCCO)CCCC(C)(C)O 6ec134d714e6905370dfddcdf3ddb0b7 [0,2,0,0,0,0|2,0,0]=4 10040 B13R0.196 COCCCN(C)CCCC(C)(C)O 6b774f8947b5b7ac95844a485c7582b5 [0,2,0,0,0,0|2,0,0]=4 10041 B13R0.280 C#CCCCCCCNCC(C)(C)O 00fe25f961a1cc31db2b9b546d0cccd2 [0,2,0,0,0,0|0,0,2]=4 10042 B13R0.280 C#CCCCCCCOCC(C)(C)O 2bd3bf0389ded8374ece61e489baa9a8 [0,2,0,0,0,0|0,0,2]=4 10043 B13R0.280 C#CCCCCCNCCC(C)(C)O 02204ced38e0faea26efc040356587f6 [0,2,0,0,0,0|0,0,2]=4 10044 B13R0.280 C#CCCCCCOCCC(C)(C)O acf54ce643c9f39d875f3fe07af11b65 [0,2,0,0,0,0|0,0,2]=4 10045 B13R0.280 C#CCCCCNCCCC(C)(C)O 1b79d75626a767b6d39addfa31429707 [0,2,0,0,0,0|0,0,2]=4 10046 B13R0.280 C#CCCCCOCCCC(C)(C)O 605bb585b4f3d670cbefe61dad39a221 [0,2,0,0,0,0|0,0,2]=4 10047 B13R0.280 C#CCCNCCCCCC(C)(C)O 01e9687b4a482cde2917b2168598ab0e [0,2,0,0,0,0|0,0,2]=4 10048 B13R0.280 C#CCCOCCCCCC(C)(C)O c1d6d600e2fb1ad48a72b6f0c4f7addd [0,2,0,0,0,0|0,0,2]=4 10049 B13R0.280 C/C=C/CCCOCCCC(C)(C)O 2ef3708fae9dd4ea016eaf54b2695a62 [0,2,0,0,0,0|0,0,2]=4 10050 B13R0.280 C/C=C/COCCCCCC(C)(C)O f8cacd36e64909ab247dcd0b5311ad4c [0,2,0,0,0,0|0,0,2]=4 10051 B13R0.280 C/C=C\CCCNCCCC(C)(C)O b7e37df1a827eadfbdc8c07ec0625f1f [0,2,0,0,0,0|0,0,2]=4 10052 B13R0.280 C/C=C\CCCOCCCC(C)(C)O 8ed712098603a00ac7502035e24e10c0 [0,2,0,0,0,0|0,0,2]=4 10053 B13R0.280 C/C=C\COCCCCCC(C)(C)O 57ad6a1e392f7e7c923dd1b68d310ce2 [0,2,0,0,0,0|0,0,2]=4 10054 B13R0.280 C=CCCCCCCNCC(C)(C)O 11e4474515be3ba0f5489d19c7af0a07 [0,2,0,0,0,0|0,0,2]=4 10055 B13R0.280 C=CCCCCCCOCC(C)(C)O 1ebf803e78e3cfacd1375b47624ec371 [0,2,0,0,0,0|0,0,2]=4 10056 B13R0.280 C=CCCCCCNCCC(C)(C)O 72755a89fe4836c96930aa18d53e73f8 [0,2,0,0,0,0|0,0,2]=4 10057 B13R0.280 C=CCCCCCOCCC(C)(C)O 223ac7168df6039bbd9d1c0a41fec4f8 [0,2,0,0,0,0|0,0,2]=4 10058 B13R0.280 C=CCCCCNCCCC(C)(C)O 056f34ffe54a157847ba8ac64c965eca [0,2,0,0,0,0|0,0,2]=4 10059 B13R0.280 C=CCCCCOCCCC(C)(C)O ccbcfbdb867da40bfc04c25b38c772f8 [0,2,0,0,0,0|0,0,2]=4 10060 B13R0.280 C=CCCNCCCCCC(C)(C)O e6e8cc45d413982a6f0ab069a4b9dc49 [0,2,0,0,0,0|0,0,2]=4 10061 B13R0.280 C=CCCOCCCCCC(C)(C)O 3947c631c6458ea56ea28e9f932cbd08 [0,2,0,0,0,0|0,0,2]=4 10062 B13R0.280 CC#CCCCNCCCC(C)(C)O 2c14a01e10360aa65e0e772e17183cd6 [0,2,0,0,0,0|0,0,2]=4 10063 B13R0.280 CC#CCCCOCCCC(C)(C)O 4c720c39b038e889931e1e58c88a4a11 [0,2,0,0,0,0|0,0,2]=4 10064 B13R0.280 CC#CCNCCCCCC(C)(C)O 619faccf7f4d96a0f1099f562904928a [0,2,0,0,0,0|0,0,2]=4 10065 B13R0.280 CC#CCOCCCCCC(C)(C)O 9b1a6c75831ba431d56f9bad1e29bb29 [0,2,0,0,0,0|0,0,2]=4 10066 B13R0.280 CC(C)(C)CCCCCCOCCF d961a6d525708ccd54ccaf98d104c354 [0,2,0,0,0,0|2,0,0]=4 10067 B13R0.280 CC(C)(C)CCCCCCOCCS 0d27fff6e014dc329674969a1b6917b2 [0,2,0,0,0,0|2,0,0]=4 10068 B13R0.280 CC(C)(C)CCCCOCCCCF 244ffe0017774c428435bef72b6b9f7e [0,2,0,0,0,0|2,0,0]=4 10069 B13R0.280 CC(C)(C)CCCNCCCCCF 1d3aea08a5aee6030d8ec988a11a9f7f [0,2,0,0,0,0|2,0,0]=4 10070 B13R0.280 CC(C)(C)CCCNCCCCCO 92c882a95b8b926f7557c4af200e2445 [0,2,0,0,0,0|2,0,0]=4 10071 B13R0.280 CC(C)(C)CCCOCCCCCF c1beec5fd356d364e3ae9dde964b7b77 [0,2,0,0,0,0|2,0,0]=4 10072 B13R0.280 CC(C)(C)CCNCCCCCCCl b5bbc6c07f4422d5beb90b6af248cc79 [0,2,0,0,0,0|2,0,0]=4 10073 B13R0.280 CC(C)(C)CCNCCCCCCF 3fc674e534d317fd710a085b8058d4d9 [0,2,0,0,0,0|2,0,0]=4 10074 B13R0.280 CC(C)(C)CCNCCCCCCO d68446760dd0fc9480fff579a758dbd0 [0,2,0,0,0,0|2,0,0]=4 10075 B13R0.280 CC(C)(C)CCOCCCCCCF 7eeb8dfde584d300366fb9b0d1d7a113 [0,2,0,0,0,0|2,0,0]=4 10076 B13R0.280 CC(C)(C)CCOCCCCCCS 170996a8e205a71755ae5b5aadb9c27f [0,2,0,0,0,0|2,0,0]=4 10077 B13R0.280 CC(C)(C)CNCCCCCCCO 3ab9ef856a4d9b782ac1f18df08b9a37 [0,2,0,0,0,0|2,0,0]=4 10078 B13R0.280 CC(C)(C)NCCCCCCCCO 0ca7e5e09280a450d2fb387387f96661 [0,2,0,0,0,0|2,0,0]=4 10079 B13R0.280 CC(C)(F)CCNCCCCCCF 8d082535fee58232c8ad84027566c157 [0,2,0,0,0,0|2,0,0]=4 10080 B13R0.280 CC(C)(F)CCNCCCCCCO 1dd4f6a74508d71c372c864ff44b2e25 [0,2,0,0,0,0|2,0,0]=4 10081 B13R0.280 CC(C)(F)CNCCCCCCCO 84c588660f64dbdb6e7778ac39361071 [0,2,0,0,0,0|2,0,0]=4 10082 B13R0.280 CC(C)(O)CCCCCNCCC#N 87c42c7a001da3005d4e5afd62e166dc [0,2,0,0,0,0|1,0,1]=4 10083 B13R0.280 CC(C)(O)CCCCCNCCCCl 3cd49d1f7a81481dcaf48ae0a5d35fc8 [0,2,0,0,0,0|1,0,0]=3 10084 B13R0.280 CC(C)(O)CCCCCNCCCO 33034b757628a2b2661820e652170ecb [0,2,0,0,0,0|1,0,0]=3 10085 B13R0.280 CC(C)(O)CCCCCNCCON 52480312f8a8ebabe321e9af04ac3ff4 [0,2,0,0,0,0|2,0,0]=4 10086 B13R0.280 CC(C)(O)CCCCCOCCC#N 92f6f3129cf3d35c45383786221ac3e3 [0,2,0,0,0,0|1,0,1]=4 10087 B13R0.280 CC(C)(O)CCCCCOCCC=O f7d51d6be2e7a015c54d4ca913ce5638 [0,2,0,0,0,0|1,0,1]=4 10088 B13R0.280 CC(C)(O)CCCCCOCCCF ee13f6610c9b8856b883e642d9f744d3 [0,2,0,0,0,0|1,0,0]=3 10089 B13R0.280 CC(C)(O)CCCCCOCCCS 7721da1dc4d166babd8f3b087dfcf676 [0,2,0,0,0,0|1,0,0]=3 10090 B13R0.280 CC(C)(O)CCCNCCCCC#N e7c0374788b719b53a8e4b2f8b33bcbd [0,2,0,0,0,0|1,0,1]=4 10091 B13R0.280 CC(C)(O)CCCNCCCCC=O 1d6d570ed00a1435db71a6bb09b40eaf [0,2,0,0,0,0|1,0,1]=4 10092 B13R0.280 CC(C)(O)CCCNCCCCCCl 85fc4ca3309f757a50c04a57f47a93bb [0,2,0,0,0,0|1,0,0]=3 10093 B13R0.280 CC(C)(O)CCCNCCCCCF 161ee1634f4f42b0181d186a53cb5c99 [0,2,0,0,0,0|1,0,0]=3 10094 B13R0.280 CC(C)(O)CCCNCCCCCO b2831288a81c3d3b774d5d4666aa5eaf [0,2,0,0,0,0|1,0,0]=3 10095 B13R0.280 CC(C)(O)CCCNCCCCON 6ee5a9a6433e91705ee82ab7609eef40 [0,2,0,0,0,0|2,0,0]=4 10096 B13R0.280 CC(C)(O)CCCNCCOCCO b97457422efa47bcae589b4487a03be2 [0,2,0,0,0,0|2,0,0]=4 10097 B13R0.280 CC(C)(O)CCCNCCOCCS 4b0bf09be01a48f908f0a4603a157de2 [0,2,0,0,0,0|2,0,0]=4 10098 B13R0.280 CC(C)(O)CCCNCCSCCO 04d40f17658788cedcba62030417562d [0,2,0,0,0,0|2,0,0]=4 10099 B13R0.280 CC(C)(O)CCCOCCCCC#N 8e26ea2b0ffceb5625463f6c21625fe8 [0,2,0,0,0,0|1,0,1]=4 10100 B13R0.280 CC(C)(O)CCCOCCCCC=O 20c1e9a602f70f124f31a10a4668491f [0,2,0,0,0,0|1,0,1]=4 10101 B13R0.280 CC(C)(O)CCCOCCOCCF 6392e212ef284ca4630f90c8679c5145 [0,2,0,0,0,0|2,0,0]=4 10102 B13R0.280 CC(C)(O)CCCOCCOCCS da1f47d9078688e3d59e17bbc1ce2866 [0,2,0,0,0,0|2,0,0]=4 10103 B13R0.280 CC(C)(O)CCNCCCCCC#N 59a23a2c1a9df1d71faff0277de5751f [0,2,0,0,0,0|1,0,1]=4 10104 B13R0.280 CC(C)(O)CCNCCCCCC=O add2702a173b856f8f01291286cdb892 [0,2,0,0,0,0|1,0,1]=4 10105 B13R0.280 CC(C)(O)CCNCCCCCCCl 1e1a111b0a60ce1336f58b9db1185979 [0,2,0,0,0,0|1,0,0]=3 10106 B13R0.280 CC(C)(O)CCNCCCCCCF 0ab0726d29ddfc33b5f7cd5a3dcc0a3d [0,2,0,0,0,0|1,0,0]=3 10107 B13R0.280 CC(C)(O)CCNCCCCCCO a0e07c036199b419551c974457cddfda [0,2,0,0,0,0|1,0,0]=3 10108 B13R0.280 CC(C)(O)CCNCCCOCCO c95dc4e943c687487b21668d25b7bb41 [0,2,0,0,0,0|2,0,0]=4 10109 B13R0.280 CC(C)(O)CCNCCOCCCO 96a6aacf386231ecdfe5b386246a441e [0,2,0,0,0,0|2,0,0]=4 10110 B13R0.280 CC(C)(O)CCOCCCCCC#N 98bef2ee0adff4701c1613f35ada08e6 [0,2,0,0,0,0|1,0,1]=4 10111 B13R0.280 CC(C)(O)CCOCCCCCCF c3e7af5cbdf979084b2e016ea62c7c9b [0,2,0,0,0,0|1,0,0]=3 10112 B13R0.280 CC(C)(O)CCOCCCCCCS 6e0bf37c1f31a4501685559c2d5ca1d2 [0,2,0,0,0,0|1,0,0]=3 10113 B13R0.280 CC(C)(O)CNCCCCCCC#N 155508fdfa466216e1993763cf114caa [0,2,0,0,0,0|1,0,1]=4 10114 B13R0.280 CC(C)(O)CNCCCCCCC=O e3e9ce0dd28a0908d49fa33ffbab5a38 [0,2,0,0,0,0|1,0,1]=4 10115 B13R0.280 CC(C)(O)CNCCCCCCCO a11dbcc1606701d44f1b2435a6b4a628 [0,2,0,0,0,0|1,0,0]=3 10116 B13R0.280 CC(C)(O)CNCCCCSCCO 3bcf080a9aa8fdc7fd7655540e8988ce [0,2,0,0,0,0|2,0,0]=4 10117 B13R0.280 CC(C)(O)CNCCCOCCCO 43704989369f75e2ae534c99d586c500 [0,2,0,0,0,0|2,0,0]=4 10118 B13R0.280 CC(C)(S)CCOCCCCCCF babfc1ae8f5328752b454d78057b5adb [0,2,0,0,0,0|1,1,0]=4 10119 B13R0.280 CC(F)(F)CCCNCCCCCCl 09d69fcff3701ef0643fff09b7ee58b9 [0,2,0,0,0,0|2,0,0]=4 10120 B13R0.280 CC(F)(F)CCCNCCCCCO 1d844addf9213c13a87c0142d30e04a5 [0,2,0,0,0,0|2,0,0]=4 10121 B13R0.280 CC(F)(F)CCNCCCCCCCl d2b7982f2754b0e25b132d511d0080f8 [0,2,0,0,0,0|2,0,0]=4 10122 B13R0.280 CC(F)(F)CCNCCCCCCO 2bf0a207ef65895e19a9964c5a4662a7 [0,2,0,0,0,0|2,0,0]=4 10123 B13R0.280 CC(F)(F)CCOCCCCCCF 819eb081a220eed7fffb762b62ccc27c [0,2,0,0,0,0|2,0,0]=4 10124 B13R0.280 CC(F)(F)CCOCCCCCCS 84fd10408b8f24ceafdf2fcfae8c0b5b [0,2,0,0,0,0|2,0,0]=4 10125 B13R0.280 CC(F)(F)CNCCCCCCCO 29db03bbd33721c588a0672735870f47 [0,2,0,0,0,0|2,0,0]=4 10126 B13R0.280 CC/C=C/CCOCCCC(C)(C)O 8deede8a5a96575d557ef0c3a5fd61d9 [0,2,0,0,0,0|0,0,2]=4 10127 B13R0.280 CC/C=C\CCCCOCC(C)(C)O f516936001f33947f82bd651ccb75edb [0,2,0,0,0,0|0,0,2]=4 10128 B13R0.280 CC/C=C\CCCOCCC(C)(C)O fbac977f99717acf95088b23a4394dbc [0,2,0,0,0,0|0,0,2]=4 10129 B13R0.280 CC/C=C\CCNCCCC(C)(C)O 60ff9592e856a0d8033e872687c6627d [0,2,0,0,0,0|0,0,2]=4 10130 B13R0.280 CC/C=C\CCOCCCC(C)(C)O 88967780fd79081a6ab42871f76667ea [0,2,0,0,0,0|0,0,2]=4 10131 B13R0.280 CC=CCCCOCCCC(C)(C)O 21a7c1dd770ac0d1e6cdb302fdbd28b0 [0,2,0,0,0,0|0,0,2]=4 10132 B13R0.280 CC=CCNCCCCCC(C)(C)O 923668b4a4dc52e0ebb444850309f618 [0,2,0,0,0,0|0,0,2]=4 10133 B13R0.280 CC=CCOCCCCCC(C)(C)O e7ea8ff9f80b13e1c8582e776d96d83f [0,2,0,0,0,0|0,0,2]=4 10134 B13R0.280 CCC#CCCOCCCC(C)(C)O 910601bde8bec061762f141cf4deca2b [0,2,0,0,0,0|0,0,2]=4 10135 B13R0.280 CCC/C=C/CCCOCC(C)(C)O 88450e5762051c6538f56cb3a4cc4455 [0,2,0,0,0,0|0,0,2]=4 10136 B13R0.280 CCC/C=C/CNCCCC(C)(C)O b9ca24a0494410311a9dad72a3582df3 [0,2,0,0,0,0|0,0,2]=4 10137 B13R0.280 CCC/C=C/COCCCC(C)(C)O ae5521c42901c68c2a0ce7e4ea09c8d6 [0,2,0,0,0,0|0,0,2]=4 10138 B13R0.280 CCC/C=C\CCCOCC(C)(C)O bf1bd69b53ba7116379c3abb8c9c30c9 [0,2,0,0,0,0|0,0,2]=4 10139 B13R0.280 CCC/C=C\CCOCCC(C)(C)O d82947e1fa354f39f45affac4834ae95 [0,2,0,0,0,0|0,0,2]=4 10140 B13R0.280 CCC/C=C\CNCCCC(C)(C)O cab0405e601efd9656518f5ac68c3618 [0,2,0,0,0,0|0,0,2]=4 10141 B13R0.280 CCC/C=C\COCCCC(C)(C)O 5b4d71804f9174e236262ae70234a1b2 [0,2,0,0,0,0|0,0,2]=4 10142 B13R0.280 CCCC#CCCOCCC(C)(C)O 4a58403609d37bc645f006ae912266c8 [0,2,0,0,0,0|0,0,2]=4 10143 B13R0.280 CCCC#CCOCCCC(C)(C)O 8f31a5332359e80112a37c05db291e4b [0,2,0,0,0,0|0,0,2]=4 10144 B13R0.280 CCCC/C=C/CNCCC(C)(C)O a15aa761b066a8c45148933a6110dac1 [0,2,0,0,0,0|0,0,2]=4 10145 B13R0.280 CCCC/C=C/COCCC(C)(C)O 450e3191e7bdda0d9ac56398ad0544ec [0,2,0,0,0,0|0,0,2]=4 10146 B13R0.280 CCCC/C=C\CCOCC(C)(C)O 121a3b8178f3c3cc9e487642903b3fc9 [0,2,0,0,0,0|0,0,2]=4 10147 B13R0.280 CCCC/C=C\CNCCC(C)(C)O 708fe6c060c7c0f3054e7ba11046e63b [0,2,0,0,0,0|0,0,2]=4 10148 B13R0.280 CCCCC#CCCOCC(C)(C)O deff4015e7dca40777be90f281a46f94 [0,2,0,0,0,0|0,0,2]=4 10149 B13R0.280 CCCCC#CCNCCC(C)(C)O bcb6f06a85ee4c527777245d62cd9c6c [0,2,0,0,0,0|0,0,2]=4 10150 B13R0.280 CCCCC#CCOCCC(C)(C)O 8eab30dacbf4103461adf75f1a5ffeab [0,2,0,0,0,0|0,0,2]=4 10151 B13R0.280 CCCCC/C=C/COCC(C)(C)O c6f8b71e15bf91062d1bd46335d8d538 [0,2,0,0,0,0|0,0,2]=4 10152 B13R0.280 CCCCCC#CCOCC(C)(C)O ad07e28407ad63f33e0781511a08b0f4 [0,2,0,0,0,0|0,0,2]=4 10153 B13R0.280 CCCCCCCCCNC(C)(C)C 7f4b7d5b54bc91ae982e2a5c089ed36a [0,2,0,0,0,0|1,0,0]=3 10154 B13R0.280 CCCCCCCCNCC(C)(C)C 007dc0c0ea99a52920759b1d247d24cf [0,2,0,0,0,0|1,0,0]=3 10155 B13R0.280 CCCCCCCCNCC(C)(C)F 3542b1d7f20c2aa02e9f4b833662785d [0,2,0,0,0,0|1,0,0]=3 10156 B13R0.280 CCCCCCCCNCC(C)(C)O b823aedfe3a06bcead5007a02eefc446 [0,2,0,0,0,0|0,0,0]=2 10157 B13R0.280 CCCCCCCCNCC(C)(F)F d0d7cd19d2ae6d7f121287a8158c70a3 [0,2,0,0,0,0|1,0,0]=3 10158 B13R0.280 CCCCCCCCNCC(F)(F)F 63bb064861e5791a567e8c300679db33 [0,2,0,0,0,0|2,0,0]=4 10159 B13R0.280 CCCCCCCCNCS(=O)(=O)C e1356bfc3ae91ddc65782eb446589f31 [0,2,0,0,0,0|1,0,1]=4 10160 B13R0.280 CCCCCCCCNCS(=O)(=O)O d8c0b4a5521d2aa291ac72d97731b016 [0,2,0,0,0,0|2,0,0]=4 10161 B13R0.280 CCCCCCCCOCC(C)(C)Br a459fe3407b8099eac9844eca59f184f [0,2,0,0,0,0|1,0,0]=3 10162 B13R0.280 CCCCCCCCOCC(C)(C)C b03410f3edd208332e4afb17eb50901a [0,2,0,0,0,0|1,0,0]=3 10163 B13R0.280 CCCCCCCCOCC(C)(C)F 987916a4fe50017766764f8045e458e0 [0,2,0,0,0,0|1,0,0]=3 10164 B13R0.280 CCCCCCCCOCC(C)(C)O 05f812bc8feaf8cd3631590e581a5767 [0,2,0,0,0,0|0,0,0]=2 10165 B13R0.280 CCCCCCCCOCC(C)(C)S f36afb833cf4ad2c10ababa1d88f3aca [0,2,0,0,0,0|0,1,0]=3 10166 B13R0.280 CCCCCCCCOCC(C)(F)F 7f89b11b85e7745051c6671acc183814 [0,2,0,0,0,0|1,0,0]=3 10167 B13R0.280 CCCCCCCCOCC(F)(F)Br fa56a7bc4074e6a2959e8ae42894c6a9 [0,2,0,0,0,0|2,0,0]=4 10168 B13R0.280 CCCCCCCCOCC(F)(F)F c87dee2f97d57d9303f78f5ca0847b34 [0,2,0,0,0,0|2,0,0]=4 10169 B13R0.280 CCCCCCCCOCS(=O)(=O)C 0d85376fa8e2f303797dabaf1735650e [0,2,0,0,0,0|1,0,1]=4 10170 B13R0.280 CCCCCCCNCCC(C)(C)C 31dda6d6c8d33c590e316ba0d320d25e [0,2,0,0,0,0|1,0,0]=3 10171 B13R0.280 CCCCCCCNCCC(C)(C)F 2425ca34890978aa1c025c1e364e1952 [0,2,0,0,0,0|1,0,0]=3 10172 B13R0.280 CCCCCCCNCCC(C)(C)O 57bc6092ec6a93831b9ad62deebee423 [0,2,0,0,0,0|0,0,0]=2 10173 B13R0.280 CCCCCCCNCCC(C)(F)F fde151b2704298c235fd0a01ea5d6d9b [0,2,0,0,0,0|1,0,0]=3 10174 B13R0.280 CCCCCCCNCCC(F)(F)F 48fdf845efa7a54a757fdba03e1ee912 [0,2,0,0,0,0|2,0,0]=4 10175 B13R0.280 CCCCCCCNCCS(=O)(=O)C bd04dc045bfe90b3b5ff29845b07692b [0,2,0,0,0,0|1,0,1]=4 10176 B13R0.280 CCCCCCCNCCS(=O)(=O)O a06097f2d7b51e6e9916dec4c134c5cc [0,2,0,0,0,0|2,0,0]=4 10177 B13R0.280 CCCCCCCOCCC(C)(C)C 94a66414e15c47fa8b0b32a9ffabfaaf [0,2,0,0,0,0|1,0,0]=3 10178 B13R0.280 CCCCCCCOCCC(C)(C)O d09f2b6260a0b4e27b1f5a3eb8752d4e [0,2,0,0,0,0|0,0,0]=2 10179 B13R0.280 CCCCCCCOCCC(C)(C)S 3f78677b9f03dfd9fa0a05a221a3f66c [0,2,0,0,0,0|0,1,0]=3 10180 B13R0.280 CCCCCCCOCCC(C)(F)F 1e44d4e00ae6a011ed5eba6e08143eda [0,2,0,0,0,0|1,0,0]=3 10181 B13R0.280 CCCCCCCOCCC(F)(F)F da0ca2da51736fd48f3881c0bbbceac2 [0,2,0,0,0,0|2,0,0]=4 10182 B13R0.280 CCCCCCCOCCS(=N)(=O)C 639331fdd219b56ba292c4806131b13c [0,2,0,0,0,0|1,0,1]=4 10183 B13R0.280 CCCCCCCOCCS(=O)(=O)C 1feb6f99d3efb18dc412ed30703b6430 [0,2,0,0,0,0|1,0,1]=4 10184 B13R0.280 CCCCCCCOCCS(=O)(=O)O 42e4b925ff28c28a42b7cef7c01f6878 [0,2,0,0,0,0|2,0,0]=4 10185 B13R0.280 CCCCCCNCCCC(C)(C)C 3e90ad22a768e5111efd022841224f55 [0,2,0,0,0,0|1,0,0]=3 10186 B13R0.280 CCCCCCNCCCC(C)(C)O b84aadd2ff75fc260b1a083ff003cb34 [0,2,0,0,0,0|0,0,0]=2 10187 B13R0.280 CCCCCCNCCCC(C)(F)F c3d0bd9202e7e83385753f3e0f400ffb [0,2,0,0,0,0|1,0,0]=3 10188 B13R0.280 CCCCCCNCCCC(F)(F)F 80575edec4d59764b259b9a8b637670d [0,2,0,0,0,0|2,0,0]=4 10189 B13R0.280 CCCCCCNCCCS(=O)(=O)C c6b56f53381e6e9c487d34a19a4df0c7 [0,2,0,0,0,0|1,0,1]=4 10190 B13R0.280 CCCCCCNCCCS(=O)(=O)O 860a2ebd5cdead679b955bca9322fd5f [0,2,0,0,0,0|2,0,0]=4 10191 B13R0.280 CCCCCCNCCOC(C)(C)C 286d02d60327b2069c334939b025a2c8 [0,2,0,0,0,0|2,0,0]=4 10192 B13R0.280 CCCCCCNCCSC(C)(C)C a9a7c622d7b6707e957c3573c6b367ca [0,2,0,0,0,0|2,0,0]=4 10193 B13R0.280 CCCCCCOCCCC(C)(C)C ca43f9448316c1832e6c45254e804372 [0,2,0,0,0,0|1,0,0]=3 10194 B13R0.280 CCCCCCOCCCC(C)(C)O b58743f368a8c9bf6d9a84ea2b992cc1 [0,2,0,0,0,0|0,0,0]=2 10195 B13R0.280 CCCCCCOCCCC(C)(F)F 416164bdd18dd79590c61ac7e365d4a4 [0,2,0,0,0,0|1,0,0]=3 10196 B13R0.280 CCCCCCOCCCC(F)(F)F 135c739b8bb45765907ae3d54959cab6 [0,2,0,0,0,0|2,0,0]=4 10197 B13R0.280 CCCCCCOCCCS(=O)(=O)C cbe641c1ae7aad54714daab4625fb65c [0,2,0,0,0,0|1,0,1]=4 10198 B13R0.280 CCCCCCOCCCS(=O)(=O)O 6443dd85832602e8558d2a2db8629288 [0,2,0,0,0,0|2,0,0]=4 10199 B13R0.280 CCCCCCOCCOC(C)(C)C c3b714d080c0e68e87f7d3c59700f21a [0,2,0,0,0,0|2,0,0]=4 10200 B13R0.280 CCCCCCOCCSC(C)(C)C dd9e0b991cb2afdb3774cf22d9d4e330 [0,2,0,0,0,0|2,0,0]=4 10201 B13R0.280 CCCCCNCCCCC(F)(F)F d8fb5405f8c0afd5c7e57d189650e343 [0,2,0,0,0,0|2,0,0]=4 10202 B13R0.280 CCCCCNCCCCS(=O)(=O)C 131ae9df9233cefcaf177b0cba68e6a1 [0,2,0,0,0,0|1,0,1]=4 10203 B13R0.280 CCCCCNCCCCS(=O)(=O)O 145a283a50652bbeeb0eaf407a95f534 [0,2,0,0,0,0|2,0,0]=4 10204 B13R0.280 CCCCCNCCCOC(C)(C)C aaa0cce99337b37ec36a37c9ac862f90 [0,2,0,0,0,0|2,0,0]=4 10205 B13R0.280 CCCCCNCCCSC(C)(C)C fd89b02472e4ac86be8a64a88b2fd6cb [0,2,0,0,0,0|2,0,0]=4 10206 B13R0.280 CCCCCOCCCCC(C)(C)C e01ed2bb3e7a5c4f8c57969a1869c80e [0,2,0,0,0,0|1,0,0]=3 10207 B13R0.280 CCCCCOCCCCC(F)(F)F d6792e6b0a2cad9b2897129ec3d60961 [0,2,0,0,0,0|2,0,0]=4 10208 B13R0.280 CCCCCOCCCCS(=O)(=O)C 0ea20e0c1995170abef826d9002a35c7 [0,2,0,0,0,0|1,0,1]=4 10209 B13R0.280 CCCCCOCCCCS(=O)(=O)O 44e5d49dfbe52ed44d1b5bc9d794a76d [0,2,0,0,0,0|2,0,0]=4 10210 B13R0.280 CCCCCOCCCSC(C)(C)C c6e30a90e8a3799ecbd6e553458536ae [0,2,0,0,0,0|2,0,0]=4 10211 B13R0.280 CCCCCOCCOCC(C)(C)C 444089c77c3ccb004ada6eb86f938bf9 [0,2,0,0,0,0|2,0,0]=4 10212 B13R0.280 CCCCCOCCOCC(C)(C)F 0af0b0e166d757403a7ebeba5a410e31 [0,2,0,0,0,0|2,0,0]=4 10213 B13R0.280 CCCCCOCCOCC(C)(C)O 4d5f4a0c64e42ebdb243aa20b413a30e [0,2,0,0,0,0|1,0,0]=3 10214 B13R0.280 CCCCCOCCOCC(C)(F)F 2642ffc17cb3734ae4a771f312253c76 [0,2,0,0,0,0|2,0,0]=4 10215 B13R0.280 CCCCNCCCCCC(C)(C)O 8b9b710f8920f31f077119d0cc43d94f [0,2,0,0,0,0|0,0,0]=2 10216 B13R0.280 CCCCNCCCCCC(F)(F)F 195c3598861d93f665e42734b1aefb8c [0,2,0,0,0,0|2,0,0]=4 10217 B13R0.280 CCCCNCCCCCS(=O)(=O)O 1d388cb022142de9404757eb95368851 [0,2,0,0,0,0|2,0,0]=4 10218 B13R0.280 CCCCOCCCCCC(C)(C)O 523e2f4cf5bc1b2db4fdf027f9e1cf4f [0,2,0,0,0,0|0,0,0]=2 10219 B13R0.280 CCCCOCCCCCC(F)(F)F 7946cc1079ac8cbf6c34312ea3af6dfe [0,2,0,0,0,0|2,0,0]=4 10220 B13R0.280 CCCCOCCCNCC(C)(C)C 59b37e163ee3d12ba4fa4360fce5ea92 [0,2,0,0,0,0|2,0,0]=4 10221 B13R0.280 CCCCOCCCNCC(C)(C)F 4d59e4726de5ca6c6465980045afcd51 [0,2,0,0,0,0|2,0,0]=4 10222 B13R0.280 CCCCOCCCNCC(C)(C)O c855259d7fef44626037ccc877ab7570 [0,2,0,0,0,0|1,0,0]=3 10223 B13R0.280 CCCCOCCCNCC(C)(F)F c6f924911e8a92cb8cf1a1eebc836c4e [0,2,0,0,0,0|2,0,0]=4 10224 B13R0.280 CCCCOCCCOCC(C)(C)C e850636a762c84b27bec6777b3a0dd54 [0,2,0,0,0,0|2,0,0]=4 10225 B13R0.280 CCCCOCCCOCC(C)(C)F e9ae4ed1f8cc6c1facda0b3938e32396 [0,2,0,0,0,0|2,0,0]=4 10226 B13R0.280 CCCCOCCCOCC(C)(C)O 7589160564bbdafe845d86c89d69bcc6 [0,2,0,0,0,0|1,0,0]=3 10227 B13R0.280 CCCCOCCCOCC(C)(F)F 89c9820d785bac44d05f6e7db0cd2fb3 [0,2,0,0,0,0|2,0,0]=4 10228 B13R0.280 CCCCOCCNCCC(C)(C)C dbf690843c154b670bce4a25ea2d90c9 [0,2,0,0,0,0|2,0,0]=4 10229 B13R0.280 CCCCOCCNCCC(C)(C)F a78a44aa1d76b99584c6deeff8d232ca [0,2,0,0,0,0|2,0,0]=4 10230 B13R0.280 CCCCOCCNCCC(C)(C)O 0cc0790dec44be3e3d1661354128843a [0,2,0,0,0,0|1,0,0]=3 10231 B13R0.280 CCCCOCCNCCC(C)(F)F 9df1c9126a462c8df499fc70ee612745 [0,2,0,0,0,0|2,0,0]=4 10232 B13R0.280 CCCCOCCOCCC(C)(C)C f65a91539becd47b12b6211f4d84f7e9 [0,2,0,0,0,0|2,0,0]=4 10233 B13R0.280 CCCCOCCOCCC(C)(C)O 463d2e23fb07eacfcb5fd1716cbcfd2a [0,2,0,0,0,0|1,0,0]=3 10234 B13R0.280 CCCCOCCOCCC(C)(C)S 04a77c08d64493b3c2ad595996fc6dcc [0,2,0,0,0,0|1,1,0]=4 10235 B13R0.280 CCCCOCCOCCC(C)(F)F 82194ce476e2687e1cd03fa03ab2375c [0,2,0,0,0,0|2,0,0]=4 10236 B13R0.280 CCCCOCNCCCC(C)(C)C 6ca55e006f5cd26699e9b53ecd924742 [0,2,0,0,0,0|2,0,0]=4 10237 B13R0.280 CCCCOCNCCCC(C)(C)O c0829e0e315cd1e2d857e28774c04745 [0,2,0,0,0,0|1,0,0]=3 10238 B13R0.280 CCCCOCOCCCC(C)(C)C d8361bac65f1574cc8b275674f8185af [0,2,0,0,0,0|2,0,0]=4 10239 B13R0.280 CCCCSCCOCCC(C)(C)C cc06a326d56c21a4eccf16a58e4d8f4f [0,2,0,0,0,0|2,0,0]=4 10240 B13R0.280 CCCCSCCOCCC(C)(C)O 49601260b648e1fa4339412c36c7acfc [0,2,0,0,0,0|1,0,0]=3 10241 B13R0.280 CCCCSCCOCCC(C)(F)F 8e8d39f75bb1b7586c6ba2960a7c7b5d [0,2,0,0,0,0|2,0,0]=4 10242 B13R0.280 CCCNCCCCCCC(F)(F)F 55672caf7c1cc5fcd6a071dcd7f5b512 [0,2,0,0,0,0|2,0,0]=4 10243 B13R0.280 CCCNCCCCCCS(=O)(=O)O ea38ebb76882f9a713f19dc96de62c07 [0,2,0,0,0,0|2,0,0]=4 10244 B13R0.280 CCCOCCCCCCC(C)(C)C f0cf37ab20efe90b48188f27e87c899b [0,2,0,0,0,0|1,0,0]=3 10245 B13R0.280 CCCOCCCNCCC(C)(C)C 19d6783bb661975f3f3562cafd8cd86f [0,2,0,0,0,0|2,0,0]=4 10246 B13R0.280 CCCOCCCNCCC(C)(C)F 00814bb5d340b6e19603db9255d8d64b [0,2,0,0,0,0|2,0,0]=4 10247 B13R0.280 CCCOCCCNCCC(C)(C)O 0334117918e6102caa0e1ab8350e33bc [0,2,0,0,0,0|1,0,0]=3 10248 B13R0.280 CCCOCCCNCCC(C)(F)F 66a4c14d4c8375ecf53762711544a3d3 [0,2,0,0,0,0|2,0,0]=4 10249 B13R0.280 CCCOCCCOCCC(C)(C)C 52696586009e0eb807abfe6c4a5a2844 [0,2,0,0,0,0|2,0,0]=4 10250 B13R0.280 CCCOCCCOCCC(C)(C)S 34b5ba5c00cbb2d6ce37b9db0189d5cb [0,2,0,0,0,0|1,1,0]=4 10251 B13R0.280 CCCOCCCOCCC(C)(F)F 6cf6e42fdc3948a4224182e37aa23fbc [0,2,0,0,0,0|2,0,0]=4 10252 B13R0.280 CCCOCCNCCCC(C)(C)C 81b5dd8fd60331ce2a9854d9f8b665b0 [0,2,0,0,0,0|2,0,0]=4 10253 B13R0.280 CCCOCCNCCCC(C)(C)O 585c3c6999c5a2530fa5fc242e8c5df1 [0,2,0,0,0,0|1,0,0]=3 10254 B13R0.280 CCCOCCNCCCC(C)(F)F 2d2ae133a985f647a78aa9e335d58654 [0,2,0,0,0,0|2,0,0]=4 10255 B13R0.280 CCCOCCOCCCC(C)(C)C 96007ddad758ed690c7d1ed22b6d6bb3 [0,2,0,0,0,0|2,0,0]=4 10256 B13R0.280 CCCOCCOCCCC(C)(C)O 647170db42492bb8cc9b313add65dcdc [0,2,0,0,0,0|1,0,0]=3 10257 B13R0.280 CCCOCCOCCCC(C)(F)F d7113c37c21130d2ab0b10e7dfc16a36 [0,2,0,0,0,0|2,0,0]=4 10258 B13R0.280 CCCSCCCCNCC(C)(C)C bbfa297b0ee5162a24544c89e45231c6 [0,2,0,0,0,0|2,0,0]=4 10259 B13R0.280 CCCSCCCCNCC(C)(C)F 9f48deccfbf4ec423df4e44023be8f91 [0,2,0,0,0,0|2,0,0]=4 10260 B13R0.280 CCCSCCCCNCC(C)(C)O 4b3704fb43c1dc9bb085fb9c4cdec233 [0,2,0,0,0,0|1,0,0]=3 10261 B13R0.280 CCCSCCCCNCC(C)(F)F 266bb8983d1cd5155d88e89a99adf9b0 [0,2,0,0,0,0|2,0,0]=4 10262 B13R0.280 CCCSCCOCCCC(C)(C)O ad43453d4b2da3af0d55b90c7ece7ed4 [0,2,0,0,0,0|1,0,0]=3 10263 B13R0.280 CCCSCCOCCCC(C)(F)F ce2f79d58c94d93d86b0ab32e2e7db00 [0,2,0,0,0,0|2,0,0]=4 10264 B13R0.280 CCOCCCNCCCC(C)(C)C 714a02f4a5c4feea3fd10be4f87c2c8d [0,2,0,0,0,0|2,0,0]=4 10265 B13R0.280 CCOCCCNCCCC(C)(C)O f12acbe62a1af1ae294a797b364c49db [0,2,0,0,0,0|1,0,0]=3 10266 B13R0.280 CCOCCCNCCCC(C)(F)F 4334ca5e76d34ca7e3b1660849cdd158 [0,2,0,0,0,0|2,0,0]=4 10267 B13R0.280 CCOCCCOCCCC(C)(C)C 452325bd3fb942e0c3c3a063290dfce1 [0,2,0,0,0,0|2,0,0]=4 10268 B13R0.280 CCOCCCOCCCC(C)(C)O 5910309c584fa37382e9a1d959010efd [0,2,0,0,0,0|1,0,0]=3 10269 B13R0.280 CCOCCCOCCCC(C)(F)F 3d7a2a9d30b212533de10a2e0058a4ac [0,2,0,0,0,0|2,0,0]=4 10270 B13R0.280 CCOCCOCCCCC(C)(C)C e36e3da9a9c0bb3ccf8f905a669bbd67 [0,2,0,0,0,0|2,0,0]=4 10271 B13R0.280 CCOCCOCCNCC(C)(C)O 8668a4004a40bb3997f6e5cc25511879 [0,2,0,0,0,0|2,0,0]=4 10272 B13R0.280 CCOCCOCCOCC(C)(C)O 237c71f5ee84cbd5ce9010bf181ada11 [0,2,0,0,0,0|2,0,0]=4 10273 B13R0.280 CCSCCCCNCCC(C)(C)C 97ebd8cf87be376483f096442d411402 [0,2,0,0,0,0|2,0,0]=4 10274 B13R0.280 CCSCCCCNCCC(C)(C)O 562fef1e0aae98d13e4f1661bc4b7343 [0,2,0,0,0,0|1,0,0]=3 10275 B13R0.280 CCSCCCCNCCC(C)(F)F a6785bad7cb605bd1f3dd3327f3b583c [0,2,0,0,0,0|2,0,0]=4 10276 B13R0.280 CCSCCCNCCCC(C)(C)C a82b9980a6f616210ebf8408c7910b8a [0,2,0,0,0,0|2,0,0]=4 10277 B13R0.280 CCSCCCNCCCC(C)(C)O 96d2067a3a7247de9cd5754ae8aecd25 [0,2,0,0,0,0|1,0,0]=3 10278 B13R0.280 CCSCCCOCCCC(C)(C)C 09a7c3730e231daf72e7d544a82b2597 [0,2,0,0,0,0|2,0,0]=4 10279 B13R0.280 CCSCCCOCCCC(C)(C)O c5e8c7bf62592f8fcf64f6eee07bd9b6 [0,2,0,0,0,0|1,0,0]=3 10280 B13R0.280 CCSCCCOCCCC(C)(F)F 97e7e2734841d3dea03ec23e8f19f743 [0,2,0,0,0,0|2,0,0]=4 10281 B13R0.280 CCSCCOCCCCC(C)(C)C b4a84a2a8fdfa5b2a0389112be497499 [0,2,0,0,0,0|2,0,0]=4 10282 B13R0.280 COCCCCCCNCC(C)(C)C 81aacfe58ed4a1a3dcb12f9addc8f7ab [0,2,0,0,0,0|2,0,0]=4 10283 B13R0.280 COCCCCCCNCC(C)(C)O 0234902908fb42064c2b2347561af624 [0,2,0,0,0,0|1,0,0]=3 10284 B13R0.280 COCCCCCCNCC(C)(F)F fae2b13e0b0a2cd6e1d58a49b110e56d [0,2,0,0,0,0|2,0,0]=4 10285 B13R0.280 COCCCCCCOCC(C)(C)Br a7829e50e056bdd90e8265c9d053100e [0,2,0,0,0,0|2,0,0]=4 10286 B13R0.280 COCCCCCCOCC(C)(C)C b9486d906234771cbfe03719764a6bb3 [0,2,0,0,0,0|2,0,0]=4 10287 B13R0.280 COCCCCCCOCC(C)(C)F 1936c65837082954b06ad42c9cc4a9ab [0,2,0,0,0,0|2,0,0]=4 10288 B13R0.280 COCCCCCCOCC(C)(C)O af1d500df4894079fc03e7022febd590 [0,2,0,0,0,0|1,0,0]=3 10289 B13R0.280 COCCCCCCOCC(C)(C)S 562efa850e20e1535078eb690f108f4f [0,2,0,0,0,0|1,1,0]=4 10290 B13R0.280 COCCCCCCOCC(C)(F)F 1900654cc7f06fd386273ba68680bd7a [0,2,0,0,0,0|2,0,0]=4 10291 B13R0.280 COCCCCCNCCC(C)(C)C 7c428cd2489f5647ac56db28895431b0 [0,2,0,0,0,0|2,0,0]=4 10292 B13R0.280 COCCCCCNCCC(C)(C)F a2acb692c5cd1a9181f16629fee8848b [0,2,0,0,0,0|2,0,0]=4 10293 B13R0.280 COCCCCCNCCC(C)(C)O e08f795f47a0297f496e34690992fd37 [0,2,0,0,0,0|1,0,0]=3 10294 B13R0.280 COCCCCCNCCC(C)(F)F dbc4de9a33edae0ee41d0c6f2fabcb5f [0,2,0,0,0,0|2,0,0]=4 10295 B13R0.280 COCCCCCOCCC(C)(C)C dea3d47271784f5aaa68e40cb5944e22 [0,2,0,0,0,0|2,0,0]=4 10296 B13R0.280 COCCCCCOCCC(C)(C)S 333496fe75baa0b34224e44889a1f9af [0,2,0,0,0,0|1,1,0]=4 10297 B13R0.280 COCCCCCOCCC(C)(F)F 4db94ab39f4e9a62cdb51787dfc0de22 [0,2,0,0,0,0|2,0,0]=4 10298 B13R0.280 COCCCCNCCCC(C)(C)C cfc5bf06c97d9e836c640093f6d0c608 [0,2,0,0,0,0|2,0,0]=4 10299 B13R0.280 COCCCCNCCCC(C)(C)O 6b7ebdab28b533bb0576fdc092f75f85 [0,2,0,0,0,0|1,0,0]=3 10300 B13R0.280 COCCCCNCCCC(C)(F)F 2e45200c0dba8fa60b6bc10dbd592fe3 [0,2,0,0,0,0|2,0,0]=4 10301 B13R0.280 COCCCCOCCCC(C)(C)C ff7b418b7aeaf21a6d4d7e0361550511 [0,2,0,0,0,0|2,0,0]=4 10302 B13R0.280 COCCCCOCCCC(C)(C)O 8a319fd57b4220accd683913e205031c [0,2,0,0,0,0|1,0,0]=3 10303 B13R0.280 COCCCCOCCCC(C)(F)F 3ed97b1197135a58a573699e66d80169 [0,2,0,0,0,0|2,0,0]=4 10304 B13R0.280 COCCCOCCCCC(C)(C)C cceb85405d327fe41f8415790e6f4cee [0,2,0,0,0,0|2,0,0]=4 10305 B13R0.280 COCCNCCCCCC(C)(C)O ad574de8cde8b6ce04938d13604763cf [0,2,0,0,0,0|1,0,0]=3 10306 B13R0.280 COCCOCCCCCC(C)(C)O ed23ec453d5b884719a1d8a7d6774c44 [0,2,0,0,0,0|1,0,0]=3 10307 B13R0.280 COCCOCCCNCC(C)(C)O 7a868d7fb7ea7a24c89e189f4c3b8e43 [0,2,0,0,0,0|2,0,0]=4 10308 B13R0.280 COCCOCCCOCC(C)(C)O 81b1006a95e1be876a72b72dd12300fb [0,2,0,0,0,0|2,0,0]=4 10309 B13R0.280 COCCOCCNCCC(C)(C)O 930533da3e024ad7732ec31170168bff [0,2,0,0,0,0|2,0,0]=4 10310 B13R0.280 COCCOCCOCCC(C)(C)O c3e6d59c810c57f7150f46948bcf9bc7 [0,2,0,0,0,0|2,0,0]=4 10311 B13R0.280 COCCOCNCCCC(C)(C)O 1d6014a8848283fb57ac39b61ea4b355 [0,2,0,0,0,0|2,0,0]=4 10312 B13R0.280 COCOCCCCCCC(C)(C)C 1d8975ac5af0b9dba446010f957465ca [0,2,0,0,0,0|2,0,0]=4 10313 B13R0.280 COCOCCNCCCC(C)(C)O f1041e99ce296a60d94a45b1da2bfc6f [0,2,0,0,0,0|2,0,0]=4 10314 B13R0.280 CSCCCCNCCCC(C)(C)O 41f37efb684de17e154f7f517e54797a [0,2,0,0,0,0|1,0,0]=3 10315 B13R0.280 CSCCCCNCCCC(C)(F)F 1ade7d6b325a48549e436b4aa1bbb9bb [0,2,0,0,0,0|2,0,0]=4 10316 B13R0.280 CSCCCCOCCCC(C)(C)O a4f43d74a077c2856933aed6685f31ec [0,2,0,0,0,0|1,0,0]=3 10317 B13R0.280 CSCCCCOCCCC(C)(F)F 4abfb596c82df178556ac1538a5f16d9 [0,2,0,0,0,0|2,0,0]=4 10318 B13R0.280 CSCCCOCCCCC(C)(C)C 91f39e34b00b57ea703a52fd3ed6dc1b [0,2,0,0,0,0|2,0,0]=4 10319 B13R0.280 CSCCNCCCCCC(C)(C)O 537da175376454ebbd9c586bfe11470b [0,2,0,0,0,0|1,0,0]=3 10320 B13R0.280 CSCCOCCCCCC(C)(C)O 723fb54cf5d07ebb82b1c392df9023f7 [0,2,0,0,0,0|1,0,0]=3 10321 B13R0.280 CSCCOCCCNCC(C)(C)O cc90a2b177d1afc177de24812136ed67 [0,2,0,0,0,0|2,0,0]=4 10322 B13R0.280 CSCOCCCCCCC(C)(C)C 937f40c9a3eb31cac91d91d2871dbe16 [0,2,0,0,0,0|2,0,0]=4 10323 B13R0.431 CC(C)(O)CCCNCCC(O)CO a15c6d443babd7411c2df1d44ee5b997 [0,2,0,0,0,0|2,0,0]=4 10324 B13R0.431 CC(CF)OCCCCCC(C)(C)O c7f975173915d10aaaf43cf3534e9408 [0,2,0,0,0,0|2,0,0]=4 10325 B13R0.431 CC(CO)CCCNCCC(C)(C)O fb51644e493f6fa37a77f645b050596a [0,2,0,0,0,0|2,0,0]=4 10326 B13R0.431 CC(CO)CCNCCCC(C)(C)O c738ee2cc3226886af19589e1bcf9983 [0,2,0,0,0,0|2,0,0]=4 10327 B13R0.431 CC(CO)NCCCCCC(C)(C)O fa7cbdac1263fd3db360608a31cb125f [0,2,0,0,0,0|2,0,0]=4 10328 B13R0.431 CC(CS)OCCCCCC(C)(C)O f699acd77481907f9f94ec4d3f3e5685 [0,2,0,0,0,0|2,0,0]=4 10329 B13R0.431 CCC(=O)CCCCNCC(C)(C)O 69ef1c52561c7330526f3c98c87434ef [0,2,0,0,0,0|1,0,1]=4 10330 B13R0.431 CCC(C)CCCCOCC(C)(C)C 3a86046bb6cd4871943347564ead3b1a [0,2,0,0,0,0|2,0,0]=4 10331 B13R0.431 CCC(C)CCCCOCC(C)(C)F 7d536179dc7e3cadf6bfb43f9a03c72c [0,2,0,0,0,0|2,0,0]=4 10332 B13R0.431 CCC(C)CCCCOCC(C)(C)O d045708e10bdd9d8fc322d39a31f9367 [0,2,0,0,0,0|1,0,0]=3 10333 B13R0.431 CCC(C)CCCCOCC(C)(F)F 001326eb04f42f4f857bd5ee7d48e9c3 [0,2,0,0,0,0|2,0,0]=4 10334 B13R0.431 CCC(C)CCCOCCC(C)(C)C d50164ca24f26edd6663b2bac8eb7e2c [0,2,0,0,0,0|2,0,0]=4 10335 B13R0.431 CCC(C)CCCOCCC(C)(C)O dcad63b2dd273c988de5a55d2fddb11b [0,2,0,0,0,0|1,0,0]=3 10336 B13R0.431 CCC(C)CCCOCCC(C)(F)F ee91988bb8a6e9704050e969080cf5f8 [0,2,0,0,0,0|2,0,0]=4 10337 B13R0.431 CCC(C)CCNCCCC(C)(C)C f98da0600c328136918fb68e48bd9fad [0,2,0,0,0,0|2,0,0]=4 10338 B13R0.431 CCC(C)CCNCCCC(C)(C)O 8694dbc64c920be6c13624aebe7355bf [0,2,0,0,0,0|1,0,0]=3 10339 B13R0.431 CCC(C)CCNCCCC(C)(F)F 40cd6b01f8ff74ba7530ddbb134ae9d4 [0,2,0,0,0,0|2,0,0]=4 10340 B13R0.431 CCC(C)CCOCCCC(C)(C)C 71391a9a621bd631b70bceeeca0f9e8a [0,2,0,0,0,0|2,0,0]=4 10341 B13R0.431 CCC(C)CCOCCCC(C)(C)O ecb2d35072bdc42575eb1e1cee3a9aea [0,2,0,0,0,0|1,0,0]=3 10342 B13R0.431 CCC(C)CCOCCCC(C)(F)F 71bb4693489f084b77a4855f66064374 [0,2,0,0,0,0|2,0,0]=4 10343 B13R0.431 CCC(C)COCCCCC(C)(C)C fcca5e04ebed70989ba23fa51a931699 [0,2,0,0,0,0|2,0,0]=4 10344 B13R0.431 CCC(C)NCCCCCC(C)(C)O f44b5e0367afa10dd586fc133a305dbd [0,2,0,0,0,0|1,0,0]=3 10345 B13R0.431 CCC(C)OCCCCCC(C)(C)O 9341dc559232f45e0019d34f74925f53 [0,2,0,0,0,0|1,0,0]=3 10346 B13R0.431 CCC(S)CCOCCCC(C)(C)O b3a6fd7261168fcce75c5e2d8cfaebd6 [0,2,0,0,0,0|1,0,0]=3 10347 B13R0.431 CCC(S)CCOCCCC(C)(F)F 4b1f96e6d91ee2c0df2d753816ed0738 [0,2,0,0,0,0|2,0,0]=4 10348 B13R0.431 CCN(C)CCCNCCC(C)(C)O 19bee8e6dc49d607b52c7a50c4b62b40 [0,2,0,0,0,0|2,0,0]=4 10349 B13R0.431 CCN(C)CCCOCCC(C)(C)O 481513aad4f73546c570bf3aaa70d05b [0,2,0,0,0,0|2,0,0]=4 10350 B13R0.431 CCS(=O)CCNCCCC(C)(C)O 0ad4f2f1aac616b3d82c69bdadabb0c0 [0,2,0,0,0,0|2,0,0]=4 10351 B13R0.431 CC[C@@H](C)COCCCCC(C)(C)C bfe5e0b8d76992897701a2b8fa7767d5 [0,2,0,0,0,0|2,0,0]=4 10352 B13R0.431 CC[C@@H](C)NCCCCCC(C)(C)O b3b474c311d100b34c62ebd7a56425ad [0,2,0,0,0,0|1,0,0]=3 10353 B13R0.431 CC[C@@H](C)OCCCCCC(C)(C)O bbbebedb452988c0922228814b88efa2 [0,2,0,0,0,0|1,0,0]=3 10354 B13R0.431 CC[C@H](C)CCCCOCC(C)(C)C b4e8da2d20d465d624c781293400e240 [0,2,0,0,0,0|2,0,0]=4 10355 B13R0.431 CC[C@H](C)CCCCOCC(C)(C)F 991c935016a22367a3b8524107ae715b [0,2,0,0,0,0|2,0,0]=4 10356 B13R0.431 CC[C@H](C)CCCCOCC(C)(C)O 8b31d29b7918ad15b7797e69fd41fdc6 [0,2,0,0,0,0|1,0,0]=3 10357 B13R0.431 CC[C@H](C)CCCCOCC(C)(F)F 390376d823ac76e7694698c1300028d5 [0,2,0,0,0,0|2,0,0]=4 10358 B13R0.431 CC[C@H](C)CCCOCCC(C)(C)C f73afc20de714590ff246252c272d56f [0,2,0,0,0,0|2,0,0]=4 10359 B13R0.431 CC[C@H](C)CCCOCCC(C)(C)O 2bb2237f9ecd9695ec6abed88a2d287f [0,2,0,0,0,0|1,0,0]=3 10360 B13R0.431 CC[C@H](C)CCCOCCC(C)(F)F df38071ff7f63fcfc3da0d003dd2bccd [0,2,0,0,0,0|2,0,0]=4 10361 B13R0.431 CC[C@H](C)CCOCCCC(C)(C)O 4bc1a5bfe04b61024b8c47835adb54ba [0,2,0,0,0,0|1,0,0]=3 10362 B13R0.431 CC[C@H](C)CCOCCCC(C)(F)F 9bd31ac47a48133962c3bbfbebaa4f34 [0,2,0,0,0,0|2,0,0]=4 10363 B13R0.431 CC[C@H](C)COCCCCC(C)(C)C f2e87e28ed3e71020b6c5891c80bba83 [0,2,0,0,0,0|2,0,0]=4 10364 B13R0.431 CC[C@H](C)NCCCCCC(C)(C)O ebda751057a8953039746333538713f4 [0,2,0,0,0,0|1,0,0]=3 10365 B13R0.431 CC[C@H](C)OCCCCCC(C)(C)O b77ac7e55e154b31c879bd46d302ab2b [0,2,0,0,0,0|1,0,0]=3 10366 B13R0.431 COC(C)CCOCCCC(C)(C)O 9b51bd4eba99ffbd539f70110c3a2b40 [0,2,0,0,0,0|2,0,0]=4 10367 B13R0.431 C[C@@H](CO)CCNCCCC(C)(C)O 87f42af0e1e144bcb7083de8d8d6ddfc [0,2,0,0,0,0|2,0,0]=4 10368 B13R0.431 C[C@@H](CO)NCCCCCC(C)(C)O c837d3f0f4601528be81c09119477435 [0,2,0,0,0,0|2,0,0]=4 10369 B13R0.431 C[C@H](CO)NCCCCCC(C)(C)O 086a040ef0d3eff0c5b69c9dca829ba2 [0,2,0,0,0,0|2,0,0]=4 10370 B13R0.431 C[C@H](CS)OCCCCCC(C)(C)O e84f00d2e99bfea1ea2613b942ae5c07 [0,2,0,0,0,0|2,0,0]=4 10371 B13R0.442 C=C(C)CCCNCCCC(C)(C)O 67a94b9594adea12b109ffff445494a0 [0,2,0,0,0,0|1,0,1]=4 10372 B13R0.442 C=C(C)CCCOCCCC(C)(C)O dfddcfdab1a21268647c2c15687c6ea1 [0,2,0,0,0,0|1,0,1]=4 10373 B13R0.442 C=C(C)CNCCCCCC(C)(C)O c064c070e5912d937f28c67cc8b99235 [0,2,0,0,0,0|1,0,1]=4 10374 B13R0.442 C=C(C)COCCCCCC(C)(C)O b645ff4775b19c1961058c46ef010b4f [0,2,0,0,0,0|1,0,1]=4 10375 B13R0.442 CC(=O)CCCCCNCC(C)(C)O cb485a8af226f7045032276760538cea [0,2,0,0,0,0|1,0,1]=4 10376 B13R0.442 CC(=O)CCCCNCCC(C)(C)O c216d1fc4af23e65f799463490bf2542 [0,2,0,0,0,0|1,0,1]=4 10377 B13R0.442 CC(=O)CCCCOCCC(C)(C)O 27d1e4880246cfb026afa958a6cc94d9 [0,2,0,0,0,0|1,0,1]=4 10378 B13R0.442 CC(=O)CCCNCCCC(C)(C)O 8c8f6444727287ea036c4b9cf7772252 [0,2,0,0,0,0|1,0,1]=4 10379 B13R0.442 CC(=O)CCCOCCCC(C)(C)O e1e61fa19eb9c85a01569ceac6bbc8e8 [0,2,0,0,0,0|1,0,1]=4 10380 B13R0.442 CC(=O)CNCCCCCC(C)(C)O 0ee8a26b629eacd80560e66eb2ecc233 [0,2,0,0,0,0|1,0,1]=4 10381 B13R0.442 CC(=O)COCCCCCC(C)(C)O 563c9c1218f05c3a780f68d3d7ead02b [0,2,0,0,0,0|1,0,1]=4 10382 B13R0.442 CC(C)(O)CCCCCNCC(F)F c8116acfb132661dd32c869d1c98d5e8 [0,2,0,0,0,0|2,0,0]=4 10383 B13R0.442 CC(C)(O)CCCCCOCC(F)F 1e77700ec41e3d003c3bf5f0e88f23a2 [0,2,0,0,0,0|2,0,0]=4 10384 B13R0.442 CC(C)(O)CCNCCCCC(F)F b37341f86e3a000fe61ae341efe8c25f [0,2,0,0,0,0|2,0,0]=4 10385 B13R0.442 CC(C)(O)CNCCCCCC(F)F e323cdbd4a5a093e694369bfb154141f [0,2,0,0,0,0|2,0,0]=4 10386 B13R0.442 CC(C)CCCCCNCC(C)(C)C 3143b4ac4020aa10117dda7ebb9dd741 [0,2,0,0,0,0|2,0,0]=4 10387 B13R0.442 CC(C)CCCCCNCC(C)(C)F 9bf9d5f9070a3aad4329f72b3b0b4a59 [0,2,0,0,0,0|2,0,0]=4 10388 B13R0.442 CC(C)CCCCCNCC(C)(C)O 82f5f194ec5a4a8ac1fa16da04a44af8 [0,2,0,0,0,0|1,0,0]=3 10389 B13R0.442 CC(C)CCCCCNCC(C)(F)F d32ed96f68ea7d4047bca266fc524710 [0,2,0,0,0,0|2,0,0]=4 10390 B13R0.442 CC(C)CCCCCOCC(C)(C)Br 579a51b96bd05fa994e1599ab942f696 [0,2,0,0,0,0|2,0,0]=4 10391 B13R0.442 CC(C)CCCCCOCC(C)(C)C 76a2673c3867822820706c7cdc2789ab [0,2,0,0,0,0|2,0,0]=4 10392 B13R0.442 CC(C)CCCCCOCC(C)(C)F b83e72ed563a50eed55f75dbd1fb1823 [0,2,0,0,0,0|2,0,0]=4 10393 B13R0.442 CC(C)CCCCCOCC(C)(C)O 2569c53e71a123cddec991c86658b421 [0,2,0,0,0,0|1,0,0]=3 10394 B13R0.442 CC(C)CCCCCOCC(C)(C)S 57d4f63649fde50f958df742ab9e3823 [0,2,0,0,0,0|1,1,0]=4 10395 B13R0.442 CC(C)CCCCCOCC(C)(F)F 1825779bc3769130bb7f04de4d1f219c [0,2,0,0,0,0|2,0,0]=4 10396 B13R0.442 CC(C)CCCCNCCC(C)(C)C 33ca699607c9d6225c94860ce8f8e7f0 [0,2,0,0,0,0|2,0,0]=4 10397 B13R0.442 CC(C)CCCCNCCC(C)(C)F eaaffa6e6d92af2d4c97610376148b1b [0,2,0,0,0,0|2,0,0]=4 10398 B13R0.442 CC(C)CCCCNCCC(C)(C)O dce44d4e7a675930364c5610edbcfdbf [0,2,0,0,0,0|1,0,0]=3 10399 B13R0.442 CC(C)CCCCOCCC(C)(C)C cc31e546aa2238b64523ea8d8cbe00f8 [0,2,0,0,0,0|2,0,0]=4 10400 B13R0.442 CC(C)CCCCOCCC(C)(C)O 84b8f71f78c7fba782f627b6bce25e10 [0,2,0,0,0,0|1,0,0]=3 10401 B13R0.442 CC(C)CCCCOCCC(C)(C)S 6972ed3c3f27d16fea508edd2520aabd [0,2,0,0,0,0|1,1,0]=4 10402 B13R0.442 CC(C)CCCCOCCC(C)(F)F b5902c169ac24cdf907b0af37b14be3f [0,2,0,0,0,0|2,0,0]=4 10403 B13R0.442 CC(C)CCCNCCCC(C)(C)C 482d22d6082fa9fa3258118f78e7cf8b [0,2,0,0,0,0|2,0,0]=4 10404 B13R0.442 CC(C)CCCNCCCC(C)(C)O 72bb55f886c56330377a02e5e02ae74f [0,2,0,0,0,0|1,0,0]=3 10405 B13R0.442 CC(C)CCCNCCCC(C)(F)F 3934932be41d2ffb53c38aec489d6261 [0,2,0,0,0,0|2,0,0]=4 10406 B13R0.442 CC(C)CCCOCCCC(C)(C)C 86aca6ee30698ea814485e724b9a5a21 [0,2,0,0,0,0|2,0,0]=4 10407 B13R0.442 CC(C)CCCOCCCC(C)(C)O 332e4a6ae020a355542fb7702d57b59d [0,2,0,0,0,0|1,0,0]=3 10408 B13R0.442 CC(C)CCCOCCCC(C)(F)F daf48f5832c3ade75d95587ed6bc6049 [0,2,0,0,0,0|2,0,0]=4 10409 B13R0.442 CC(C)CCOCCCCC(C)(C)C bb0ffdd98c83c8e11a5dba2399d3c613 [0,2,0,0,0,0|2,0,0]=4 10410 B13R0.442 CC(C)CNCCCCCC(C)(C)O b9e87256a3257e58bd7f2c3124d36872 [0,2,0,0,0,0|1,0,0]=3 10411 B13R0.442 CC(C)COCCCCCC(C)(C)O 5375f182f67bbebe17b9feb088b3bdf5 [0,2,0,0,0,0|1,0,0]=3 10412 B13R0.442 CC(C)COCCCNCC(C)(C)O 0ee525f0ad94e37db313627da564b258 [0,2,0,0,0,0|2,0,0]=4 10413 B13R0.442 CC(C)COCCCOCC(C)(C)O 37f3b5bada5e9cb3e7e758476997b4b3 [0,2,0,0,0,0|2,0,0]=4 10414 B13R0.442 CC(C)COCCNCCC(C)(C)O 705f89f89524e648bab7e330108a80a8 [0,2,0,0,0,0|2,0,0]=4 10415 B13R0.442 CC(C)COCCOCCC(C)(C)O 16cbc9834578a9121851a2cb19709a2a [0,2,0,0,0,0|2,0,0]=4 10416 B13R0.442 CC(C)CSCCCOCC(C)(C)O 99fbde4acb1ad7094611dc089b531a37 [0,2,0,0,0,0|2,0,0]=4 10417 B13R0.442 CC(C)CSCCOCCC(C)(C)O c2e1d5ba66a6345a01a5886cba847db7 [0,2,0,0,0,0|2,0,0]=4 10418 B13R0.442 CC(C)OCCCCCCC(C)(C)C 5c203aedc49112520304fccd5ef4901f [0,2,0,0,0,0|2,0,0]=4 10419 B13R0.442 CC(C)OCCCNCCC(C)(C)O 4e0bc7ed4da9a2dbf967acf817f40c98 [0,2,0,0,0,0|2,0,0]=4 10420 B13R0.442 CC(C)OCCCOCCC(C)(C)O 29d2ff3978fb4492f9a8530b00b08268 [0,2,0,0,0,0|2,0,0]=4 10421 B13R0.442 CC(C)OCCNCCCC(C)(C)O e8cb666e730c9c4d5eafcb73850d6e40 [0,2,0,0,0,0|2,0,0]=4 10422 B13R0.442 CC(C)OCCOCCCC(C)(C)O 24e8d1971b7744a476437f9964c3768a [0,2,0,0,0,0|2,0,0]=4 10423 B13R0.442 CC(C)SCCCNCCC(C)(C)O 44d47ce9f9b0526daaeab67a5767a2d5 [0,2,0,0,0,0|2,0,0]=4 10424 B13R0.442 CC(C)SCCCOCCC(C)(C)O 74e67581a745d8ce1a6da3868a9f7f3a [0,2,0,0,0,0|2,0,0]=4 10425 B13R0.442 CC(C)SCCNCCCC(C)(C)O f9fc38c1848645d10375113049f53629 [0,2,0,0,0,0|2,0,0]=4 10426 B13R0.442 CC(C)SCCOCCCC(C)(C)O 9aada81bf49e069e4a485a412340e227 [0,2,0,0,0,0|2,0,0]=4 10427 B13R0.442 CC(F)COCCCCCC(C)(C)O 7c7179b125e5129550f5256b0b519825 [0,2,0,0,0,0|1,0,0]=3 10428 B13R0.442 CC(O)CCCCNCCC(C)(C)C b508ba686b3e66fde816d8e701662383 [0,2,0,0,0,0|1,0,0]=3 10429 B13R0.442 CC(O)CCCCNCCC(C)(C)F 31f7c21fcbeb3133231d45b7aaf5dfd4 [0,2,0,0,0,0|1,0,0]=3 10430 B13R0.442 CC(O)CCCCNCCC(C)(C)O 0782476c2f7b5c924bda8c5d5a12e5f0 [0,2,0,0,0,0|1,0,0]=3 10431 B13R0.442 CC(O)CCCCNCCC(F)(F)F c0a0ea453117fc905a820e11fa73d0ef [0,2,0,0,0,0|2,0,0]=4 10432 B13R0.442 CC(O)CCCCNCCS(=O)(=O)C 84d9f292ce338d3571c2885731489761 [0,2,0,0,0,0|2,0,0]=4 10433 B13R0.442 CC(O)CCCNCCCC(C)(C)C 1dcc190d03afe588f95697da39f6acdd [0,2,0,0,0,0|1,0,0]=3 10434 B13R0.442 CC(O)CCCNCCCC(C)(C)O b54913fd5ba240f95bc4738fc51cdd78 [0,2,0,0,0,0|1,0,0]=3 10435 B13R0.442 CC(O)CCCNCCCC(F)(F)F ee26bf1e17731aa632fb0917067ef9b3 [0,2,0,0,0,0|2,0,0]=4 10436 B13R0.442 CC(O)CCCNCCCS(=O)(=O)C 469b64544b99c56d4af767bd24eda162 [0,2,0,0,0,0|2,0,0]=4 10437 B13R0.442 CC(O)CCCNCCOC(C)(C)C 919d84e7502012cc6c6fd009c1b4b66a [0,2,0,0,0,0|2,0,0]=4 10438 B13R0.442 CC(O)CCCNCCSC(C)(C)C ce8f3a6fa4cc6983ed249c8c9224c6f9 [0,2,0,0,0,0|2,0,0]=4 10439 B13R0.442 CC(O)CCNCCCCC(F)(F)F 2cf8824fe62532848eb3e7474aac1ff9 [0,2,0,0,0,0|2,0,0]=4 10440 B13R0.442 CC(O)CCNCCCCS(=O)(=O)C a0b4e3d98254da362421c758cf219a2f [0,2,0,0,0,0|2,0,0]=4 10441 B13R0.442 CC(O)CCNCCCOC(C)(C)C ab20272edba918a4c177ac6d55056b63 [0,2,0,0,0,0|2,0,0]=4 10442 B13R0.442 CC(O)CCNCCCSC(C)(C)C c19bfdb9669f52da0936326f07d813b0 [0,2,0,0,0,0|2,0,0]=4 10443 B13R0.442 CC(O)CNCCCCCC(C)(C)O 8f9de92e1a6ecb8d1d9755f57269af20 [0,2,0,0,0,0|1,0,0]=3 10444 B13R0.442 CC(O)CNCCCCCC(F)(F)F e3e5a2db560d04a277df030fa9d655cb [0,2,0,0,0,0|2,0,0]=4 10445 B13R0.442 CC(O)CNCCCCCS(=O)(=O)C 8a8d133f88a5e7b3b916f3758daaeaaf [0,2,0,0,0,0|2,0,0]=4 10446 B13R0.442 CC(S)COCCCCCC(C)(C)O fe745fe5ae03f6420c9ee1e72101ae47 [0,2,0,0,0,0|1,0,0]=3 10447 B13R0.442 CN(C)CCCCCNCC(C)(C)O 5d098a6a6723ecd2512c4374beb24582 [0,2,0,0,0,0|2,0,0]=4 10448 B13R0.442 CN(C)CCCCCOCC(C)(C)O 97f24aceb8143aac95d7917d57ef2db0 [0,2,0,0,0,0|2,0,0]=4 10449 B13R0.442 CN(C)CCCCNCCC(C)(C)O f4bf70989e0b0ef1dba7938cf2aa3277 [0,2,0,0,0,0|2,0,0]=4 10450 B13R0.442 CN(C)CCCCOCCC(C)(C)O 3160051b5ee7410cddd01ecfe2c403c8 [0,2,0,0,0,0|2,0,0]=4 10451 B13R0.442 CN(C)CCCNCCCC(C)(C)O 31e91c0a60040de6ff953d87238c4bb3 [0,2,0,0,0,0|2,0,0]=4 10452 B13R0.442 CN(C)CCCOCCCC(C)(C)O ede8b3a920ab3bd9cedb338bc2ac3f98 [0,2,0,0,0,0|2,0,0]=4 10453 B13R0.442 CS(=O)CCCNCCCC(C)(C)O 69e7c14efcdefd17f5ab1a54b8cf9693 [0,2,0,0,0,0|2,0,0]=4 10454 B13R0.442 C[C@@H](F)COCCCCCC(C)(C)O feebe54b03c5ee6a830648e39db85964 [0,2,0,0,0,0|1,0,0]=3 10455 B13R0.442 C[C@@H](O)CCCCNCCC(C)(C)C 62ae54a8070f39441e6419fc7a57b343 [0,2,0,0,0,0|1,0,0]=3 10456 B13R0.442 C[C@@H](O)CCCCNCCC(C)(C)F c50f1ad8487430bd0ad1f727184243ee [0,2,0,0,0,0|1,0,0]=3 10457 B13R0.442 C[C@@H](O)CCCCNCCC(C)(C)O 30d7bc88d7cb014394fc6fbcfa7246af [0,2,0,0,0,0|1,0,0]=3 10458 B13R0.442 C[C@@H](O)CCCCNCCC(F)(F)F d0f351b748105f04408f155b735e048c [0,2,0,0,0,0|2,0,0]=4 10459 B13R0.442 C[C@@H](O)CCCCNCCS(=O)(=O)C 6bdc56a1aeb7a85c1c2b2b6148c1804e [0,2,0,0,0,0|2,0,0]=4 10460 B13R0.442 C[C@@H](O)CCNCCCCC(F)(F)F d0ae7757ede5d89f5033d8db12c9fc5b [0,2,0,0,0,0|2,0,0]=4 10461 B13R0.442 C[C@@H](O)CCNCCCCS(=O)(=O)C 0a366c39b27210a77e66a0bb5db4b6b2 [0,2,0,0,0,0|2,0,0]=4 10462 B13R0.442 C[C@@H](O)CCNCCCSC(C)(C)C 1e85573b3aedb9a529957a759ba3ad53 [0,2,0,0,0,0|2,0,0]=4 10463 B13R0.442 C[C@@H](O)CNCCCCCC(C)(C)O f1f1f144e1a9dc85d9f024f2aa4a0048 [0,2,0,0,0,0|1,0,0]=3 10464 B13R0.442 C[C@@H](O)CNCCCCCC(F)(F)F 9fe7db2653366e652c88d8ffafa6b8bb [0,2,0,0,0,0|2,0,0]=4 10465 B13R0.442 C[C@@H](O)CNCCCCCS(=O)(=O)C bceee20b342d8efc1b23c8565cf89c0a [0,2,0,0,0,0|2,0,0]=4 10466 B13R0.442 C[C@H](F)COCCCCCC(C)(C)O 535dcd3a45a2c6ae7000b6c23b2a0626 [0,2,0,0,0,0|1,0,0]=3 10467 B13R0.442 C[C@H](O)CCNCCCCC(F)(F)F f1a7a69a947eac8cf5ccf755c01958ac [0,2,0,0,0,0|2,0,0]=4 10468 B13R0.442 C[C@H](O)CCNCCCCS(=O)(=O)C b70889873df7bf683ba3ff5b71d045d7 [0,2,0,0,0,0|2,0,0]=4 10469 B13R0.442 C[C@H](O)CCNCCCSC(C)(C)C 899e3dc04ca6b35273e955fb4d5f8f46 [0,2,0,0,0,0|2,0,0]=4 10470 B13R0.442 C[C@H](O)CNCCCCCC(C)(C)O 723fa39044aea63cd90b6b10a7ec6745 [0,2,0,0,0,0|1,0,0]=3 10471 B13R0.442 C[C@H](O)CNCCCCCC(F)(F)F e43f35c05bcad6dc869fae8d3e69e88c [0,2,0,0,0,0|2,0,0]=4 10472 B13R0.442 C[C@H](O)CNCCCCCS(=O)(=O)C 0da2b2f81742e3bb4473b8f3f45678fb [0,2,0,0,0,0|2,0,0]=4 10473 B13R0.1172 CCCCCCC(=O)NCC(C)(C)O d449da807816301d17384fcbf85bc916 [0,2,0,0,0,0|1,0,1]=4 10474 B13R0.1172 CCCCCCC(C)NCC(C)(C)C ac0f46c7e2e6e1927a80c4ed41c91d4d [0,2,0,0,0,0|2,0,0]=4 10475 B13R0.1172 CCCCCCC(C)NCC(C)(C)F 0ad77778067a48d001b6262d53598f50 [0,2,0,0,0,0|2,0,0]=4 10476 B13R0.1172 CCCCCCC(C)NCC(C)(C)O 1ffc30b26f0ecfb2bcd56d5cbca14575 [0,2,0,0,0,0|1,0,0]=3 10477 B13R0.1172 CCCCCCC(C)NCC(C)(F)F 158cf6511864d5789efec3f18c46b7dc [0,2,0,0,0,0|2,0,0]=4 10478 B13R0.1172 CCCCCCC(C)OCC(C)(C)C e79df21a6f1ad0793383781b7c10c18f [0,2,0,0,0,0|2,0,0]=4 10479 B13R0.1172 CCCCCCC(C)OCC(C)(C)F 05ba1bff97055ddfe2631c6f6ac1934b [0,2,0,0,0,0|2,0,0]=4 10480 B13R0.1172 CCCCCCC(C)OCC(C)(C)O 13c1983026cd8387600c58783b528b03 [0,2,0,0,0,0|1,0,0]=3 10481 B13R0.1172 CCCCCCC(C)OCC(C)(C)S 170d8dcc0a851047d5f531a2304006f2 [0,2,0,0,0,0|1,1,0]=4 10482 B13R0.1172 CCCCCCC(C)OCC(C)(F)F 8363a78fb5c6b9c9ee9dabf96a84ea62 [0,2,0,0,0,0|2,0,0]=4 10483 B13R0.1172 CCCCCCN(C)CCC(C)(C)C 8fca7aed09b2e4e09790a2de9cdd611b [0,2,0,0,0,0|2,0,0]=4 10484 B13R0.1172 CCCCCCN(C)CCC(C)(C)O 304acb007460b8c0def569d6d4d50e58 [0,2,0,0,0,0|1,0,0]=3 10485 B13R0.1172 CCCCCCN(C)CCC(C)(F)F 24408fa8e2fc603708ca91a35a8ecccf [0,2,0,0,0,0|2,0,0]=4 10486 B13R0.1172 CCCCCC[C@@H](C)NCC(C)(C)C b2c6d1583b385ea575f807749399ed65 [0,2,0,0,0,0|2,0,0]=4 10487 B13R0.1172 CCCCCC[C@@H](C)NCC(C)(C)F 79dca94529c88738ef03366af05dc8ff [0,2,0,0,0,0|2,0,0]=4 10488 B13R0.1172 CCCCCC[C@@H](C)NCC(C)(C)O 945aec22edc5d22998ab2bb3b26d8688 [0,2,0,0,0,0|1,0,0]=3 10489 B13R0.1172 CCCCCC[C@@H](C)NCC(C)(F)F 6728e3f71cc60c74bd239265c05ff610 [0,2,0,0,0,0|2,0,0]=4 10490 B13R0.1172 CCCCCC[C@@H](C)OCC(C)(C)C dfd52f1369c1535345ed4ab949485ab2 [0,2,0,0,0,0|2,0,0]=4 10491 B13R0.1172 CCCCCC[C@@H](C)OCC(C)(C)F c6e843b4ddb941de7b7d5f2be40d6bc3 [0,2,0,0,0,0|2,0,0]=4 10492 B13R0.1172 CCCCCC[C@@H](C)OCC(C)(C)O 89af33596b647c0fb494a86893229b8a [0,2,0,0,0,0|1,0,0]=3 10493 B13R0.1172 CCCCCC[C@@H](C)OCC(C)(F)F 82c9ae0e4cf2644939d601e74fb87d40 [0,2,0,0,0,0|2,0,0]=4 10494 B13R0.1172 CCCCCC[C@H](C)NCC(C)(C)C 6f9c04a7158abd830a6edb5a30306241 [0,2,0,0,0,0|2,0,0]=4 10495 B13R0.1172 CCCCCC[C@H](C)NCC(C)(C)F c20bf542ac4b42796da949ecf2479e42 [0,2,0,0,0,0|2,0,0]=4 10496 B13R0.1172 CCCCCC[C@H](C)NCC(C)(C)O 4a149f4fa753c6a4debce2b0be2706b3 [0,2,0,0,0,0|1,0,0]=3 10497 B13R0.1172 CCCCCC[C@H](C)NCC(C)(F)F 00cc79815651c4ee576b863bf2e638c3 [0,2,0,0,0,0|2,0,0]=4 10498 B13R0.1172 CCCCCC[C@H](C)OCC(C)(C)C 71f30d1c68f796d43b237353454f8797 [0,2,0,0,0,0|2,0,0]=4 10499 B13R0.1172 CCCCCC[C@H](C)OCC(C)(C)F 7116cf13a739c4133fccf8dc0cbc1200 [0,2,0,0,0,0|2,0,0]=4 10500 B13R0.1172 CCCCCC[C@H](C)OCC(C)(C)O 5a6d063fd319b983c7ed7e93e989fd5b [0,2,0,0,0,0|1,0,0]=3 10501 B13R0.1172 CCCCCC[C@H](C)OCC(C)(F)F 7f2069cf84a81a42a025d83a33a73757 [0,2,0,0,0,0|2,0,0]=4 10502 B13R0.1172 CCCCCNC(C)CCC(C)(C)C 15a5cb0101efbf8b866c2311d37eca13 [0,2,0,0,0,0|2,0,0]=4 10503 B13R0.1172 CCCCOCC(C)OCC(C)(C)O 876fcef2c5fd6f9bc46e9c2b6bb933bf [0,2,0,0,0,0|2,0,0]=4 10504 B13R0.1172 CCCCOCN(C)CCC(C)(C)O 3a48855451f71e69ca9d6d9be642275d [0,2,0,0,0,0|2,0,0]=4 10505 B13R0.1172 CCCOCCN(C)CCC(C)(C)O ebd17f71bf8d0d689efb5f4c2540350e [0,2,0,0,0,0|2,0,0]=4 10506 B13R0.1172 CCOCCCN(C)CCC(C)(C)O d7219aff95f724c439a0f67a28e4e422 [0,2,0,0,0,0|2,0,0]=4 10507 B13R0.1172 CCSCCCN(C)CCC(C)(C)O 7b8399d0af17870dbf3b9ffa26a617df [0,2,0,0,0,0|2,0,0]=4 10508 B13R0.1172 CN(CCCCCF)CCC(C)(C)O 6fba02935c65ed62df6a0c97e7f65128 [0,2,0,0,0,0|2,0,0]=4 10509 B13R0.1172 CN(CCCCCO)CCC(C)(C)O d393796a1934c499a326bfba55341b74 [0,2,0,0,0,0|2,0,0]=4 10510 B13R0.1172 COCCCCN(C)CCC(C)(C)O ea141ebfa74bdcaf752cd815b78748f7 [0,2,0,0,0,0|2,0,0]=4 10511 B13R0.1215 C#CC(C)(C)COCCCCCCC fa64a06a3a3c8a6796e5088a0005542f [0,2,0,0,0,0|2,0,0]=4 10512 B13R0.1215 C#CC(C)(C)NCCCCCCCC feef29c8f5d80b591de8f8f058467da6 [0,2,0,0,0,0|2,0,0]=4 10513 B13R0.1215 C=CC(C)(C)CCCNCCCCC fbddad3ad50665f40d8363dce6197d5b [0,2,0,0,0,0|2,0,0]=4 10514 B13R0.1215 C=CC(C)(C)COCCCCCCC 38af403e1db23d27d3cb94225fd56756 [0,2,0,0,0,0|2,0,0]=4 10515 B13R0.1215 CC(C)(CO)CCCNCCCCF cd99a791dcf72b67f0613d5b2b0c153f [0,2,0,0,0,0|2,0,0]=4 10516 B13R0.1215 CC(C)(CO)CCCNCCCCO 0c67c6768479950c7d2ea693a9039ce7 [0,2,0,0,0,0|2,0,0]=4 10517 B13R0.1215 CC(C)(CO)CNCCCCCCCl 2624ad31067998982441b555b5c0f889 [0,2,0,0,0,0|2,0,0]=4 10518 B13R0.1215 CC(C)(CO)CNCCCCCCF 273305a853d7c3ca152dc19b01fb3df6 [0,2,0,0,0,0|2,0,0]=4 10519 B13R0.1215 CC(C)(CO)CNCCCCCCO 020819df6d8e433f75493be41d5e31f5 [0,2,0,0,0,0|2,0,0]=4 10520 B13R0.1215 CC(C)(CO)NCCCCCCCO b3af367726d19d6c2b9929ed0ad69561 [0,2,0,0,0,0|2,0,0]=4 10521 B13R0.1215 CCC(C)(O)CNCCCCCCF 3e4338311138ed1b24499ba702bfc665 [0,2,0,0,0,0|2,0,0]=4 10522 B13R0.1215 CCC(C)(O)CNCCCCCCO c331ccd1f1f3f197e433995f64b20688 [0,2,0,0,0,0|2,0,0]=4 10523 B13R0.1215 CCC(C)(O)CNCCCCCOC 80ec3ce3547438ec26a355b32eb48133 [0,2,0,0,0,0|2,0,0]=4 10524 B13R0.1215 CCCCCCCCNC(C)(C)C#N 06dbb831e4f841b71e08065007ea5de6 [0,2,0,0,0,0|2,0,0]=4 10525 B13R0.1215 CCCCCCCCNC(C)(C)CC 5e394ca59476827c1f61ddc1bb1c7d7b [0,2,0,0,0,0|2,0,0]=4 10526 B13R0.1215 CCCCCCCCNC(C)(C)CF 78d323669db07106c344ee4f58fee9a3 [0,2,0,0,0,0|2,0,0]=4 10527 B13R0.1215 CCCCCCCCNC(C)(C)CO ef76c2def9f9407a31b3b60b15a3e378 [0,2,0,0,0,0|1,0,0]=3 10528 B13R0.1215 CCCCCCCNCC(C)(C)C#N 3e58e5a94e56019445e5358f91ce3a67 [0,2,0,0,0,0|2,0,0]=4 10529 B13R0.1215 CCCCCCCNCC(C)(C)CC b277456394efbdea429975cce94f55ec [0,2,0,0,0,0|2,0,0]=4 10530 B13R0.1215 CCCCCCCNCC(C)(C)CF cdfa888387717ed31e82336b33f66e9c [0,2,0,0,0,0|2,0,0]=4 10531 B13R0.1215 CCCCCCCNCC(C)(C)CO f0d567e6b9268eb02012e5abad3baf79 [0,2,0,0,0,0|1,0,0]=3 10532 B13R0.1215 CCCCCCCNCC(C)(C)OC 2ba5ed03b1d03d0823b57e9b9b976f39 [0,2,0,0,0,0|1,0,0]=3 10533 B13R0.1215 CCCCCCCNCC(C)(O)CC 0a84e57132e63e6d354950305583c0a9 [0,2,0,0,0,0|1,0,0]=3 10534 B13R0.1215 CCCCCCCOCC(C)(C)C#N 8564f8fc40e100724206d72897771e9d [0,2,0,0,0,0|2,0,0]=4 10535 B13R0.1215 CCCCCCCOCC(C)(C)C=O 36f7b8b062e2a83e023036025a57dd42 [0,2,0,0,0,0|1,0,1]=4 10536 B13R0.1215 CCCCCCCOCC(C)(C)CF 1d54ab7cfb651ebfd46544c974ed72ba [0,2,0,0,0,0|2,0,0]=4 10537 B13R0.1215 CCCCCCCOCC(C)(C)OC fad2c78943f76b16c273672598114097 [0,2,0,0,0,0|1,0,0]=3 10538 B13R0.1215 CCCCCCCOCC(F)(F)CC ab8a05f887e27758dfc52053dee913b0 [0,2,0,0,0,0|2,0,0]=4 10539 B13R0.1215 CCCCCCNCCC(C)(C)CC 3d61401825da6ab928b1e571cba2ea72 [0,2,0,0,0,0|2,0,0]=4 10540 B13R0.1215 CCCCCCNCCC(C)(C)OC 0ac972e65a9fb4e42e6fc69efbc5ff63 [0,2,0,0,0,0|1,0,0]=3 10541 B13R0.1215 CCCCCCNCCC(F)(F)CO 7043990dadbe02289b118eb689b9c21d [0,2,0,0,0,0|2,0,0]=4 10542 B13R0.1215 CCCCCCOCCC(C)(C)C#N ede1b64b69da379c8ca55aa1071cc0a6 [0,2,0,0,0,0|2,0,0]=4 10543 B13R0.1215 CCCCCCOCCC(C)(C)CC 1bea5e91fb3a9e3508dbd73dba8f8100 [0,2,0,0,0,0|2,0,0]=4 10544 B13R0.1215 CCCCCCOCCC(C)(C)OC 52afc4b0d714c99445b6ebdbdc2eef62 [0,2,0,0,0,0|1,0,0]=3 10545 B13R0.1215 CCCCCNCCCC(C)(C)C#N c2e10754852068a24fdd69704bb4c66b [0,2,0,0,0,0|2,0,0]=4 10546 B13R0.1215 CCCCCNCCCC(C)(C)C=O 42bfad31b00f2d1300f34c94dca2ebd8 [0,2,0,0,0,0|1,0,1]=4 10547 B13R0.1215 CCCCCNCCCC(C)(C)CO 5a4c6c4226d30513e6bc2d13b68e35b9 [0,2,0,0,0,0|1,0,0]=3 10548 B13R0.1215 CCCCCOCCCC(C)(C)C#N ced1234e290b697259c75a3b6c800699 [0,2,0,0,0,0|2,0,0]=4 10549 B13R0.1215 CCCCCOCCCC(C)(C)C=O 621f74f3130a7eba066284c2ab7577b1 [0,2,0,0,0,0|1,0,1]=4 10550 B13R0.1215 CCCCOCCNCC(C)(C)CO 20ac7e0474827b3c943e52c8190109d6 [0,2,0,0,0,0|2,0,0]=4 10551 B13R0.1215 CCCCOCCNCC(C)(C)OC c27a77d6d9ad91e13da07458f62e8272 [0,2,0,0,0,0|2,0,0]=4 10552 B13R0.1215 CCCCOCCNCC(C)(O)CC 6df2d4ce9232c269a0ab2c00fc07bd4f [0,2,0,0,0,0|2,0,0]=4 10553 B13R0.1215 CCCCOCCOCC(C)(C)OC 9cc5fa2ddad001fb683fb4fe0bf1001a [0,2,0,0,0,0|2,0,0]=4 10554 B13R0.1215 CCCCOCNCCC(C)(C)OC 5656a3741313cb16fa2e797a1d77c897 [0,2,0,0,0,0|2,0,0]=4 10555 B13R0.1215 CCCCOCOCCC(C)(C)OC 362ef58867f8cfcbefe037367dd0a2db [0,2,0,0,0,0|2,0,0]=4 10556 B13R0.1215 CCCCSCCOCC(C)(C)OC 10122298cc480e9a61ae82205e73bf8c [0,2,0,0,0,0|2,0,0]=4 10557 B13R0.1215 CCCOCCCNCC(C)(C)CO 9ac04635de4dbd7dc4dbf129ddc54b7f [0,2,0,0,0,0|2,0,0]=4 10558 B13R0.1215 CCCOCCCNCC(C)(C)OC 537bdf248ad618dd5d7a10fd74aa011d [0,2,0,0,0,0|2,0,0]=4 10559 B13R0.1215 CCCOCCCNCC(C)(O)CC 891593484d41cee9cbd8b2f7f52cad46 [0,2,0,0,0,0|2,0,0]=4 10560 B13R0.1215 CCCOCCCOCC(C)(C)OC faff11f8f6e36e37526940287bb01100 [0,2,0,0,0,0|2,0,0]=4 10561 B13R0.1215 CCCOCCNCCC(C)(C)OC fc2ffd7ee20ef35ab7e294acf87e8bc0 [0,2,0,0,0,0|2,0,0]=4 10562 B13R0.1215 CCCOCCOCCC(C)(C)OC b688eba686e2bd9ba65c811b89c88ed8 [0,2,0,0,0,0|2,0,0]=4 10563 B13R0.1215 CCOCCCNCCC(C)(C)OC fb8afa3e490325e289c519b2da570c3c [0,2,0,0,0,0|2,0,0]=4 10564 B13R0.1215 CCOCCCOCCC(C)(C)OC 4fd6713c1e90f100bffda9af7f618a93 [0,2,0,0,0,0|2,0,0]=4 10565 B13R0.1215 CCOCCNCCCC(C)(C)CO fe0ef17ca70e028532eb19d9a10ae225 [0,2,0,0,0,0|2,0,0]=4 10566 B13R0.1215 CCSCCCCNCC(C)(C)CO 0978675b7970861e5f4956d66c885523 [0,2,0,0,0,0|2,0,0]=4 10567 B13R0.1215 CCSCCCCNCC(C)(C)OC 27cb15a68293464d4daaff136ded879d [0,2,0,0,0,0|2,0,0]=4 10568 B13R0.1215 CCSCCCNCCC(C)(C)OC fa7048cb752e2412fe3ee29a8b6138b1 [0,2,0,0,0,0|2,0,0]=4 10569 B13R0.1215 CCSCCCOCCC(C)(C)OC cd185564200581ad437a8c8245c1e735 [0,2,0,0,0,0|2,0,0]=4 10570 B13R0.1215 CCSCCNCCCC(C)(C)CO bec04faaf5b8e1aa3820cc2fddf8382a [0,2,0,0,0,0|2,0,0]=4 10571 B13R0.1215 COC(C)(C)CCNCCCCCF dc8768453abcfb8dc035ce0f0d28f546 [0,2,0,0,0,0|2,0,0]=4 10572 B13R0.1215 COC(C)(C)CCNCCCCCO cc379d8b540b060810b6e722e15d22b4 [0,2,0,0,0,0|2,0,0]=4 10573 B13R0.1215 COC(C)(C)CCOCCCCCF 4b05061da2fceb3bba58e4151d35898e [0,2,0,0,0,0|2,0,0]=4 10574 B13R0.1215 COC(C)(C)CNCCCCCCCl dfb8751e240bd60b5bb1d23579f6ebd3 [0,2,0,0,0,0|2,0,0]=4 10575 B13R0.1215 COC(C)(C)CNCCCCCCF ef1b12d864c8683458ac4f91c15fe2a0 [0,2,0,0,0,0|2,0,0]=4 10576 B13R0.1215 COC(C)(C)CNCCCCCCO cbd92ef9539967a1adecd7f64186b0cb [0,2,0,0,0,0|2,0,0]=4 10577 B13R0.1215 COC(C)(C)COCCCCCCF 692a4d63cd6e9eb79eea78eba27b820d [0,2,0,0,0,0|2,0,0]=4 10578 B13R0.1215 COC(C)(C)COCCCCCCS 7a2db70a72943605f271c256a540d609 [0,2,0,0,0,0|2,0,0]=4 10579 B13R0.1215 COCCCCCCNC(C)(C)CO 1c6bfdce35d8a8c3e8a396d67cbeb119 [0,2,0,0,0,0|2,0,0]=4 10580 B13R0.1215 COCCCCCNCC(C)(C)CO 6ff1c8af266fb277413d7caa1fd1a53c [0,2,0,0,0,0|2,0,0]=4 10581 B13R0.1215 COCCCCCNCC(C)(C)OC 06ac8b11c2fe3f04b3429003dce1af0c [0,2,0,0,0,0|2,0,0]=4 10582 B13R0.1215 COCCCCCOCC(C)(C)OC 1fecd3c44963f0eb19b8ff3bc71ec4ad [0,2,0,0,0,0|2,0,0]=4 10583 B13R0.1215 COCCCCNCCC(C)(C)OC 5c8fa43ae1c1410d68e75406070b4292 [0,2,0,0,0,0|2,0,0]=4 10584 B13R0.1215 COCCCCOCCC(C)(C)OC a3cc24c653bbf78c7b0a0f9b01025a99 [0,2,0,0,0,0|2,0,0]=4 10585 B13R0.1215 COCCCNCCCC(C)(C)CO e4de5a30a344190298590c2cfb288d5b [0,2,0,0,0,0|2,0,0]=4 10586 B13R0.1215 CSCCCNCCCC(C)(C)CO a88e515a5322a19462f8974c3d0dde43 [0,2,0,0,0,0|2,0,0]=4 10587 B13R0.88 C=C(C)CCCOCCC(C)CCC 2eb0240420986bc48162f57f6b2e103e [0,2,0,0,0,0|1,0,1]=4 10588 B13R0.88 C=C(C)CCCOCCC(S)CCC 324ce90514c73886036d74d688247886 [0,2,0,0,0,0|1,0,1]=4 10589 B13R0.88 C=C(C)CCOCCCC(C)CCC 4c4696212d9ebda5b9ecdd9412b8dd9a [0,2,0,0,0,0|1,0,1]=4 10590 B13R0.88 C=CCC(O)CNCCCCC(C)O 43e5855f8c4b39bbd99160e7e257d4bb [0,2,0,0,0,0|0,0,2]=4 10591 B13R0.88 C=CCC(O)CNCCCC[C@@H](C)O 9d4bd9048e7f316a8a4ec1b166763247 [0,2,0,0,0,0|0,0,2]=4 10592 B13R0.88 CC(C)CCCCCNC(C)CCO f678f12bca04009485414ef2353d84ac [0,2,0,0,0,0|2,0,0]=4 10593 B13R0.88 CC(C)CCCCCN[C@@H](C)CCO c42114974a99fb944c51be14e07bd38d [0,2,0,0,0,0|2,0,0]=4 10594 B13R0.88 CC(C)CCCCCN[C@H](C)CCO 1bde75826562d3b1e39f7309a3062968 [0,2,0,0,0,0|2,0,0]=4 10595 B13R0.88 CC(C)CCCCNCC(C)CCO 7915f9a0fbc9658f56b1394f72a8880b [0,2,0,0,0,0|2,0,0]=4 10596 B13R0.88 CC(C)CCCCOC[C@@H](O)CCO b2a2695a4e27918065c8d66873d57dab [0,2,0,0,0,0|2,0,0]=4 10597 B13R0.88 CC(CCO)CNCCCC[C@@H](C)O 6112578826c1197376a8b4659261b30c [0,2,0,0,0,0|1,0,0]=3 10598 B13R0.88 CC(O)CCCCNCC(C)CCO 5d7ce347c4887ca5107c42af586809b8 [0,2,0,0,0,0|1,0,0]=3 10599 B13R0.88 CC(O)CCCNCCN(C)CCO 520f0d7467945000db28cd98ceb7ba1b [0,2,0,0,0,0|2,0,0]=4 10600 B13R0.88 CC(O)CCNCCCN(C)CCO 08f04b2b963f8768c595a400e48306ed [0,2,0,0,0,0|2,0,0]=4 10601 B13R0.88 CC(O)CNCCCCS(=O)CCO cdc82f8507ed1c689b0b0ca7bc54996f [0,2,0,0,0,0|2,0,0]=4 10602 B13R0.88 CCCC(=O)COCCCCC(C)C 02b08f2bd85f289427e05af2a837f942 [0,2,0,0,0,0|1,0,1]=4 10603 B13R0.88 CCCC(=O)NCCCCCC(C)C cee0b9b67e3d47094dd75f050b18a4ae [0,2,0,0,0,0|1,0,1]=4 10604 B13R0.88 CCCC(=S)OCCCCCC(C)C 9d74078bfb93e5b473e62d4e0ea4383c [0,2,0,0,0,0|1,0,1]=4 10605 B13R0.88 CCCC(C)CCCOCCC(=O)C e4bad76b976d624c37f1c06f27b37e49 [0,2,0,0,0,0|0,0,2]=4 10606 B13R0.88 CCCC(C)CCCOCCC(=O)O 6f8fb9722a4f93a46c062dcdbe574f8a [0,2,0,0,0,0|1,0,1]=4 10607 B13R0.88 CCCC(C)CCCOCCC(C)C 6a346eb816d293796f8e6d8ae494650f [0,2,0,0,0,0|1,0,0]=3 10608 B13R0.88 CCCC(C)CCCOCCN(C)C 36e581ae1ea86c0b9776e815f178f8ff [0,2,0,0,0,0|2,0,0]=4 10609 B13R0.88 CCCC(C)CCCOCCS(=O)C 743bf63329ec5e3ef4ebaa74d4d95027 [0,2,0,0,0,0|1,0,1]=4 10610 B13R0.88 CCCC(C)CCCOCOC(C)C d9aa17b1fd052784947c350f1a7a0fa6 [0,2,0,0,0,0|2,0,0]=4 10611 B13R0.88 CCCC(C)CCOCCCC(=O)C ddc1a28b7ee1aec4a390ea6bd3c447c0 [0,2,0,0,0,0|0,0,2]=4 10612 B13R0.88 CCCC(C)CCOCCCC(=O)O d955a35c876b1bc9664a027e2100bdce [0,2,0,0,0,0|1,0,1]=4 10613 B13R0.88 CCCC(C)CCOCCCC(C)C cd3ad9691607df6ef1a4b90a91d9cc3c [0,2,0,0,0,0|1,0,0]=3 10614 B13R0.88 CCCC(C)CCOCCCN(C)C 659483256c2f2c2537754830f2dc1750 [0,2,0,0,0,0|2,0,0]=4 10615 B13R0.88 CCCC(C)CCOCCOC(C)C 55a7490d58ad63496a76373a16e1bff7 [0,2,0,0,0,0|2,0,0]=4 10616 B13R0.88 CCCC(C)CCOCCSC(C)C 01785a5e8e810bcd9e7ebc3e15225317 [0,2,0,0,0,0|2,0,0]=4 10617 B13R0.88 CCCC(C)CNCCCCC(=O)O 462fdb7ba95f264ab88df683cba002c3 [0,2,0,0,0,0|1,0,1]=4 10618 B13R0.88 CCCC(C)CNCCCCC(F)F 377d84979cdbbd2950cf4d11f595a12b [0,2,0,0,0,0|2,0,0]=4 10619 B13R0.88 CCCC(C)CNCCCCN(C)C fc86a26de16626916f98374ebcee3e1f [0,2,0,0,0,0|2,0,0]=4 10620 B13R0.88 CCCC(C)CNCCCOC(C)C c7fd369eedfe07f1cebe66d05f408122 [0,2,0,0,0,0|2,0,0]=4 10621 B13R0.88 CCCC(C)CNCCCSC(C)C 52dfef51ccc19f6d3a94ffc4d162df59 [0,2,0,0,0,0|2,0,0]=4 10622 B13R0.88 CCCC(C)COCCCCC(=O)C 7abc8706c37a4a7e39299422bf882cd3 [0,2,0,0,0,0|0,0,2]=4 10623 B13R0.88 CCCC(C)COCCCCC(=O)O a76f6c36ae6419ed5923269685d8f284 [0,2,0,0,0,0|1,0,1]=4 10624 B13R0.88 CCCC(C)COCCCCC(C)C 0d29ace55035445683623e7bf4de7a00 [0,2,0,0,0,0|1,0,0]=3 10625 B13R0.88 CCCC(C)COCCCCN(C)C dc8d038dc901cb5c83167f5d9e20ac65 [0,2,0,0,0,0|2,0,0]=4 10626 B13R0.88 CCCC(C)COCCCOC(C)C 81f424d91b2d8f344ff069663274be01 [0,2,0,0,0,0|2,0,0]=4 10627 B13R0.88 CCCC(C)COCCCSC(C)C 850e5536c68bc43cec9bec0b5708e131 [0,2,0,0,0,0|2,0,0]=4 10628 B13R0.88 CCCC(C)COCCOCC(C)C 69604ce3b226c13dddffcbf28fbf3366 [0,2,0,0,0,0|2,0,0]=4 10629 B13R0.88 CCCC(C)COCCSCC(C)C 7958c95eef19f9eb5bb88f489ffd9695 [0,2,0,0,0,0|2,0,0]=4 10630 B13R0.88 CCCC(C)NCCCCCC(=O)C 8a8964b51ecb281010ab5880801d9a44 [0,2,0,0,0,0|0,0,2]=4 10631 B13R0.88 CCCC(C)NCCCCCC(=O)O bcee38a7bf0dc6ed80fc0abeb3567072 [0,2,0,0,0,0|1,0,1]=4 10632 B13R0.88 CCCC(C)NCCCCCC(C)C 59b0757fda6fa685656ecee20d9f5984 [0,2,0,0,0,0|1,0,0]=3 10633 B13R0.88 CCCC(C)NCCCCCC(F)F 9d88360492ad76524cbf4483b4502a88 [0,2,0,0,0,0|2,0,0]=4 10634 B13R0.88 CCCC(C)NCCCCCN(C)C 2fd5f8ad322773a9936298c897009c97 [0,2,0,0,0,0|2,0,0]=4 10635 B13R0.88 CCCC(C)NCCCOCC(C)C 2a8ab8f4987f120c57726d3154ab2546 [0,2,0,0,0,0|2,0,0]=4 10636 B13R0.88 CCCC(C)OCCCCCC(=O)C 73eff4a247995d2cbaba8b470a844c26 [0,2,0,0,0,0|0,0,2]=4 10637 B13R0.88 CCCC(C)OCCCCCC(=O)O 87636ff0b23c01bb4d48fe6d13ebc4d8 [0,2,0,0,0,0|1,0,1]=4 10638 B13R0.88 CCCC(C)OCCCCCC(C)C 408451774fdc9a1059a49bcfdfacaff7 [0,2,0,0,0,0|1,0,0]=3 10639 B13R0.88 CCCC(C)OCCCCCC(F)F e9f5c23960e05243b42c8bb92d620305 [0,2,0,0,0,0|2,0,0]=4 10640 B13R0.88 CCCC(C)OCCCCCN(C)C a2169809c9090a15a51f262dce4acc8e [0,2,0,0,0,0|2,0,0]=4 10641 B13R0.88 CCCC(C)OCCCOCC(C)C 6d499f8348091ab173a4af4347368f49 [0,2,0,0,0,0|2,0,0]=4 10642 B13R0.88 CCCC(C)OCCCSCC(C)C 44d2cc74b7d338a2ac9b481871a0b605 [0,2,0,0,0,0|2,0,0]=4 10643 B13R0.88 CCCC(O)CNCCCCC(=O)C 881c5f3494d108cf783081712b4122d1 [0,2,0,0,0,0|0,0,2]=4 10644 B13R0.88 CCCC(O)CNCCCCC(=O)O 1895969de1f94a4add3a74e488e695e3 [0,2,0,0,0,0|1,0,1]=4 10645 B13R0.88 CCCC(O)CNCCCCC(C)C 984b157c0adeff20952f4453f23e3b1e [0,2,0,0,0,0|1,0,0]=3 10646 B13R0.88 CCCC(O)CNCCCCC(C)O aea55b092c53d40d489f33e611c791a4 [0,2,0,0,0,0|0,0,0]=2 10647 B13R0.88 CCCC(O)CNCCCCN(C)C 4b74ba21a17b0618cecacff8e9112906 [0,2,0,0,0,0|2,0,0]=4 10648 B13R0.88 CCCC(O)CNCCCC[C@@H](C)O ce36a06a83902f71290f8dc84741d3e3 [0,2,0,0,0,0|0,0,0]=2 10649 B13R0.88 CCCC(O)CNCCOCC(C)C 655cbb656e5eb7d07ce69d33937fc66b [0,2,0,0,0,0|2,0,0]=4 10650 B13R0.88 CCCC(S)CCOCCCC(=O)C 57fd8a9e75cc1276fe57bcedc724caa5 [0,2,0,0,0,0|0,0,2]=4 10651 B13R0.88 CCCC(S)CCOCCCC(=O)O 1ddb6e284e99154f683a92cce44a0053 [0,2,0,0,0,0|1,0,1]=4 10652 B13R0.88 CCCC(S)CCOCCCC(C)C c721c385d82d36fd05d329c8afad8f62 [0,2,0,0,0,0|1,0,0]=3 10653 B13R0.88 CCCC(S)CCOCCCN(C)C 6fa50531f4bd0e34789b613ec806aaeb [0,2,0,0,0,0|2,0,0]=4 10654 B13R0.88 CCCC(S)CCOCCOC(C)C 57778e08594e5a23055a4e828bd217cf [0,2,0,0,0,0|2,0,0]=4 10655 B13R0.88 CCCC(S)CCOCCSC(C)C 1342b0461b1a48afe9cc361cabeb847e [0,2,0,0,0,0|2,0,0]=4 10656 B13R0.88 CCCN(C)CCCCCCC(=O)O b0f59cfd36622ab723bc1e297a452899 [0,2,0,0,0,0|1,0,1]=4 10657 B13R0.88 CCC[C@@H](C)OCCCCCC(=O)C 8f55765e61c810d33053ef8560fb72a1 [0,2,0,0,0,0|0,0,2]=4 10658 B13R0.88 CCC[C@@H](C)OCCCCCC(C)C 9cc71b6dbcd1d1a50ff4039998099b4c [0,2,0,0,0,0|1,0,0]=3 10659 B13R0.88 CCC[C@@H](C)OCCCCCC(F)F c532995dd6194f700691decf32539ac2 [0,2,0,0,0,0|2,0,0]=4 10660 B13R0.88 CCC[C@H](C)NCCCCCC(=O)C ae9eaa7cb496cc9b42c6faf320c2b10d [0,2,0,0,0,0|0,0,2]=4 10661 B13R0.88 CCC[C@H](C)NCCCCCC(C)C 0bdb67a3f898f867d8196cbd6cb3db24 [0,2,0,0,0,0|1,0,0]=3 10662 B13R0.88 CCC[C@H](C)NCCCCCC(F)F 3fc01b6ec0f04afea47efb750b92c7d3 [0,2,0,0,0,0|2,0,0]=4 10663 B13R0.88 CCC[C@H](C)OCCCCCC(=O)C ef759a0780c9697eec5b5693dd0d69e7 [0,2,0,0,0,0|0,0,2]=4 10664 B13R0.88 CCC[C@H](C)OCCCCCC(C)C 45714b9888c8fc936c5c698d22b88af6 [0,2,0,0,0,0|1,0,0]=3 10665 B13R0.88 CCC[C@H](C)OCCCCCC(F)F 0bc1558faaf842d86625a97e5a4cfa7d [0,2,0,0,0,0|2,0,0]=4 10666 B13R0.88 CCNC(=O)CNCCCCC(C)O 238e730c84f6d170a5b62c8b6323d80b [0,2,0,0,0,0|1,0,1]=4 10667 B13R0.88 CCNC(=O)CNCCCC[C@@H](C)O d75b7403bc15c2339e772edbdfceaaab [0,2,0,0,0,0|1,0,1]=4 10668 B13R0.88 CCOC(=O)CCCCNCC(C)O 2031012c6e7c519ab5e609d9f08ef1f2 [0,2,0,0,0,0|1,0,1]=4 10669 B13R0.88 CCOC(=O)CCCCNC[C@@H](C)O 1e86b5b5ea7286c29c807f6fb120e7fc [0,2,0,0,0,0|1,0,1]=4 10670 B13R0.88 CCOC(=O)CCCCNC[C@H](C)O c4de52b1a4678361efe9c9bf0fd36ef4 [0,2,0,0,0,0|1,0,1]=4 10671 B13R0.88 CCOC(=O)CCCNCCC(C)O a7573d31565e89f3e7a02a3d53c18980 [0,2,0,0,0,0|1,0,1]=4 10672 B13R0.88 CCOC(=O)CCCNCC[C@@H](C)O 97730946afc6c6fd4d76d2e1fbfe4e69 [0,2,0,0,0,0|1,0,1]=4 10673 B13R0.88 CCOC(=O)CCCNCC[C@H](C)O 27aefea7a73779d09fbb1945567dbc1e [0,2,0,0,0,0|1,0,1]=4 10674 B13R0.88 CCOC(=O)CCNCCCC(C)O 90d2deb68e60dcba1a5f167b80d6a884 [0,2,0,0,0,0|1,0,1]=4 10675 B13R0.88 CCOC(=O)CNCCCCC(C)O f8aed573a50a1c078422e9aae9db1a81 [0,2,0,0,0,0|1,0,1]=4 10676 B13R0.88 CCOC(=O)CNCCCC[C@@H](C)O 2894c1c2a01d8d1471ae3e9ecc66ea42 [0,2,0,0,0,0|1,0,1]=4 10677 B13R0.88 CCOC(C)CCCCCCC(=O)O 0895d603eb38158c32cc45b10a690085 [0,2,0,0,0,0|1,0,1]=4 10678 B13R0.88 CCOC(C)CNCCCCC(C)C 52bde8240c6cde40828026dbed452bd2 [0,2,0,0,0,0|2,0,0]=4 10679 B13R0.88 CCOC(C)CNCCCCC(C)O a7e1c0d9890acc49ab05e9bc5af609d0 [0,2,0,0,0,0|1,0,0]=3 10680 B13R0.88 CCOC(C)CNCCCC[C@@H](C)O 08a6511d4fdb8d7f4795a8f5da92da15 [0,2,0,0,0,0|1,0,0]=3 10681 B13R0.88 CCOC(C)COCCCCC(C)C 76665bbaea37f780b6684d004bc9366c [0,2,0,0,0,0|2,0,0]=4 10682 B13R0.88 COCC(C)COCCCCC(C)C a3565211a92c69eb546ac5ad5b1a6127 [0,2,0,0,0,0|2,0,0]=4 10683 B13R0.88 COCC(C)NCCCCCC(C)C d969acc5905eacbc26bcf6404444efb2 [0,2,0,0,0,0|2,0,0]=4 10684 B13R0.88 COCC(C)OCCCCCC(C)C d730e060b920ad2443c6cc964881eda2 [0,2,0,0,0,0|2,0,0]=4 10685 B13R0.88 COCC(O)CNCCCCC(C)C 0c06fe90c0c1d2b99ebab3de34a4d422 [0,2,0,0,0,0|2,0,0]=4 10686 B13R0.88 COCC(O)CNCCCCC(C)O e7efb7302d339dcb97f5e222864a4aea [0,2,0,0,0,0|1,0,0]=3 10687 B13R0.88 COCC(O)CNCCCC[C@@H](C)O 637f20654643d28574136be564824ac4 [0,2,0,0,0,0|1,0,0]=3 10688 B13R0.88 COC[C@@H](C)NCCCCCC(C)C b693f4476fd5247e286814deb457f57d [0,2,0,0,0,0|2,0,0]=4 10689 B13R0.88 COC[C@@H](C)OCCCCCC(C)C 119ed921f3b1c53b71f1e64cb36502c3 [0,2,0,0,0,0|2,0,0]=4 10690 B13R0.88 COC[C@@H](O)CNCCCCC(C)C 503016e6875558eb86a517236a42c95f [0,2,0,0,0,0|2,0,0]=4 10691 B13R0.88 COC[C@@H](O)CNCCCCC(C)O 674936912aac35e53787df712fd992e2 [0,2,0,0,0,0|1,0,0]=3 10692 B13R0.88 COC[C@@H](O)CNCCCC[C@@H](C)O e3644c51d1404da61768951925584acd [0,2,0,0,0,0|1,0,0]=3 10693 B13R0.88 COC[C@H](C)COCCCCC(C)C bcb25675d3b89c1f85546e8ccfcc4957 [0,2,0,0,0,0|2,0,0]=4 10694 B13R0.88 COC[C@H](C)NCCCCCC(C)C 412dc76ed78a8a5bd3fdc9525021c62f [0,2,0,0,0,0|2,0,0]=4 10695 B13R0.88 COC[C@H](C)OCCCCCC(C)C ace8af032286494607341ecf83bedd7c [0,2,0,0,0,0|2,0,0]=4 10696 B13R0.88 CSCC(C)OCCCCCC(C)C 227bff6b322b13373c64108b1bdd0b4c [0,2,0,0,0,0|2,0,0]=4 10697 B13R0.88 C[C@@H](O)CNCCCCS(=O)CCO bd6ba3fd69e18d67387147594c78a5ac [0,2,0,0,0,0|2,0,0]=4 10698 B13R0.88 C[C@H](O)CNCCCCS(=O)CCO 00254ef8c45a2a2bf12a1b8812ae9dec [0,2,0,0,0,0|2,0,0]=4 10699 B13R0.101 CCC(C)C(C)NCCCCC(C)C 844048f1cd0885a376f3886705d7921b [0,2,0,0,0,0|2,0,0]=4 10700 B13R0.101 CCC(C)C(C)NCCCCC(C)O be9dce54354d0ba68530f23ac71f26b8 [0,2,0,0,0,0|1,0,0]=3 10701 B13R0.101 CCC(C)C(C)NCCCC[C@@H](C)O 443025d832159c25f777efdd8b61c270 [0,2,0,0,0,0|1,0,0]=3 10702 B13R0.101 CCC(C)C(C)OCCCCC(C)C 71176c0fe67265504c526920e15c005f [0,2,0,0,0,0|2,0,0]=4 10703 B13R0.101 CCC(C)N(C)CCCCCC(C)C 023963c965b82260cf246890aba386af [0,2,0,0,0,0|2,0,0]=4 10704 B13R0.101 CCC(C)N(C)CCNCCC(C)O 038b41854ce49840ff53671b20ff765b [0,2,0,0,0,0|2,0,0]=4 10705 B13R0.101 CCC(S)C(C)COCCCC(C)C edbd126bf319877f1b34a398671ac1b3 [0,2,0,0,0,0|2,0,0]=4 10706 B13R0.101 CCN(C)C(=O)CCCCCC(C)O a22533ac27930d1c0cd1c25d24dd369d [0,2,0,0,0,0|1,0,1]=4 10707 B13R0.101 CCN(C)C(C)CCNCCC(C)O 42d966bf79aab1471d13027ec2dec253 [0,2,0,0,0,0|2,0,0]=4 10708 B13R0.180 CC(=O)CCCCCNC(C)C(C)O ee37ae6c1986955f118275447e226b9f [0,2,0,0,0,0|1,0,1]=4 10709 B13R0.180 CC(C)C(O)CNCCCC[C@@H](C)O 39afa33ac4a54e0c7afe27a54b06bfe3 [0,2,0,0,0,0|1,0,0]=3 10710 B13R0.180 CC(C)CCCCCNC(=O)C(C)O d2efbbada16529379e66f9883fdf73df [0,2,0,0,0,0|1,0,1]=4 10711 B13R0.180 CC(C)CCCCCNC(=O)[C@@H](C)O bc71e29ac7fec01191848abf00b9c49d [0,2,0,0,0,0|1,0,1]=4 10712 B13R0.180 CC(C)CCCCCNC(=O)[C@H](C)O e949936747b5f8e3d42b5661c00f2dd0 [0,2,0,0,0,0|1,0,1]=4 10713 B13R0.180 CC(C)CCCCCNC(C)C(C)C c1e820426162ee668ff4c6c8cdaaeb67 [0,2,0,0,0,0|2,0,0]=4 10714 B13R0.180 CC(C)CCCCCNC(C)C(C)O 1c6f2fafed521cb89cf0ac3c9cd35d36 [0,2,0,0,0,0|1,0,0]=3 10715 B13R0.180 CC(C)CCCCCN[C@@H](C)C(C)C f39b63298aadafc51892cb89a17427f1 [0,2,0,0,0,0|2,0,0]=4 10716 B13R0.180 CC(C)CCCCCN[C@H](C)C(C)C 42406a28d201175aa7c7b58109429fbf [0,2,0,0,0,0|2,0,0]=4 10717 B13R0.180 CC(C)CCCCCOC(C)C(C)C 2a1eb7b91f54f701aba828a0f0748d93 [0,2,0,0,0,0|2,0,0]=4 10718 B13R0.180 CC(C)CCCCCOC(C)C(C)S 029a86cc691cb7456443d66e84c8545c [0,2,0,0,0,0|1,1,0]=4 10719 B13R0.180 CC(C)CCCCCO[C@@H](C)C(C)C 6bd998e88448cc63d92e7370c71746dc [0,2,0,0,0,0|2,0,0]=4 10720 B13R0.180 CC(C)CCCCCO[C@H](C)C(C)C b98c17b09a64e6fcfc59d11fd4b90fe9 [0,2,0,0,0,0|2,0,0]=4 10721 B13R0.180 CC(C)CCCCNCC(O)C(C)C cf54cade3e0024f114923edcc28925f7 [0,2,0,0,0,0|2,0,0]=4 10722 B13R0.180 CC(C)CCCCOCC(C)C(C)C e3bf158fe092f2b018b3eaeec0a6dccd [0,2,0,0,0,0|2,0,0]=4 10723 B13R0.180 CC(C)CCCOCCC(C)C(C)C 018542aad659f43537e5ed8f52906c30 [0,2,0,0,0,0|2,0,0]=4 10724 B13R0.180 CC(CNCCCC[C@@H](C)O)N(C)C f1ae33b744e666054e6549bc4563014c [0,2,0,0,0,0|2,0,0]=4 10725 B13R0.180 CC(O)C(C)NCCCCCC(F)F 7da9cd3aa9f201287d89f0268dd9288b [0,2,0,0,0,0|2,0,0]=4 10726 B13R0.180 CC(O)CCCCNCC(C)N(C)C 9b36d91fbc3758f7d0aa41b75557fdf9 [0,2,0,0,0,0|2,0,0]=4 10727 B13R0.180 CC(O)CCCCNCC(O)C(C)C 30b9272648d8f06be3609d101db20780 [0,2,0,0,0,0|1,0,0]=3 10728 B13R0.180 CC(O)CCCCNCC(O)C(F)F c7988592f3521159e61ca290e6ca7aaf [0,2,0,0,0,0|2,0,0]=4 10729 B13R0.180 CC(O)CCCNCCC(C)N(C)C f1f7d4ecd9923067be0d3d038a77fa5a [0,2,0,0,0,0|2,0,0]=4 10730 B13R0.180 CC(O)CCCNCCN(C)C(C)C 48a9c65b6d65baa7c5a73701e516025b [0,2,0,0,0,0|2,0,0]=4 10731 B13R0.180 CC(O)CCCNCC[C@@H](C)N(C)C 832b7dbbdf78e07aec418f236cfc30af [0,2,0,0,0,0|2,0,0]=4 10732 B13R0.180 CC(O)CCCNCC[C@H](C)N(C)C de656a9298cff2c42f8a54b6a92b869f [0,2,0,0,0,0|2,0,0]=4 10733 B13R0.180 C[C@@H](O)CCCCNCC(O)C(F)F 4693f4d99ca2cede6a35ea57551dc6f3 [0,2,0,0,0,0|2,0,0]=4 10734 B13R0.201 C#CC(C)OCCCCCC(C)CC 08de23f9ca5f31558d8656baaa8d365f [0,2,0,0,0,0|2,0,0]=4 10735 B13R0.201 C#CC(C)OCCCCC[C@@H](C)CC 2498d53b913d261b9bf29dc1bde5bbd7 [0,2,0,0,0,0|2,0,0]=4 10736 B13R0.201 C#CC(O)CCCCCNC(C)CC 3dca42c1b0059fc2d899a17427c5ee81 [0,2,0,0,0,0|1,0,1]=4 10737 B13R0.201 C#CC(O)CCCCCN[C@@H](C)CC 500d620d4ada076d965affcac8402790 [0,2,0,0,0,0|1,0,1]=4 10738 B13R0.201 C#CC(O)CCCCCN[C@H](C)CC 77f17d0a3ecc4cd37bd4fd0e30dfcf5e [0,2,0,0,0,0|1,0,1]=4 10739 B13R0.201 C=CC(C)OCCCCCC(C)CC 4492f581a145c10bcbdaa0b7247c5b4d [0,2,0,0,0,0|2,0,0]=4 10740 B13R0.201 C=CC(C)OCCCCC[C@@H](C)CC 8b198f9ace7b06330279af16b4078910 [0,2,0,0,0,0|2,0,0]=4 10741 B13R0.201 CC(CO)CCCNCCC(C)CO c27e8f9a4b4805b965c25f68df42cde3 [0,2,0,0,0,0|2,0,0]=4 10742 B13R0.201 CCC(=O)CCCCNCC(C)CO 5a383181ea5acbe9f5b0ac364cce1722 [0,2,0,0,0,0|1,0,1]=4 10743 B13R0.201 CCC(=O)CCCCNCC(O)CC 3db1f259249d572c6eac68fad6cd5451 [0,2,0,0,0,0|1,0,1]=4 10744 B13R0.201 CCC(=O)CCCCNCC(O)CO 8463b9ee953b0b00d609229812f5ac73 [0,2,0,0,0,0|1,0,1]=4 10745 B13R0.201 CCC(=O)CCCCNC[C@@H](C)OC 32a664023bd09e5d077ccaae963354e5 [0,2,0,0,0,0|1,0,1]=4 10746 B13R0.201 CCC(=O)CCCCNC[C@@H](O)CO 1960a4b21e16d1cd0fb5375c039a492a [0,2,0,0,0,0|1,0,1]=4 10747 B13R0.201 CCC(=O)CCCCNC[C@H](C)CO 6421b15f5c0338f1a58a0969c6314cf9 [0,2,0,0,0,0|1,0,1]=4 10748 B13R0.201 CCC(=O)CCCCNC[C@H](C)OC f6cae355b74e46165ec0d209039e45a6 [0,2,0,0,0,0|1,0,1]=4 10749 B13R0.201 CCC(=O)CCCCNC[C@H](O)CC e7afd982f5c34f1d834891cd3d3693e3 [0,2,0,0,0,0|1,0,1]=4 10750 B13R0.201 CCC(=O)CCCCNC[C@H](O)CO 173cec4dfd8ac78df721fcae5053731f [0,2,0,0,0,0|1,0,1]=4 10751 B13R0.201 CCC(=O)CCCCOCC(C)OC 3134b6b5b5ade133942e879a80c43f37 [0,2,0,0,0,0|1,0,1]=4 10752 B13R0.201 CCC(=O)CCCCOC[C@@H](C)OC 95c98a565a3c78db02a7762cce14044c [0,2,0,0,0,0|1,0,1]=4 10753 B13R0.201 CCC(=O)CCCCOC[C@H](C)OC 0a6e937b86ebaa2d3717a2fb3a5c4719 [0,2,0,0,0,0|1,0,1]=4 10754 B13R0.201 CCC(C)CCCCCOC(C)C#N 38525b70bb44d93e2415889022b9dd92 [0,2,0,0,0,0|2,0,0]=4 10755 B13R0.201 CCC(C)CCCCCOC(C)C=O c8dafd98087fad6542f707733287bfb4 [0,2,0,0,0,0|1,0,1]=4 10756 B13R0.201 CCC(C)CCCCCOC(C)CC 933d84a4bcc7328fd6b2a2288720fd46 [0,2,0,0,0,0|2,0,0]=4 10757 B13R0.201 CCC(C)CCCCCO[C@H](C)C=O ab99dc1696a481a76d52ade830e04c89 [0,2,0,0,0,0|1,0,1]=4 10758 B13R0.201 CCC(C)CCCCOCC(C)C#N cec35c3cb470b57548482c2a81f141eb [0,2,0,0,0,0|2,0,0]=4 10759 B13R0.201 CCC(C)CCCCOCC(C)CC ab424c21c717f0e00dd9c966421ab0b3 [0,2,0,0,0,0|2,0,0]=4 10760 B13R0.201 CCC(C)CCCCOCC(C)OC ff625b74d533dc150a9a29cb44686dd3 [0,2,0,0,0,0|1,0,0]=3 10761 B13R0.201 CCC(C)CCCCOCC(O)CO 4f52f6a08f1a502c308cc92c1dd32e41 [0,2,0,0,0,0|1,0,0]=3 10762 B13R0.201 CCC(C)CCCCOC[C@@H](C)CC dac2abf21ac179b2fa20402ed080ff15 [0,2,0,0,0,0|2,0,0]=4 10763 B13R0.201 CCC(C)CCCCOC[C@@H](C)OC fbd9aa8cdc61b76d2ebbb88181e20975 [0,2,0,0,0,0|1,0,0]=3 10764 B13R0.201 CCC(C)CCCCOC[C@@H](O)CO 3d645bc9c52794025036c0cc19aa220f [0,2,0,0,0,0|1,0,0]=3 10765 B13R0.201 CCC(C)CCCCOC[C@H](C)CC c7938c23ea7ebc132aac3cd781183ee9 [0,2,0,0,0,0|2,0,0]=4 10766 B13R0.201 CCC(C)CCCCOC[C@H](C)OC 300a1e29f1f00c217c2013c89a730b06 [0,2,0,0,0,0|1,0,0]=3 10767 B13R0.201 CCC(C)CCCCOC[C@H](O)CO 013bd9e37e70c2c893d8e23054e2bc4a [0,2,0,0,0,0|1,0,0]=3 10768 B13R0.201 CCC(C)CCCOCCC(C)CC 99ed477787ae74ff39b659dbc169cffc [0,2,0,0,0,0|2,0,0]=4 10769 B13R0.201 CCC(C)CCNCCCC(C)CO e4adf65fff73e43af610d2bf4e114836 [0,2,0,0,0,0|1,0,0]=3 10770 B13R0.201 CCC(C)CCOCCC[C@@H](C)CC aa733da35ca21b0be9e52466f66dea7e [0,2,0,0,0,0|2,0,0]=4 10771 B13R0.201 CCC(C)COCCCC[C@@H](C)CC 065fcdd45ed816a7ca39d4d363dd71c9 [0,2,0,0,0,0|2,0,0]=4 10772 B13R0.201 CCC(C)OCCCCC[C@@H](C)CC 2eb60c08ebd327a937d6f169424c3ab0 [0,2,0,0,0,0|2,0,0]=4 10773 B13R0.201 CCN(C)CCCNCCC(C)CO ca35970c4d588099d8bf824fa6f03c7a [0,2,0,0,0,0|2,0,0]=4 10774 B13R0.201 CCS(=O)CCNCCCC(C)CO 3dd2be2240f96970fabedc8f181a7042 [0,2,0,0,0,0|2,0,0]=4 10775 B13R0.201 CC[C@@H](C)COCCCC[C@@H](C)CC b8aa6c76393483168c27190cd157aa61 [0,2,0,0,0,0|2,0,0]=4 10776 B13R0.201 CC[C@H](C)CCCCCOC(C)C#N e2cb11142d4ae19db6f73e9361fe8938 [0,2,0,0,0,0|2,0,0]=4 10777 B13R0.201 CC[C@H](C)CCCCCOC(C)C=O 29073b50a8e9c83f9f2bf56084914933 [0,2,0,0,0,0|1,0,1]=4 10778 B13R0.201 CC[C@H](C)CCCCCO[C@H](C)C=O 0983ac2b07a53db67dedc872d09aa3d9 [0,2,0,0,0,0|1,0,1]=4 10779 B13R0.201 CC[C@H](C)CCCCOCC(C)C#N 98f91e6bdae17d8dc425056565884461 [0,2,0,0,0,0|2,0,0]=4 10780 B13R0.201 CC[C@H](C)CCCCOCC(C)OC d381cfb93d1fd3381d792d1a4a768ef9 [0,2,0,0,0,0|1,0,0]=3 10781 B13R0.201 CC[C@H](C)CCCCOCC(O)CO cc3dc9f7e95d11b1ed9590304d3a8965 [0,2,0,0,0,0|1,0,0]=3 10782 B13R0.201 CC[C@H](C)CCCCOC[C@@H](C)CC f1a5c5ef46e0ece4ee211c4f091a30e9 [0,2,0,0,0,0|2,0,0]=4 10783 B13R0.201 CC[C@H](C)CCCCOC[C@@H](C)OC 1ca7355e18852035a3fe690e26226bef [0,2,0,0,0,0|1,0,0]=3 10784 B13R0.201 CC[C@H](C)CCCCOC[C@@H](O)CO 1653270b4c3a644e52f42e5f53ea8863 [0,2,0,0,0,0|1,0,0]=3 10785 B13R0.201 CC[C@H](C)CCCCOC[C@H](C)OC a75b8f586d763d8a4160436a842d8975 [0,2,0,0,0,0|1,0,0]=3 10786 B13R0.201 CC[C@H](C)CCCCOC[C@H](O)CO eda7d4caa0022901d60b256dac0e6500 [0,2,0,0,0,0|1,0,0]=3 10787 B13R0.204 CCC(=O)CCCCNC(C)C(C)O 0ca2b8d4c2d732ebfe8c3c4e1c5c55e9 [0,2,0,0,0,0|1,0,1]=4 10788 B13R0.204 CCC(C)CCCCOC(C)C(C)C e8ecf8c6486b5692dabfbdd4cb089656 [0,2,0,0,0,0|2,0,0]=4 10789 B13R0.204 CCC(C)CCCOCC(C)C(C)C 346a6673652a232b82f0dbd189d3be06 [0,2,0,0,0,0|2,0,0]=4 10790 B13R0.204 CCC(C)CCOCCC(C)C(C)C f6b8a670cea50167027e8e980317936e [0,2,0,0,0,0|2,0,0]=4 10791 B13R0.204 CC[C@H](C)CCCCOC(C)C(C)C c1a6af718ba4c65099feb285216a3555 [0,2,0,0,0,0|2,0,0]=4 10792 B13R0.204 CC[C@H](C)CCCOCC(C)C(C)C dc41e49c9a902fd22ba5cd5de7ed2dc6 [0,2,0,0,0,0|2,0,0]=4 10793 B13R0.208 CCC(C)CCCC(=O)NCC(C)O 25057afb2eb6e5f39cdf347a1d9a599a [0,2,0,0,0,0|1,0,1]=4 10794 B13R0.208 CCC(C)CCCC(=O)NC[C@@H](C)O 8d53bbef51acafd09fbbcb574050e9a7 [0,2,0,0,0,0|1,0,1]=4 10795 B13R0.208 CCC(C)CCCC(=O)NC[C@H](C)O 3f294bbbdc013be7ceadba9a8286a038 [0,2,0,0,0,0|1,0,1]=4 10796 B13R0.208 CCC(C)CCNC(=O)CCC(C)O 21372ce79c5db47c1049af7eddbb3c42 [0,2,0,0,0,0|1,0,1]=4 10797 B13R0.208 CCC(C)CCNC(C)CCC(C)C 1d052204963761ac59217f48a71bb560 [0,2,0,0,0,0|2,0,0]=4 10798 B13R0.208 CCC(C)CCOC(C)CCC(C)C 83ea3794bd694c5f671561520d13b2db [0,2,0,0,0,0|2,0,0]=4 10799 B13R0.208 CCC(C)CNCC(C)CCC(C)C bba86b01b4c354427ca0fe44eaddefb2 [0,2,0,0,0,0|2,0,0]=4 10800 B13R0.208 CCC(C)COCC(C)CCC(C)C d75de62c7bc45eccda7aa88da37b26ce [0,2,0,0,0,0|2,0,0]=4 10801 B13R0.208 CCC(O)CNCC(C)CCC(C)C bba625ecfc3a4da96cdd8ad62bd53f87 [0,2,0,0,0,0|2,0,0]=4 10802 B13R0.208 CCC(S)CCOC(C)CCC(C)C 0d86be77fe6e0e0b2c09b2f983f46d99 [0,2,0,0,0,0|2,0,0]=4 10803 B13R0.208 CC[C@@H](C)COCC(C)CCC(C)C 52e5da67430de56b16389206de0109ed [0,2,0,0,0,0|2,0,0]=4 10804 B13R0.208 CC[C@@H](O)CNCC(C)CCC(C)C f1c5d2f1111c013f4c22efbb1c9a1c8a [0,2,0,0,0,0|2,0,0]=4 10805 B13R0.208 CC[C@H](C)CCOC(C)CCC(C)C 87b869407414a77edef3b26afb163e52 [0,2,0,0,0,0|2,0,0]=4 10806 B13R0.208 CC[C@H](C)CNCC(C)CCC(C)C 068a2e717112dfe83b4a9d965d1ef604 [0,2,0,0,0,0|2,0,0]=4 10807 B13R0.208 CC[C@H](C)COCC(C)CCC(C)C 7d3027e5aab00b1c49f55732c783b154 [0,2,0,0,0,0|2,0,0]=4 10808 B13R0.291 CC(O)CCCCNCC(C)(C)CF 56fa79c04de4326577fffcc11fcff369 [0,2,0,0,0,0|2,0,0]=4 10809 B13R0.291 CC(O)CCCCNCC(C)(C)CO 709977db5bfe0886a80ac744c9c8776e [0,2,0,0,0,0|2,0,0]=4 10810 B13R0.291 CC(O)CCCNCCC(F)(F)CO 93041096af1533c6e6ab700b9b8e47a4 [0,2,0,0,0,0|2,0,0]=4 10811 B13R0.291 CC(O)CCNCCCC(C)(C)CO 06363d4bc0e1078bc561426d9b7fa772 [0,2,0,0,0,0|2,0,0]=4 10812 B13R0.291 CCC(C)(C)CCNCCCC(C)C ec362600844b3b9d783572064f27d1b9 [0,2,0,0,0,0|2,0,0]=4 10813 B13R0.291 CCC(C)(C)CCOCCCC(C)C 7c48d60958f7c6564d4bd2cd8f010c05 [0,2,0,0,0,0|2,0,0]=4 10814 B13R0.291 CCC(C)(C)CNCCCCC(C)C b5fd930262cdf22fbc4d53c6f0bdddd0 [0,2,0,0,0,0|2,0,0]=4 10815 B13R0.291 CCC(C)(C)CNCCCCC(C)O 22e9ff48d48f678e42ee471a627fb41e [0,2,0,0,0,0|1,0,0]=3 10816 B13R0.291 CCC(C)(C)CNCCCC[C@@H](C)O fcd92225c2c0c80de1a0a37e6cafa9a4 [0,2,0,0,0,0|1,0,0]=3 10817 B13R0.291 CCC(C)(C)NCCCCCC(C)C e9ff3a8b27d6b548a146bd5d32465281 [0,2,0,0,0,0|2,0,0]=4 10818 B13R0.291 CCC(C)(O)CNCCCCC(C)C e520a09f05e56430115396614c4bc86b [0,2,0,0,0,0|2,0,0]=4 10819 B13R0.291 CCC(C)(O)CNCCCCC(C)O 920037b5dd4758fc1964565e0a89090d [0,2,0,0,0,0|1,0,0]=3 10820 B13R0.291 CCC(C)(O)CNCCCC[C@@H](C)O 2d76ac0ad6e3646006c8cac5ae479d2e [0,2,0,0,0,0|1,0,0]=3 10821 B13R0.291 CCC(F)(F)COCCCCC(C)C 9a1bbf3ab6e5ccfaa0664cc2fa6ed3ec [0,2,0,0,0,0|2,0,0]=4 10822 B13R0.291 CCS(=O)(=O)CCCCNCC(C)O ff975866b804fe91a2a4d96095dc4529 [0,2,0,0,0,0|2,0,0]=4 10823 B13R0.291 CCS(=O)(=O)CCCCNC[C@H](C)O 4b8e81bafa7e9fd9e5eb58e033f084f6 [0,2,0,0,0,0|2,0,0]=4 10824 B13R0.291 CCS(=O)(=O)CCNCCCC(C)O d97372c3c5416e8078e542f546e4b5a7 [0,2,0,0,0,0|2,0,0]=4 10825 B13R0.291 COC(C)(C)CCNCCCC(C)O cf228b3abc7be7cd9b89dca5f975c420 [0,2,0,0,0,0|2,0,0]=4 10826 B13R0.291 COC(C)(C)CNCCCCC(C)O fd37ea82c95a854c760c33ae9c2ce3d5 [0,2,0,0,0,0|2,0,0]=4 10827 B13R0.291 COC(C)(C)CNCCCC[C@@H](C)O da323ca83048927bf52a733d597e4ff7 [0,2,0,0,0,0|2,0,0]=4 10828 B13R0.291 C[C@@H](O)CCCCNCC(C)(C)CF 8056e209301dedfadccf85f4b0436b9a [0,2,0,0,0,0|2,0,0]=4 10829 B13R0.291 C[C@@H](O)CCCCNCC(C)(C)CO 1dc1c7d281f6d7cea8e851593cf0de76 [0,2,0,0,0,0|2,0,0]=4 10830 B13R0.493 CCC(C)CCC(=O)NCCC(C)O a18f4a582527a8ebb3f29fe3e4430a59 [0,2,0,0,0,0|1,0,1]=4 10831 B13R0.493 CCC(C)CCC(=O)NCC[C@@H](C)O 5734d29ea3654c39452f3d33736aac8a [0,2,0,0,0,0|1,0,1]=4 10832 B13R0.493 CCC(C)CCC(=O)NCC[C@H](C)O c7c922f94b5840283e905661136c686a [0,2,0,0,0,0|1,0,1]=4 10833 B13R0.493 CCC(C)CCC(C)COCC(C)C 5c73e7a91e52edbbe5724bbd9205685c [0,2,0,0,0,0|2,0,0]=4 10834 B13R0.493 CCC(C)CCC(C)OCCC(C)C 60e8cbc014847bedb94ce6c0ff5bae8f [0,2,0,0,0,0|2,0,0]=4 10835 B13R0.493 CCC(C)CNC(C)CCCC(C)C b0d0f9f6fed1ac2f9b60ba0f3c19352d [0,2,0,0,0,0|2,0,0]=4 10836 B13R0.493 CCC(C)COC(C)CCCC(C)C 411db08f8da275b5dbbf599e1d3e5b10 [0,2,0,0,0,0|2,0,0]=4 10837 B13R0.493 CCC(O)CNC(C)CCCC(C)C bd1f960f5a21e7e83728677e59740a5a [0,2,0,0,0,0|2,0,0]=4 10838 B13R0.493 CCN(C)CCC(C)CCCC(C)C 9fb39080841d1837d683d26e18f3a8bc [0,2,0,0,0,0|2,0,0]=4 10839 B13R0.493 CCN(C)CCN(C)CCCC(C)O ce7e5fc5105ddd2ff2f5541bfa7fc0f5 [0,2,0,0,0,0|2,0,0]=4 10840 B13R0.493 CC[C@@H](C)CNC(C)CCCC(C)C 4d8acad8a454ea571494a5a3bb775539 [0,2,0,0,0,0|2,0,0]=4 10841 B13R0.493 CC[C@@H](C)COC(C)CCCC(C)C fb3e052d95a0cd4134ad66f7e6d8338e [0,2,0,0,0,0|2,0,0]=4 10842 B13R0.493 CC[C@H](C)CNC(C)CCCC(C)C 70374bb0934ce004e4a5d0181b91ada4 [0,2,0,0,0,0|2,0,0]=4 10843 B13R0.493 CC[C@H](C)COC(C)CCCC(C)C 95e6ab3cf891e4b722fa5dd54ab976d3 [0,2,0,0,0,0|2,0,0]=4 10844 B13R0.1120 C#CC(CC)OCCCCCC(C)C fb68da37ed829bad2dfbe4204b7dd7d2 [0,2,0,0,0,0|2,0,0]=4 10845 B13R0.1120 C=CC(CC)OCCCCCC(C)C b8181ae799739d9e5481db8378d07681 [0,2,0,0,0,0|2,0,0]=4 10846 B13R0.1120 CC(O)CCCCNCC(CO)CO 9c0dba211e1b2c306b94ff8f018d049a [0,2,0,0,0,0|2,0,0]=4 10847 B13R0.1120 CC(O)CCCNCCC(CO)CO 7b6951ce70d5a9198aa5946750eaa95d [0,2,0,0,0,0|2,0,0]=4 10848 B13R0.1120 CC(O)CNCCCCC(CO)CO 865da18cb3d12679063a6fe9d1591c02 [0,2,0,0,0,0|2,0,0]=4 10849 B13R0.1120 CCC(C#N)OCCCCCC(C)C 49597dd8a68f8e4e8694f090b2ba67e5 [0,2,0,0,0,0|2,0,0]=4 10850 B13R0.1120 CCC(C=O)NCCCCCC(C)C 31172ff86b7aa80a4e593b29b23d33f1 [0,2,0,0,0,0|2,0,0]=4 10851 B13R0.1120 CCC(C=O)OCCCCCC(C)C f76e84fb24a5bf1d332738a09ea81613 [0,2,0,0,0,0|2,0,0]=4 10852 B13R0.1120 CCC(CC)CCNCCCC(C)C 6569f8a9c9efa5d789ba828724499d4e [0,2,0,0,0,0|2,0,0]=4 10853 B13R0.1120 CCC(CC)CCNCCCC(C)O 8729b648109b92baf7180116cb565be5 [0,2,0,0,0,0|1,0,0]=3 10854 B13R0.1120 CCC(CC)CNCCCCC(C)C 2b560149348b4cc59c62696b6b10243d [0,2,0,0,0,0|2,0,0]=4 10855 B13R0.1120 CCC(CC)CNCCCCC(C)O 9e9ce0835238c07633ac48201a11ce44 [0,2,0,0,0,0|1,0,0]=3 10856 B13R0.1120 CCC(CC)CNCCCC[C@@H](C)O f33efa292952987c2fbaae75120540b8 [0,2,0,0,0,0|1,0,0]=3 10857 B13R0.1120 CCC(CC)COCCCCC(C)C 96653c4ae3f59453c60a9f62c2153de2 [0,2,0,0,0,0|2,0,0]=4 10858 B13R0.1120 CCC(CC)NCCCCCC(C)C a32a13ee945156a603163550c781e2af [0,2,0,0,0,0|2,0,0]=4 10859 B13R0.1120 CCC(CC)OCCCCCC(C)C 2aaf661e9af80a443d1948b611a42420 [0,2,0,0,0,0|2,0,0]=4 10860 B13R0.1120 CCC(CO)CNCCCCC(C)C 0b724757be62338f7220dc76726cfb4a [0,2,0,0,0,0|2,0,0]=4 10861 B13R0.1120 CCC(CO)CNCCCCC(C)O 95c267eb8728825f2c56995d0a9a09b4 [0,2,0,0,0,0|1,0,0]=3 10862 B13R0.1120 CCC(CO)CNCCCC[C@@H](C)O 0307a3818c95e6fbbc13f4af2a2ad1b5 [0,2,0,0,0,0|1,0,0]=3 10863 B13R0.1120 CCC(CO)NCCCCCC(C)C 727b2f40d9d57b08746bd778a415c73b [0,2,0,0,0,0|2,0,0]=4 10864 B13R0.1120 CCC(COCCCCC(C)C)OC 6c429690b0f03a2a890590728d706657 [0,2,0,0,0,0|2,0,0]=4 10865 B13R0.1120 CCN(CC)CCCCNCC(C)O d812f59155886497df71f630cf87bb07 [0,2,0,0,0,0|2,0,0]=4 10866 B13R0.1120 CCN(CC)CCCCNC[C@@H](C)O dc54446d35c0466904521bc0c0a81764 [0,2,0,0,0,0|2,0,0]=4 10867 B13R0.1120 CCN(CC)CCCCNC[C@H](C)O a86be014fbff52e5f6493b027822ee49 [0,2,0,0,0,0|2,0,0]=4 10868 B13R0.1120 CCN(CC)CCCNCCC(C)O 49969b4b2d09ef6b2664a2368b0e88bd [0,2,0,0,0,0|2,0,0]=4 10869 B13R0.1120 CCN(CC)CCCNCC[C@@H](C)O e5d0d95f52911b161a467c912e0f43ca [0,2,0,0,0,0|2,0,0]=4 10870 B13R0.1120 CCN(CC)CCCNCC[C@H](C)O 5647e0768f3f50474c1052b680fa9c79 [0,2,0,0,0,0|2,0,0]=4 10871 B13R0.1120 CCN(CC)CCNCCCC(C)O 5a13f99ed2e3523bc365296237004c25 [0,2,0,0,0,0|2,0,0]=4 10872 B13R0.1120 CC[C@@H](CO)NCCCCCC(C)C 58bb2df0c77ab04a1693588fba3a27dc [0,2,0,0,0,0|2,0,0]=4 10873 B13R0.1120 CC[C@H](CO)NCCCCCC(C)C 330703497cd4602021477822971da35c [0,2,0,0,0,0|2,0,0]=4 10874 B13R0.1120 COC(CCCCNCC(C)O)OC 8df9a91911bd127adf08d3ecf095230d [0,2,0,0,0,0|2,0,0]=4 10875 B13R0.1120 COC(CCCCNC[C@@H](C)O)OC 34a453adb602bf64fd39bcb49a85820f [0,2,0,0,0,0|2,0,0]=4 10876 B13R0.1120 COC(CCCCNC[C@H](C)O)OC a09db2b2a94a03a6e592be5ff8697ceb [0,2,0,0,0,0|2,0,0]=4 10877 B13R0.1120 COC(CCCNCCC(C)O)OC a2fe835c4d50142c465b55e7b80a1f28 [0,2,0,0,0,0|2,0,0]=4 10878 B13R0.1120 COC(CCCNCC[C@@H](C)O)OC a53ceedebb9bbf3485b495af16f005c8 [0,2,0,0,0,0|2,0,0]=4 10879 B13R0.1120 COC(CCCNCC[C@H](C)O)OC cebeb41f3fb8bc292a8c171dac7e06fd [0,2,0,0,0,0|2,0,0]=4 10880 B13R0.1120 COC(CCNCCCC(C)O)OC 5927b6e8ced9f5f1e74a2abe5e67a424 [0,2,0,0,0,0|2,0,0]=4 10881 B13R0.1120 COC(CNCCCCC(C)O)OC 02d7e292efb4d228723fd81d245e4481 [0,2,0,0,0,0|2,0,0]=4 10882 B13R0.1120 COC(CNCCCC[C@@H](C)O)OC 4b6b4dc4a79945504d96b7292f427915 [0,2,0,0,0,0|2,0,0]=4 10883 B13R0.1120 CO[C@@H](CO)CNCCCCC(C)O 7feb78678e38d4e522a7f877ec3d0a62 [0,2,0,0,0,0|2,0,0]=4 10884 B13R0.1120 CO[C@@H](CO)CNCCCC[C@@H](C)O 4ed284a8b16b010df31663c222434fe6 [0,2,0,0,0,0|2,0,0]=4 10885 B13R0.1120 C[C@@H](O)CCCCNCC(CO)CO 4b60c193c6e2ae45554908a6605654b4 [0,2,0,0,0,0|2,0,0]=4 10886 B13R0.1120 C[C@@H](O)CNCCCCC(CO)CO c923197268c89c36803f4caa13f85197 [0,2,0,0,0,0|2,0,0]=4 10887 B13R0.1120 C[C@H](O)CNCCCCC(CO)CO 2bde48c0fd268ab88d8b38fd5d501faf [0,2,0,0,0,0|2,0,0]=4 10888 B13R0.1 C=C(C)CCCC(C)CCOCCC 22ada021c401da41c9a2e235bc55feb8 [0,2,0,0,0,0|1,0,1]=4 10889 B13R0.1 C=C(C)CCCN(C)CCCCCC 72d385bf2cb771159bf67a59f45b9549 [0,2,0,0,0,0|1,0,1]=4 10890 B13R0.1 C=C(C)CCNC(C)CCCCCC 553e49a7a966254ef5862d7dc4a035d4 [0,2,0,0,0,0|1,0,1]=4 10891 B13R0.1 C=C(C)CCN[C@@H](C)CCCCCC b7c8c9bb44370b84c5158975bb7abcd6 [0,2,0,0,0,0|1,0,1]=4 10892 B13R0.1 C=C(C)CCN[C@H](C)CCCCCC fc06e59ed1b5cf507d29f1df5e3c24a2 [0,2,0,0,0,0|1,0,1]=4 10893 B13R0.1 C=C(C)CCOC(C)CCCCCC f307f70ccccfe20dbdc9801dfe79d72e [0,2,0,0,0,0|1,0,1]=4 10894 B13R0.1 C=C(C)CCO[C@@H](C)CCCCCC c0e079b5538ef1dc99e773b9e26b1970 [0,2,0,0,0,0|1,0,1]=4 10895 B13R0.1 C=C(C)CCO[C@H](C)CCCCCC 059691b0239641ee8765214e8106cb64 [0,2,0,0,0,0|1,0,1]=4 10896 B13R0.1 C=C(C)COCC(C)CCCCCC fc222ab0dd526b6bb1a423e3ff85634d [0,2,0,0,0,0|1,0,1]=4 10897 B13R0.1 C=CCCCCN(C)CCCC(C)O 24026ce4259ad6f4b19347974881c5c3 [0,2,0,0,0,0|0,0,2]=4 10898 B13R0.1 CC(C)CCCC(C)CCNCCBr 6bea491c847f7d54c7401f61a8e6c5c2 [0,2,0,0,0,0|2,0,0]=4 10899 B13R0.1 CC(C)CCCC(C)CCNCCF 5fea8a312566629315c1f8719b3b56e7 [0,2,0,0,0,0|2,0,0]=4 10900 B13R0.1 CC(C)CCCC(C)CCNCCI 3aae9973037962264f21f0ed733df146 [0,2,0,0,0,0|2,0,0]=4 10901 B13R0.1 CC(C)CCCC(C)CCNCCO babd18b1313ee97542bcb53f00e7aae0 [0,2,0,0,0,0|2,0,0]=4 10902 B13R0.1 CC(C)CCCC(C)CCNCCS 7cc831521903a93fd9523d5367121573 [0,2,0,0,0,0|2,0,0]=4 10903 B13R0.1 CC(C)CCCC(C)CCOCCF 9687ebc2856c520e0e553074cbf3591b [0,2,0,0,0,0|2,0,0]=4 10904 B13R0.1 CC(C)CCCC(C)CCOCCS 2835c3e9d84ee68038a47ff9c169c8f0 [0,2,0,0,0,0|2,0,0]=4 10905 B13R0.1 CC(C)CCCC(C)NCCCCF 5e23a3c3982b6e02313a53565661764c [0,2,0,0,0,0|2,0,0]=4 10906 B13R0.1 CC(C)CCCC(C)NCCCCO f694abbeccdd1b95c38930c73c49d59d [0,2,0,0,0,0|2,0,0]=4 10907 B13R0.1 CC(C)CCCC(C)OCCCCF 9dac4c8c596307509d23d2c111f6d088 [0,2,0,0,0,0|2,0,0]=4 10908 B13R0.1 CC(C)CCCN(C)CCCCCO a9ea561e89926de85f9c37a43390cc5d [0,2,0,0,0,0|2,0,0]=4 10909 B13R0.1 CC(C)CCC[C@H](C)CCOCCF 28d068eb2076c329f3eb5379ef0633a1 [0,2,0,0,0,0|2,0,0]=4 10910 B13R0.1 CC(C)CCC[C@H](C)CCOCCS 59432772918a482a6aeec4bfb779921a [0,2,0,0,0,0|2,0,0]=4 10911 B13R0.1 CC(O)CCCN(C)CCCCCO 0b322826b64ce14c4bcfbad5d64b4ffe [0,2,0,0,0,0|1,0,0]=3 10912 B13R0.1 CC(O)CCCN(C)CCOCCO e6dd9313104a5813f35eb0c4794b511a [0,2,0,0,0,0|2,0,0]=4 10913 B13R0.1 CC(O)CCNC(=O)CCCCCF 0cd80b44cedd825526e99929ff292067 [0,2,0,0,0,0|1,0,1]=4 10914 B13R0.1 CC(O)CCNC(=O)CCCCCO 3f9f40299115e286622b176994ca0cb5 [0,2,0,0,0,0|1,0,1]=4 10915 B13R0.1 CC(O)CCNC(=O)CCCCCS f5d816bc169ad3fec8217ad01106a91e [0,2,0,0,0,0|1,0,1]=4 10916 B13R0.1 CCCCCCC(=O)NCCC(C)C cbca19dc37427deed8fd5a367763b4de [0,2,0,0,0,0|1,0,1]=4 10917 B13R0.1 CCCCCCC(=O)NCCC(C)O 72e3592a17cc2c2ef771ca9513fffa69 [0,2,0,0,0,0|0,0,1]=3 10918 B13R0.1 CCCCCCC(=O)NCC[C@@H](C)O 15447ff52a323e4cd322f6f3c5add060 [0,2,0,0,0,0|0,0,1]=3 10919 B13R0.1 CCCCCCC(=O)NCC[C@H](C)O 49ee76b27e4206dae6d8975725aef122 [0,2,0,0,0,0|0,0,1]=3 10920 B13R0.1 CCCCCCC(C)CCOC(C)C f3e58dd93976245c13184114793311aa [0,2,0,0,0,0|1,0,0]=3 10921 B13R0.1 CCCCCCC(C)COCC(=O)O e8cb84463d4c42a53af0231f0184c636 [0,2,0,0,0,0|1,0,1]=4 10922 B13R0.1 CCCCCCC(C)COCC(C)C de2a7f6e140df75e31cde2783b7f2a8c [0,2,0,0,0,0|1,0,0]=3 10923 B13R0.1 CCCCCCC(C)COCC(F)F 9e5d5ccaf8e6b6b3d5b57bf700ca93d2 [0,2,0,0,0,0|2,0,0]=4 10924 B13R0.1 CCCCCCC(C)COCN(C)C 2a04994dd613b36b6f66850fe877e8d6 [0,2,0,0,0,0|2,0,0]=4 10925 B13R0.1 CCCCCCC(C)NCCC(=O)C f9d5e71c1fe16851fc70d2ba2666af17 [0,2,0,0,0,0|0,0,2]=4 10926 B13R0.1 CCCCCCC(C)NCCC(=O)O f76c107b5556bc38336392a31d94b7a6 [0,2,0,0,0,0|1,0,1]=4 10927 B13R0.1 CCCCCCC(C)NCCC(C)C 4bbd6827386594d7478a2474404ca225 [0,2,0,0,0,0|1,0,0]=3 10928 B13R0.1 CCCCCCC(C)NCCC(C)O 3da08a759ac6188349a584781836fa40 [0,2,0,0,0,0|0,0,0]=2 10929 B13R0.1 CCCCCCC(C)NCCC(F)F ab49f97e3f0165af129d74a927cd92ce [0,2,0,0,0,0|2,0,0]=4 10930 B13R0.1 CCCCCCC(C)NCCN(C)C 6337fbce655a4a2b96639f470ee17588 [0,2,0,0,0,0|2,0,0]=4 10931 B13R0.1 CCCCCCC(C)NCCS(=O)C 773b55d403e139b1055073d228d99b57 [0,2,0,0,0,0|1,0,1]=4 10932 B13R0.1 CCCCCCC(C)NCCS(=O)O f4a627b8264d8beadbd5747deb055781 [0,2,0,0,0,0|2,0,0]=4 10933 B13R0.1 CCCCCCC(C)NCC[C@@H](C)O 01f8a71ade9ca431a0460fc7f3acc0f5 [0,2,0,0,0,0|0,0,0]=2 10934 B13R0.1 CCCCCCC(C)NCC[C@H](C)O 1e691bb241fade97ff33cd522614ac67 [0,2,0,0,0,0|0,0,0]=2 10935 B13R0.1 CCCCCCC(C)NCOC(C)C ed31cafd179c48b060a250f386168080 [0,2,0,0,0,0|2,0,0]=4 10936 B13R0.1 CCCCCCC(C)OCCC(=O)C 147b8a54d9ded1eebcb47adf01061300 [0,2,0,0,0,0|0,0,2]=4 10937 B13R0.1 CCCCCCC(C)OCCC(=O)O fbf74add55c316cbf09693fb9af81d13 [0,2,0,0,0,0|1,0,1]=4 10938 B13R0.1 CCCCCCC(C)OCCC(C)C f28aa8630fd15882cee86df807beb947 [0,2,0,0,0,0|1,0,0]=3 10939 B13R0.1 CCCCCCC(C)OCCC(F)F 77c4d48a45a94346e46dba6d43dfc558 [0,2,0,0,0,0|2,0,0]=4 10940 B13R0.1 CCCCCCC(C)OCCN(C)C 1523ec39d43e3788ee27ef3c95d9cd78 [0,2,0,0,0,0|2,0,0]=4 10941 B13R0.1 CCCCCCC(C)OCCS(=O)C 442cbf38baa882030beb0f0c2ff1c623 [0,2,0,0,0,0|1,0,1]=4 10942 B13R0.1 CCCCCCC(C)OCOC(C)C dd38e55e191ac3dfdcd6cac8718a344b [0,2,0,0,0,0|2,0,0]=4 10943 B13R0.1 CCCCCCN(C)CCCC(=O)C 2f9d53a2c3c662f2e1c160f0399c99d8 [0,2,0,0,0,0|0,0,2]=4 10944 B13R0.1 CCCCCCN(C)CCCC(=O)O dfe38c98b9c6b8e2674a2b55eff76e67 [0,2,0,0,0,0|1,0,1]=4 10945 B13R0.1 CCCCCCN(C)CCCC(C)C 43a1f62abea288609d6d75a3b58aabf4 [0,2,0,0,0,0|1,0,0]=3 10946 B13R0.1 CCCCCCN(C)CCCC(C)O 8b3009c5ca13cacf3dbf9bcabb2470ef [0,2,0,0,0,0|0,0,0]=2 10947 B13R0.1 CCCCCCN(C)CCCN(C)C 9b00a81a9b6da98dcda97d634cd7b2d3 [0,2,0,0,0,0|2,0,0]=4 10948 B13R0.1 CCCCCCN(C)CCOC(C)C 635e2d5b005edce02cc2362fdf536779 [0,2,0,0,0,0|2,0,0]=4 10949 B13R0.1 CCCCCCN(C)CCSC(C)C 11f64b53b5c76e6a894a02072bf89d16 [0,2,0,0,0,0|2,0,0]=4 10950 B13R0.1 CCCCCC[C@@H](C)NCCC(=O)C 76d81adc18f93d7b2c06de0170d56a00 [0,2,0,0,0,0|0,0,2]=4 10951 B13R0.1 CCCCCC[C@@H](C)NCCC(=O)O a1963d6d70dabce63f9c8954e43ef9cc [0,2,0,0,0,0|1,0,1]=4 10952 B13R0.1 CCCCCC[C@@H](C)NCCC(C)C 576d2756884930e881aa2fec27d66160 [0,2,0,0,0,0|1,0,0]=3 10953 B13R0.1 CCCCCC[C@@H](C)NCCC(C)O 16355ce816e1d62ce7df1bc1b50a9ff9 [0,2,0,0,0,0|0,0,0]=2 10954 B13R0.1 CCCCCC[C@@H](C)NCCN(C)C 850ccc2d2dc536bdf4abac12af26560e [0,2,0,0,0,0|2,0,0]=4 10955 B13R0.1 CCCCCC[C@@H](C)NCCS(=O)C 8aa14c50c1011189e5db896ed7ce5fbf [0,2,0,0,0,0|1,0,1]=4 10956 B13R0.1 CCCCCC[C@@H](C)NCOC(C)C f9a8031ffd73d26dc7de6dd2fa9b12a0 [0,2,0,0,0,0|2,0,0]=4 10957 B13R0.1 CCCCCC[C@@H](C)OCCC(=O)C d7f42c44b05ad4e66f0aa74339b7d311 [0,2,0,0,0,0|0,0,2]=4 10958 B13R0.1 CCCCCC[C@@H](C)OCCC(=O)O cd0d197c68b78adbfbefc8bbee6ddfb0 [0,2,0,0,0,0|1,0,1]=4 10959 B13R0.1 CCCCCC[C@@H](C)OCCC(C)C b3a09b8689e601afa8d633cbf17d24fd [0,2,0,0,0,0|1,0,0]=3 10960 B13R0.1 CCCCCC[C@@H](C)OCCN(C)C a1f18318b0a78201ef63697adbba34e7 [0,2,0,0,0,0|2,0,0]=4 10961 B13R0.1 CCCCCC[C@@H](C)OCCS(=O)C 3e07017a035a47bd72184a220bee0560 [0,2,0,0,0,0|1,0,1]=4 10962 B13R0.1 CCCCCC[C@@H](C)OCOC(C)C a16f6b186477929cf8303d679feffc0e [0,2,0,0,0,0|2,0,0]=4 10963 B13R0.1 CCCCCC[C@H](C)NCCC(=O)C 6c259aad09b4cc17a39bc7386bc700db [0,2,0,0,0,0|0,0,2]=4 10964 B13R0.1 CCCCCC[C@H](C)NCCC(=O)O ec61bb383850e7ae5e169be113997cbf [0,2,0,0,0,0|1,0,1]=4 10965 B13R0.1 CCCCCC[C@H](C)NCCC(C)C 717f6c9aebb996b770a5b73e93f3fe8b [0,2,0,0,0,0|1,0,0]=3 10966 B13R0.1 CCCCCC[C@H](C)NCCC(C)O 804b74beced8b5bfc50530882ba4a02a [0,2,0,0,0,0|0,0,0]=2 10967 B13R0.1 CCCCCC[C@H](C)NCCN(C)C e0adccbcb61970b493c76bfc9d40a921 [0,2,0,0,0,0|2,0,0]=4 10968 B13R0.1 CCCCCC[C@H](C)NCCS(=O)C cb2bbafa1c544966d2791528cc6ea552 [0,2,0,0,0,0|1,0,1]=4 10969 B13R0.1 CCCCCC[C@H](C)NCOC(C)C c9cc82c6a65cc17d09ef6ef057a0adff [0,2,0,0,0,0|2,0,0]=4 10970 B13R0.1 CCCCCC[C@H](C)OCCC(=O)C d5a77074228994f4898d383b40655596 [0,2,0,0,0,0|0,0,2]=4 10971 B13R0.1 CCCCCC[C@H](C)OCCC(=O)O a4ab9929f11ea125410c3c3e11f89276 [0,2,0,0,0,0|1,0,1]=4 10972 B13R0.1 CCCCCC[C@H](C)OCCC(C)C 623bbab48562dd2783e531c6fb9339b5 [0,2,0,0,0,0|1,0,0]=3 10973 B13R0.1 CCCCCC[C@H](C)OCCN(C)C 195684c7e4173874af155071a25c1058 [0,2,0,0,0,0|2,0,0]=4 10974 B13R0.1 CCCCCC[C@H](C)OCCS(=O)C a1aea0eb52d17aba8cb6d1c5ec233d69 [0,2,0,0,0,0|1,0,1]=4 10975 B13R0.1 CCCCCC[C@H](C)OCOC(C)C cd979951541fd78f5da6f7365556b1bf [0,2,0,0,0,0|2,0,0]=4 10976 B13R0.1 CCCCCNC(=O)CCCC(C)C 766d1a53eb1b5d50f5620f833adb8ca4 [0,2,0,0,0,0|1,0,1]=4 10977 B13R0.1 CCCCCNC(=O)CNCC(C)O 0f27b166a93fde8fa3068c5227d332eb [0,2,0,0,0,0|1,0,1]=4 10978 B13R0.1 CCCCCNC(=O)CNC[C@@H](C)O 8cd4e626844cb61e0eba753579c26c62 [0,2,0,0,0,0|1,0,1]=4 10979 B13R0.1 CCCCCNC(=O)CNC[C@H](C)O b81f714eb0070e7ba35ad95214aed407 [0,2,0,0,0,0|1,0,1]=4 10980 B13R0.1 CCCCCNC(=O)NCCC(C)O c6219ff38a10588dbf5eaacb7b78fe5d [0,2,0,0,0,0|1,0,1]=4 10981 B13R0.1 CCCCCNC(=O)NCC[C@@H](C)O d86c97312300c636b79fc10822c5a530 [0,2,0,0,0,0|1,0,1]=4 10982 B13R0.1 CCCCCNC(=O)NCC[C@H](C)O 8228b49330728ad844558c11cc06be04 [0,2,0,0,0,0|1,0,1]=4 10983 B13R0.1 CCCCCNC(=S)NCCC(C)O 8e31ce5df8b5d940799c5b7a876d17b6 [0,2,0,0,0,0|1,0,1]=4 10984 B13R0.1 CCCCCNC(=S)NCC[C@@H](C)O 641c18d6430092616821c17d46705f1e [0,2,0,0,0,0|1,0,1]=4 10985 B13R0.1 CCCCCNC(=S)NCC[C@H](C)O dfb4a26d41a0a037e4a5c0e96caeaff5 [0,2,0,0,0,0|1,0,1]=4 10986 B13R0.1 CCCCCNC(C)CCCC(C)C d56643a78f5f1869fa15416b1dbbc2e1 [0,2,0,0,0,0|1,0,0]=3 10987 B13R0.1 CCCCCOC(C)CCCC(C)C fd4fb9d06127f9c617e51f010fb580d8 [0,2,0,0,0,0|1,0,0]=3 10988 B13R0.1 CCCCOCC(=O)NCCC(C)O 5519151b1bab7029229826d1c459b4cd [0,2,0,0,0,0|1,0,1]=4 10989 B13R0.1 CCCCOCC(=O)NCC[C@@H](C)O acfa9d0ef6a82fba6c17307971c8fc85 [0,2,0,0,0,0|1,0,1]=4 10990 B13R0.1 CCCCOCC(=O)NCC[C@H](C)O 7e4d35c0709002dbff16c971ba7c8964 [0,2,0,0,0,0|1,0,1]=4 10991 B13R0.1 CCCCOCC(C)OCCC(C)C e1f3f1c69f1aa7e52d86cc60ac3c6685 [0,2,0,0,0,0|2,0,0]=4 10992 B13R0.1 CCCCSCC(=O)NCCC(C)O 1b9f440ce58736b4f74607ba9e79a24e [0,2,0,0,0,0|1,0,1]=4 10993 B13R0.1 CCCCSCC(=O)NCC[C@@H](C)O 93530d7ac99749ba69f48bc7fcbe1e0d [0,2,0,0,0,0|1,0,1]=4 10994 B13R0.1 CCCCSCC(=O)NCC[C@H](C)O 5fe225aaf5c6154804ac5262abfb9935 [0,2,0,0,0,0|1,0,1]=4 10995 B13R0.1 CCCNCCC(C)CCCC(C)C 637b1956d554c17b421eeba3504a874d [0,2,0,0,0,0|1,0,0]=3 10996 B13R0.1 CCCOCCC(=O)NCCC(C)O 5b6c63fec49094d4d372b5a586594bb6 [0,2,0,0,0,0|1,0,1]=4 10997 B13R0.1 CCCOCCC(=O)NCC[C@@H](C)O 0d21c460cc70218abffd03418512a9cd [0,2,0,0,0,0|1,0,1]=4 10998 B13R0.1 CCCOCCC(=O)NCC[C@H](C)O fe86cfe7073f23b852d1be090dae5829 [0,2,0,0,0,0|1,0,1]=4 10999 B13R0.1 CCCOCCC(C)CCCC(C)C 9fe00f1fc6c7d3e8f9e2a3b0bb014354 [0,2,0,0,0,0|1,0,0]=3 11000 B13R0.1 CCCOCC[C@@H](C)CCCC(C)C 17640dcdfba3781efd35a729e0098936 [0,2,0,0,0,0|1,0,0]=3 11001 B13R0.1 CCOCCNC(C)CCCC(C)C d1be1b65e42a6fb9ce5292587e67b6a5 [0,2,0,0,0,0|2,0,0]=4 11002 B13R0.1 CCOCCOC(C)CCCC(C)C 6355aef495feab939cadb4febd88f3b2 [0,2,0,0,0,0|2,0,0]=4 11003 B13R0.1 CCSCCNC(C)CCCC(C)C f185ba3abd4cc39b9ca8260596ecbca3 [0,2,0,0,0,0|2,0,0]=4 11004 B13R0.1 CCSCCOC(C)CCCC(C)C 72884d80c925139f7befea7e491ba0fd [0,2,0,0,0,0|2,0,0]=4 11005 B13R0.1 COCCCCN(C)CCCC(C)C e18ebe1d9ddac34548ebc8129ff00304 [0,2,0,0,0,0|2,0,0]=4 11006 B13R0.1 COCCCCN(C)CCCC(C)O 8f3966588e7773ffc2d190fe6aaae2a1 [0,2,0,0,0,0|1,0,0]=3 11007 B13R0.1 COCCCNC(C)CCCC(C)C 863713bcd0542de57b67065ca64d00fd [0,2,0,0,0,0|2,0,0]=4 11008 B13R0.1 COCCCOC(C)CCCC(C)C 0c858ee78af4dd797043a3e3a56eebe4 [0,2,0,0,0,0|2,0,0]=4 11009 B13R0.1 COCNCCC(C)CCCC(C)C c6cf4f86c6732c64dfae4a89d173f195 [0,2,0,0,0,0|2,0,0]=4 11010 B13R0.1 COCOCCC(C)CCCC(C)C 63db7c6358017c10b98af431c3ffb0cd [0,2,0,0,0,0|2,0,0]=4 11011 B13R0.1 COCOCC[C@@H](C)CCCC(C)C 1ecfba8aff0cd06caaa907c4f1f30f16 [0,2,0,0,0,0|2,0,0]=4 11012 B13R0.1 CSCCCNC(C)CCCC(C)C 554bb23dc0381c261339ed23d3123900 [0,2,0,0,0,0|2,0,0]=4 11013 B13R0.1 CSCCCOC(C)CCCC(C)C fb4c7428827bbf6457fefcf9379d0459 [0,2,0,0,0,0|2,0,0]=4 11014 B13R0.1 CSCNCCC(C)CCCC(C)C d4992ccfa98d3b9ac2701aea7efe99f6 [0,2,0,0,0,0|2,0,0]=4 11015 B13R0.1 CSCOCCC(C)CCCC(C)C 23325c6dc71dca761c6c25296d211b57 [0,2,0,0,0,0|2,0,0]=4 11016 B13R0.1 CSCOCC[C@@H](C)CCCC(C)C d61c2befc11b4e24856626ff96951787 [0,2,0,0,0,0|2,0,0]=4 11017 B13R0.1 C[C@@H](O)CCNC(=O)CCCCCF 1e3f9415fab03f20baec5d25209bfa6a [0,2,0,0,0,0|1,0,1]=4 11018 B13R0.1 C[C@@H](O)CCNC(=O)CCCCCO 8249742862f3d6e7eb4b8515663d92e9 [0,2,0,0,0,0|1,0,1]=4 11019 B13R0.1 C[C@@H](O)CCNC(=O)CCCCCS 0b78f4071f4ea1e26fca659c9338d6b3 [0,2,0,0,0,0|1,0,1]=4 11020 B13R0.1 C[C@H](O)CCNC(=O)CCCCCF cd772876401e2f450137d6f43649a73e [0,2,0,0,0,0|1,0,1]=4 11021 B13R0.1 C[C@H](O)CCNC(=O)CCCCCO 9c8d303879553b3627f41c2bd0997f1b [0,2,0,0,0,0|1,0,1]=4 11022 B13R0.1 C[C@H](O)CCNC(=O)CCCCCS d0cfafab2ab2d37b5ddba2a0e6d9bc87 [0,2,0,0,0,0|1,0,1]=4 11023 B13R0.139 CC(O)CCN(C)C(C)CCCCO 8c5306c86a35f56ec8630dac842b5569 [0,2,0,0,0,0|2,0,0]=4 11024 B13R0.139 CCCCCC(=O)N(C)CCC(C)O 7218ea36a7885eefc1e6fc4beef9e994 [0,2,0,0,0,0|1,0,1]=4 11025 B13R0.139 CCCCCC(C)N(C)CCC(C)C 6c53a4aa2d122f0c241dfc5f1646cb5b [0,2,0,0,0,0|2,0,0]=4 11026 B13R0.139 CCCCCC(C)N(C)CCC(C)O 22dea40801a9b9c8b22dee31970c8bd5 [0,2,0,0,0,0|1,0,0]=3 11027 B13R0.139 CCCCCC(O)C(=O)NCC(C)O bad10ff7d7a221dc3b1ddc07f779f904 [0,2,0,0,0,0|1,0,1]=4 11028 B13R0.139 CCCCCC(O)C(=O)NC[C@@H](C)O 0ebb8c3e47d23704868e185dda6b489f [0,2,0,0,0,0|1,0,1]=4 11029 B13R0.139 CCCCCC(O)C(=O)NC[C@H](C)O 9bfccf2da338b00b014f68a1708e2ed2 [0,2,0,0,0,0|1,0,1]=4 11030 B13R0.139 CCCCCN(C)C(=O)CCC(C)O 2c5526b5a3c7819b87edfe90af0815b4 [0,2,0,0,0,0|1,0,1]=4 11031 B13R0.139 CCCCCN(C)C(C)CCC(C)C 9fc262564bc6f3186469d45648d636fa [0,2,0,0,0,0|2,0,0]=4 11032 B13R0.139 CCCCC[C@H](C)N(C)CCC(C)C 5466a1d1316ec9f5aeacfcfe0415f6e7 [0,2,0,0,0,0|2,0,0]=4 11033 B13R0.139 CCCCC[C@H](C)N(C)CCC(C)O f4a61799660a77fca498f870f9d1d9ff [0,2,0,0,0,0|1,0,0]=3 11034 B13R0.153 C#CC(CCCCC)OCCC(C)C 3e2140d6eeef8d2e479143dc3400ae72 [0,2,0,0,0,0|2,0,0]=4 11035 B13R0.153 C#C[C@H](CCCCC)OCCC(C)C 75342d14e408eb1050fbec1804ebb622 [0,2,0,0,0,0|2,0,0]=4 11036 B13R0.153 C=CC(CCCCC)OCCC(C)C d41910f269cbedc9dce88fee65f09118 [0,2,0,0,0,0|2,0,0]=4 11037 B13R0.153 C=C[C@H](CCCCC)OCCC(C)C 11e94b6d2a62c53cd85eba0cdd25b296 [0,2,0,0,0,0|2,0,0]=4 11038 B13R0.153 CCCCCC(CC)COCC(C)C 924861b4d3a1d976b896b081702eea28 [0,2,0,0,0,0|2,0,0]=4 11039 B13R0.153 CCCCCC(CC)OCCC(C)C 8ee878318a382cce8b74956ea8ccbcc8 [0,2,0,0,0,0|2,0,0]=4 11040 B13R0.153 CCCCC[C@H](CC)OCCC(C)C 8003cb49051009cbe245e8ea28d7ab88 [0,2,0,0,0,0|2,0,0]=4 11041 B13R0.153 CCN(CCCCO)CCCC(C)O 2b54f2ebbb64be4a4200e8319e505b42 [0,2,0,0,0,0|2,0,0]=4 11042 B13R0.153 CCN(CCCOC)CCCC(C)O d2bcd8e50cfdcc69c749be2478fddf47 [0,2,0,0,0,0|2,0,0]=4 11043 B13R0.153 CCOCCN(CC)CCCC(C)O a7d29d0833988b16dae40e767e2e9dee [0,2,0,0,0,0|2,0,0]=4 11044 B13R0.194 CC(CCCCO)NCCC(O)CO cc89325b4d42eeda4a2ff23e3adf593d [0,2,0,0,0,0|2,0,0]=4 11045 B13R0.194 CC(CCCCO)NCC[C@@H](C)CO 74951fc1f1961ec9437fdc27a105a6b7 [0,2,0,0,0,0|2,0,0]=4 11046 B13R0.194 CC(CO)CCNC(C)CCCCO 1ecf6d91cc23cf202a6772d745156895 [0,2,0,0,0,0|2,0,0]=4 11047 B13R0.194 CCCCCC(=O)CNCC(C)CO 5b5a246167ddddb6f5f1fb9efc3f52e0 [0,2,0,0,0,0|1,0,1]=4 11048 B13R0.194 CCCCCC(=O)CNCC(O)CC bfa61c1d691bdb92cd1c00ca9154b8e2 [0,2,0,0,0,0|1,0,1]=4 11049 B13R0.194 CCCCCC(=O)CNCC(O)CO 4856e9b83eea179479a9e3b50635ea0d [0,2,0,0,0,0|1,0,1]=4 11050 B13R0.194 CCCCCC(=O)CNC[C@@H](C)OC dbd36ec07bfc8a0dc9f6c381f6f94cbd [0,2,0,0,0,0|1,0,1]=4 11051 B13R0.194 CCCCCC(=O)CNC[C@@H](O)CO b7de974d3dfb02454d914e1f89901049 [0,2,0,0,0,0|1,0,1]=4 11052 B13R0.194 CCCCCC(=O)CNC[C@H](C)CO d0b8bb5eb7e9f768f2626569c57afd95 [0,2,0,0,0,0|1,0,1]=4 11053 B13R0.194 CCCCCC(=O)CNC[C@H](C)OC cae1871d6d2f11828b18a6e17345caa2 [0,2,0,0,0,0|1,0,1]=4 11054 B13R0.194 CCCCCC(=O)CNC[C@H](O)CC c5cf668784927ea1184a61c6d5d79a1c [0,2,0,0,0,0|1,0,1]=4 11055 B13R0.194 CCCCCC(=O)CNC[C@H](O)CO 091d6af20c689c0e9dab57108c7794d2 [0,2,0,0,0,0|1,0,1]=4 11056 B13R0.194 CCCCCC(=O)COCC(C)OC ca86ca946bfe609a6416296fd85f0b76 [0,2,0,0,0,0|1,0,1]=4 11057 B13R0.194 CCCCCC(=O)COC[C@@H](C)OC f3bbf459b83456dbec77e7b62c34e1c2 [0,2,0,0,0,0|1,0,1]=4 11058 B13R0.194 CCCCCC(=O)COC[C@H](C)OC 9f12dc05f45099ca579c85e5d3408271 [0,2,0,0,0,0|1,0,1]=4 11059 B13R0.194 CCCCCC(=O)NCCC(C)CO 70cf6eb456459afeeb96c5bdd1dbaec5 [0,2,0,0,0,0|1,0,1]=4 11060 B13R0.194 CCCCCC(=O)NCCC(O)CO 147bc8cccf5b8e903236b5ec81206c42 [0,2,0,0,0,0|1,0,1]=4 11061 B13R0.194 CCCCCC(=O)NCC[C@@H](C)CO 86bf667954bf3ccc148aca61f132528a [0,2,0,0,0,0|1,0,1]=4 11062 B13R0.194 CCCCCC(C)COCC(C)C#N aeaafbc77bb6fac5ef657f774cabe3da [0,2,0,0,0,0|2,0,0]=4 11063 B13R0.194 CCCCCC(C)COCC(C)CC 80d728ec0d10fe7a5fec6dd6fddfd687 [0,2,0,0,0,0|2,0,0]=4 11064 B13R0.194 CCCCCC(C)COCC(C)OC d97fc3947a9320f6d1dc32754157930d [0,2,0,0,0,0|1,0,0]=3 11065 B13R0.194 CCCCCC(C)COCC(O)CO 955b72e39256b357d8441fe355d92c85 [0,2,0,0,0,0|1,0,0]=3 11066 B13R0.194 CCCCCC(C)COC[C@@H](C)CC 83693089448e116fc1ba2d2ff65faea0 [0,2,0,0,0,0|2,0,0]=4 11067 B13R0.194 CCCCCC(C)COC[C@@H](C)OC cf90dbae7b3ec457564de2f539ebed1b [0,2,0,0,0,0|1,0,0]=3 11068 B13R0.194 CCCCCC(C)COC[C@@H](O)CO 3c4f872623d2229068e0e4804efb7a2b [0,2,0,0,0,0|1,0,0]=3 11069 B13R0.194 CCCCCC(C)COC[C@H](C)CC 9dc7eee4936dbbb0a0a405c0171aa62f [0,2,0,0,0,0|2,0,0]=4 11070 B13R0.194 CCCCCC(C)COC[C@H](C)OC 23a1aef4cb8bea658ef06a3522753611 [0,2,0,0,0,0|1,0,0]=3 11071 B13R0.194 CCCCCC(C)COC[C@H](O)CO 1ce7739ab034b7aeff6190fb8660479c [0,2,0,0,0,0|1,0,0]=3 11072 B13R0.194 CCCCCC(C)NCCC(C)CC af575a978d2c7c7e73387c04837120ad [0,2,0,0,0,0|2,0,0]=4 11073 B13R0.194 CCCCCC(C)NCCC(C)CO e9aa006f1214d6370b729aecec62f63c [0,2,0,0,0,0|1,0,0]=3 11074 B13R0.194 CCCCCC(C)NCCC(O)CO ccf18b525492674b963678a58796e787 [0,2,0,0,0,0|1,0,0]=3 11075 B13R0.194 CCCCCC(C)NCC[C@@H](C)CO 0056c340b7db39669d270efe5615fd21 [0,2,0,0,0,0|1,0,0]=3 11076 B13R0.194 CCCCCC(C)OCCC(C)CC 5eb7b03e30f99f77eab3878bcfed5ebd [0,2,0,0,0,0|2,0,0]=4 11077 B13R0.194 CCCCCC(C)OCCC(C)OC a4163e51f2525a6262a85705a8c1c079 [0,2,0,0,0,0|1,0,0]=3 11078 B13R0.194 CCCCCC(C)OCCC(S)CC a0e81a83dd43f6cd7cb8fc13230adbf6 [0,2,0,0,0,0|1,1,0]=4 11079 B13R0.194 CCCCCC(C)OCC[C@@H](C)CC dca8ae3004fd5286239e283c46c35a80 [0,2,0,0,0,0|2,0,0]=4 11080 B13R0.194 CCCCC[C@@H](C)OCCC(C)CC 6fd167c5601181057beb7f05861bc19c [0,2,0,0,0,0|2,0,0]=4 11081 B13R0.194 CCCCC[C@H](C)NCCC(C)CC 611a98dbe0df11ec8b414f133f358a34 [0,2,0,0,0,0|2,0,0]=4 11082 B13R0.194 CCCCC[C@H](C)NCCC(C)CO c2ba0a9fdd6680b07ac4a93701e23fbc [0,2,0,0,0,0|1,0,0]=3 11083 B13R0.194 CCCCC[C@H](C)NCCC(O)CO d75c86dfcdee5ea41e918035309e8030 [0,2,0,0,0,0|1,0,0]=3 11084 B13R0.194 CCCCC[C@H](C)NCC[C@@H](C)CO bf26eebed33348fd3c59e36c073ac011 [0,2,0,0,0,0|1,0,0]=3 11085 B13R0.194 CCCCC[C@H](C)OCCC(C)CC 16ffd8276c20c470f50c477a01d2f400 [0,2,0,0,0,0|2,0,0]=4 11086 B13R0.194 CCCCC[C@H](C)OCCC(C)OC 4955a3cdc146f40e01f4bd08a748aeeb [0,2,0,0,0,0|1,0,0]=3 11087 B13R0.194 CCCCC[C@H](C)OCCC(S)CC d00bb3fc5549ed16e351cd76b6987b20 [0,2,0,0,0,0|1,1,0]=4 11088 B13R0.194 CCCCC[C@H](C)OCC[C@@H](C)CC 399c360fb144efbf92e1d53d68b8d804 [0,2,0,0,0,0|2,0,0]=4 11089 B13R0.194 CCCCNC(=O)CCCC(O)CO fc85262b2686cfd8c448445db03729c4 [0,2,0,0,0,0|1,0,1]=4 11090 B13R0.194 CCCOCC(C)COCC(C)OC 6e7369e5a4c8c0589727230be256cf64 [0,2,0,0,0,0|2,0,0]=4 11091 B13R0.194 CCCOCC(C)COCC(O)CO e60556734f64aa176ceefe984edb8e43 [0,2,0,0,0,0|2,0,0]=4 11092 B13R0.194 CCCOCC(C)COC[C@@H](C)OC 014eae8f7964930ed853e2b0491a9af9 [0,2,0,0,0,0|2,0,0]=4 11093 B13R0.194 CCCOCC(C)COC[C@@H](O)CO 975868701f36abf99ec992e42fe25f11 [0,2,0,0,0,0|2,0,0]=4 11094 B13R0.194 CCCOCC(C)COC[C@H](C)OC 8ff62a0fb1954ecd7a4da96534dae077 [0,2,0,0,0,0|2,0,0]=4 11095 B13R0.194 CCCOCC(C)COC[C@H](O)CO e0e18aa39d3b0fcb6fb00b542a71a3b8 [0,2,0,0,0,0|2,0,0]=4 11096 B13R0.331 CCCC(C)CC(=O)NCCC(C)O 760cda34a725ba79844d2d8e825de03f [0,2,0,0,0,0|1,0,1]=4 11097 B13R0.331 CCCC(C)CC(=O)NCC[C@@H](C)O 21a45340863d8fdfdf77a4d7dd5341a5 [0,2,0,0,0,0|1,0,1]=4 11098 B13R0.331 CCCC(C)CC(=O)NCC[C@H](C)O 61a8774fb1069e0ec45bbbfec05213ec [0,2,0,0,0,0|1,0,1]=4 11099 B13R0.331 CCCC(C)CC(C)OCCC(C)C 1f34ca1f244ebdd11f51a9647b933fc7 [0,2,0,0,0,0|2,0,0]=4 11100 B13R0.331 CCCC(C)NC(C)CCCC(C)C 533e80d951efd6b4580a71dea7aa380f [0,2,0,0,0,0|2,0,0]=4 11101 B13R0.331 CCCC(C)OC(C)CCCC(C)C fb443604b4207f304311eee3870c3441 [0,2,0,0,0,0|2,0,0]=4 11102 B13R0.331 CCCC(O)CC(=O)NCCC(C)O 14da52ddae82a966c0af94dd765feb0e [0,2,0,0,0,0|1,0,1]=4 11103 B13R0.331 CCCC(O)CC(=O)NCC[C@@H](C)O d51451af6869560312400f1d087eb3b3 [0,2,0,0,0,0|1,0,1]=4 11104 B13R0.331 CCCC(O)CC(=O)NCC[C@H](C)O 2880a87a99bc0d6fbd9628d35aac0f79 [0,2,0,0,0,0|1,0,1]=4 11105 B13R0.331 CCOC(C)CN(C)CCCC(C)O f6e24881e55edc510ac0892bd62126bf [0,2,0,0,0,0|2,0,0]=4 11106 B13R0.331 COCC(O)CN(C)CCCC(C)O 81e55473ebc9756b46b0b3d46d1e40aa [0,2,0,0,0,0|2,0,0]=4 11107 B13R0.339 CCCCCC(=O)CNC(C)C(C)O 0686cfe8f60703e8f9c7b95c3f7deb91 [0,2,0,0,0,0|1,0,1]=4 11108 B13R0.339 CCCCCC(C)COC(C)C(C)C caac0aff56ee3871cc9dccd68d9a5b91 [0,2,0,0,0,0|2,0,0]=4 11109 B13R0.339 CCCCCC(C)NCC(C)C(C)C 300d49b5cf0e71dcafcec05e7fc92596 [0,2,0,0,0,0|2,0,0]=4 11110 B13R0.339 CCCCCC(C)NCC(O)C(C)C 0bf625f8432730fd56dadf024f682b0e [0,2,0,0,0,0|2,0,0]=4 11111 B13R0.339 CCCCCC(C)OCC(C)C(C)C c33f49b13acd57e94dd3c30e0240823e [0,2,0,0,0,0|2,0,0]=4 11112 B13R0.339 CCCCC[C@@H](C)OCC(C)C(C)C edc2574674e36fe3482e8f1525e0f1f1 [0,2,0,0,0,0|2,0,0]=4 11113 B13R0.339 CCCCC[C@H](C)NCC(C)C(C)C 0859a2b7541b549c374355032ebedccb [0,2,0,0,0,0|2,0,0]=4 11114 B13R0.339 CCCCC[C@H](C)NCC(O)C(C)C 4d81356e5fa9111f23e4f0ac3351e7de [0,2,0,0,0,0|2,0,0]=4 11115 B13R0.339 CCCCC[C@H](C)OCC(C)C(C)C 398f113d2f0a12525a9df5d0a46d68ba [0,2,0,0,0,0|2,0,0]=4 11116 B13R0.1259 CC(O)CCNC(C)(C)CCCCO fc1ad6ca552528777c38b1e2cc5f89f4 [0,2,0,0,0,0|2,0,0]=4 11117 B13R0.1398 CC(C)CCCC(=O)NCCC(C)O 1fd9c0d5149ce50b9b85b6a877919f92 [0,2,0,0,0,0|1,0,1]=4 11118 B13R0.1398 CC(C)CCCC(=O)NCC[C@@H](C)O a070b9edb68fe589a6bf4b1c9048a2ff [0,2,0,0,0,0|1,0,1]=4 11119 B13R0.1398 CC(C)CCCC(=O)NCC[C@H](C)O bdf655d63283465a37f26afe52fa148d [0,2,0,0,0,0|1,0,1]=4 11120 B13R0.1398 CC(C)CCCC(C)CCNC(C)C 2697d6b673e6e27f2d126ed803dad685 [0,2,0,0,0,0|2,0,0]=4 11121 B13R0.1398 CC(C)CCCC(C)CCOC(C)C 3becab12737c658085721cf3dcfa60ca [0,2,0,0,0,0|2,0,0]=4 11122 B13R0.1398 CC(C)CCCC(C)NCCC(C)C e2fd7493eb1c57d9e26ffa968a3e6547 [0,2,0,0,0,0|2,0,0]=4 11123 B13R0.1398 CC(C)CCCC(C)NCCC(C)O cd7e382e6203631a5f2f1d4531810313 [0,2,0,0,0,0|1,0,0]=3 11124 B13R0.1398 CC(C)CCCC(C)OCCC(C)C 7a71bd738678f327a50695688b325020 [0,2,0,0,0,0|2,0,0]=4 11125 B13R0.1398 CC(C)CCC[C@H](C)CCOC(C)C da35fb4f47dcacee33b8db61af97e0f5 [0,2,0,0,0,0|2,0,0]=4 11126 B13R0.1398 CC(O)CCCN(C)CCCN(C)C dac2d6fd47f08b08b6fc53440fe1ed9f [0,2,0,0,0,0|2,0,0]=4 11127 B13R0.1398 CC(O)CCCN(C)CCOC(C)C 42b1ae5365f999276782713f6e37590a [0,2,0,0,0,0|2,0,0]=4 11128 B13R0.54 C#CCCCCCCCCNC(C)C 5d972a4b786905e8226a9debec1ac8ed [0,2,0,0,0,0|1,0,1]=4 11129 B13R0.54 C#CCCCCCCCCOC(C)C e2219c6b1a5268aa1f8c9c85b3c302fb [0,2,0,0,0,0|1,0,1]=4 11130 B13R0.54 C#CCCCCCCCNCC(C)C 81b7e25ca424f5e3b620261fafa75777 [0,2,0,0,0,0|1,0,1]=4 11131 B13R0.54 C#CCCCCCCCNCC(C)O f078974189cd10b0670889072a5bf1b3 [0,2,0,0,0,0|0,0,1]=3 11132 B13R0.54 C#CCCCCCCCNC[C@@H](C)O 51c8f7cf3be121c1c4cb6d726da6ee5f [0,2,0,0,0,0|0,0,1]=3 11133 B13R0.54 C#CCCCCCCCNC[C@H](C)O 8a2fdc75e8c9a184ae53d9efcb8be985 [0,2,0,0,0,0|0,0,1]=3 11134 B13R0.54 C#CCCCCCCCOCC(C)C 694796e0bf312bcfa8e43e09a79a6887 [0,2,0,0,0,0|1,0,1]=4 11135 B13R0.54 C#CCCCCCCCOCC(C)F 477d9a2cabd10e6bc82c8ffac30e938e [0,2,0,0,0,0|1,0,1]=4 11136 B13R0.54 C#CCCCCCCCOCC(C)S c2da3e3c2a20fac19cc69d90e72742d0 [0,2,0,0,0,0|0,1,1]=4 11137 B13R0.54 C#CCCCCCCCOC[C@@H](C)F 7d44a1971a869c9202d4d6d04032a767 [0,2,0,0,0,0|1,0,1]=4 11138 B13R0.54 C#CCCCCCCCOC[C@H](C)F 78fda215404125554ba580f7ec81bcb7 [0,2,0,0,0,0|1,0,1]=4 11139 B13R0.54 C#CCCCCCCNCCC(C)C d091028c040ed061efe31ad45a7a8827 [0,2,0,0,0,0|1,0,1]=4 11140 B13R0.54 C#CCCCCCCNCCC(C)O 98c25962db454633174249646d47edad [0,2,0,0,0,0|0,0,1]=3 11141 B13R0.54 C#CCCCCCCNCC[C@@H](C)O c45df8fc4e018a90d387fd4076fd9b7f [0,2,0,0,0,0|0,0,1]=3 11142 B13R0.54 C#CCCCCCCNCC[C@H](C)O 3933fc81ef70bd65a546540f10271f78 [0,2,0,0,0,0|0,0,1]=3 11143 B13R0.54 C#CCCCCCCOCCC(C)C af04b83e6e12327433eaee63fa4e5b20 [0,2,0,0,0,0|1,0,1]=4 11144 B13R0.54 C#CCCCCCNCCCC(C)C 847caa879dc98c2229025d3233d6e80b [0,2,0,0,0,0|1,0,1]=4 11145 B13R0.54 C#CCCCCCNCCCC(C)O aeae881e9fa702d77f95f5a1d8295346 [0,2,0,0,0,0|0,0,1]=3 11146 B13R0.54 C#CCCCCCOCCCC(C)C 4941fe87038fcdc93a0deb9003292ec5 [0,2,0,0,0,0|1,0,1]=4 11147 B13R0.54 C#CCCCCNCCCCC(C)C 5bb93b42ddcaf3eda3d5e213cfd04190 [0,2,0,0,0,0|1,0,1]=4 11148 B13R0.54 C#CCCCCNCCCCC(C)O 247fa7504c7fab2b32762a21a9653055 [0,2,0,0,0,0|0,0,1]=3 11149 B13R0.54 C#CCCCCNCCCC[C@@H](C)O ac90ea8b94584a51f852c9872e8f2023 [0,2,0,0,0,0|0,0,1]=3 11150 B13R0.54 C#CCCCCOCCCCC(C)C b11c3fde571bdc149970bbdd1e0b7f49 [0,2,0,0,0,0|1,0,1]=4 11151 B13R0.54 C#CCCCNCCCCCC(C)C 1fad330ce413d1e9665b411506254b7b [0,2,0,0,0,0|1,0,1]=4 11152 B13R0.54 C#CCCCOCCCCCC(C)C a70a9b72e2be42dc993e8837d342121c [0,2,0,0,0,0|1,0,1]=4 11153 B13R0.54 C#CCCNCCCCCCC(C)C 20ff04d2397913ba2f6f6cc47a9118f3 [0,2,0,0,0,0|1,0,1]=4 11154 B13R0.54 C#CCCOCCCCCCC(C)C 64e2ac4ea99efc4287f431236756106d [0,2,0,0,0,0|1,0,1]=4 11155 B13R0.54 C#CCOCCCCCCCC(C)C e05334b59659ed7d582dbfeb8a441ce0 [0,2,0,0,0,0|1,0,1]=4 11156 B13R0.54 C#CCOCCNCCCCC(C)O 502802575f8fb6c06daf35f9ad682241 [0,2,0,0,0,0|0,0,2]=4 11157 B13R0.54 C#CCOCCNCCCC[C@@H](C)O dbade50e9696d29c96634d55d6e440a0 [0,2,0,0,0,0|0,0,2]=4 11158 B13R0.54 C/C=C/CCCOCCCCC(C)C 62b9d8ca17801e4433a17b76469a2126 [0,2,0,0,0,0|1,0,1]=4 11159 B13R0.54 C/C=C/CCOCCCCCC(C)C 34efd883b0e21f6b71c89ad7571f66b5 [0,2,0,0,0,0|1,0,1]=4 11160 B13R0.54 C/C=C/CNCCCCCCC(C)C 7bb8e3f5f398daff370a03f317a3d5ed [0,2,0,0,0,0|1,0,1]=4 11161 B13R0.54 C/C=C/COCCCCCCC(C)C 2595f7598b76381d9abee48592a009ee [0,2,0,0,0,0|1,0,1]=4 11162 B13R0.54 C/C=C\CCCOCCCCC(C)C bed655e79831fba3308adb17bfabb5f8 [0,2,0,0,0,0|1,0,1]=4 11163 B13R0.54 C/C=C\CNCCCCCCC(C)C c40cf93a525908e849f63f2dc879269b [0,2,0,0,0,0|1,0,1]=4 11164 B13R0.54 C/C=C\COCCCCCCC(C)C 757104de7248d08b0eba71343c0831f5 [0,2,0,0,0,0|1,0,1]=4 11165 B13R0.54 C=C(C)CCCNCCCCCCC b49c31c7a4cd125664dc95b04ba17e43 [0,2,0,0,0,0|1,0,1]=4 11166 B13R0.54 C=C(C)CCCNCCCCCCCl bfa0a885dce580b428c3b4bf2136c058 [0,2,0,0,0,0|1,0,1]=4 11167 B13R0.54 C=C(C)CCCNCCCCCCO bd2ce3d0f9f1dae5ead28ba6c728e2b0 [0,2,0,0,0,0|1,0,1]=4 11168 B13R0.54 C=C(C)CCCNCCCCCOC 2478af26c8eae8d2a6c6845c242e863d [0,2,0,0,0,0|1,0,1]=4 11169 B13R0.54 C=C(C)CCCNCCCCSCC 48a7a8268b647b96de4265c4614025cf [0,2,0,0,0,0|1,0,1]=4 11170 B13R0.54 C=C(C)CCCNCCCOCCC 395c975bf33f8c74ae2740e3ad477b3c [0,2,0,0,0,0|1,0,1]=4 11171 B13R0.54 C=C(C)CCCNCCOCCCC 4f778c8d5bae0f56998d4869c6812bca [0,2,0,0,0,0|1,0,1]=4 11172 B13R0.54 C=C(C)CCCOCCCCCCC 2bc6cb08a83111347e2ed020ead700e8 [0,2,0,0,0,0|1,0,1]=4 11173 B13R0.54 C=C(C)CCCOCCCCCCF 97016eb8165e773ea0752cea38e28c81 [0,2,0,0,0,0|1,0,1]=4 11174 B13R0.54 C=C(C)CCCOCCCCCCS c9aa6a0446a4d8adc67ae56f1f78de5b [0,2,0,0,0,0|1,0,1]=4 11175 B13R0.54 C=C(C)CCCOCCCCCOC 1525d67af76a026f3a96722ee5020867 [0,2,0,0,0,0|1,0,1]=4 11176 B13R0.54 C=C(C)CCCOCCCOCCC ba8c4da1df73b90a4eb9211a1367f859 [0,2,0,0,0,0|1,0,1]=4 11177 B13R0.54 C=C(C)CCCOCCOCCCC 3b1fbc8de80b99d961414af875e2539c [0,2,0,0,0,0|1,0,1]=4 11178 B13R0.54 C=C(C)CCCOCCSCCCC c19bd12b33e5dabe1e18759691a76fed [0,2,0,0,0,0|1,0,1]=4 11179 B13R0.54 C=C(C)CCNCCCCCCCC c176ff9320afb8727cb895b1f5afab2a [0,2,0,0,0,0|1,0,1]=4 11180 B13R0.54 C=C(C)CCNCCCCCCCO 3e7063f96e3c9c36998e0e3570b14964 [0,2,0,0,0,0|1,0,1]=4 11181 B13R0.54 C=C(C)CCNCCCCCCOC 84d6d0bf58f9cb9ba9fd430f99d66a50 [0,2,0,0,0,0|1,0,1]=4 11182 B13R0.54 C=C(C)CCNCCCCSCCC 6566236fe282e33a5717090af6656884 [0,2,0,0,0,0|1,0,1]=4 11183 B13R0.54 C=C(C)CCNCCCOCCCC fbd903bcfc0763caa5b10603e30360ca [0,2,0,0,0,0|1,0,1]=4 11184 B13R0.54 C=C(C)CCOCCCCCCCC f0354db8afe22515eaccdc9be57175e0 [0,2,0,0,0,0|1,0,1]=4 11185 B13R0.54 C=C(C)CCOCCCCCCOC 5c9daaa0f6eeff3e26839fe7d087a1dd [0,2,0,0,0,0|1,0,1]=4 11186 B13R0.54 C=C(C)CCOCCCOCCCC 096d68cb3c115898edd711dbd0d3ac05 [0,2,0,0,0,0|1,0,1]=4 11187 B13R0.54 C=C(C)CCOCCOCCCCC bfa917ec26cd0d870d7f5131685b4871 [0,2,0,0,0,0|1,0,1]=4 11188 B13R0.54 C=C(C)CNCCCCCCCCC 1374f1ed680a1ac12ebed8f9b8df24e6 [0,2,0,0,0,0|1,0,1]=4 11189 B13R0.54 C=C(C)CNCCCCCCCCO ba5f463d43d32acb0fd0e853f682d12a [0,2,0,0,0,0|1,0,1]=4 11190 B13R0.54 C=C(C)COCCCCCCCCC 4bdb00db0e85eb62457054641061e57b [0,2,0,0,0,0|1,0,1]=4 11191 B13R0.54 C=C(C)COCCCOCCCCC 802f8fd2e35c5dc1ba5b425a405ce667 [0,2,0,0,0,0|1,0,1]=4 11192 B13R0.54 C=C(C)COCCOCCCCCC f52752608014a7b7054d8e4c1a932b06 [0,2,0,0,0,0|1,0,1]=4 11193 B13R0.54 C=CCCCCCCCCOC(C)C fbef2e9d22612fdcfd1af4f2957584e9 [0,2,0,0,0,0|1,0,1]=4 11194 B13R0.54 C=CCCCCCCCNCC(C)C 32f8f56f40269345e534aa15d0d314ce [0,2,0,0,0,0|1,0,1]=4 11195 B13R0.54 C=CCCCCCCCNCC(C)O 5c891dbfdbfa78583ca4010fee2136fb [0,2,0,0,0,0|0,0,1]=3 11196 B13R0.54 C=CCCCCCCCNC[C@@H](C)O fb21298d6246cbb83fedaeb2c7e35e97 [0,2,0,0,0,0|0,0,1]=3 11197 B13R0.54 C=CCCCCCCCNC[C@H](C)O a5cb3ca699075a78037552cb2fbf8e06 [0,2,0,0,0,0|0,0,1]=3 11198 B13R0.54 C=CCCCCCCCOCC(C)C 5ce2d0336e593a2cc352d3703b4d0c9f [0,2,0,0,0,0|1,0,1]=4 11199 B13R0.54 C=CCCCCCCCOCC(C)F 1b81f736d87daf59f0ea099a030db459 [0,2,0,0,0,0|1,0,1]=4 11200 B13R0.54 C=CCCCCCCCOCC(C)S d426f76bb3dee8eefd2bc11bca4d5c06 [0,2,0,0,0,0|0,1,1]=4 11201 B13R0.54 C=CCCCCCCCOC[C@@H](C)F 48d0092fd8a1da2baa905c169699a4e0 [0,2,0,0,0,0|1,0,1]=4 11202 B13R0.54 C=CCCCCCCCOC[C@H](C)F 13a82b8bb665192278405cefb51e6990 [0,2,0,0,0,0|1,0,1]=4 11203 B13R0.54 C=CCCCCCCNCCC(C)C 29c989e8e3601d7c1d8c6573154d28a1 [0,2,0,0,0,0|1,0,1]=4 11204 B13R0.54 C=CCCCCCCNCCC(C)O d5b38a7e561c62bba4dc2eb470aa1ff5 [0,2,0,0,0,0|0,0,1]=3 11205 B13R0.54 C=CCCCCCCNCC[C@@H](C)O 0165f3f443ed5861fa0db604b9a98506 [0,2,0,0,0,0|0,0,1]=3 11206 B13R0.54 C=CCCCCCCNCC[C@H](C)O d258df75746453a400cbb9e3b875d5fb [0,2,0,0,0,0|0,0,1]=3 11207 B13R0.54 C=CCCCCCCOCCC(C)C 19866360314478d356ec73a7d5fb95f6 [0,2,0,0,0,0|1,0,1]=4 11208 B13R0.54 C=CCCCCCNCCCC(C)C 8c91e74f7f8eece0d080d685b92e033d [0,2,0,0,0,0|1,0,1]=4 11209 B13R0.54 C=CCCCCCNCCCC(C)O a20cbd88d011cd887a35fd846cb4a2c0 [0,2,0,0,0,0|0,0,1]=3 11210 B13R0.54 C=CCCCCCOCCCC(C)C 7ac392d893cdacc01d4831edc16fe7ad [0,2,0,0,0,0|1,0,1]=4 11211 B13R0.54 C=CCCCCNCCCCC(C)C dfae66a16767cefa8244234a48fadb41 [0,2,0,0,0,0|1,0,1]=4 11212 B13R0.54 C=CCCCCNCCCCC(C)O 741e00e09a0253ed2719aaaa4631c0c3 [0,2,0,0,0,0|0,0,1]=3 11213 B13R0.54 C=CCCCCNCCCC[C@@H](C)O bbc6175a5755dce3e4af1eae529b411e [0,2,0,0,0,0|0,0,1]=3 11214 B13R0.54 C=CCCCCOCCCCC(C)C 063584ef65ed3770116fed3f6c60703b [0,2,0,0,0,0|1,0,1]=4 11215 B13R0.54 C=CCCCNCCCCCC(C)C cd6d05be7301be12cbd1909ee4dd323a [0,2,0,0,0,0|1,0,1]=4 11216 B13R0.54 C=CCCCOCCCCCC(C)C b3841976f021fcb37bdc545e5a2de3cf [0,2,0,0,0,0|1,0,1]=4 11217 B13R0.54 C=CCCNCCCCCCC(C)C f4773bbdf0165aac85928c3584821908 [0,2,0,0,0,0|1,0,1]=4 11218 B13R0.54 C=CCCOCCCCCCC(C)C 21bd013aeb52a202fd4334c5fa2b823c [0,2,0,0,0,0|1,0,1]=4 11219 B13R0.54 C=CCOCCCCCCCC(C)C 33752d4d7f512091cdb539227af62e4f [0,2,0,0,0,0|1,0,1]=4 11220 B13R0.54 C=COCCCNCCCCC(C)O 2ed6ed4374966ef7ee9fb7e86eb503dc [0,2,0,0,0,0|0,0,2]=4 11221 B13R0.54 C=COCCCNCCCC[C@@H](C)O de393ce7824e7405fdf1ad5587bc2324 [0,2,0,0,0,0|0,0,2]=4 11222 B13R0.54 CC#CCCCOCCCCC(C)C 2dd4f42b0888d4bd97e56e80f3110f1a [0,2,0,0,0,0|1,0,1]=4 11223 B13R0.54 CC#CCCOCCCCCC(C)C 5d6821f2cc189b3a788d4c715e562457 [0,2,0,0,0,0|1,0,1]=4 11224 B13R0.54 CC#CCOCCCCCCC(C)C 68b3da62154dd65ddf11523a792c3b82 [0,2,0,0,0,0|1,0,1]=4 11225 B13R0.54 CC(=O)CCCCCCCOCCF 0b02fec05f6eb1c5249a789aaae52226 [0,2,0,0,0,0|0,0,2]=4 11226 B13R0.54 CC(=O)CCCCCCCOCCS cb87d8c9044423a17c7149433cc7d27e [0,2,0,0,0,0|0,0,2]=4 11227 B13R0.54 CC(=O)CCCCCNCCCCCl 374d3c63f86c7acc0cc7893991208b73 [0,2,0,0,0,0|0,0,2]=4 11228 B13R0.54 CC(=O)CCCCCNCCCCO 4d60cdc40b76582982726bb145a143b1 [0,2,0,0,0,0|0,0,2]=4 11229 B13R0.54 CC(=O)CCCCCNCCCCS 58975febf88502229045906b808ac4e7 [0,2,0,0,0,0|0,0,2]=4 11230 B13R0.54 CC(=O)CCCCCOCCCCF a7de39bf0565d289f812706657442cef [0,2,0,0,0,0|0,0,2]=4 11231 B13R0.54 CC(=O)CCCCCOCCCCS cc54e88488744d800d02d15afb9f44f3 [0,2,0,0,0,0|0,0,2]=4 11232 B13R0.54 CC(=O)CCCCNCCCCCCl 5d3f3cad28f14c8e2ec6fe01e3175ad3 [0,2,0,0,0,0|0,0,2]=4 11233 B13R0.54 CC(=O)CCCCNCCCCCO 558889bf3f9684c877ff036cfbcbdc93 [0,2,0,0,0,0|0,0,2]=4 11234 B13R0.54 CC(=O)CCCCOCCCCCF 4ff3794d638ca6b794cdffaf076b64bd [0,2,0,0,0,0|0,0,2]=4 11235 B13R0.54 CC(=O)CCCNCCCCCCCl 7d47e77488461f2efe359e3945ae1088 [0,2,0,0,0,0|0,0,2]=4 11236 B13R0.54 CC(=O)CCCNCCCCCCO 1d073efa3c5bf9a3b895c419affdd0bf [0,2,0,0,0,0|0,0,2]=4 11237 B13R0.54 CC(=O)CCCOCCCCCCF 1754a02a1b0880cb94534c2e30740de5 [0,2,0,0,0,0|0,0,2]=4 11238 B13R0.54 CC(=O)CCCOCCCCCCS 18b0bc0b1581f87605bdb1117e75bf39 [0,2,0,0,0,0|0,0,2]=4 11239 B13R0.54 CC(=O)CCNCCCCCCCO 36a3254de8214bffcc27ce1cb64b8787 [0,2,0,0,0,0|0,0,2]=4 11240 B13R0.54 CC(=O)CNCCCCCCCCO 410d29eb4622e7d0b78c036d759687e3 [0,2,0,0,0,0|0,0,2]=4 11241 B13R0.54 CC(=O)NCCCCCCCCCO 1769feeef07c9f0d37d9586138bc5ab2 [0,2,0,0,0,0|0,0,2]=4 11242 B13R0.54 CC(C)CCCCCCCCOCF 4cc35ac3e6c87b27fe92991946f4dc25 [0,2,0,0,0,0|1,0,0]=3 11243 B13R0.54 CC(C)CCCCCCCOCC#N 79cfd4cfa6dce17b2df19096d6904cba [0,2,0,0,0,0|1,0,1]=4 11244 B13R0.54 CC(C)CCCCCCCOCC=O cae39a5a7d24815638b7ae999a94d6f1 [0,2,0,0,0,0|1,0,1]=4 11245 B13R0.54 CC(C)CCCCCCCOCCF 9482f387255913aa170dd789ce8e7dd4 [0,2,0,0,0,0|1,0,0]=3 11246 B13R0.54 CC(C)CCCCCCCOCCS 057ecde5069cfe99c75784991bbfbcae [0,2,0,0,0,0|1,0,0]=3 11247 B13R0.54 CC(C)CCCCCCNCCC#N 74b08616b1a44b26c3343af67b9dcb2c [0,2,0,0,0,0|1,0,1]=4 11248 B13R0.54 CC(C)CCCCCCNCCC=O 1837dd0d45d0c815d88c034275810cf7 [0,2,0,0,0,0|1,0,1]=4 11249 B13R0.54 CC(C)CCCCCCNCCCF 0f99b266466d0a429e5a7dd9eb04e4a3 [0,2,0,0,0,0|1,0,0]=3 11250 B13R0.54 CC(C)CCCCCCNCCCO 99c176cc5491ebaccbf7992692e050b1 [0,2,0,0,0,0|1,0,0]=3 11251 B13R0.54 CC(C)CCCCCCNCCCS c242c7f76daa6fd3705edde519c5e472 [0,2,0,0,0,0|1,0,0]=3 11252 B13R0.54 CC(C)CCCCCCOCCC#N 2460991d70674bfcb49a43dc4d168a41 [0,2,0,0,0,0|1,0,1]=4 11253 B13R0.54 CC(C)CCCCCCOCCC=O 65730e0b3861c74437d62aa33acf39a4 [0,2,0,0,0,0|1,0,1]=4 11254 B13R0.54 CC(C)CCCCCCOCCCF 2b1f938ab4ea2179889781c12278ba9a [0,2,0,0,0,0|1,0,0]=3 11255 B13R0.54 CC(C)CCCCCCOCCCS 9ac7ff58a627278ea5bb1383a4079e88 [0,2,0,0,0,0|1,0,0]=3 11256 B13R0.54 CC(C)CCCCCNCCCC#N 024df8a72beca3cbb8a99cfa0ef7186b [0,2,0,0,0,0|1,0,1]=4 11257 B13R0.54 CC(C)CCCCCNCCCC=O e05aea3ae12bcaa92bc3ee9dd7885730 [0,2,0,0,0,0|1,0,1]=4 11258 B13R0.54 CC(C)CCCCCNCCCCCl a77de431b1cc4fc80b1bc66e999bd459 [0,2,0,0,0,0|1,0,0]=3 11259 B13R0.54 CC(C)CCCCCNCCCCF 777d99e32d919e0d1fc98fe344b7624b [0,2,0,0,0,0|1,0,0]=3 11260 B13R0.54 CC(C)CCCCCNCCCCO 4bd8ef98fdbdfd6fa37afc36fba610f0 [0,2,0,0,0,0|1,0,0]=3 11261 B13R0.54 CC(C)CCCCCNCCCCS 38a4ade5dfb8407b40e4b148897ae609 [0,2,0,0,0,0|1,0,0]=3 11262 B13R0.54 CC(C)CCCCCOCCCC#N 3e10d3a13a0e5c2f88bf8c6c32a5079e [0,2,0,0,0,0|1,0,1]=4 11263 B13R0.54 CC(C)CCCCCOCCCC=O ea8768396c90f89bbcf04dc120fb7cf2 [0,2,0,0,0,0|1,0,1]=4 11264 B13R0.54 CC(C)CCCCCOCCCCF 975d1843d07f658a881e680a2571bc54 [0,2,0,0,0,0|1,0,0]=3 11265 B13R0.54 CC(C)CCCCCOCCCCS e4c2a9898ac04861559a38e5b2be135e [0,2,0,0,0,0|1,0,0]=3 11266 B13R0.54 CC(C)CCCCNCCCCC#N faf9faed2e2baf9085e1e9aff96d157e [0,2,0,0,0,0|1,0,1]=4 11267 B13R0.54 CC(C)CCCCNCCCCCCl f88c3583cfe221b1adb2f252f164c661 [0,2,0,0,0,0|1,0,0]=3 11268 B13R0.54 CC(C)CCCCNCCCCCO 73af73f9bc13952c57c637deb0a8d0c3 [0,2,0,0,0,0|1,0,0]=3 11269 B13R0.54 CC(C)CCCCNCCOCCO 03d901567f87fe7c857d03bc15393093 [0,2,0,0,0,0|2,0,0]=4 11270 B13R0.54 CC(C)CCCCNCCOCCS 6f717b112fc88d58dae7a600cce53d3a [0,2,0,0,0,0|2,0,0]=4 11271 B13R0.54 CC(C)CCCCNCCSCCO 36711fcd250bf459230a8dcdb81ae24d [0,2,0,0,0,0|2,0,0]=4 11272 B13R0.54 CC(C)CCCCOCCCCC#N b90cc96d5029c4ed360d541f50490c9b [0,2,0,0,0,0|1,0,1]=4 11273 B13R0.54 CC(C)CCCCOCCCCC=O 0468230ae371b39176f596b4a4dcba93 [0,2,0,0,0,0|1,0,1]=4 11274 B13R0.54 CC(C)CCCCOCCCCCF 2a4fffcdfff1a7908bc67044adeff538 [0,2,0,0,0,0|1,0,0]=3 11275 B13R0.54 CC(C)CCCCOCCOCCF 1032a3222491bb86eb9b346925c313a2 [0,2,0,0,0,0|2,0,0]=4 11276 B13R0.54 CC(C)CCCCOCCOCCS 0d37732baed0c7077890f08d8250ea1a [0,2,0,0,0,0|2,0,0]=4 11277 B13R0.54 CC(C)CCCNCCCCCC#N 1df51e85d8c0212e2dd44835a00ea921 [0,2,0,0,0,0|1,0,1]=4 11278 B13R0.54 CC(C)CCCNCCCCCC=O 2e983d018a0e782ae04df697d6f6526c [0,2,0,0,0,0|1,0,1]=4 11279 B13R0.54 CC(C)CCCNCCCCCCCl db2f3e9cee2f8c820ee86d157e0fb620 [0,2,0,0,0,0|1,0,0]=3 11280 B13R0.54 CC(C)CCCNCCCCCCF 0fd019617c6217b9b8b0a676898ff143 [0,2,0,0,0,0|1,0,0]=3 11281 B13R0.54 CC(C)CCCNCCCCCCO 4e14420580017297bc93687fbd7af6e9 [0,2,0,0,0,0|1,0,0]=3 11282 B13R0.54 CC(C)CCCNCCCOCCO 0e4fe2853fa578d4fabf4286c99925ac [0,2,0,0,0,0|2,0,0]=4 11283 B13R0.54 CC(C)CCCNCCOCCCO d15c32e910c4c71b9b2a28802ea5d7db [0,2,0,0,0,0|2,0,0]=4 11284 B13R0.54 CC(C)CCCOCCCCCC#N 5c057bf804fbcbd84a03de01bf208680 [0,2,0,0,0,0|1,0,1]=4 11285 B13R0.54 CC(C)CCCOCCCCCC=O 812a87caf5b837a3a413b24ba023dfdc [0,2,0,0,0,0|1,0,1]=4 11286 B13R0.54 CC(C)CCCOCCCCCCF 8c5d7427dc8370a1f3a964f7168d7a71 [0,2,0,0,0,0|1,0,0]=3 11287 B13R0.54 CC(C)CCCOCCCCCCS fff2e8a31572214fb1211ccf7e4bf242 [0,2,0,0,0,0|1,0,0]=3 11288 B13R0.54 CC(C)CCNCCCCCCC#N 211862703f30f8c2c4f6451d694d1d66 [0,2,0,0,0,0|1,0,1]=4 11289 B13R0.54 CC(C)CCNCCCCCCC=O 86e54feecc7ffbce399fb9f6c614ae2f [0,2,0,0,0,0|1,0,1]=4 11290 B13R0.54 CC(C)CCNCCCCCCCO f6d7519376c5fc7e4d0b195c5671f153 [0,2,0,0,0,0|1,0,0]=3 11291 B13R0.54 CC(C)CCNCCCCSCCO b57e35b7c1bb9e6686784c4c9cb91a27 [0,2,0,0,0,0|2,0,0]=4 11292 B13R0.54 CC(C)CCNCCCOCCCO 76c7e8dfabf8a2bd32365eebd69be4fc [0,2,0,0,0,0|2,0,0]=4 11293 B13R0.54 CC(C)CCOCCCCCCC#N 5c51c9d2610078db5d5bb56c1af52670 [0,2,0,0,0,0|1,0,1]=4 11294 B13R0.54 CC(C)CCOCCCCCCC=O 113a842273ccfbd982e545a0e6f7a9ee [0,2,0,0,0,0|1,0,1]=4 11295 B13R0.54 CC(C)CNCCCCCCCCO 2e352329733121f8d294d6ac349aec53 [0,2,0,0,0,0|1,0,0]=3 11296 B13R0.54 CC(C)COCCCNCCCCF 223ed6f7e07d50a0247937ab5c47ec7b [0,2,0,0,0,0|2,0,0]=4 11297 B13R0.54 CC(C)COCCCNCCCCO 15616f5f8ad41f64d6a0804c0436cd9f [0,2,0,0,0,0|2,0,0]=4 11298 B13R0.54 CC(C)COCCCOCCCCF 77eff244ed198d1b2c1f8753e64da511 [0,2,0,0,0,0|2,0,0]=4 11299 B13R0.54 CC(C)COCCNCCCCCCl 1a973ec6aa4659436e2c13b3c3a0f13a [0,2,0,0,0,0|2,0,0]=4 11300 B13R0.54 CC(C)COCCNCCCCCO aadf6c40a64f3975a59655474982ca44 [0,2,0,0,0,0|2,0,0]=4 11301 B13R0.54 CC(C)COCCOCCCCCF 640f2674125b4bc76736b1a082c99b68 [0,2,0,0,0,0|2,0,0]=4 11302 B13R0.54 CC(C)CSCCCCNCCCF e98b841b6d00311a024681990372a454 [0,2,0,0,0,0|2,0,0]=4 11303 B13R0.54 CC(C)CSCCCCNCCCO 938819d268d6942a17ba17f15e8a7caf [0,2,0,0,0,0|2,0,0]=4 11304 B13R0.54 CC(C)CSCCCCNCCCS 072bf1fbf5cb7c6024cf348dc28e83be [0,2,0,0,0,0|2,0,0]=4 11305 B13R0.54 CC(C)CSCCCOCCCCF 705616779f3a2473434e44c38e1754aa [0,2,0,0,0,0|2,0,0]=4 11306 B13R0.54 CC(C)CSCCOCCCCCF 0868c40e4208f21cc1e7b1ba21e874cf [0,2,0,0,0,0|2,0,0]=4 11307 B13R0.54 CC(C)NCCCCCCCCCO 61d98e7f0371d76ca8ebcbdc038c0acf [0,2,0,0,0,0|1,0,0]=3 11308 B13R0.54 CC(C)OCCCCCCCCC=O 574e9e6f15c0135fff2d5b0287054acc [0,2,0,0,0,0|1,0,1]=4 11309 B13R0.54 CC(C)OCCCCCCCCCS 816d12feba042bce30660101a517b0c5 [0,2,0,0,0,0|1,0,0]=3 11310 B13R0.54 CC(C)OCCCNCCCCCF a4138319516099d291dcd1830421fb94 [0,2,0,0,0,0|2,0,0]=4 11311 B13R0.54 CC(C)OCCCNCCCCCO 05a6ba938471e8ed9d9ea9a6fc3811fc [0,2,0,0,0,0|2,0,0]=4 11312 B13R0.54 CC(C)OCCCOCCCCCF a109dd2747f25c8613abdde91a33ee8b [0,2,0,0,0,0|2,0,0]=4 11313 B13R0.54 CC(C)OCCNCCCCCCCl 70fe8094268b9163ef3b06ea580f5b08 [0,2,0,0,0,0|2,0,0]=4 11314 B13R0.54 CC(C)OCCNCCCCCCF c087dd1b23fb857b256c13976e666f6a [0,2,0,0,0,0|2,0,0]=4 11315 B13R0.54 CC(C)OCCNCCCCCCO 9f5a1345ec17b797a9ad4db88a9aed26 [0,2,0,0,0,0|2,0,0]=4 11316 B13R0.54 CC(C)OCCOCCCCCCF ac6c79a155cfce60d5fa3f77098247ea [0,2,0,0,0,0|2,0,0]=4 11317 B13R0.54 CC(C)OCCOCCCCCCS 90b835b24ee8a493808812b69e1a5fa9 [0,2,0,0,0,0|2,0,0]=4 11318 B13R0.54 CC(C)OCNCCCCCCCO 68fa718c5ea5f435825eab60849ef27c [0,2,0,0,0,0|2,0,0]=4 11319 B13R0.54 CC(C)SCCCNCCCCCF 8d057063de6bb8290452659450ec29fa [0,2,0,0,0,0|2,0,0]=4 11320 B13R0.54 CC(C)SCCCNCCCCCO f513eb0460c02486c78e5887604359e5 [0,2,0,0,0,0|2,0,0]=4 11321 B13R0.54 CC(C)SCCCOCCCCCF 971a3ce79f860453915a5556a19b66a8 [0,2,0,0,0,0|2,0,0]=4 11322 B13R0.54 CC(C)SCCNCCCCCCCl a52c9b38c3d5d264376e4bf3522fc455 [0,2,0,0,0,0|2,0,0]=4 11323 B13R0.54 CC(C)SCCNCCCCCCO bee0757e3567596765224b1a27eab4cb [0,2,0,0,0,0|2,0,0]=4 11324 B13R0.54 CC(C)SCCOCCCCCCF a81603b7d3dd9588d665189046690c64 [0,2,0,0,0,0|2,0,0]=4 11325 B13R0.54 CC(C)SCCOCCCCCCS f00601ff3320f6d1c8f27fa6d7957b67 [0,2,0,0,0,0|2,0,0]=4 11326 B13R0.54 CC(O)CCCCNCCCCC#N 795e3441726e24bd4b8f242d21755acb [0,2,0,0,0,0|0,0,1]=3 11327 B13R0.54 CC(O)CCCCNCCCCCCl bdde5c4385884c6195a46b4738824f1d [0,2,0,0,0,0|0,0,0]=2 11328 B13R0.54 CC(O)CCCCNCCCCCO 39200f08686ba1ef8e10b59aebc1b1dd [0,2,0,0,0,0|0,0,0]=2 11329 B13R0.54 CC(O)CCCCNCCOCCO 30951cad63fb35ba44181bafdcba093f [0,2,0,0,0,0|1,0,0]=3 11330 B13R0.54 CC(O)CCCCNCCOCCS 8ac5c002b11a09ad65135e4f4a51af03 [0,2,0,0,0,0|1,0,0]=3 11331 B13R0.54 CC(O)CCCCNCCSCCO 010465e4c4e4fb1d8d600d9638e731cb [0,2,0,0,0,0|1,0,0]=3 11332 B13R0.54 CC(O)CCCNCCCCCC#N 90698b5f64266a7b13ae378c22128d8e [0,2,0,0,0,0|0,0,1]=3 11333 B13R0.54 CC(O)CCCNCCCCCCCl 5092e777df7e87f6ee8f84ee0a2a4587 [0,2,0,0,0,0|0,0,0]=2 11334 B13R0.54 CC(O)CCCNCCCCCCO 568479c9cdcba2e0acb6b04d6c673e04 [0,2,0,0,0,0|0,0,0]=2 11335 B13R0.54 CC(O)CCCNCCCOCCO 545a59c0bbee0b2d33fd6cdbafa2a977 [0,2,0,0,0,0|1,0,0]=3 11336 B13R0.54 CC(O)CCCNCCOCCCO 64d2248acc19b6099e6dc696a1373428 [0,2,0,0,0,0|1,0,0]=3 11337 B13R0.54 CC(O)CCCNCCOCCON 280e316299c914db6552f9e64cb81e0a [0,2,0,0,0,0|2,0,0]=4 11338 B13R0.54 CC(O)CCCNCCSSCCO a4ab179736f78dc9523c85cf8bb63ddd [0,2,0,0,0,0|2,0,0]=4 11339 B13R0.54 CC(O)CCNCCCCCCC#N 09f9727141c693d64faad9c2c1e797b3 [0,2,0,0,0,0|0,0,1]=3 11340 B13R0.54 CC(O)CCNCCCCCCC=O f25c02c59ef8f825ec2878522db67dff [0,2,0,0,0,0|0,0,1]=3 11341 B13R0.54 CC(O)CCNCCCCCCCO a2691130f855cc5dd9a372930929b190 [0,2,0,0,0,0|0,0,0]=2 11342 B13R0.54 CC(O)CCNCCCCSCCO 6d79dae0b24e3e895c4bbf0e0631638c [0,2,0,0,0,0|1,0,0]=3 11343 B13R0.54 CC(O)CCNCCCOCCCO e6b91b6e6e1ad12615b41fda56cbf2de [0,2,0,0,0,0|1,0,0]=3 11344 B13R0.54 CC(O)CNCCCCCCCCO 0a3ac505f7047cf615bf8bd2dbdfb323 [0,2,0,0,0,0|0,0,0]=2 11345 B13R0.54 CC(O)CNCCOCCOCCF b76d7314669797df858b805a6c746ab8 [0,2,0,0,0,0|2,0,0]=4 11346 B13R0.54 CC(O)CNCCOCCOCCO 016651122bd898d0cce75c22dde47d17 [0,2,0,0,0,0|2,0,0]=4 11347 B13R0.54 CC/C=C/CCOCCCCC(C)C eaad8fb30b8eaeac433ea084935c8ed4 [0,2,0,0,0,0|1,0,1]=4 11348 B13R0.54 CC/C=C/CNCCCCCC(C)C 7b578e5396133b8e0612b79f2116856c [0,2,0,0,0,0|1,0,1]=4 11349 B13R0.54 CC/C=C/COCCCCCC(C)C 59d7b547d6081d817d7cef7c7fbe8127 [0,2,0,0,0,0|1,0,1]=4 11350 B13R0.54 CC/C=C\CCCCCNCC(C)C 875eb69cc7cf4414be397b4b8197371b [0,2,0,0,0,0|1,0,1]=4 11351 B13R0.54 CC/C=C\CCCCCNCC(C)O e070643ad4802705dfd3e46a971cea38 [0,2,0,0,0,0|0,0,1]=3 11352 B13R0.54 CC/C=C\CCCCCNC[C@@H](C)O 25386eedd61a080054d0b9362cde40d4 [0,2,0,0,0,0|0,0,1]=3 11353 B13R0.54 CC/C=C\CCCCCNC[C@H](C)O 2df9e928d75d680d4bd8688de0e09c94 [0,2,0,0,0,0|0,0,1]=3 11354 B13R0.54 CC/C=C\CCCCCOCC(C)C 3fd5a08637b03a604127ad9948dc8719 [0,2,0,0,0,0|1,0,1]=4 11355 B13R0.54 CC/C=C\CCCCCOCC(C)F 00f1695df5096c448e59aa81d4490aa6 [0,2,0,0,0,0|1,0,1]=4 11356 B13R0.54 CC/C=C\CCCCCOCC(C)S f537e612bfe9851e81780b74cef2ef1f [0,2,0,0,0,0|0,1,1]=4 11357 B13R0.54 CC/C=C\CCCCCOC[C@@H](C)F 9c015c772736732d94c24e72d0c8aad2 [0,2,0,0,0,0|1,0,1]=4 11358 B13R0.54 CC/C=C\CCCCCOC[C@H](C)F 4217eeaa3e5a2dc393ebe169e9424b7a [0,2,0,0,0,0|1,0,1]=4 11359 B13R0.54 CC/C=C\CCCCOCCC(C)C de0ee71e0d0d8f0f3d84b7d7e714f05f [0,2,0,0,0,0|1,0,1]=4 11360 B13R0.54 CC/C=C\CCCOCCCC(C)C 8b7f13287624394c42ce4c488e02a53c [0,2,0,0,0,0|1,0,1]=4 11361 B13R0.54 CC/C=C\CCOCCCCC(C)C b7d837037c86592d43b663bb48cf7119 [0,2,0,0,0,0|1,0,1]=4 11362 B13R0.54 CC/C=C\COCCCCCC(C)C 02e5676b28d175a1b4f6efdafe6451a5 [0,2,0,0,0,0|1,0,1]=4 11363 B13R0.54 CC=CCCCOCCCCC(C)C 201e0b7d9139ce28b14fd9f8f721b436 [0,2,0,0,0,0|1,0,1]=4 11364 B13R0.54 CCC#CCCOCCCCC(C)C 70f581938c9d9ab013bb343161335ae8 [0,2,0,0,0,0|1,0,1]=4 11365 B13R0.54 CCC#CCNCCCCCC(C)C f7efc49e2512c4f9bbb6bc333f2e9f74 [0,2,0,0,0,0|1,0,1]=4 11366 B13R0.54 CCC#CCOCCCCCC(C)C 130b03a2f57d0c59c7c04028a23ec116 [0,2,0,0,0,0|1,0,1]=4 11367 B13R0.54 CCC/C=C/CCCOCCC(C)C 0f935fea5dcc3b5136ddaec0275474fc [0,2,0,0,0,0|1,0,1]=4 11368 B13R0.54 CCC/C=C/COCCCCC(C)C b93c281510d04cc1a4748b9f6d1eddcb [0,2,0,0,0,0|1,0,1]=4 11369 B13R0.54 CCC/C=C\CCCOCCC(C)C b0f8887d0dfdc9dc54f717fe84df63bb [0,2,0,0,0,0|1,0,1]=4 11370 B13R0.54 CCC/C=C\CCOCCCC(C)C f7bce26ec5d7b7a97e891e64c748a913 [0,2,0,0,0,0|1,0,1]=4 11371 B13R0.54 CCC/C=C\COCCCCC(C)C 6f44145cae91c7c3afba38b376229466 [0,2,0,0,0,0|1,0,1]=4 11372 B13R0.54 CCC=CCCCCCOCC(C)C 701896463ba6269b45d0adde0cf28bdf [0,2,0,0,0,0|1,0,1]=4 11373 B13R0.54 CCCC#CCCOCCCC(C)C 80b893d6e4d21aae0f0752900841050d [0,2,0,0,0,0|1,0,1]=4 11374 B13R0.54 CCCC#CCOCCCCC(C)C cbd7a14ce8388155832a913cf2ffe017 [0,2,0,0,0,0|1,0,1]=4 11375 B13R0.54 CCCC/C=C/CCCCOC(C)C 3a83e267dd8659e934f41417b8584d76 [0,2,0,0,0,0|1,0,1]=4 11376 B13R0.54 CCCC/C=C/CNCCCC(C)C 75cdb02c595fe4210000235a03784424 [0,2,0,0,0,0|1,0,1]=4 11377 B13R0.54 CCCC/C=C/COCCCC(C)C 75307086d6693512b21f4728b1e532bc [0,2,0,0,0,0|1,0,1]=4 11378 B13R0.54 CCCC/C=C\CCCCOC(C)C 90be604ccf57b3ac75582890044a10eb [0,2,0,0,0,0|1,0,1]=4 11379 B13R0.54 CCCC/C=C\CCOCCC(C)C 86084ec599a305f1c196d01153f37369 [0,2,0,0,0,0|1,0,1]=4 11380 B13R0.54 CCCC/C=C\CNCCCC(C)C 8e5df3b686ea3e8edbe9e65a9b7c97ac [0,2,0,0,0,0|1,0,1]=4 11381 B13R0.54 CCCC/C=C\COCCCC(C)C 9535a820f9c49bf8a86f094563d37624 [0,2,0,0,0,0|1,0,1]=4 11382 B13R0.54 CCCCC#CCCCCOC(C)C 9142e05bc774d502cb82c0a2bb597c55 [0,2,0,0,0,0|1,0,1]=4 11383 B13R0.54 CCCCC#CCCOCCC(C)C 2bfbfa05a499fff0728259fe114859ff [0,2,0,0,0,0|1,0,1]=4 11384 B13R0.54 CCCCC#CCOCCCC(C)C 18d28a064dcd13b186de0b97f59b8f5c [0,2,0,0,0,0|1,0,1]=4 11385 B13R0.54 CCCCC/C=C/COCCC(C)C 8b7c6f28af13c6757c90f50ad901f5a1 [0,2,0,0,0,0|1,0,1]=4 11386 B13R0.54 CCCCC/C=C\CCCOC(C)C abb5ed4170d489caba0bbad2e89689c1 [0,2,0,0,0,0|1,0,1]=4 11387 B13R0.54 CCCCC/C=C\CCOCC(C)C fa0290f2997ed85e8e01598eafa07616 [0,2,0,0,0,0|1,0,1]=4 11388 B13R0.54 CCCCCC#CCCOCC(C)C 1e10315ba8484d87ce7c43f6ff83abb9 [0,2,0,0,0,0|1,0,1]=4 11389 B13R0.54 CCCCCC#CCOCCC(C)C bfa44cf1c8728243122bda6b5a2ec989 [0,2,0,0,0,0|1,0,1]=4 11390 B13R0.54 CCCCCC/C=C/COCC(C)C b622d26b37a84ea71fde3874619ca7ff [0,2,0,0,0,0|1,0,1]=4 11391 B13R0.54 CCCCCC/C=C\COCC(C)C f1489369bd3c23cdd84fefcc7abe57b3 [0,2,0,0,0,0|1,0,1]=4 11392 B13R0.54 CCCCCC=CCCCOC(C)C 037db7f1f5860f11848a5dde2b5fe23b [0,2,0,0,0,0|1,0,1]=4 11393 B13R0.54 CCCCCCC#CCCOC(C)C 532583ad49af8afca02cabdd92ea4da7 [0,2,0,0,0,0|1,0,1]=4 11394 B13R0.54 CCCCCCC#CCOCC(C)C 45479ddbdc62b65e5d2c56ddc39ccc87 [0,2,0,0,0,0|1,0,1]=4 11395 B13R0.54 CCCCCCCC#CCOC(C)C 0ce9bddb4f027351dde7aa5858541874 [0,2,0,0,0,0|1,0,1]=4 11396 B13R0.54 CCCCCCCCCCNC(=O)C ed95f9130e5c1d438dc2bde1ac386ec4 [0,2,0,0,0,0|0,0,2]=4 11397 B13R0.54 CCCCCCCCCCNC(C)C 5bae3568b56a73bc076dd417412522f5 [0,2,0,0,0,0|1,0,0]=3 11398 B13R0.54 CCCCCCCCCCOC(C)C 05c7b2c619c5b1d1084d47b3a91f9e8e [0,2,0,0,0,0|1,0,0]=3 11399 B13R0.54 CCCCCCCCCNCC(=O)C 3f74c4af83600c7fae7ed85d0783b199 [0,2,0,0,0,0|0,0,2]=4 11400 B13R0.54 CCCCCCCCCNCC(=O)O 7fe37e42f1bd61b43c93a56a2716301b [0,2,0,0,0,0|1,0,1]=4 11401 B13R0.54 CCCCCCCCCNCC(C)C d83d3728f6e5a46310cc4495fb0cf251 [0,2,0,0,0,0|1,0,0]=3 11402 B13R0.54 CCCCCCCCCNCC(C)O c5a0775d7b7b66281f42f9ba56f5415b [0,2,0,0,0,0|0,0,0]=2 11403 B13R0.54 CCCCCCCCCNCC(F)F 53ee10d84526beef9e505d1624829c98 [0,2,0,0,0,0|2,0,0]=4 11404 B13R0.54 CCCCCCCCCNCN(C)C 0f0325d3bf3fa74a62cef553ad4b8406 [0,2,0,0,0,0|2,0,0]=4 11405 B13R0.54 CCCCCCCCCNC[C@@H](C)O 6ec7abd6d608d81636bbba805d13c84c [0,2,0,0,0,0|0,0,0]=2 11406 B13R0.54 CCCCCCCCCNC[C@H](C)O 63bfa8073f054426a4043bd7fc680aae [0,2,0,0,0,0|0,0,0]=2 11407 B13R0.54 CCCCCCCCCOCC(=O)C 6c9d4c4f0dd4344668e5f3c5c0ead5b5 [0,2,0,0,0,0|0,0,2]=4 11408 B13R0.54 CCCCCCCCCOCC(=O)O b5ad244415d15ef7380ec5f81e97882f [0,2,0,0,0,0|1,0,1]=4 11409 B13R0.54 CCCCCCCCCOCC(C)C ce18516a6e9ab4703178eb03b908d4d9 [0,2,0,0,0,0|1,0,0]=3 11410 B13R0.54 CCCCCCCCCOCC(C)F 8d2328cc4083ba82f194cc7adcdac691 [0,2,0,0,0,0|1,0,0]=3 11411 B13R0.54 CCCCCCCCCOCC(C)S e19e314d2adc5a5966d55410230ac43f [0,2,0,0,0,0|0,1,0]=3 11412 B13R0.54 CCCCCCCCCOCC(F)F 8df018a448d70af65394690cc90b999e [0,2,0,0,0,0|2,0,0]=4 11413 B13R0.54 CCCCCCCCCOCN(C)C 1945025d568901ae058133d76f30fb95 [0,2,0,0,0,0|2,0,0]=4 11414 B13R0.54 CCCCCCCCCOCS(=O)O 8b5c6e8cea51f4475fcbbf1631dfc443 [0,2,0,0,0,0|2,0,0]=4 11415 B13R0.54 CCCCCCCCCOC[C@@H](C)F 9ccb5cf11323da7c1f9fa01c68b586f5 [0,2,0,0,0,0|1,0,0]=3 11416 B13R0.54 CCCCCCCCCOC[C@H](C)F 72d0433db49736314809e27e4d8a0cad [0,2,0,0,0,0|1,0,0]=3 11417 B13R0.54 CCCCCCCCNC/C=C(/C)\I 31e7931041996a8579b2ed6f75bbbe8b [0,2,0,0,0,0|1,0,1]=4 11418 B13R0.54 CCCCCCCCNC/C=C(\C)/Cl 34d27655e289864777403a19e687d9a4 [0,2,0,0,0,0|1,0,1]=4 11419 B13R0.54 CCCCCCCCNCC=C(C)C b0929898f2b6dbc777a821a9f44b4625 [0,2,0,0,0,0|1,0,1]=4 11420 B13R0.54 CCCCCCCCNCC=C(C)Cl 74a0ac469775f41602e9fabeef0abb98 [0,2,0,0,0,0|1,0,1]=4 11421 B13R0.54 CCCCCCCCNCC=C(C)I 3dc90c4971cc1d8f85e9edb3ba0bea8d [0,2,0,0,0,0|1,0,1]=4 11422 B13R0.54 CCCCCCCCNCCC(=O)C c195e11627f02a38d9c6793105c5db8b [0,2,0,0,0,0|0,0,2]=4 11423 B13R0.54 CCCCCCCCNCCC(=O)O f70b1cba9d4621f79ec6f5b876443aca [0,2,0,0,0,0|1,0,1]=4 11424 B13R0.54 CCCCCCCCNCCC(C)C 59c44147740eafd259358ed1ef9e6035 [0,2,0,0,0,0|1,0,0]=3 11425 B13R0.54 CCCCCCCCNCCC(C)O 944a3cb796afd02a2e5aee68c0a8a5ef [0,2,0,0,0,0|0,0,0]=2 11426 B13R0.54 CCCCCCCCNCCC(F)F 19a3b2687c6e7d94433d368d9ecceed1 [0,2,0,0,0,0|2,0,0]=4 11427 B13R0.54 CCCCCCCCNCCN(C)C 17c934253bb277c777d880ec11495e60 [0,2,0,0,0,0|2,0,0]=4 11428 B13R0.54 CCCCCCCCNCCS(=O)C 923f6a6983b32c5deabfd127e4dcee3b [0,2,0,0,0,0|1,0,1]=4 11429 B13R0.54 CCCCCCCCNCCS(=O)O 51fbfb4066ecfea1ac3ed400a30a2380 [0,2,0,0,0,0|2,0,0]=4 11430 B13R0.54 CCCCCCCCNCC[C@@H](C)O 8ff14f92e600951e00fd7af7b9816057 [0,2,0,0,0,0|0,0,0]=2 11431 B13R0.54 CCCCCCCCNCC[C@H](C)O 97963810abe967d373c657742e7cb74c [0,2,0,0,0,0|0,0,0]=2 11432 B13R0.54 CCCCCCCCNCOC(=O)C 580af45d74b8709f8b2d99a1aa5491d8 [0,2,0,0,0,0|0,0,2]=4 11433 B13R0.54 CCCCCCCCNCOC(C)C 793c22cc19fb32f67ac62186b9a26893 [0,2,0,0,0,0|1,0,0]=3 11434 B13R0.54 CCCCCCCCOC/C=C(/C)\Cl 65d9a51acbe239838953f24e8dcae3a6 [0,2,0,0,0,0|1,0,1]=4 11435 B13R0.54 CCCCCCCCOC/C=C(/C)\I b78fa3a2366e1a5303b9e7c2bfdf0f01 [0,2,0,0,0,0|1,0,1]=4 11436 B13R0.54 CCCCCCCCOC/C=C(\C)/Cl 3bdbc436d091681bb39efe4107915275 [0,2,0,0,0,0|1,0,1]=4 11437 B13R0.54 CCCCCCCCOCC=C(C)C df0d8da40a7b800008c264e52f56445f [0,2,0,0,0,0|1,0,1]=4 11438 B13R0.54 CCCCCCCCOCC=C(C)Cl 7cdc59889269df631939178653127fca [0,2,0,0,0,0|1,0,1]=4 11439 B13R0.54 CCCCCCCCOCC=C(C)I 3fe4381b27ef3932e940c26e081d90a8 [0,2,0,0,0,0|1,0,1]=4 11440 B13R0.54 CCCCCCCCOCCC(=O)C b648a732a6e47faa10e6a5e888f34cd7 [0,2,0,0,0,0|0,0,2]=4 11441 B13R0.54 CCCCCCCCOCCC(=O)O 4eb12bac98ba83059c97d141773c2d2d [0,2,0,0,0,0|1,0,1]=4 11442 B13R0.54 CCCCCCCCOCCC(C)C 8360e5bf8fce7661469851e4774b7e7a [0,2,0,0,0,0|1,0,0]=3 11443 B13R0.54 CCCCCCCCOCCC(F)F 043347311e455f599be59edff4c94f1d [0,2,0,0,0,0|2,0,0]=4 11444 B13R0.54 CCCCCCCCOCCN(C)C 27c0bbb71d040ef570d1de03d167ef2a [0,2,0,0,0,0|2,0,0]=4 11445 B13R0.54 CCCCCCCCOCCS(=O)C 591d31ab8a41d35f904ba3729c5b4746 [0,2,0,0,0,0|1,0,1]=4 11446 B13R0.54 CCCCCCCCOCNC(=O)C aa24c300c3dfe3ecef3f7bc6b1cf5970 [0,2,0,0,0,0|0,0,2]=4 11447 B13R0.54 CCCCCCCCOCOC(=O)C 55d7f77de24a2ded8bc1a52efe1b67d7 [0,2,0,0,0,0|0,0,2]=4 11448 B13R0.54 CCCCCCCCOCOC(C)C 19ecddbd919ccb9c9345bbff39f0a57e [0,2,0,0,0,0|1,0,0]=3 11449 B13R0.54 CCCCCCCNC/C=C/C(C)C ba66bfc5d0f301a8e02cd008ddde3cfc [0,2,0,0,0,0|1,0,1]=4 11450 B13R0.54 CCCCCCCNCCC=C(C)C d1a4e74a5bca88bfc26ec3b3fc360bef [0,2,0,0,0,0|1,0,1]=4 11451 B13R0.54 CCCCCCCNCCCC(=O)C 491bba76c380093f60a1dd7fbaf4c20c [0,2,0,0,0,0|0,0,2]=4 11452 B13R0.54 CCCCCCCNCCCC(=O)O fac3238cc1739210a7b8513266477d8d [0,2,0,0,0,0|1,0,1]=4 11453 B13R0.54 CCCCCCCNCCCC(C)C 8da31dff595c6deda34557ba052286d6 [0,2,0,0,0,0|1,0,0]=3 11454 B13R0.54 CCCCCCCNCCCC(C)O 2afc79ee2d11e08362bec750f0e2a38d [0,2,0,0,0,0|0,0,0]=2 11455 B13R0.54 CCCCCCCNCCCN(C)C a76404815e31e5bb4ec1efa862e0977a [0,2,0,0,0,0|2,0,0]=4 11456 B13R0.54 CCCCCCCNCCCS(=O)C 745a0464840f150445ba6d263e1b148a [0,2,0,0,0,0|1,0,1]=4 11457 B13R0.54 CCCCCCCNCCNC(=O)C 5f12c454ef15915c1bede42efdffb5fa [0,2,0,0,0,0|0,0,2]=4 11458 B13R0.54 CCCCCCCNCCOC(=O)C bdc13754d0e8ce371c7e55d9bed81269 [0,2,0,0,0,0|0,0,2]=4 11459 B13R0.54 CCCCCCCNCCOC(C)C f38c537185a7bb0c4dfb346bf94cea57 [0,2,0,0,0,0|1,0,0]=3 11460 B13R0.54 CCCCCCCNCCOC(F)F 56191bd6fe62513f75b42cd5c96698fc [0,2,0,0,0,0|2,0,0]=4 11461 B13R0.54 CCCCCCCNCCSC(=O)C 4fcbcf5db520bc07379faabd546f0d83 [0,2,0,0,0,0|0,0,2]=4 11462 B13R0.54 CCCCCCCNCCSC(C)C 0787a8c3424ec3145f78f57962d7c1db [0,2,0,0,0,0|1,0,0]=3 11463 B13R0.54 CCCCCCCOC/C=C/C(C)C 4daf47460d7e79d0577d2d961bc0ec1b [0,2,0,0,0,0|1,0,1]=4 11464 B13R0.54 CCCCCCCOCCC=C(C)C 07c0ec0c48512a874a1dcebdf0426b27 [0,2,0,0,0,0|1,0,1]=4 11465 B13R0.54 CCCCCCCOCCCC(=O)C 1d78b36816e67733fd925179c4336856 [0,2,0,0,0,0|0,0,2]=4 11466 B13R0.54 CCCCCCCOCCCC(C)C 1ec47b1e61480e38f0cab068e14d10e2 [0,2,0,0,0,0|1,0,0]=3 11467 B13R0.54 CCCCCCCOCCCN(C)C f00a632f647e8cdc9bbf28f5e8bd5e09 [0,2,0,0,0,0|2,0,0]=4 11468 B13R0.54 CCCCCCCOCCNC(=O)C b9f04837b306dd3ee71fb51d1d9a3241 [0,2,0,0,0,0|0,0,2]=4 11469 B13R0.54 CCCCCCCOCCOC(=O)C bb87360532d81fa3f479112c5c4a5ae2 [0,2,0,0,0,0|0,0,2]=4 11470 B13R0.54 CCCCCCCOCCOC(C)C 7b1fb0297915810715a9a8de632a5ed5 [0,2,0,0,0,0|1,0,0]=3 11471 B13R0.54 CCCCCCCOCCOC(F)F dd8850a9b9bcf7223b82d2b8e4d0b4f8 [0,2,0,0,0,0|2,0,0]=4 11472 B13R0.54 CCCCCCCOCCSC(=O)C b6bbf44286b1538e20655f38073697e1 [0,2,0,0,0,0|0,0,2]=4 11473 B13R0.54 CCCCCCCOCCSC(C)C eb8731c0d573b932096f9d407588d39d [0,2,0,0,0,0|1,0,0]=3 11474 B13R0.54 CCCCCCNCCCCC(=O)C 6798a138451fee38b400d4d3b7174009 [0,2,0,0,0,0|0,0,2]=4 11475 B13R0.54 CCCCCCNCCCCC(=O)O e445001a0390334d700bc8760810bdaf [0,2,0,0,0,0|1,0,1]=4 11476 B13R0.54 CCCCCCNCCCCC(C)C 8f2fb8ed962b1c5817aa1c63d7fa6025 [0,2,0,0,0,0|1,0,0]=3 11477 B13R0.54 CCCCCCNCCCCC(C)O 01f89e27e7f3d6b6bbea487768007fdd [0,2,0,0,0,0|0,0,0]=2 11478 B13R0.54 CCCCCCNCCCCC(F)F 6119ffeb37671501d5ef7246984ab675 [0,2,0,0,0,0|2,0,0]=4 11479 B13R0.54 CCCCCCNCCCCN(C)C 6d4f08edc653b11edb196e996d2faad8 [0,2,0,0,0,0|2,0,0]=4 11480 B13R0.54 CCCCCCNCCCC[C@@H](C)O 8a79a56ce35293400e8fac0cbf96dab8 [0,2,0,0,0,0|0,0,0]=2 11481 B13R0.54 CCCCCCNCCCNC(=O)C 957560084a2e214934659df59cd7836d [0,2,0,0,0,0|0,0,2]=4 11482 B13R0.54 CCCCCCNCCCOC(=O)C a7ad73b762399526ddcad6fcf3aed7fc [0,2,0,0,0,0|0,0,2]=4 11483 B13R0.54 CCCCCCNCCCOC(=S)C 303ee5eb3f40b6002a837d24854a6937 [0,2,0,0,0,0|0,1,1]=4 11484 B13R0.54 CCCCCCNCCCOC(C)C 7dbc37a5e8c267095b577f6f53fa4754 [0,2,0,0,0,0|1,0,0]=3 11485 B13R0.54 CCCCCCNCCCOC(F)F e8de3ff24be050cda9867106ba7cd2e0 [0,2,0,0,0,0|2,0,0]=4 11486 B13R0.54 CCCCCCNCCCSC(=O)C 64e47aa7609891de9c327a95d22807bd [0,2,0,0,0,0|0,0,2]=4 11487 B13R0.54 CCCCCCNCCCSC(C)C 84ae8091bb70da182cba1d31c5358f70 [0,2,0,0,0,0|1,0,0]=3 11488 B13R0.54 CCCCCCNCCOCC(=O)O 7827f3e5e0ba885f24cc5448e6327eb1 [0,2,0,0,0,0|1,0,1]=4 11489 B13R0.54 CCCCCCNCCOCC(C)C 49fae2baeb1b69cffc8eac38965bbba9 [0,2,0,0,0,0|1,0,0]=3 11490 B13R0.54 CCCCCCNCCOCC(F)F a405c463c5d1f0515e38049402ae0911 [0,2,0,0,0,0|2,0,0]=4 11491 B13R0.54 CCCCCCOCCCCC(=O)C db3ee6778980af86ea5eaf4d8c063ddd [0,2,0,0,0,0|0,0,2]=4 11492 B13R0.54 CCCCCCOCCCCC(=O)O 2f8c57ac0872fb5b3975b9fd6011999d [0,2,0,0,0,0|1,0,1]=4 11493 B13R0.54 CCCCCCOCCCCC(C)C eb26e698d040ae42d0567974061566f8 [0,2,0,0,0,0|1,0,0]=3 11494 B13R0.54 CCCCCCOCCCCN(C)C 5acc0d52b3282589fd0e9f5c5d670cf0 [0,2,0,0,0,0|2,0,0]=4 11495 B13R0.54 CCCCCCOCCCNC(=O)C b1f153d4ddc145644c13ca3b954866db [0,2,0,0,0,0|0,0,2]=4 11496 B13R0.54 CCCCCCOCCCOC(=O)C 95be72f61fcccab7740efbc6a5da9d07 [0,2,0,0,0,0|0,0,2]=4 11497 B13R0.54 CCCCCCOCCCOC(=S)C 129eed735784cb20477d6a129c9566ca [0,2,0,0,0,0|0,1,1]=4 11498 B13R0.54 CCCCCCOCCCOC(C)C 21aa865b93ade3ba5d13c57a46dcf889 [0,2,0,0,0,0|1,0,0]=3 11499 B13R0.54 CCCCCCOCCCSC(=O)C 12c9fc3dd33f021576f6bd931eb13ec4 [0,2,0,0,0,0|0,0,2]=4 11500 B13R0.54 CCCCCCOCCCSC(C)C b40493b1a19737593d121105f8886c11 [0,2,0,0,0,0|1,0,0]=3 11501 B13R0.54 CCCCCCOCCOCC(=O)O 02c79f045b4217964a028e24a1820c5d [0,2,0,0,0,0|1,0,1]=4 11502 B13R0.54 CCCCCCOCCOCC(C)C 7a2c981a16e4a7676c619bb61275ed27 [0,2,0,0,0,0|1,0,0]=3 11503 B13R0.54 CCCCCCOCCOCC(F)F 572a8a2565f8ba17088aedfb7fafa1cf [0,2,0,0,0,0|2,0,0]=4 11504 B13R0.54 CCCCCCOCCOCN(C)C 46fb19ad2fc4f134107c37067db8a852 [0,2,0,0,0,0|2,0,0]=4 11505 B13R0.54 CCCCCCOCCSCC(C)C dcfb89b655f52a9c4c15939bf05c71fc [0,2,0,0,0,0|1,0,0]=3 11506 B13R0.54 CCCCCNCCCCCC(=O)C beb17b4c460d76e0ac587606197bf765 [0,2,0,0,0,0|0,0,2]=4 11507 B13R0.54 CCCCCNCCCCCC(=O)O 2d45a8d9a3ca6b3d45a505049c07c00b [0,2,0,0,0,0|1,0,1]=4 11508 B13R0.54 CCCCCNCCCCCC(C)C 2d1bb6703ae2f9956790764f6742655b [0,2,0,0,0,0|1,0,0]=3 11509 B13R0.54 CCCCCNCCCCCC(F)F 2c6fd09a791102f037c7ba15821c69b7 [0,2,0,0,0,0|2,0,0]=4 11510 B13R0.54 CCCCCNCCCCCN(C)C 8d86fb6ab76bf4968729a46573de4cfb [0,2,0,0,0,0|2,0,0]=4 11511 B13R0.54 CCCCCNCCCCNC(=O)C 2ae907e8a52575d754c528b181a52626 [0,2,0,0,0,0|0,0,2]=4 11512 B13R0.54 CCCCCNCCCCOC(=O)C 6a59cbb3648a9daf244c84e50733e83b [0,2,0,0,0,0|0,0,2]=4 11513 B13R0.54 CCCCCNCCCCOC(F)F 06515827adf3d33ef4a0d1aa6862c4c7 [0,2,0,0,0,0|2,0,0]=4 11514 B13R0.54 CCCCCNCCCCSC(=O)C 1da9849c6da7c60f5693163c363fb093 [0,2,0,0,0,0|0,0,2]=4 11515 B13R0.54 CCCCCNCCCOCC(=O)O cbe8e5ae61905fa711263a6a8bcaa551 [0,2,0,0,0,0|1,0,1]=4 11516 B13R0.54 CCCCCNCCCOCC(C)C ca713dc63923649d1db2d73164af6654 [0,2,0,0,0,0|1,0,0]=3 11517 B13R0.54 CCCCCNCCOCCC(=O)O c30a19889f0ad86d0f13d8348915b149 [0,2,0,0,0,0|1,0,1]=4 11518 B13R0.54 CCCCCNCCOCCN(C)C bf150c2d275f25d1e83dca99f036e918 [0,2,0,0,0,0|2,0,0]=4 11519 B13R0.54 CCCCCOCCCCCC(=O)C e73cd3916c33ca240e68781b5ab42f84 [0,2,0,0,0,0|0,0,2]=4 11520 B13R0.54 CCCCCOCCCCCC(=O)O 73594829d7b138694f1246f54efc0dcb [0,2,0,0,0,0|1,0,1]=4 11521 B13R0.54 CCCCCOCCCCCC(C)C 3d4ef657254ed573e3c864dd8a090471 [0,2,0,0,0,0|1,0,0]=3 11522 B13R0.54 CCCCCOCCCCCC(F)F bbdd55fc4ed4f036c1421bbf41df39cb [0,2,0,0,0,0|2,0,0]=4 11523 B13R0.54 CCCCCOCCCCCN(C)C 575fa61fc6a6ad2c003e95aebbbf876a [0,2,0,0,0,0|2,0,0]=4 11524 B13R0.54 CCCCCOCCCCOC(=O)C 9884c3154adcc30bd4b7e4cbfef809aa [0,2,0,0,0,0|0,0,2]=4 11525 B13R0.54 CCCCCOCCCCSC(=O)C fabd16d8c6607961386d14551eabd8d7 [0,2,0,0,0,0|0,0,2]=4 11526 B13R0.54 CCCCCOCCCOCC(=O)O f7c9adee31a23ee516e6fc70d19aed3b [0,2,0,0,0,0|1,0,1]=4 11527 B13R0.54 CCCCCOCCCOCC(C)C 3869ea61ea2e4bd6a8c3087248fd09bf [0,2,0,0,0,0|1,0,0]=3 11528 B13R0.54 CCCCCOCCCOCC(F)F f8315f00b0dffe86169d86d329b660f2 [0,2,0,0,0,0|2,0,0]=4 11529 B13R0.54 CCCCCOCCCOCN(C)C fb970678c98534892dc3655631451230 [0,2,0,0,0,0|2,0,0]=4 11530 B13R0.54 CCCCCOCCCSCC(C)C 488fb138d6e48bb5d99a9027a02133b8 [0,2,0,0,0,0|1,0,0]=3 11531 B13R0.54 CCCCCOCCOCCC(=O)C 4d553cd3eb9de2f43cd521d63d801584 [0,2,0,0,0,0|0,0,2]=4 11532 B13R0.54 CCCCCOCCOCCC(=O)O 34d2a4e77de6ce10ab9c0ae1578557d7 [0,2,0,0,0,0|1,0,1]=4 11533 B13R0.54 CCCCCOCCOCCC(C)C b9dee76875c0c853e2736426a66aa404 [0,2,0,0,0,0|1,0,0]=3 11534 B13R0.54 CCCCCOCCOCCN(C)C 7fb11bd8e1771018410471736b7336a2 [0,2,0,0,0,0|2,0,0]=4 11535 B13R0.54 CCCCCOCCOCCS(=O)C 3d263cae4da8a5f72e59b492334b2e91 [0,2,0,0,0,0|1,0,1]=4 11536 B13R0.54 CCCCCOCCOCOC(C)C a477d0cd2cb791ba4b19e74170db325c [0,2,0,0,0,0|2,0,0]=4 11537 B13R0.54 CCCCNCCCCCCC(=O)O c941cf8f4857351872a191e2efe59613 [0,2,0,0,0,0|1,0,1]=4 11538 B13R0.54 CCCCNCCCCCCC(C)C 7334a2ded8ad74313ed5f9510b8e57fc [0,2,0,0,0,0|1,0,0]=3 11539 B13R0.54 CCCCNCCCCCCN(C)C 029571cdb6565a1fccf523386b437805 [0,2,0,0,0,0|2,0,0]=4 11540 B13R0.54 CCCCNCCCCCNC(=O)C 9f330859b218abd81ac6fe1d141b26b2 [0,2,0,0,0,0|0,0,2]=4 11541 B13R0.54 CCCCNCCCCCOC(=O)C 85e7e3562d85eedb1a3b6e1fefc15820 [0,2,0,0,0,0|0,0,2]=4 11542 B13R0.54 CCCCNCCCCSCC(C)C 96afe7e59ac819a00134b850b007d39e [0,2,0,0,0,0|1,0,0]=3 11543 B13R0.54 CCCCOCCCCCCC(=O)O b75a171cf0e6a144a5f8f048973de421 [0,2,0,0,0,0|1,0,1]=4 11544 B13R0.54 CCCCOCCCCCCC(C)C 9068e24109cbb1b2953fea243bd3ddb6 [0,2,0,0,0,0|1,0,0]=3 11545 B13R0.54 CCCCOCCCCCCN(C)C 24bb726b2034f6d24a33aaa735da4929 [0,2,0,0,0,0|2,0,0]=4 11546 B13R0.54 CCCCOCCCCCOC(=O)C 31e122c33afd12d072f118cf83dcd934 [0,2,0,0,0,0|0,0,2]=4 11547 B13R0.54 CCCCOCCCNCCC(=O)C 1284f24fd944d8fdbd77319083c227a9 [0,2,0,0,0,0|0,0,2]=4 11548 B13R0.54 CCCCOCCCNCCC(=O)O f057db8c9f094a0ce88c9d20efad28e4 [0,2,0,0,0,0|1,0,1]=4 11549 B13R0.54 CCCCOCCCNCCC(C)C 64252768cf709fe5218c482c0b717cf8 [0,2,0,0,0,0|1,0,0]=3 11550 B13R0.54 CCCCOCCCNCCC(C)O d4251aee2e74e8697f3fa192c9cf4c4a [0,2,0,0,0,0|0,0,0]=2 11551 B13R0.54 CCCCOCCCNCCN(C)C 2ae27aa71095070e1d82d3140c5c59a9 [0,2,0,0,0,0|2,0,0]=4 11552 B13R0.54 CCCCOCCCNCCS(=O)C c2fe5d46fb8274a1c4dfee399f339a2c [0,2,0,0,0,0|1,0,1]=4 11553 B13R0.54 CCCCOCCCNCOC(C)C ed31fa1e5c40771fa7173735ceb45e28 [0,2,0,0,0,0|2,0,0]=4 11554 B13R0.54 CCCCOCCCOCCC(=O)C 6d630aa2f9163911cc7c12560cabfed0 [0,2,0,0,0,0|0,0,2]=4 11555 B13R0.54 CCCCOCCCOCCC(=O)O 05e1bab649f45171a3598f27096a4f9e [0,2,0,0,0,0|1,0,1]=4 11556 B13R0.54 CCCCOCCCOCCC(C)C 38ab00ddbafcf03c07f946d58ad7712f [0,2,0,0,0,0|1,0,0]=3 11557 B13R0.54 CCCCOCCCOCCN(C)C 0a7eaea419a98e112601774d1bcedb5d [0,2,0,0,0,0|2,0,0]=4 11558 B13R0.54 CCCCOCCCOCCS(=O)C 23fc04882ec5a97d0e3a7d11540c087b [0,2,0,0,0,0|1,0,1]=4 11559 B13R0.54 CCCCOCCCOCOC(C)C 3766be8b09985395008f5d25c4380757 [0,2,0,0,0,0|2,0,0]=4 11560 B13R0.54 CCCCOCCNCCCC(=O)C aa93b6847ef83169c0a8f10b9fb9b112 [0,2,0,0,0,0|0,0,2]=4 11561 B13R0.54 CCCCOCCNCCCC(=O)O 28f46a51828cf20923bb0fab3b4fa93f [0,2,0,0,0,0|1,0,1]=4 11562 B13R0.54 CCCCOCCNCCCC(C)C 665fb8d491beb69fdb03a9e7c84115d3 [0,2,0,0,0,0|1,0,0]=3 11563 B13R0.54 CCCCOCCNCCCC(C)O 57cf9f786e619a73bd57c83b6470755c [0,2,0,0,0,0|0,0,0]=2 11564 B13R0.54 CCCCOCCNCCCN(C)C 601dd462d66432fe9760f285a396df8b [0,2,0,0,0,0|2,0,0]=4 11565 B13R0.54 CCCCOCCNCCCS(=O)C 69bc1dd1ac112507f2ac49a467459212 [0,2,0,0,0,0|1,0,1]=4 11566 B13R0.54 CCCCOCCNCCOC(C)C 5226f861ea3d27157e1eeeadb9648b42 [0,2,0,0,0,0|2,0,0]=4 11567 B13R0.54 CCCCOCCNCCSC(C)C f9753f6d4c7074f42570ec5471866c76 [0,2,0,0,0,0|2,0,0]=4 11568 B13R0.54 CCCCOCCOCCCC(=O)C 000dd01c73eed5285e1c415372e5716d [0,2,0,0,0,0|0,0,2]=4 11569 B13R0.54 CCCCOCCOCCCC(=O)O a572fcc212b020f57bde54665708c29b [0,2,0,0,0,0|1,0,1]=4 11570 B13R0.54 CCCCOCCOCCCC(C)C 78027a315e843eebd4f8b01428118c34 [0,2,0,0,0,0|1,0,0]=3 11571 B13R0.54 CCCCOCCOCCCN(C)C 9ce778fd5e103ca3fe5182b66cb6f5a9 [0,2,0,0,0,0|2,0,0]=4 11572 B13R0.54 CCCCOCCOCCNC(C)C 545fb6854dfa7cfc6746796cf9f8ad86 [0,2,0,0,0,0|2,0,0]=4 11573 B13R0.54 CCCCOCCOCCOC(C)C 9b38c02373d0bcc49ca1d1bde9822178 [0,2,0,0,0,0|2,0,0]=4 11574 B13R0.54 CCCCOCCOCCSC(C)C a48163be204431c5892d04ad3e8d40a6 [0,2,0,0,0,0|2,0,0]=4 11575 B13R0.54 CCCCOCNCCCCC(=O)O 22de1ea80c4d2a69cdb21fc92ca6a43a [0,2,0,0,0,0|1,0,1]=4 11576 B13R0.54 CCCCOCNCCCCC(F)F d23685c366a7d8d088e8707dceb34089 [0,2,0,0,0,0|2,0,0]=4 11577 B13R0.54 CCCCOCNCCCCN(C)C 5d3a7389f8748984c0a855b4ef644250 [0,2,0,0,0,0|2,0,0]=4 11578 B13R0.54 CCCCOCNCCCOC(C)C 55798ac74a36608957a84e37333c1b3c [0,2,0,0,0,0|2,0,0]=4 11579 B13R0.54 CCCCOCNCCCSC(C)C 697d362086dda33450d900fab7763cb8 [0,2,0,0,0,0|2,0,0]=4 11580 B13R0.54 CCCCOCOCCCCC(=O)C 14948c7bef994b53d74b4e771a88f96f [0,2,0,0,0,0|0,0,2]=4 11581 B13R0.54 CCCCOCOCCCCC(=O)O 2e2d4abe4f01f56b4f339f2841c5b550 [0,2,0,0,0,0|1,0,1]=4 11582 B13R0.54 CCCCOCOCCCCC(C)C 0a52c4d88934da7ed98982acab546d45 [0,2,0,0,0,0|1,0,0]=3 11583 B13R0.54 CCCCOCOCCCCN(C)C febcbbedbfdf1598d4c9b812de7dbc0e [0,2,0,0,0,0|2,0,0]=4 11584 B13R0.54 CCCCOCOCCCOC(C)C 254aa78f6c61f3f00d05ad074ccbdcbc [0,2,0,0,0,0|2,0,0]=4 11585 B13R0.54 CCCCOCOCCCSC(C)C 63835c3716d2c8e15b4a610f53ccb53c [0,2,0,0,0,0|2,0,0]=4 11586 B13R0.54 CCCCOCOCCOCC(C)C 36f7ec7844d5ce78beb158d95f16c85a [0,2,0,0,0,0|2,0,0]=4 11587 B13R0.54 CCCCOCOCCSCC(C)C cac5d7a0e4f4df8169dfcc7d9def0be6 [0,2,0,0,0,0|2,0,0]=4 11588 B13R0.54 CCCCSCCOCCCC(=O)C 8c70a677b58d20a80db54aba321a6232 [0,2,0,0,0,0|0,0,2]=4 11589 B13R0.54 CCCCSCCOCCCC(=O)O 27ab2022d1215131056db44cd316db97 [0,2,0,0,0,0|1,0,1]=4 11590 B13R0.54 CCCCSCCOCCCC(C)C c18838f28fd20f29275dddcd4616f119 [0,2,0,0,0,0|1,0,0]=3 11591 B13R0.54 CCCCSCCOCCCN(C)C 53223714648e4e8e0854efbc8ae1f671 [0,2,0,0,0,0|2,0,0]=4 11592 B13R0.54 CCCCSCCOCCOC(C)C 28d54d98352d70b9498657374f54f408 [0,2,0,0,0,0|2,0,0]=4 11593 B13R0.54 CCCCSCCOCCSC(C)C 86dbb5357e7fb2074c5e2b6dfecd38f7 [0,2,0,0,0,0|2,0,0]=4 11594 B13R0.54 CCCNCCCCCCCC(=O)O 0f9021c0b19d2c73e2c6a10a540b9e3d [0,2,0,0,0,0|1,0,1]=4 11595 B13R0.54 CCCNCCCCCCCN(C)C 455f771c79e7b4c5abe8c95ea9fc47cf [0,2,0,0,0,0|2,0,0]=4 11596 B13R0.54 CCCNCCCCCCNC(=O)C 9356dbea178d5e34291f1191652b3edc [0,2,0,0,0,0|0,0,2]=4 11597 B13R0.54 CCCNCCCCCCOC(=O)C f2f6f82e80cdb199c1c49eb946f44ac4 [0,2,0,0,0,0|0,0,2]=4 11598 B13R0.54 CCCNCCOCCCCC(=O)O e07e43623a7413bf3ecf73faf5afaf62 [0,2,0,0,0,0|1,0,1]=4 11599 B13R0.54 CCCOCCCCCCCC(=O)C d9573ec0fb29c079d407c4ce5bb464a9 [0,2,0,0,0,0|0,0,2]=4 11600 B13R0.54 CCCOCCCCCCCC(=O)O d399c858bdc8df17acbe58eee1e9c0da [0,2,0,0,0,0|1,0,1]=4 11601 B13R0.54 CCCOCCCCCCCC(C)C f4fee1484138c2383622e9cf211b6d16 [0,2,0,0,0,0|1,0,0]=3 11602 B13R0.54 CCCOCCCCCCOC(=O)C 983cf8312ba9ec099779da05106aa0e1 [0,2,0,0,0,0|0,0,2]=4 11603 B13R0.54 CCCOCCCNCCCC(=O)C 6bf2086f438154f8365c4b67ef28bce5 [0,2,0,0,0,0|0,0,2]=4 11604 B13R0.54 CCCOCCCNCCCC(=O)O 3af5bd1603c2e397f0fdc1e265612fc3 [0,2,0,0,0,0|1,0,1]=4 11605 B13R0.54 CCCOCCCNCCCC(C)C dbe63f987fcc08a9637fc6d7df11febf [0,2,0,0,0,0|1,0,0]=3 11606 B13R0.54 CCCOCCCNCCCC(C)O 062db987b3c50cedb9cb3dafd1a9d160 [0,2,0,0,0,0|0,0,0]=2 11607 B13R0.54 CCCOCCCNCCCN(C)C be47abb7e198993e2eb9ee52e1380c3e [0,2,0,0,0,0|2,0,0]=4 11608 B13R0.54 CCCOCCCNCCCS(=O)C 3ab16e7e1bdcca9e675caeec38ea05ab [0,2,0,0,0,0|1,0,1]=4 11609 B13R0.54 CCCOCCCNCCOC(C)C 0aa0a533ae4de3d9b2af54de90d60a82 [0,2,0,0,0,0|2,0,0]=4 11610 B13R0.54 CCCOCCCNCCSC(C)C bfdfd2ceda10acc8d974c883336ee0dd [0,2,0,0,0,0|2,0,0]=4 11611 B13R0.54 CCCOCCCOCCCC(=O)C 7e8a26d2fa7554af84e5b4af9a51d592 [0,2,0,0,0,0|0,0,2]=4 11612 B13R0.54 CCCOCCCOCCCC(C)C 343f9eb989dd3a0c705b7c5c1a27c2bd [0,2,0,0,0,0|1,0,0]=3 11613 B13R0.54 CCCOCCCOCCCN(C)C bcac168acee44641bb2ccdb2e3ade16c [0,2,0,0,0,0|2,0,0]=4 11614 B13R0.54 CCCOCCCOCCOC(C)C cbae15ddebb7f6479f23094498ee1153 [0,2,0,0,0,0|2,0,0]=4 11615 B13R0.54 CCCOCCCOCCSC(C)C d8349b7078cf823e6cb6c65f2b41a5fa [0,2,0,0,0,0|2,0,0]=4 11616 B13R0.54 CCCOCCNCCCCC(=O)C b012d5ef623382f05235189d01dfa59d [0,2,0,0,0,0|0,0,2]=4 11617 B13R0.54 CCCOCCNCCCCC(=O)O e192c1b4e7866943d208a28058955df5 [0,2,0,0,0,0|1,0,1]=4 11618 B13R0.54 CCCOCCNCCCCC(C)C 31617bd0921379b242c65a2bd1b5d837 [0,2,0,0,0,0|1,0,0]=3 11619 B13R0.54 CCCOCCNCCCCC(C)O 0c200277fa99b6ab9e980c464f79e3c3 [0,2,0,0,0,0|0,0,0]=2 11620 B13R0.54 CCCOCCNCCCCC(F)F 56e6a6249ebcfc7d57a6cebe43ee449a [0,2,0,0,0,0|2,0,0]=4 11621 B13R0.54 CCCOCCNCCCCN(C)C 53b0cb7c1bdbc0a5053cc5159f4fd533 [0,2,0,0,0,0|2,0,0]=4 11622 B13R0.54 CCCOCCNCCCC[C@@H](C)O aa51e0beebbbd0aa4b5f6e2a8742598e [0,2,0,0,0,0|0,0,0]=2 11623 B13R0.54 CCCOCCNCCCOC(C)C 115227084fd6b4dff24f0174193b11af [0,2,0,0,0,0|2,0,0]=4 11624 B13R0.54 CCCOCCNCCCSC(C)C 53628230ee65e70a40fd1725a0c650bd [0,2,0,0,0,0|2,0,0]=4 11625 B13R0.54 CCCOCCNCCOCC(C)C ab83fb102b3a9e4a6597694bdd49f482 [0,2,0,0,0,0|2,0,0]=4 11626 B13R0.54 CCCOCCOCCCCC(=O)C 2ee60ce8eb1b4258f91c0e4d3b2720c0 [0,2,0,0,0,0|0,0,2]=4 11627 B13R0.54 CCCOCCOCCCCC(=O)O 3fa74f061e892d8be1c8dce9d7b16989 [0,2,0,0,0,0|1,0,1]=4 11628 B13R0.54 CCCOCCOCCCCC(C)C 6e1994fc0d14488a2cc7adae329efe44 [0,2,0,0,0,0|1,0,0]=3 11629 B13R0.54 CCCOCCOCCCCN(C)C 635bf7345df659d50007fa17fe879e66 [0,2,0,0,0,0|2,0,0]=4 11630 B13R0.54 CCCOCCOCCCOC(C)C 24169870d5801270194bcda1dcd6f1a5 [0,2,0,0,0,0|2,0,0]=4 11631 B13R0.54 CCCOCCOCCCSC(C)C 249d1f416e2a8fc6fe2e1264f144b5e6 [0,2,0,0,0,0|2,0,0]=4 11632 B13R0.54 CCCOCCOCCOCC(C)C 7c278c01e851ffeaa23d39fb8a289100 [0,2,0,0,0,0|2,0,0]=4 11633 B13R0.54 CCCOCCOCCSCC(C)C 702b27ec55c6adb6fbc052e1626a1ee7 [0,2,0,0,0,0|2,0,0]=4 11634 B13R0.54 CCCSCCCCNCCC(=O)C 422e042c82f89261ee5bceb14bde9d42 [0,2,0,0,0,0|0,0,2]=4 11635 B13R0.54 CCCSCCCCNCCC(=O)O cf11b18f6ec3b46b299c666d9aee36fb [0,2,0,0,0,0|1,0,1]=4 11636 B13R0.54 CCCSCCCCNCCC(C)C fa6b8ede6b5053b12efebde769159f1d [0,2,0,0,0,0|1,0,0]=3 11637 B13R0.54 CCCSCCCCNCCC(C)O 0dc3e532b2e67bbc7152948493f9fa77 [0,2,0,0,0,0|0,0,0]=2 11638 B13R0.54 CCCSCCCCNCCN(C)C 89de8daec3a7db418eda6b75f675eec8 [0,2,0,0,0,0|2,0,0]=4 11639 B13R0.54 CCCSCCCCNCCS(=O)C acf83e697a9f80c2dbdcbac4c8b77032 [0,2,0,0,0,0|1,0,1]=4 11640 B13R0.54 CCCSCCCCNCOC(C)C b645cbfec51ff157adfcb214c34ac47b [0,2,0,0,0,0|2,0,0]=4 11641 B13R0.54 CCCSCCOCCCCC(=O)C 917355bc37189e7c7d046196a396fed7 [0,2,0,0,0,0|0,0,2]=4 11642 B13R0.54 CCCSCCOCCCCC(=O)O 352301f7c821bca6d3e9e5d117e988a4 [0,2,0,0,0,0|1,0,1]=4 11643 B13R0.54 CCCSCCOCCCCC(C)C c49b8d2642535934604c9f56ad2691f3 [0,2,0,0,0,0|1,0,0]=3 11644 B13R0.54 CCCSCCOCCCCN(C)C f239758e2b6dfcdb991b5903c9ecfff4 [0,2,0,0,0,0|2,0,0]=4 11645 B13R0.54 CCCSCCOCCOCC(C)C 6bafeb98ebbd5905ff782cecff1fa1ac [0,2,0,0,0,0|2,0,0]=4 11646 B13R0.54 CCNCCCCCCCCC(=O)O 056f8b683208a845493b246553c9bd4c [0,2,0,0,0,0|1,0,1]=4 11647 B13R0.54 CCOCCCCCCCCC(=O)O f71efee8afdc78f30a98612ae629fb40 [0,2,0,0,0,0|1,0,1]=4 11648 B13R0.54 CCOCCCCCCCCC(C)C 09e25e44a9c00db9d35bbdee89eaf358 [0,2,0,0,0,0|1,0,0]=3 11649 B13R0.54 CCOCCCCCCCCN(C)C a1a2a77aa30de87ade00fd4bb2878bdd [0,2,0,0,0,0|2,0,0]=4 11650 B13R0.54 CCOCCCNCCCCC(=O)C 117bf2c392facab5162c97a15e5a26c5 [0,2,0,0,0,0|0,0,2]=4 11651 B13R0.54 CCOCCCNCCCCC(=O)O dcef957a36a290adeb9b8b4fe46ae14d [0,2,0,0,0,0|1,0,1]=4 11652 B13R0.54 CCOCCCNCCCCC(C)C 4669a3264b495ede824777559a917e3d [0,2,0,0,0,0|1,0,0]=3 11653 B13R0.54 CCOCCCNCCCCC(C)O a97ad79b2762854b82fc0ce0bc662e5d [0,2,0,0,0,0|0,0,0]=2 11654 B13R0.54 CCOCCCNCCCCC(F)F bc6fa1e354d4d307888323fe53795306 [0,2,0,0,0,0|2,0,0]=4 11655 B13R0.54 CCOCCCNCCCCN(C)C 54eafafd30afb96ad533c5c2d16dd7c1 [0,2,0,0,0,0|2,0,0]=4 11656 B13R0.54 CCOCCCNCCCC[C@@H](C)O 69165553d1ccfcbfc5efcdfafa50039f [0,2,0,0,0,0|0,0,0]=2 11657 B13R0.54 CCOCCCNCCCOC(C)C a9bee8f26014488890de59297af303b0 [0,2,0,0,0,0|2,0,0]=4 11658 B13R0.54 CCOCCCNCCCSC(C)C 93bc27395d6101b12dadf1ff7db8ce2d [0,2,0,0,0,0|2,0,0]=4 11659 B13R0.54 CCOCCCNCCOCC(C)C 9268c9a605c470b3dbbe0403d0e5682d [0,2,0,0,0,0|2,0,0]=4 11660 B13R0.54 CCOCCCOCCCCC(=O)C 1b30fd10e26b01be4f6bf13416c6114a [0,2,0,0,0,0|0,0,2]=4 11661 B13R0.54 CCOCCCOCCCCC(=O)O 47833c16aa828ee4d1a3dd45818ac60a [0,2,0,0,0,0|1,0,1]=4 11662 B13R0.54 CCOCCCOCCCCC(C)C a651df245afb03cc3b4c3287e7df731a [0,2,0,0,0,0|1,0,0]=3 11663 B13R0.54 CCOCCCOCCCCN(C)C 9dd77aac6984c6250a895163c53390ee [0,2,0,0,0,0|2,0,0]=4 11664 B13R0.54 CCOCCCOCCCOC(C)C ab94acd356e02e57b23e13248a023cbd [0,2,0,0,0,0|2,0,0]=4 11665 B13R0.54 CCOCCCOCCCSC(C)C e197bb6fb585e6018d0dcc6f53d55245 [0,2,0,0,0,0|2,0,0]=4 11666 B13R0.54 CCOCCCOCCOCC(C)C 0e68686d77f5fe59d96914eb00fe3f7e [0,2,0,0,0,0|2,0,0]=4 11667 B13R0.54 CCOCCCOCCSCC(C)C 4cc33c182501516e3e8ade89e4355a5b [0,2,0,0,0,0|2,0,0]=4 11668 B13R0.54 CCOCCNCCCCCC(=O)C 497b9af8d0a12a4f6c61076af50f7468 [0,2,0,0,0,0|0,0,2]=4 11669 B13R0.54 CCOCCNCCCCCC(=O)O 4ffa3cf8bf84f4459b780772f44875e2 [0,2,0,0,0,0|1,0,1]=4 11670 B13R0.54 CCOCCNCCCCCC(C)C 50077916e535c140d5a17cd82f0a9cbd [0,2,0,0,0,0|1,0,0]=3 11671 B13R0.54 CCOCCNCCCCCC(F)F 649ce7231adfa876a606a73eb8cb53bb [0,2,0,0,0,0|2,0,0]=4 11672 B13R0.54 CCOCCNCCCCCN(C)C 96fdc2c3688d8f71978c126ea956d113 [0,2,0,0,0,0|2,0,0]=4 11673 B13R0.54 CCOCCNCCCOCC(C)C a7e29ffabe425664c1396753d6c89a78 [0,2,0,0,0,0|2,0,0]=4 11674 B13R0.54 CCOCCOCCCCCC(=O)C 7a9ec39476f69a122b939a184d137368 [0,2,0,0,0,0|0,0,2]=4 11675 B13R0.54 CCOCCOCCCCCC(=O)O 8dedefa0b7e651b9d0e5991fce469cbc [0,2,0,0,0,0|1,0,1]=4 11676 B13R0.54 CCOCCOCCCCCC(C)C f7ccdde63eaf02ffebde478f40e9c0dd [0,2,0,0,0,0|1,0,0]=3 11677 B13R0.54 CCOCCOCCCCCC(F)F 67f424332e66c7435f6c4b0a43c339f2 [0,2,0,0,0,0|2,0,0]=4 11678 B13R0.54 CCOCCOCCCCCN(C)C e158a0b31b59bcb7303f3c518b6cb4ef [0,2,0,0,0,0|2,0,0]=4 11679 B13R0.54 CCOCCOCCCOCC(C)C cfcc71e6c668a1c717fefbbcb72a6fc0 [0,2,0,0,0,0|2,0,0]=4 11680 B13R0.54 CCOCCOCCCSCC(C)C c7be462765f53b4884d8b631eb39161d [0,2,0,0,0,0|2,0,0]=4 11681 B13R0.54 CCOCCOCCNCCC(C)C abe257bc966a76bf3ff1ff84111ca6d0 [0,2,0,0,0,0|2,0,0]=4 11682 B13R0.54 CCOCCOCCNCCC(C)O bfe4fe3d71b195c4f014c7ef3a1c6256 [0,2,0,0,0,0|1,0,0]=3 11683 B13R0.54 CCOCCOCCNCC[C@@H](C)O 0a2098b05627528dfb8ed7f3de020cec [0,2,0,0,0,0|1,0,0]=3 11684 B13R0.54 CCOCCOCCNCC[C@H](C)O 2772385b21eaa05b00407f70c4baee9a [0,2,0,0,0,0|1,0,0]=3 11685 B13R0.54 CCOCCOCCOCCC(C)C ec92718ea103d4f802b29cdfeb8eac58 [0,2,0,0,0,0|2,0,0]=4 11686 B13R0.54 CCOCNCCCCCCC(C)C a077daddb7ab5ddfb9ac0a4c8a563195 [0,2,0,0,0,0|1,0,0]=3 11687 B13R0.54 CCOCNCCCCCCN(C)C 4e4b8f7b41f03d2469c32ad4cc7ecd8f [0,2,0,0,0,0|2,0,0]=4 11688 B13R0.54 CCOCNCCCCSCC(C)C 66e6c47987f30fedbe897b32d9d20b05 [0,2,0,0,0,0|2,0,0]=4 11689 B13R0.54 CCOCOCCCCCCC(C)C 3e1a68c7f8d4748a7f1da2907bdce235 [0,2,0,0,0,0|1,0,0]=3 11690 B13R0.54 CCOCOCCCCCCN(C)C 80d6de087a2f0eb41b13b22939f5215c [0,2,0,0,0,0|2,0,0]=4 11691 B13R0.54 CCSCCCCNCCCC(=O)C b201c34ef07230ba28ac4055e859c096 [0,2,0,0,0,0|0,0,2]=4 11692 B13R0.54 CCSCCCCNCCCC(=O)O d8e63eab9521786528761209af297886 [0,2,0,0,0,0|1,0,1]=4 11693 B13R0.54 CCSCCCCNCCCC(C)C 2da8e3b48373b93b7058ef2e4069efc3 [0,2,0,0,0,0|1,0,0]=3 11694 B13R0.54 CCSCCCCNCCCC(C)O 0e449a63eec9dbd58edd47767d34e7eb [0,2,0,0,0,0|0,0,0]=2 11695 B13R0.54 CCSCCCCNCCCN(C)C e9bdfdb2f011ae86d095e20d074f0c78 [0,2,0,0,0,0|2,0,0]=4 11696 B13R0.54 CCSCCCCNCCOC(C)C 86abe1cca46e58bd5cb2f1706b8165b2 [0,2,0,0,0,0|2,0,0]=4 11697 B13R0.54 CCSCCCCNCCSC(C)C 94282b5a8fa6cadb7ced17e537a84f83 [0,2,0,0,0,0|2,0,0]=4 11698 B13R0.54 CCSCCCNCCCCC(F)F b8a3609f8a8eac7e8b3828aa9898bf21 [0,2,0,0,0,0|2,0,0]=4 11699 B13R0.54 CCSCCCNCCCCN(C)C c230615eceafbd050d502be846739fb0 [0,2,0,0,0,0|2,0,0]=4 11700 B13R0.54 CCSCCCNCCCOC(C)C 9eb1e69f6785be6ca22acc310a602e2e [0,2,0,0,0,0|2,0,0]=4 11701 B13R0.54 CCSCCCNCCCSC(C)C bb88aac2ed474ae0b23c9979c3a0e627 [0,2,0,0,0,0|2,0,0]=4 11702 B13R0.54 CCSCCCOCCCCC(=O)C 23d89dd4b9dc81b57fd409d61fbe9ea9 [0,2,0,0,0,0|0,0,2]=4 11703 B13R0.54 CCSCCCOCCCCC(=O)O f66f1b9121109bf9a49f10a569091706 [0,2,0,0,0,0|1,0,1]=4 11704 B13R0.54 CCSCCCOCCCCC(C)C 25a61fc73ef058e96289964859e515e9 [0,2,0,0,0,0|1,0,0]=3 11705 B13R0.54 CCSCCCOCCCCN(C)C d6291943702144ba28af19a3acda52eb [0,2,0,0,0,0|2,0,0]=4 11706 B13R0.54 CCSCCCOCCCOC(C)C 7850963e58dd187f8639125f71d0dd2a [0,2,0,0,0,0|2,0,0]=4 11707 B13R0.54 CCSCCCOCCCSC(C)C 4948d526d3c2546cd8f6e04a1e238382 [0,2,0,0,0,0|2,0,0]=4 11708 B13R0.54 CCSCCCOCCOCC(C)C f9b293afa502a052cde776eae9067c65 [0,2,0,0,0,0|2,0,0]=4 11709 B13R0.54 CCSCCCOCCSCC(C)C a46c3611a893fff3aff73a94ec2f02c3 [0,2,0,0,0,0|2,0,0]=4 11710 B13R0.54 CCSCCNCCCCCC(=O)C bcdc66af8f3a60316539a49cda0513f0 [0,2,0,0,0,0|0,0,2]=4 11711 B13R0.54 CCSCCNCCCCCC(C)C b8686114166c41fbe76d9505155aa43d [0,2,0,0,0,0|1,0,0]=3 11712 B13R0.54 CCSCCNCCCCCC(F)F 3198e1c00766bbffb10ea16cd672e684 [0,2,0,0,0,0|2,0,0]=4 11713 B13R0.54 CCSCCNCCCCCN(C)C 37cd05efe4ed097a5793890e446ff5bf [0,2,0,0,0,0|2,0,0]=4 11714 B13R0.54 CCSCCNCCCOCC(C)C 4c5a133f3d6e4ddc5f7d3f8dd7b26ee7 [0,2,0,0,0,0|2,0,0]=4 11715 B13R0.54 CCSCCOCCCCCC(=O)C bf0b3f08db460e3319b583ef6b1703be [0,2,0,0,0,0|0,0,2]=4 11716 B13R0.54 CCSCCOCCCCCC(=O)O c6c550b830a040e29795e02e2c7e8f24 [0,2,0,0,0,0|1,0,1]=4 11717 B13R0.54 CCSCCOCCCCCC(C)C 9b501f39be23b7121835e078a71862d9 [0,2,0,0,0,0|1,0,0]=3 11718 B13R0.54 CCSCCOCCCCCC(F)F a2a28afb2cd36ba92268b3c9ccad8379 [0,2,0,0,0,0|2,0,0]=4 11719 B13R0.54 CCSCCOCCCCCN(C)C d1140766958b97d1a0746cf29d961ba7 [0,2,0,0,0,0|2,0,0]=4 11720 B13R0.54 CCSCCOCCCOCC(C)C 3f03cc70609a8bc66b3f939c00685c8e [0,2,0,0,0,0|2,0,0]=4 11721 B13R0.54 CCSCCOCCCSCC(C)C d95bd68a55b2d6583f90b49f4137d880 [0,2,0,0,0,0|2,0,0]=4 11722 B13R0.54 CN(C)CCCCCCCCOCF fd0dc8da85f7194506fe0f0377552078 [0,2,0,0,0,0|2,0,0]=4 11723 B13R0.54 CN(C)CCCCCCCNCCF 4063a8248204beb7817734d7decc8d15 [0,2,0,0,0,0|2,0,0]=4 11724 B13R0.54 CN(C)CCCCCCCNCCO 661d7290191d3323c9a49313af512b1a [0,2,0,0,0,0|2,0,0]=4 11725 B13R0.54 CN(C)CCCCCCCNCCS 08731276f2ba43a0ef6a882ff2fb3ae2 [0,2,0,0,0,0|2,0,0]=4 11726 B13R0.54 CN(C)CCCCCCNCCCF 1a1daa7b80633d7469e5c752201bfc3a [0,2,0,0,0,0|2,0,0]=4 11727 B13R0.54 CN(C)CCCCCCNCCCO aca67eb8a017113ada6ab48cfedd1ac2 [0,2,0,0,0,0|2,0,0]=4 11728 B13R0.54 CN(C)CCCCCCNCCCS 6322c7b3c7470a34a5225bc8135aaf57 [0,2,0,0,0,0|2,0,0]=4 11729 B13R0.54 CN(C)CCCCCCOCCCF 1b69880098ebd56debd8fde36ca1ef60 [0,2,0,0,0,0|2,0,0]=4 11730 B13R0.54 CN(C)CCCCCCOCCCS 2ee0de0fa24da67081ac93a5c4012491 [0,2,0,0,0,0|2,0,0]=4 11731 B13R0.54 CN(C)CCCCCNCCCCF 3af20b01fb5e85feeacc840b23839a8d [0,2,0,0,0,0|2,0,0]=4 11732 B13R0.54 CN(C)CCCCCNCCCCO a7d96313cbfb3b64ea23a2cc148500c9 [0,2,0,0,0,0|2,0,0]=4 11733 B13R0.54 CN(C)CCCCCOCCCCF 842c0ad0acaff9771ada396400f87673 [0,2,0,0,0,0|2,0,0]=4 11734 B13R0.54 CN(C)CCCCNCCCCCCl 20079ee30c7f9bbf758e74995fff147f [0,2,0,0,0,0|2,0,0]=4 11735 B13R0.54 CN(C)CCCCNCCCCCF 9397a45c44646283272bec4808e52695 [0,2,0,0,0,0|2,0,0]=4 11736 B13R0.54 CN(C)CCCCNCCCCCO cbb7cf575a0bee2f04b1424fd83d8893 [0,2,0,0,0,0|2,0,0]=4 11737 B13R0.54 CN(C)CCCCOCCCCCF 95b550cc9960c33ae27b820f271da7b7 [0,2,0,0,0,0|2,0,0]=4 11738 B13R0.54 CN(C)CCCNCCCCCCCl 7bcdacc96a17c1710b61abbf7272f433 [0,2,0,0,0,0|2,0,0]=4 11739 B13R0.54 CN(C)CCCNCCCCCCF f92d850b69f0ee5aabb50f1fe5ec75fb [0,2,0,0,0,0|2,0,0]=4 11740 B13R0.54 CN(C)CCCNCCCCCCO 678ed5a7b8caf6da6b4d74701dba3fe7 [0,2,0,0,0,0|2,0,0]=4 11741 B13R0.54 CN(C)CCCOCCCCCCF 266c11a473c24e9b2aba48183ec20a8b [0,2,0,0,0,0|2,0,0]=4 11742 B13R0.54 CN(C)CCCOCCCCCCS f693c4d79cbc8bd3b7ec1784948af005 [0,2,0,0,0,0|2,0,0]=4 11743 B13R0.54 CN(C)CCNCCCCCCCO c49547cbe4771820023acda497c5827e [0,2,0,0,0,0|2,0,0]=4 11744 B13R0.54 CN(C)CNCCCCCCCCO 16352cf3f18ee82f68d3553648e7aaba [0,2,0,0,0,0|2,0,0]=4 11745 B13R0.54 COCCCCCCNCCC(=O)O e39a7735e36c7c24df967aaff5087af2 [0,2,0,0,0,0|1,0,1]=4 11746 B13R0.54 COCCCCCCNCCC(C)C 03eea03974450bc7143b51e25c49f44c [0,2,0,0,0,0|1,0,0]=3 11747 B13R0.54 COCCCCCCNCCC(C)O bdc439c0c659edf4770eb0b6a858917b [0,2,0,0,0,0|0,0,0]=2 11748 B13R0.54 COCCCCCCNCCC(F)F f65bd7c2ac93881f5abe79572e163b22 [0,2,0,0,0,0|2,0,0]=4 11749 B13R0.54 COCCCCCCNCCN(C)C 66f048b39c6e5a4db057a66e8d9f2cd2 [0,2,0,0,0,0|2,0,0]=4 11750 B13R0.54 COCCCCCCNCCS(=O)C 5f4fb5fa07b6f80e5fe09b6c51374be6 [0,2,0,0,0,0|1,0,1]=4 11751 B13R0.54 COCCCCCCNCCS(=O)O a183b9c6792ad45e93546ebf0e6d7fea [0,2,0,0,0,0|2,0,0]=4 11752 B13R0.54 COCCCCCCNCC[C@@H](C)O 36fba03271cd4aa097ce750a36257694 [0,2,0,0,0,0|0,0,0]=2 11753 B13R0.54 COCCCCCCNCC[C@H](C)O a92f400f622470866857a37f23627e53 [0,2,0,0,0,0|0,0,0]=2 11754 B13R0.54 COCCCCCCOCCC(=O)C 6077f187bb82b5103e2c9cdbfa772e22 [0,2,0,0,0,0|0,0,2]=4 11755 B13R0.54 COCCCCCCOCCC(=O)O 04d3d005e55f4fd8bcb957e224ced8c9 [0,2,0,0,0,0|1,0,1]=4 11756 B13R0.54 COCCCCCCOCCC(C)C 571e886b4a2ff62065a46991749bf010 [0,2,0,0,0,0|1,0,0]=3 11757 B13R0.54 COCCCCCCOCCC(F)F 473461657a8938d3f46243c26e66ce90 [0,2,0,0,0,0|2,0,0]=4 11758 B13R0.54 COCCCCCCOCCN(C)C 67e9cc2d5270b427ca1d0392be443611 [0,2,0,0,0,0|2,0,0]=4 11759 B13R0.54 COCCCCCCOCCS(=O)C ac599a152d71fdbe372f61b8f0cc6ac5 [0,2,0,0,0,0|1,0,1]=4 11760 B13R0.54 COCCCCCCOCOC(C)C a341777e48a7af3c147cef7b8c61dc66 [0,2,0,0,0,0|2,0,0]=4 11761 B13R0.54 COCCCCCNCCCC(=O)C 143d95c1f0830f152de80be706dabc08 [0,2,0,0,0,0|0,0,2]=4 11762 B13R0.54 COCCCCCNCCCC(=O)O 613a84398088354e3f719e17a9d6a306 [0,2,0,0,0,0|1,0,1]=4 11763 B13R0.54 COCCCCCNCCCC(C)C 8ebae0547ad5aea3fff0d9acd33ba30e [0,2,0,0,0,0|1,0,0]=3 11764 B13R0.54 COCCCCCNCCCC(C)O fca692e362d7c90d6778d07eacaf8487 [0,2,0,0,0,0|0,0,0]=2 11765 B13R0.54 COCCCCCNCCCN(C)C b53bb5c36f49866da8ccf98b48b1c1e9 [0,2,0,0,0,0|2,0,0]=4 11766 B13R0.54 COCCCCCNCCCS(=O)C d23515f632c37aa14b26cd2f2139fe10 [0,2,0,0,0,0|1,0,1]=4 11767 B13R0.54 COCCCCCNCCOC(C)C f01bd5b5012e1f05b38aac0fe35374cb [0,2,0,0,0,0|2,0,0]=4 11768 B13R0.54 COCCCCCNCCSC(C)C 0390f8952b4a3903b7f7303f8b7e8016 [0,2,0,0,0,0|2,0,0]=4 11769 B13R0.54 COCCCCCOCCCC(=O)C 30158641dc47b3d5c9cf616e0607b618 [0,2,0,0,0,0|0,0,2]=4 11770 B13R0.54 COCCCCCOCCCC(C)C e897fc7ae5c228cd771e96002df7cf1d [0,2,0,0,0,0|1,0,0]=3 11771 B13R0.54 COCCCCCOCCCN(C)C e628cec6233a380f607b0a71205a758c [0,2,0,0,0,0|2,0,0]=4 11772 B13R0.54 COCCCCCOCCOC(C)C cb3a625ea804af0340e9123e16eb246f [0,2,0,0,0,0|2,0,0]=4 11773 B13R0.54 COCCCCCOCCSC(C)C c68493a3c432282b933085561290038b [0,2,0,0,0,0|2,0,0]=4 11774 B13R0.54 COCCCCNCCCCC(=O)C 8fde1b276d2343b3f176923a9d7e9a1e [0,2,0,0,0,0|0,0,2]=4 11775 B13R0.54 COCCCCNCCCCC(=O)O 18eee65b676c4c35c6831fff82abe11b [0,2,0,0,0,0|1,0,1]=4 11776 B13R0.54 COCCCCNCCCCC(C)C 3fde744b676cf607a1ddcee90188fc7e [0,2,0,0,0,0|1,0,0]=3 11777 B13R0.54 COCCCCNCCCCC(C)O 14d24585588a34ce4b1651940b461cb2 [0,2,0,0,0,0|0,0,0]=2 11778 B13R0.54 COCCCCNCCCCC(F)F 924af864a3c7c41fbcc1301b94883deb [0,2,0,0,0,0|2,0,0]=4 11779 B13R0.54 COCCCCNCCCCN(C)C 2b8ebd8e49ad923b8f72db516c36d726 [0,2,0,0,0,0|2,0,0]=4 11780 B13R0.54 COCCCCNCCCC[C@@H](C)O 6f684c021fb069f90df391a572ae7b6d [0,2,0,0,0,0|0,0,0]=2 11781 B13R0.54 COCCCCNCCCOC(C)C fb790162447b5a49cf81c46c02a1e9be [0,2,0,0,0,0|2,0,0]=4 11782 B13R0.54 COCCCCNCCCSC(C)C 3483e4a7094a754d63b7388b22bb05af [0,2,0,0,0,0|2,0,0]=4 11783 B13R0.54 COCCCCNCCOCC(C)C 2fa6c508b7a01b28f616508be91e54b9 [0,2,0,0,0,0|2,0,0]=4 11784 B13R0.54 COCCCCOCCCCC(=O)C e5ad8ce5a5bdcc5551b18a2ecf427d61 [0,2,0,0,0,0|0,0,2]=4 11785 B13R0.54 COCCCCOCCCCC(=O)O 9a92992a074f3cde42b2c56b2370929e [0,2,0,0,0,0|1,0,1]=4 11786 B13R0.54 COCCCCOCCCCC(C)C 832541b215843014fd78ba9fc2739b53 [0,2,0,0,0,0|1,0,0]=3 11787 B13R0.54 COCCCCOCCCCN(C)C 367bc8fa42c3eb2474a83dec14d22b6f [0,2,0,0,0,0|2,0,0]=4 11788 B13R0.54 COCCCCOCCCOC(C)C 7b3811201289ba2cf1279290464f2499 [0,2,0,0,0,0|2,0,0]=4 11789 B13R0.54 COCCCCOCCCSC(C)C c8535a2f5f8bf848771e31da2d660781 [0,2,0,0,0,0|2,0,0]=4 11790 B13R0.54 COCCCCOCCOCC(C)C e2a9d991e2b68acec65c4c2de793c947 [0,2,0,0,0,0|2,0,0]=4 11791 B13R0.54 COCCCCOCCSCC(C)C 382bc3c6b06c9fff20062f2a8a6de02e [0,2,0,0,0,0|2,0,0]=4 11792 B13R0.54 COCCCNCCCCCC(=O)C 3dc4f19ed618518780ee859cb5d9c5d7 [0,2,0,0,0,0|0,0,2]=4 11793 B13R0.54 COCCCNCCCCCC(=O)O d02ed54e53c8559aa099ecea3876d02b [0,2,0,0,0,0|1,0,1]=4 11794 B13R0.54 COCCCNCCCCCC(C)C c61d7b58acf5e08d81ee50445eba9b85 [0,2,0,0,0,0|1,0,0]=3 11795 B13R0.54 COCCCNCCCCCC(F)F 3cee87895b778ff805a5d9b92e0e8018 [0,2,0,0,0,0|2,0,0]=4 11796 B13R0.54 COCCCNCCCCCN(C)C b2addb455c5a1ec84b8f026ed14d3aac [0,2,0,0,0,0|2,0,0]=4 11797 B13R0.54 COCCCNCCCOCC(C)C 72c88e638436821d36dd40bedeed00a7 [0,2,0,0,0,0|2,0,0]=4 11798 B13R0.54 COCCCOCCCCCC(=O)C 10e15c28347a6905f0ac2a761a5f8e5b [0,2,0,0,0,0|0,0,2]=4 11799 B13R0.54 COCCCOCCCCCC(=O)O 47f36631dbe1ef5c8d4b489503f39dd0 [0,2,0,0,0,0|1,0,1]=4 11800 B13R0.54 COCCCOCCCCCC(C)C bac841db817e40d50857496bd64eea4c [0,2,0,0,0,0|1,0,0]=3 11801 B13R0.54 COCCCOCCCCCC(F)F f82fa64456ce5600cfd6942855d598a1 [0,2,0,0,0,0|2,0,0]=4 11802 B13R0.54 COCCCOCCCCCN(C)C e3b0512c89f5566a7e96ec95131518d2 [0,2,0,0,0,0|2,0,0]=4 11803 B13R0.54 COCCCOCCCOCC(C)C babceca3cf915a399b951cc653a3611b [0,2,0,0,0,0|2,0,0]=4 11804 B13R0.54 COCCCOCCCSCC(C)C c1abecad9b3caacc7c0d2db4e20ba9cc [0,2,0,0,0,0|2,0,0]=4 11805 B13R0.54 COCCNCCCCCCC(=O)O fda96dfecf49ea1ee82a96f970f7f6eb [0,2,0,0,0,0|1,0,1]=4 11806 B13R0.54 COCCNCCCCCCC(C)C 408a330d43b0869afdc3d43543d83b1f [0,2,0,0,0,0|1,0,0]=3 11807 B13R0.54 COCCNCCCCCCN(C)C f6f46566bee501418791e2bfe73477ec [0,2,0,0,0,0|2,0,0]=4 11808 B13R0.54 COCCNCCCCSCC(C)C df098e3d9b08aa9b253c3dc30f19efe4 [0,2,0,0,0,0|2,0,0]=4 11809 B13R0.54 COCCOCCCCCCC(=O)O 6d8abc2a5d8d534414d06d578a5d6590 [0,2,0,0,0,0|1,0,1]=4 11810 B13R0.54 COCCOCCCCCCC(C)C a2e62af0ac92fe1bdba6d4dec580e7fa [0,2,0,0,0,0|1,0,0]=3 11811 B13R0.54 COCCOCCCCCCN(C)C 3f9ae9093a0179ec5510d34e8a42aad9 [0,2,0,0,0,0|2,0,0]=4 11812 B13R0.54 COCCOCCCCNCC(C)C 17e81e9914a1336e974e0dcd32f1763a [0,2,0,0,0,0|2,0,0]=4 11813 B13R0.54 COCCOCCCCNCC(C)O eb387fff934dd94ed3cb1428cdaba5bc [0,2,0,0,0,0|1,0,0]=3 11814 B13R0.54 COCCOCCCCNC[C@@H](C)O cad8d0257012393acc63b15b32a51070 [0,2,0,0,0,0|1,0,0]=3 11815 B13R0.54 COCCOCCCCNC[C@H](C)O 60c1ca40fc4182effadee2879531976e [0,2,0,0,0,0|1,0,0]=3 11816 B13R0.54 COCCOCCCNCCC(C)C 4704c83ae6ff93044a0662083c1410e7 [0,2,0,0,0,0|2,0,0]=4 11817 B13R0.54 COCCOCCCNCCC(C)O c682ebb26a517a6868a4a3adc609d3cf [0,2,0,0,0,0|1,0,0]=3 11818 B13R0.54 COCCOCCCNCC[C@@H](C)O fdb757c2006b5d1c098b28b70eaa9a19 [0,2,0,0,0,0|1,0,0]=3 11819 B13R0.54 COCCOCCCNCC[C@H](C)O e135240526e4e28fc8b3261730428b7a [0,2,0,0,0,0|1,0,0]=3 11820 B13R0.54 COCCOCCCOCCC(C)C 387bd6ab1303fde873a14a45f4687851 [0,2,0,0,0,0|2,0,0]=4 11821 B13R0.54 COCCOCCNCCCC(C)C f6541eadf6fd5a5475583dca6e3a5c1c [0,2,0,0,0,0|2,0,0]=4 11822 B13R0.54 COCCOCCNCCCC(C)O 708e61967a4337373f534a76530ae3f5 [0,2,0,0,0,0|1,0,0]=3 11823 B13R0.54 COCCOCCOCCCC(C)C 931ddbd27a6c03d684da698813d4d836 [0,2,0,0,0,0|2,0,0]=4 11824 B13R0.54 COCCOCOCCCCC(C)C 6b9d189b3d7d7592a23f6d3b0e567753 [0,2,0,0,0,0|2,0,0]=4 11825 B13R0.54 COCNCCCCCCCC(=O)O 8fbf3719e8a20062e8d3dcf9677dc3b3 [0,2,0,0,0,0|1,0,1]=4 11826 B13R0.54 COCNCCCCCCCN(C)C 69ba948071246eae73125b3d302617d9 [0,2,0,0,0,0|2,0,0]=4 11827 B13R0.54 COCOCCCCCCCC(=O)C 10024233c25da8ccb0ce35b5ac460a3d [0,2,0,0,0,0|0,0,2]=4 11828 B13R0.54 COCOCCCCCCCC(=O)O da93443a610969d76a15b3e40ada2493 [0,2,0,0,0,0|1,0,1]=4 11829 B13R0.54 COCOCCCCCCCC(C)C ece8f46a37653fb21d4ec66eded53828 [0,2,0,0,0,0|1,0,0]=3 11830 B13R0.54 COCOCCOCCCCC(C)C 2e43f92daa2130ccdfcf25e28352ab1a [0,2,0,0,0,0|2,0,0]=4 11831 B13R0.54 CS(=O)CCCNCCCCCCF 67054fffe9262e4fab599d0d5cc5200b [0,2,0,0,0,0|1,0,1]=4 11832 B13R0.54 CS(=O)CCCNCCCCCCO 8d006a791e3b7bf3d4e27c9852b3e80a [0,2,0,0,0,0|1,0,1]=4 11833 B13R0.54 CS(=O)CCNCCCCCCCO 3eef7187b4d10b61742605a7b2e0155e [0,2,0,0,0,0|1,0,1]=4 11834 B13R0.54 CSCCCCNCCCCC(=O)C 4dc99c9dd637a7e797d7d2a0d7425dca [0,2,0,0,0,0|0,0,2]=4 11835 B13R0.54 CSCCCCNCCCCC(C)C 9ed76f01cac354c77b7b6ec2a7fc79c1 [0,2,0,0,0,0|1,0,0]=3 11836 B13R0.54 CSCCCCNCCCCC(C)O b1ca639b8170bd240b56ebe0ef351127 [0,2,0,0,0,0|0,0,0]=2 11837 B13R0.54 CSCCCCNCCCCN(C)C c391329a957984c198098e59cebb0441 [0,2,0,0,0,0|2,0,0]=4 11838 B13R0.54 CSCCCCNCCCC[C@@H](C)O 4743968dc0d1f9a2bceca297f063f804 [0,2,0,0,0,0|0,0,0]=2 11839 B13R0.54 CSCCCCNCCOCC(C)C d99d03975652b40d95e39a5eb4fb60d7 [0,2,0,0,0,0|2,0,0]=4 11840 B13R0.54 CSCCCCOCCCCC(=O)C 10cdd3a76ea815e34a8e857c40eb8f91 [0,2,0,0,0,0|0,0,2]=4 11841 B13R0.54 CSCCCCOCCCCC(=O)O ddd473eb0777f29e30309fe61b0d51e0 [0,2,0,0,0,0|1,0,1]=4 11842 B13R0.54 CSCCCCOCCCCC(C)C fab9134f3f6b68c97016fc6dfa2ea7fe [0,2,0,0,0,0|1,0,0]=3 11843 B13R0.54 CSCCCCOCCCCN(C)C 596e072d24da1ef7a87af3f7d5f60e0e [0,2,0,0,0,0|2,0,0]=4 11844 B13R0.54 CSCCCCOCCOCC(C)C c77c4e4030841e3f0812f457adecdfe0 [0,2,0,0,0,0|2,0,0]=4 11845 B13R0.54 CSCCCNCCCCCC(=O)C 155735173baa647cd85dd68827045ece [0,2,0,0,0,0|0,0,2]=4 11846 B13R0.54 CSCCCNCCCCCC(=O)O 2332993ab42a88e89a375bbea2a07f0f [0,2,0,0,0,0|1,0,1]=4 11847 B13R0.54 CSCCCNCCCCCC(C)C 68288a1d5e23b2403e4af1a65731a4b1 [0,2,0,0,0,0|1,0,0]=3 11848 B13R0.54 CSCCCNCCCCCC(F)F 873e3087c5bbba26c56261f9cc865174 [0,2,0,0,0,0|2,0,0]=4 11849 B13R0.54 CSCCCNCCCCCN(C)C 7fa87522d09698d115d7683fe0a84eed [0,2,0,0,0,0|2,0,0]=4 11850 B13R0.54 CSCCCNCCCOCC(C)C 4d1e0507ce814144def9ffca8cfdfef6 [0,2,0,0,0,0|2,0,0]=4 11851 B13R0.54 CSCCCOCCCCCC(=O)C f4d7d3b97627a833d887babe9d1cf1d3 [0,2,0,0,0,0|0,0,2]=4 11852 B13R0.54 CSCCCOCCCCCC(=O)O e3367dd54316b007622c2e61a6341a36 [0,2,0,0,0,0|1,0,1]=4 11853 B13R0.54 CSCCCOCCCCCC(C)C 9074c50172e2ffd11771979853d4eb47 [0,2,0,0,0,0|1,0,0]=3 11854 B13R0.54 CSCCCOCCCCCC(F)F 38c81d7d2f56d543dc1b748a5ed28006 [0,2,0,0,0,0|2,0,0]=4 11855 B13R0.54 CSCCCOCCCCCN(C)C 66aefd8ba1ed1f8fc62ae4a80e54e383 [0,2,0,0,0,0|2,0,0]=4 11856 B13R0.54 CSCCCOCCCOCC(C)C d431b39adc5bbf8cb583a0521cb948e0 [0,2,0,0,0,0|2,0,0]=4 11857 B13R0.54 CSCCCOCCCSCC(C)C 7a752eccc173e2edaf6e059d1a109411 [0,2,0,0,0,0|2,0,0]=4 11858 B13R0.54 CSCCNCCCCCCC(=O)O d45bcaea8b549f3455648f0688edbb75 [0,2,0,0,0,0|1,0,1]=4 11859 B13R0.54 CSCCNCCCCCCC(C)C 8eddb7e6581f585914bceb501344a239 [0,2,0,0,0,0|1,0,0]=3 11860 B13R0.54 CSCCNCCCCCCN(C)C 37929397281f2fdb70d33575fb87aff9 [0,2,0,0,0,0|2,0,0]=4 11861 B13R0.54 CSCCNCCCCSCC(C)C 358f14e69b09a6dcef1ba7d3245803c2 [0,2,0,0,0,0|2,0,0]=4 11862 B13R0.54 CSCCOCCCCCCC(=O)O 27221fe47154be770ad118f7c527364f [0,2,0,0,0,0|1,0,1]=4 11863 B13R0.54 CSCCOCCCCCCC(C)C b9c641130f1cf08e80e183a8deb3bc08 [0,2,0,0,0,0|1,0,0]=3 11864 B13R0.54 CSCCOCCCCCCN(C)C 8d6f2b1aae56a8b9bb1171a869fb28c1 [0,2,0,0,0,0|2,0,0]=4 11865 B13R0.54 CSCCOCCCNCCC(C)C bf3659aa21fcec7825f14ffe13ff9409 [0,2,0,0,0,0|2,0,0]=4 11866 B13R0.54 CSCCOCCCNCCC(C)O a4950c4950715b3511d1f9708b5c7ecc [0,2,0,0,0,0|1,0,0]=3 11867 B13R0.54 CSCNCCCCCCCC(=O)O 813c9ff45de6e9eae30edb07a3e73efc [0,2,0,0,0,0|1,0,1]=4 11868 B13R0.54 CSCNCCCCCCCN(C)C f2f50c7f3adee0847c43c7e351ba66ca [0,2,0,0,0,0|2,0,0]=4 11869 B13R0.54 CSCOCCCCCCCC(=O)C f6c132b02042ede24d554038c31296f5 [0,2,0,0,0,0|0,0,2]=4 11870 B13R0.54 CSCOCCCCCCCC(=O)O 09cdb3c0dd952fa1c8d428c58a3b9dca [0,2,0,0,0,0|1,0,1]=4 11871 B13R0.54 CSCOCCCCCCCC(C)C 4beba604f4f840fbd629c222bc7d9cb9 [0,2,0,0,0,0|1,0,0]=3 11872 B13R0.54 C[C@@H](O)CCCCNCCCCC#N 80f0f424227f81e655622c5718768336 [0,2,0,0,0,0|0,0,1]=3 11873 B13R0.54 C[C@@H](O)CCCCNCCCCCCl 4d684b048362781fbe029284e57f8ca2 [0,2,0,0,0,0|0,0,0]=2 11874 B13R0.54 C[C@@H](O)CCCCNCCCCCO 78359f98c8e84e6b4594f8343960cbc3 [0,2,0,0,0,0|0,0,0]=2 11875 B13R0.54 C[C@@H](O)CCCCNCCOCCO f6e4abba52d08acdaef1373545a699df [0,2,0,0,0,0|1,0,0]=3 11876 B13R0.54 C[C@@H](O)CCCCNCCOCCS e053782620c636b8dcca9cd79bfdb52d [0,2,0,0,0,0|1,0,0]=3 11877 B13R0.54 C[C@@H](O)CCCCNCCSCCO f8f58836840d8a42e1f6da9540c95f21 [0,2,0,0,0,0|1,0,0]=3 11878 B13R0.54 C[C@@H](O)CCNCCCCCCC#N 3caf9c46e33f4635aea199ed93cd46d5 [0,2,0,0,0,0|0,0,1]=3 11879 B13R0.54 C[C@@H](O)CCNCCCCCCC=O b465701401172aaff1a05ee903308925 [0,2,0,0,0,0|0,0,1]=3 11880 B13R0.54 C[C@@H](O)CCNCCCCCCCO 76cb257b7e1d57f2e40da6e2ebfacaf5 [0,2,0,0,0,0|0,0,0]=2 11881 B13R0.54 C[C@@H](O)CCNCCCOCCCO 02c4f1a98cb0f3d7153a273565645bd5 [0,2,0,0,0,0|1,0,0]=3 11882 B13R0.54 C[C@@H](O)CNCCCCCCCCO b1e84124ce8a9971a8164c8203afcdc8 [0,2,0,0,0,0|0,0,0]=2 11883 B13R0.54 C[C@@H](O)CNCCOCCOCCF 5bc837bd71686bb8ed20364a62bbccc8 [0,2,0,0,0,0|2,0,0]=4 11884 B13R0.54 C[C@@H](O)CNCCOCCOCCO 31c9ed9e46aa1ea0c71abfd800997d96 [0,2,0,0,0,0|2,0,0]=4 11885 B13R0.54 C[C@H](O)CCNCCCCCCC#N cd3fe1a4ff651db4eb0ac6d300c978dc [0,2,0,0,0,0|0,0,1]=3 11886 B13R0.54 C[C@H](O)CCNCCCCCCC=O 8c7bee6d2a61bbed73fb17e5e21dbf4d [0,2,0,0,0,0|0,0,1]=3 11887 B13R0.54 C[C@H](O)CCNCCCCCCCO 959cbd1407285841b88137340237a884 [0,2,0,0,0,0|0,0,0]=2 11888 B13R0.54 C[C@H](O)CCNCCCOCCCO aaa9ed1ee740b91785a7401efb7bdbec [0,2,0,0,0,0|1,0,0]=3 11889 B13R0.54 C[C@H](O)CNCCCCCCCCO 6fa72f99082fd8835d49c90b7acbc59e [0,2,0,0,0,0|0,0,0]=2 11890 B13R0.54 C[C@H](O)CNCCOCCOCCF 8f73beb9edf994993ea3abb39c5f5ad8 [0,2,0,0,0,0|2,0,0]=4 11891 B13R0.54 C[C@H](O)CNCCOCCOCCO fc3484da4c6172ad785410baa9d8f1cb [0,2,0,0,0,0|2,0,0]=4 11892 B13R0.54 FC(F)CCCCCNCCCCCl 563078256c1f9ec7417fb0d4e186eb34 [0,2,0,0,0,0|2,0,0]=4 11893 B13R0.54 FC(F)CCCCCNCCCCS b4d249f55a9d820103c566e489510108 [0,2,0,0,0,0|2,0,0]=4 11894 B13R0.54 FC(F)CCCCCOCCCCS e2e3bb50278a1560afdb0a84c97bd99a [0,2,0,0,0,0|2,0,0]=4 11895 B13R0.54 FCCCCCNCCCCC(F)F aaefb6b9ae90f80aa9f47325b41e1d44 [0,2,0,0,0,0|2,0,0]=4 11896 B13R0.54 FCCCCOCCCCCC(F)F 5b8366f1afd45040fbbb2a11ba623a68 [0,2,0,0,0,0|2,0,0]=4 11897 B13R0.54 O=C(O)CCCCCCCCNCF 30ea2922f10d1e003a2f51065e126242 [0,2,0,0,0,0|1,0,1]=4 11898 B13R0.54 O=C(O)CCCCCCCCNCO 9b3c91b142b29a7f723d23a14331bc9a [0,2,0,0,0,0|1,0,1]=4 11899 B13R0.54 O=C(O)CCCCCCCCOCF 411ff4a18f4a9c160bb7e1c49f9d86b3 [0,2,0,0,0,0|1,0,1]=4 11900 B13R0.54 O=C(O)CCCCCCCNCCF 590275ed0f880f1d9e3277711f1c58a1 [0,2,0,0,0,0|1,0,1]=4 11901 B13R0.54 O=C(O)CCCCCCCNCCI 35d6687d3cb4e2f6f4f4921e66271cba [0,2,0,0,0,0|1,0,1]=4 11902 B13R0.54 O=C(O)CCCCCCCNCCO 0170dd02fd19123d7212cedecb06c9ff [0,2,0,0,0,0|1,0,1]=4 11903 B13R0.54 O=C(O)CCCCCCCNCCS 069e7a795fcf3a3dd4fd8fd20bc95962 [0,2,0,0,0,0|1,0,1]=4 11904 B13R0.54 O=C(O)CCCCCCCOCCF 1cfc970bb3c5b4bc2821ab7db260dd6d [0,2,0,0,0,0|1,0,1]=4 11905 B13R0.54 O=C(O)CCCCCCCOCCS 12afa6a85e27c181bf775bd772af8d43 [0,2,0,0,0,0|1,0,1]=4 11906 B13R0.54 O=C(O)CCCCCCNCCCCl 5b66274712314b89a0ff1b3e8135f761 [0,2,0,0,0,0|1,0,1]=4 11907 B13R0.54 O=C(O)CCCCCCNCCCF 48bc55519ae39b271d991bb26a9b4b42 [0,2,0,0,0,0|1,0,1]=4 11908 B13R0.54 O=C(O)CCCCCCNCCCO 2db76f24bd0a72d16611fabf6f184e26 [0,2,0,0,0,0|1,0,1]=4 11909 B13R0.54 O=C(O)CCCCCCNCCCS f587e1425a329fee7b5519adbddd1e4e [0,2,0,0,0,0|1,0,1]=4 11910 B13R0.54 O=C(O)CCCCCCOCCCF 3046a30d506471d58849b4b845016f7e [0,2,0,0,0,0|1,0,1]=4 11911 B13R0.54 O=C(O)CCCCCCOCCCS 1688a640b77deff1bfdf19089f8daa0e [0,2,0,0,0,0|1,0,1]=4 11912 B13R0.54 O=C(O)CCCCCNCCCCF 120baa3c47702d9c31278125cac1ad6b [0,2,0,0,0,0|1,0,1]=4 11913 B13R0.54 O=C(O)CCCCCNCCCCO f7b57506148fd32ee92b116d88db79ca [0,2,0,0,0,0|1,0,1]=4 11914 B13R0.54 O=C(O)CCCCCOCCCCF 0a5e10bb7061cdc06ec68641f11f2c2d [0,2,0,0,0,0|1,0,1]=4 11915 B13R0.54 O=C(O)CCCCNCCCCCCl 82d0675d81c4bbf363a94d5cf6ecbbe5 [0,2,0,0,0,0|1,0,1]=4 11916 B13R0.54 O=C(O)CCCCNCCCCCF 4c6e4ba9e721ee2a33538b43750f6b3b [0,2,0,0,0,0|1,0,1]=4 11917 B13R0.54 O=C(O)CCCCNCCCCCO 46df79fde7e5ce1cf6653b411843efe4 [0,2,0,0,0,0|1,0,1]=4 11918 B13R0.54 O=C(O)CCCCOCCCCCF 3ddde0289a6902089d07e085e74aea7f [0,2,0,0,0,0|1,0,1]=4 11919 B13R0.54 O=C(O)CCCNCCCCCCF 360cb28dc8819d46430bf5b8ed8f8da3 [0,2,0,0,0,0|1,0,1]=4 11920 B13R0.54 O=C(O)CCCNCCCCCCO 3d665abe26fdc6e2fbc2ae2d30894cbc [0,2,0,0,0,0|1,0,1]=4 11921 B13R0.54 O=C(O)CCCOCCCCCCF 50daffb7a68b82f7b723588b58da1a57 [0,2,0,0,0,0|1,0,1]=4 11922 B13R0.54 O=C(O)CCNCCCCCCCO 1638a8399abe83e55d2e266e2b2fdec6 [0,2,0,0,0,0|1,0,1]=4 11923 B13R0.54 O=C(O)CNCCCCCCCCO 0e36bac6fd0609ac64e2e3db3eabb114 [0,2,0,0,0,0|1,0,1]=4 11924 B13R0.54 O=S(O)CCNCCCCCCCO e068fe1b5bca82db2cbe620b9607a9ae [0,2,0,0,0,0|2,0,0]=4 11925 B13R0.54 OCCCCCCCCNCC(F)F e8aef67bf1c36f72070710cca58229e8 [0,2,0,0,0,0|2,0,0]=4 11926 B13R0.54 OCCCCCCCNCCC(F)F 76d65787a9dcf6c081b4b148fbb7f248 [0,2,0,0,0,0|2,0,0]=4 11927 B13R0.54 OCCCCCNCCCCC(F)F 223ec8bfb8b0fef20cba7e9527e1339f [0,2,0,0,0,0|2,0,0]=4 11928 B13R0.54 OCCCCNCCCCCC(F)F 8caee7e453cc5f1ae20b91299a8dde05 [0,2,0,0,0,0|2,0,0]=4 11929 B13R0.119 C=C(C)CCCNCC(O)CCCC b047b73d1e5b7ba98f5856fdc1275a18 [0,2,0,0,0,0|1,0,1]=4 11930 B13R0.119 C=C(C)CCCOCC(C)CCCC c2da6edf2551998772bd318a0be67527 [0,2,0,0,0,0|1,0,1]=4 11931 B13R0.119 C=C(C)CCOCCC(C)CCCC 08780293717f650eb2aff3443646a4a3 [0,2,0,0,0,0|1,0,1]=4 11932 B13R0.119 C=CCCC(O)CNCCCC(C)O cb9cb4b31424ab64f85c274ec41aba45 [0,2,0,0,0,0|0,0,2]=4 11933 B13R0.119 CC(C)CCCCCN(C)CCCO 951a7f7b2fc81ffc8b2ae286afd13331 [0,2,0,0,0,0|2,0,0]=4 11934 B13R0.119 CC(C)CCCCNC(C)CCCO be916fe256a98063df3bceb6e3f04b95 [0,2,0,0,0,0|2,0,0]=4 11935 B13R0.119 CC(C)CCCCN[C@H](C)CCCO 41bb7078cade32864d4d204a528c52c8 [0,2,0,0,0,0|2,0,0]=4 11936 B13R0.119 CC(C)CCCNC[C@H](C)CCCO 0461216e1056a90a09d4ed7164ac38d5 [0,2,0,0,0,0|2,0,0]=4 11937 B13R0.119 CC(CCCO)NCCCC[C@@H](C)O ffa0f7fbe8682736e294a02e41384409 [0,2,0,0,0,0|1,0,0]=3 11938 B13R0.119 CC(O)CCCCCC(=O)NCCBr 899791fd19d59dbc9bdaa8f34b61ee15 [0,2,0,0,0,0|1,0,1]=4 11939 B13R0.119 CC(O)CCCCCC(=O)NCCF b5bb04e2bb37e6522a19401d83e4e616 [0,2,0,0,0,0|1,0,1]=4 11940 B13R0.119 CC(O)CCCCCC(=O)NCCI 7df589eca43737ee909dfb067719b64a [0,2,0,0,0,0|1,0,1]=4 11941 B13R0.119 CC(O)CCCCCC(=O)NCCO c5e462d6dbf7ccdccca9dc5607711dda [0,2,0,0,0,0|1,0,1]=4 11942 B13R0.119 CC(O)CCCCCC(=O)NCCS d50c6dadccbc553e8fa5405de14da029 [0,2,0,0,0,0|1,0,1]=4 11943 B13R0.119 CC(O)CCCCNC(C)CCCO 992dc8056fefda41fece8411028e070c [0,2,0,0,0,0|1,0,0]=3 11944 B13R0.119 CC(O)CCCCN[C@H](C)CCCO 8c394fe3f20e27362362beaf8c2bf258 [0,2,0,0,0,0|1,0,0]=3 11945 B13R0.119 CC(O)CCCNC[C@H](C)CCCO 634667ee11e2fe7f75873cf9cd58e4d8 [0,2,0,0,0,0|1,0,0]=3 11946 B13R0.119 CCCCC(=O)OCNCCC(C)O f97487f791e091b511bfc80fba15fbdb [0,2,0,0,0,0|1,0,1]=4 11947 B13R0.119 CCCCC(=O)OCNCC[C@@H](C)O a96d79caf2c1470fe9eec82b5b7213ec [0,2,0,0,0,0|1,0,1]=4 11948 B13R0.119 CCCCC(=O)OCNCC[C@H](C)O 9ccf9a03ec36dd85875187f4ca3fdbe7 [0,2,0,0,0,0|1,0,1]=4 11949 B13R0.119 CCCCC(C)CCCCOC(C)C e2dddfc2d9494ebe99c500431cf86e26 [0,2,0,0,0,0|1,0,0]=3 11950 B13R0.119 CCCCC(C)CCOCCC(=O)C 53d5358a9b9d7cb9e9280c6ec2066ca7 [0,2,0,0,0,0|0,0,2]=4 11951 B13R0.119 CCCCC(C)CCOCCC(=O)O 6e95e697222d71b6f869c91a8936eb90 [0,2,0,0,0,0|1,0,1]=4 11952 B13R0.119 CCCCC(C)CCOCCC(C)C 53abc6c7d2f0d321ae7a2131610ab04a [0,2,0,0,0,0|1,0,0]=3 11953 B13R0.119 CCCCC(C)CCOCCN(C)C f1bfac57832fddd02e9fb0daed08eed5 [0,2,0,0,0,0|2,0,0]=4 11954 B13R0.119 CCCCC(C)CCOCCS(=O)C 78f2b60c403d01301962cb01a879c870 [0,2,0,0,0,0|1,0,1]=4 11955 B13R0.119 CCCCC(C)CCOCOC(C)C c4f258d3389f44b96c8ae7fdc9676d8d [0,2,0,0,0,0|2,0,0]=4 11956 B13R0.119 CCCCC(C)COCCCC(=O)C d70fe437e6c1f0ebc86dc911cc9945c4 [0,2,0,0,0,0|0,0,2]=4 11957 B13R0.119 CCCCC(C)COCCCC(C)C 53e9b331846847b9ffef4e8710f07fc0 [0,2,0,0,0,0|1,0,0]=3 11958 B13R0.119 CCCCC(C)COCCCN(C)C d760a4f3c248b9c63d1cf3dd9ee19fd3 [0,2,0,0,0,0|2,0,0]=4 11959 B13R0.119 CCCCC(C)COCCOC(C)C 789a7cdd5caea46d1256544ba2e91195 [0,2,0,0,0,0|2,0,0]=4 11960 B13R0.119 CCCCC(C)COCCSC(C)C 944842ee2537015adc803310a06ddebd [0,2,0,0,0,0|2,0,0]=4 11961 B13R0.119 CCCCC(C)NCCCCC(=O)C 1a454f869982c6fd5a2edc4a8947575b [0,2,0,0,0,0|0,0,2]=4 11962 B13R0.119 CCCCC(C)NCCCCC(=O)O 5ad004698fe5230cb57783e24bd4f613 [0,2,0,0,0,0|1,0,1]=4 11963 B13R0.119 CCCCC(C)NCCCCC(C)C 7906e848096120efda4382efe9054356 [0,2,0,0,0,0|1,0,0]=3 11964 B13R0.119 CCCCC(C)NCCCCC(C)O e6a9fe93f128bce5ebe0d1f2c12730a5 [0,2,0,0,0,0|0,0,0]=2 11965 B13R0.119 CCCCC(C)NCCCCC(F)F c2d19370965e15ae04d0d9f9f536d57c [0,2,0,0,0,0|2,0,0]=4 11966 B13R0.119 CCCCC(C)NCCCCN(C)C 97e2b76ef8a16ab1daa90eef8a636ce9 [0,2,0,0,0,0|2,0,0]=4 11967 B13R0.119 CCCCC(C)NCCCC[C@@H](C)O fb4fe2b7f42a1db926ade6b6676ee539 [0,2,0,0,0,0|0,0,0]=2 11968 B13R0.119 CCCCC(C)NCCCOC(C)C 06a620aafab401ecdacb1789a563d729 [0,2,0,0,0,0|2,0,0]=4 11969 B13R0.119 CCCCC(C)NCCCSC(C)C 58cbac5ecd6f453ad48e4efff79fee77 [0,2,0,0,0,0|2,0,0]=4 11970 B13R0.119 CCCCC(C)NCCOCC(C)C baf7a4a6519b853a7c83203214d1c3e6 [0,2,0,0,0,0|2,0,0]=4 11971 B13R0.119 CCCCC(C)OCCCCC(=O)C 264f4eb5e3401b395af5422c3ee7db90 [0,2,0,0,0,0|0,0,2]=4 11972 B13R0.119 CCCCC(C)OCCCCC(C)C caac42b4c7489d39c7d9194e65c30f77 [0,2,0,0,0,0|1,0,0]=3 11973 B13R0.119 CCCCC(C)OCCCCN(C)C 57d33ada2dc2c86b75e9804b5bf02a72 [0,2,0,0,0,0|2,0,0]=4 11974 B13R0.119 CCCCC(C)OCCCOC(C)C 2ef5935d33c740bf2e96f41d7a996181 [0,2,0,0,0,0|2,0,0]=4 11975 B13R0.119 CCCCC(C)OCCCSC(C)C e2166292b33388249fe58578c2bfa085 [0,2,0,0,0,0|2,0,0]=4 11976 B13R0.119 CCCCC(C)OCCOCC(C)C 9719f97e70dad86dc716c44b8676a661 [0,2,0,0,0,0|2,0,0]=4 11977 B13R0.119 CCCCC(C)OCCSCC(C)C 7916ef0da066dea96e92b9dcea25ba9c [0,2,0,0,0,0|2,0,0]=4 11978 B13R0.119 CCCCC(O)CNCCCC(=O)C a2c59599aa5c6733d01aa2e432e6231e [0,2,0,0,0,0|0,0,2]=4 11979 B13R0.119 CCCCC(O)CNCCCC(C)C 7904cd1038779a3b477c600a2f09d6e7 [0,2,0,0,0,0|1,0,0]=3 11980 B13R0.119 CCCCC(O)CNCCCC(C)O 39207001c619d3fea3fb06f92ef7f5a2 [0,2,0,0,0,0|0,0,0]=2 11981 B13R0.119 CCCCC(O)CNCCCN(C)C 79cac03a924d6e83fceca941f88b1352 [0,2,0,0,0,0|2,0,0]=4 11982 B13R0.119 CCCCC(O)CNCCOC(C)C fee45a0fbd25a9001206ee80626e1f64 [0,2,0,0,0,0|2,0,0]=4 11983 B13R0.119 CCCCC(O)CNCCSC(C)C fb33157dcf9f9245b98091d4672e32bc [0,2,0,0,0,0|2,0,0]=4 11984 B13R0.119 CCCCN(C)CCCCCC(=O)C 056e86056c043223d9b333bd9b533f7c [0,2,0,0,0,0|0,0,2]=4 11985 B13R0.119 CCCCN(C)CCCCCC(C)C d82342a7fb787820516b9318b7eddc50 [0,2,0,0,0,0|1,0,0]=3 11986 B13R0.119 CCCCN(C)CCCCCC(F)F 83b365d1dce52044990903cec29b5091 [0,2,0,0,0,0|2,0,0]=4 11987 B13R0.119 CCCCN(C)CCCNCC(C)C 26b23c9fb9d71765b58488c018c28d15 [0,2,0,0,0,0|2,0,0]=4 11988 B13R0.119 CCCCN(C)CCCNCC(C)O 337685711578d4061ed5a610590c8a82 [0,2,0,0,0,0|1,0,0]=3 11989 B13R0.119 CCCCN(C)CCCNC[C@@H](C)O 1452b08323b8e5316c1f5f24ed171870 [0,2,0,0,0,0|1,0,0]=3 11990 B13R0.119 CCCCN(C)CCCNC[C@H](C)O e4bf748a2dd1413b28a37a01d4fe9185 [0,2,0,0,0,0|1,0,0]=3 11991 B13R0.119 CCCCN(C)CCNCCC(C)C 9d747e52f26477074f71aa30aa12ba59 [0,2,0,0,0,0|2,0,0]=4 11992 B13R0.119 CCCCN(C)CCNCCC(C)O e2bff2c4e962679d4a530eda01a013bb [0,2,0,0,0,0|1,0,0]=3 11993 B13R0.119 CCCC[C@@H](C)NCCCCC(=O)C 244bf571ebc3966a0aa2add1cfc3a913 [0,2,0,0,0,0|0,0,2]=4 11994 B13R0.119 CCCC[C@@H](C)NCCCCC(C)C 7aebd2baddd1eef48c3a80841b2dcbd6 [0,2,0,0,0,0|1,0,0]=3 11995 B13R0.119 CCCC[C@@H](C)NCCCCC(C)O d059085cfe95dc9bd44ea9f67139916f [0,2,0,0,0,0|0,0,0]=2 11996 B13R0.119 CCCC[C@@H](C)NCCCCN(C)C a2b04f07be7cd6db0fd4af855575ca70 [0,2,0,0,0,0|2,0,0]=4 11997 B13R0.119 CCCC[C@@H](C)NCCCC[C@@H](C)O dfa2279c7216bbb4e3337903dfdf9f16 [0,2,0,0,0,0|0,0,0]=2 11998 B13R0.119 CCCC[C@@H](C)NCCOCC(C)C 939157424e734b4d26bf4721b65e9d73 [0,2,0,0,0,0|2,0,0]=4 11999 B13R0.119 CCCC[C@@H](C)OCCCCC(=O)C 02c9831bf9a93f4ab593caa105becd91 [0,2,0,0,0,0|0,0,2]=4 12000 B13R0.119 CCCC[C@@H](C)OCCCCC(C)C 4e9359054a6bf0637eb1ca9edb989870 [0,2,0,0,0,0|1,0,0]=3 12001 B13R0.119 CCCC[C@@H](C)OCCCCN(C)C f6482cac90a5c7a2f2ddff8ba430cc11 [0,2,0,0,0,0|2,0,0]=4 12002 B13R0.119 CCCC[C@@H](C)OCCOCC(C)C 7dd5c9ab7df2bbb9d8e90ca5b0d926a3 [0,2,0,0,0,0|2,0,0]=4 12003 B13R0.119 CCCC[C@H](C)OCCCCC(=O)C 8b3a73ac67850d37690fe0f852532dcd [0,2,0,0,0,0|0,0,2]=4 12004 B13R0.119 CCCC[C@H](C)OCCCCC(C)C f52d08497a1602accbd5b6a4dda73e56 [0,2,0,0,0,0|1,0,0]=3 12005 B13R0.119 CCCC[C@H](C)OCCCCN(C)C dbbc32e3135dcb347be0ac6910762dfb [0,2,0,0,0,0|2,0,0]=4 12006 B13R0.119 CCCC[C@H](C)OCCOCC(C)C 221fa52b9e4b870737320c90384f7289 [0,2,0,0,0,0|2,0,0]=4 12007 B13R0.119 CCCNC(=O)CCCCCC(C)C e17d0828e2aa9452a8691837df9b9cc5 [0,2,0,0,0,0|1,0,1]=4 12008 B13R0.119 CCCNC(=O)CCCCCC(C)O e886bacacc4d500efc0dcd655220bee2 [0,2,0,0,0,0|0,0,1]=3 12009 B13R0.119 CCCNC(=O)CCCNCC(C)O a7a230aca410a7830a63b72be919b4db [0,2,0,0,0,0|1,0,1]=4 12010 B13R0.119 CCCNC(=O)CCCNC[C@@H](C)O dd4d8e4646e943ecf7189a8422e967bb [0,2,0,0,0,0|1,0,1]=4 12011 B13R0.119 CCCNC(=O)CCCNC[C@H](C)O d89d8a5cc29ee1bfc35adfa1e09b1d89 [0,2,0,0,0,0|1,0,1]=4 12012 B13R0.119 CCCNC(=O)CNCCCC(C)O 33dde16654627ae98d07a26a9f79dde0 [0,2,0,0,0,0|1,0,1]=4 12013 B13R0.119 CCCOC(C)CCCCCC(=O)O 90562734e8cea4e673ac41abe750fc00 [0,2,0,0,0,0|1,0,1]=4 12014 B13R0.119 CCOCC(C)COCCCC(C)C a9cd65cc4cc6abc20c08bbacb9c387e6 [0,2,0,0,0,0|2,0,0]=4 12015 B13R0.119 CCOCC(C)OCCCCC(C)C 2d3aa71ad14e9178a12d3158a17e8379 [0,2,0,0,0,0|2,0,0]=4 12016 B13R0.119 CCOCC(O)CNCCCC(C)C f41e4ce4f66466dca72d8679c63f0fad [0,2,0,0,0,0|2,0,0]=4 12017 B13R0.119 CCOCC(O)CNCCCC(C)O 6a8c136606658e78b95d0f583819d1db [0,2,0,0,0,0|1,0,0]=3 12018 B13R0.119 COCCC(C)OCCCCC(C)C 6e7f554f16dbdb22f576345d43cf2686 [0,2,0,0,0,0|2,0,0]=4 12019 B13R0.119 COCCN(C)CCCCCC(C)C 7e960220bec9b14a302b95557ffc237b [0,2,0,0,0,0|2,0,0]=4 12020 B13R0.119 CSCCC(C)OCCCCC(C)C efc02af66a6d56fd3b85bfe41a98cc1d [0,2,0,0,0,0|2,0,0]=4 12021 B13R0.119 CSCCN(C)CCCCCC(C)C 9c5543ba43711358d96f28aa77ecc2df [0,2,0,0,0,0|2,0,0]=4 12022 B13R0.119 C[C@H](CCCO)NCCCC[C@@H](C)O f932d8cf0bc2e523924ee523fad760a8 [0,2,0,0,0,0|1,0,0]=3 12023 B13R0.147 C#CC(C)NCCCCCCCCC 5463f3c402915e7428761f83763eada6 [0,2,0,0,0,0|1,0,0]=3 12024 B13R0.147 C#CC(C)NCCCCCCCCO 7793b8387916a859ca32f9f691aad608 [0,2,0,0,0,0|2,0,0]=4 12025 B13R0.147 C#CC(C)OCCCCCCCCC 5b9c24b33b31f3e754b219de8aabc82e [0,2,0,0,0,0|1,0,0]=3 12026 B13R0.147 C#CC(C)OCCCOCCCCC 6c590d7c2029d511fa06ab4e85c95ccc [0,2,0,0,0,0|2,0,0]=4 12027 B13R0.147 C#CC(C)OCCOCCCCCC 02107d6490a71937517bd2453792365b [0,2,0,0,0,0|2,0,0]=4 12028 B13R0.147 C#CC(O)CCCCCNCCCC 3a2c4a489dcbc964aaf015cd19cdf208 [0,2,0,0,0,0|0,0,1]=3 12029 B13R0.147 C#CC(O)CCCCCNCCCCl e65a1086f4193f3e2c95629a4392ff2b [0,2,0,0,0,0|1,0,1]=4 12030 B13R0.147 C#CC(O)CCCCCNCCCO b25fe3da790827d9965043b05515b4a7 [0,2,0,0,0,0|1,0,1]=4 12031 B13R0.147 C#CC(O)CCCCCNCCOC c9581dd7af7d2f83f2eb0ccc00ee8f10 [0,2,0,0,0,0|1,0,1]=4 12032 B13R0.147 C#CC(O)CCCCCNCCSC f54b6c9bccd8981cc8b5f73642b67c8f [0,2,0,0,0,0|1,0,1]=4 12033 B13R0.147 C#CCCCCCCCNC(C)CO cc43780095eb1425295d48b601139532 [0,2,0,0,0,0|0,0,2]=4 12034 B13R0.147 C#CCCCCCCCN[C@@H](C)CO 1a89e9163490a6697852fa91af3cbd48 [0,2,0,0,0,0|0,0,2]=4 12035 B13R0.147 C#CCCCCCCCN[C@H](C)CO 95f44ec252af29fde59d821e6de436de [0,2,0,0,0,0|0,0,2]=4 12036 B13R0.147 C#CCCCCCCNCC(C)CO 1f9db2e18b034a2d6d56617cacec62bc [0,2,0,0,0,0|0,0,2]=4 12037 B13R0.147 C#CCCCCCCNCC(C)OC caac1c4551466e2a671cc5d73e80023d [0,2,0,0,0,0|0,0,2]=4 12038 B13R0.147 C#CCCCCCCNCC(O)CC 30d00843768d9c75fe6cb9bcb217c69a [0,2,0,0,0,0|0,0,2]=4 12039 B13R0.147 C#CCCCCCCNCC(O)CF 907d4ec78fcb39b1aa02f0210ba3cf62 [0,2,0,0,0,0|0,0,2]=4 12040 B13R0.147 C#CCCCCCCNCC(O)CO 7150536732165b6984f17bd7c5edb0c5 [0,2,0,0,0,0|0,0,2]=4 12041 B13R0.147 C#CCCCCCCNC[C@@H](C)CO e39eb20f8b8498482f0b0ef590500442 [0,2,0,0,0,0|0,0,2]=4 12042 B13R0.147 C#CCCCCCCNC[C@@H](C)OC 028404c0d5c7e944c20b784e2bfd0cb9 [0,2,0,0,0,0|0,0,2]=4 12043 B13R0.147 C#CCCCCCCNC[C@@H](O)CO fda94c3729201744dfc331768ad8e606 [0,2,0,0,0,0|0,0,2]=4 12044 B13R0.147 C#CCCCCCCNC[C@H](C)CO 5689da329394ce55d1a0ef430d986687 [0,2,0,0,0,0|0,0,2]=4 12045 B13R0.147 C#CCCCCCCNC[C@H](C)OC ad3f55e6ca71b98f6e1955cb5b426e5c [0,2,0,0,0,0|0,0,2]=4 12046 B13R0.147 C#CCCCCCCNC[C@H](O)CC 53ef5281bfbf32d5aa7390a779275b4b [0,2,0,0,0,0|0,0,2]=4 12047 B13R0.147 C#CCCCCCCNC[C@H](O)CO 1be9823bf9057f5debebc9c2ada46425 [0,2,0,0,0,0|0,0,2]=4 12048 B13R0.147 C#CCCCCCCOCC(C)OC 9829860060885ead78072e43e0d27a48 [0,2,0,0,0,0|0,0,2]=4 12049 B13R0.147 C#CCCCCCCOCC(O)CO 0f3d2267c1cdc17148537100ed22fe42 [0,2,0,0,0,0|0,0,2]=4 12050 B13R0.147 C#CCCCCCCOC[C@@H](C)OC cdef496fb55673d079f58d1b03badbd9 [0,2,0,0,0,0|0,0,2]=4 12051 B13R0.147 C#CCCCCCCOC[C@@H](O)CO 60d624e92d8c54af77dda62842a48bd1 [0,2,0,0,0,0|0,0,2]=4 12052 B13R0.147 C#CCCCCCCOC[C@H](C)OC 6c21d69602c13557255c3778fb03a000 [0,2,0,0,0,0|0,0,2]=4 12053 B13R0.147 C#CCCCCCCOC[C@H](O)CO 571bf81478b3e52428339394d81d67f9 [0,2,0,0,0,0|0,0,2]=4 12054 B13R0.147 C#CCCCCCNCCC(C)CO 4245cbd6979c5824b0dd3a1c4b028e57 [0,2,0,0,0,0|0,0,2]=4 12055 B13R0.147 C#CCCCCCNCCC(O)CO 0253051ddf99580aaf5d1b024907563a [0,2,0,0,0,0|0,0,2]=4 12056 B13R0.147 C#CCCCCCNCC[C@@H](C)CO d0e87afffc2acb98528cbe1ae68863e9 [0,2,0,0,0,0|0,0,2]=4 12057 B13R0.147 C#CCCCCCOCCC(C)OC 9847e35378295d1ad7580edf467f5f5a [0,2,0,0,0,0|0,0,2]=4 12058 B13R0.147 C#CCCCCNCCCC(C)CO d682309bad64e4be65c606f798cfa825 [0,2,0,0,0,0|0,0,2]=4 12059 B13R0.147 C#C[C@@H](C)NCCCCCCCCC a7a954232ef0ebe4d32ad950cf31ecd7 [0,2,0,0,0,0|1,0,0]=3 12060 B13R0.147 C#C[C@@H](C)NCCCCCCCCO b6e7a0a7beeca9d96aa49a06a4e624c0 [0,2,0,0,0,0|2,0,0]=4 12061 B13R0.147 C#C[C@@H](C)OCCCCCCCCC 7180936cc9fed4841944f7984ec7137c [0,2,0,0,0,0|1,0,0]=3 12062 B13R0.147 C#C[C@H](C)NCCCCCCCCC 37bed48b9efe1d1ebe79f2f29c5f9862 [0,2,0,0,0,0|1,0,0]=3 12063 B13R0.147 C#C[C@H](C)NCCCCCCCCO d4aa59ea6102e31af9e2a20a6ab26975 [0,2,0,0,0,0|2,0,0]=4 12064 B13R0.147 C#C[C@H](C)OCCCCCCCCC add1a04ba91626ab3f12008779bf550b [0,2,0,0,0,0|1,0,0]=3 12065 B13R0.147 C/C=C\CCCNCCCC(C)CO 6bb304064fc846f4f1c4a6a39f82077a [0,2,0,0,0,0|0,0,2]=4 12066 B13R0.147 C=C(CC)CNCCCCCCCC 93961cf34fa0de3d4db720e799423f33 [0,2,0,0,0,0|1,0,1]=4 12067 B13R0.147 C=C(CC)COCCCCCCCC 48ab808801c64e2af84ddf379a472aa3 [0,2,0,0,0,0|1,0,1]=4 12068 B13R0.147 C=C(CNCCCCCCCC)OC 8148c8fd7fd57ec38c270350f959b7e4 [0,2,0,0,0,0|0,0,2]=4 12069 B13R0.147 C=C(CO)CNCCCCCCCC 3f774da4c78ea1084a02bdd4474e944f [0,2,0,0,0,0|0,0,2]=4 12070 B13R0.147 C=C(COCCCCCCCC)OC 179b45e902e05e6702472d8c1d56a255 [0,2,0,0,0,0|0,0,2]=4 12071 B13R0.147 C=CC(C)COCCCCCCCC 58cf82de34cf52eef6984695ed4ce051 [0,2,0,0,0,0|1,0,0]=3 12072 B13R0.147 C=CC(C)COCCCCCCOC 66695bb18516232dd8e509786b666e43 [0,2,0,0,0,0|2,0,0]=4 12073 B13R0.147 C=CC(C)NCCCCCCCCC e9a28f68805d30e542653dc3f029d6d6 [0,2,0,0,0,0|1,0,0]=3 12074 B13R0.147 C=CC(C)NCCCCCCCCO bc667c148ab75ac739826bbd28e8ca9e [0,2,0,0,0,0|2,0,0]=4 12075 B13R0.147 C=CC(C)OCCCCCCCCC 47f99fc01e0285a3de973c269c989988 [0,2,0,0,0,0|1,0,0]=3 12076 B13R0.147 C=CC(C)OCCCOCCCCC 06c2ccdef7a1ae4361d90a6ab186f9d6 [0,2,0,0,0,0|2,0,0]=4 12077 B13R0.147 C=CC(C)OCCOCCCCCC b77d4f61823e9694cb13932a486b80d7 [0,2,0,0,0,0|2,0,0]=4 12078 B13R0.147 C=CC(O)CNCCCCCCCC b949d2977ffe9a4d1d4f87d98feefa71 [0,2,0,0,0,0|0,0,1]=3 12079 B13R0.147 C=CC(O)CNCCCCCCCO 44f4b90a97f1f43dafb63a1af8a68bff [0,2,0,0,0,0|1,0,1]=4 12080 B13R0.147 C=CC(O)CNCCCCCCOC 161f184d4a6280907694a5f869450ad2 [0,2,0,0,0,0|1,0,1]=4 12081 B13R0.147 C=CCCCCCCCNC(C)CO 309f78a6d27faa6f5cc3afafd94ded4f [0,2,0,0,0,0|0,0,2]=4 12082 B13R0.147 C=CCCCCCCCN[C@@H](C)CO 825b37b90590bc4c30e7b43a785314b0 [0,2,0,0,0,0|0,0,2]=4 12083 B13R0.147 C=CCCCCCCCN[C@H](C)CO e538ca79cf130afae3adbd7a6a608f64 [0,2,0,0,0,0|0,0,2]=4 12084 B13R0.147 C=CCCCCCCNCC(C)CO 2d51e8a9b7ce4e5fa5de32a5604cdf47 [0,2,0,0,0,0|0,0,2]=4 12085 B13R0.147 C=CCCCCCCNCC(O)CC 5bff3c69cdaed6e9b77a24ebea61fc58 [0,2,0,0,0,0|0,0,2]=4 12086 B13R0.147 C=CCCCCCCNCC(O)CO 1b2c324e3935fd093758fe062c196823 [0,2,0,0,0,0|0,0,2]=4 12087 B13R0.147 C=CCCCCCCNC[C@@H](C)OC d5ff880fc490a6dcec85047ebaca5926 [0,2,0,0,0,0|0,0,2]=4 12088 B13R0.147 C=CCCCCCCNC[C@@H](O)CO 31e8199542c79d3895ed611f79eaab59 [0,2,0,0,0,0|0,0,2]=4 12089 B13R0.147 C=CCCCCCCNC[C@H](C)CO dfedd984bf6a746673851f5ff0e6b80a [0,2,0,0,0,0|0,0,2]=4 12090 B13R0.147 C=CCCCCCCNC[C@H](C)OC 478a4521c2d8ad1d5182d47540d820fc [0,2,0,0,0,0|0,0,2]=4 12091 B13R0.147 C=CCCCCCCNC[C@H](O)CC 1571dc87b650dbb91bf6f90cb587cd95 [0,2,0,0,0,0|0,0,2]=4 12092 B13R0.147 C=CCCCCCCNC[C@H](O)CO 63db5dff60554b94379a8a8f8e947050 [0,2,0,0,0,0|0,0,2]=4 12093 B13R0.147 C=CCCCCCCOCC(C)OC f7d6ea9b93b4b3ed58cb24b6c9c050d2 [0,2,0,0,0,0|0,0,2]=4 12094 B13R0.147 C=CCCCCCCOCC(O)CO 6c2622b2145939524f62a4af7e2800ec [0,2,0,0,0,0|0,0,2]=4 12095 B13R0.147 C=CCCCCCCOC[C@@H](C)OC c1bb2719f37e7de1da5bc05bee8b9bd8 [0,2,0,0,0,0|0,0,2]=4 12096 B13R0.147 C=CCCCCCCOC[C@@H](O)CO 66bb843ea73ce3f8877d7b3ca42f9099 [0,2,0,0,0,0|0,0,2]=4 12097 B13R0.147 C=CCCCCCCOC[C@H](C)OC 6fbe0d8383fb163f98f86f72bd902837 [0,2,0,0,0,0|0,0,2]=4 12098 B13R0.147 C=CCCCCCCOC[C@H](O)CO 62dc7c93c7ac396e06e5a6c5eb98ed9b [0,2,0,0,0,0|0,0,2]=4 12099 B13R0.147 C=CCCCCCNCCC(C)CO 29ad857dbda39be05f2dd5599f77c4f9 [0,2,0,0,0,0|0,0,2]=4 12100 B13R0.147 C=CCCCCCNCCC(O)CO 1622498c81316246468bdfb3b3485436 [0,2,0,0,0,0|0,0,2]=4 12101 B13R0.147 C=CCCCCCNCC[C@@H](C)CO 68b2ee53db160e5828aa86ae089990df [0,2,0,0,0,0|0,0,2]=4 12102 B13R0.147 C=CCCCCCOCCC(C)OC db9257d89bcc7b9113cffe656028cf4e [0,2,0,0,0,0|0,0,2]=4 12103 B13R0.147 C=CCCCCNCCCC(C)CO c5cb863b790c28e8a17587261a1c3412 [0,2,0,0,0,0|0,0,2]=4 12104 B13R0.147 C=C[C@H](C)OCCCCCCCCC 6ab66f87c010a6474b2e84e6c5723e7e [0,2,0,0,0,0|1,0,0]=3 12105 B13R0.147 CC(C#N)CNCCCCCCCO db363dfecaed6eead28335ee6249dedd [0,2,0,0,0,0|2,0,0]=4 12106 B13R0.147 CC(C#N)NCCCCCCCCO 56d047cdb1eb415e16744be317fa0f47 [0,2,0,0,0,0|2,0,0]=4 12107 B13R0.147 CC(C=O)NCCCCCCCCO 3dafa7bb0ecd584a886431e5d62d3419 [0,2,0,0,0,0|1,0,1]=4 12108 B13R0.147 CC(CO)CCCNCCCCC#N 5a972593b0eed129876e6f9a06fe7782 [0,2,0,0,0,0|1,0,1]=4 12109 B13R0.147 CC(CO)CCCNCCCCC=O 8fe0461aa3663c665d9e9c02582cacca [0,2,0,0,0,0|1,0,1]=4 12110 B13R0.147 CC(CO)CCCNCCCCCF 6fac8354b260dc4bee01fae86e72d1c1 [0,2,0,0,0,0|1,0,0]=3 12111 B13R0.147 CC(CO)CCCNCCCCCO c7acc94cf308498287104978d89b7339 [0,2,0,0,0,0|1,0,0]=3 12112 B13R0.147 CC(CO)CCCNCCCCON a2d597c3b1873159cb0adcc0d0aecefd [0,2,0,0,0,0|2,0,0]=4 12113 B13R0.147 CC(CO)CCCNCCOCCO be9c97cea2858711185ab47f1d98cf15 [0,2,0,0,0,0|2,0,0]=4 12114 B13R0.147 CC(CO)CCNCCCCCC#N 9a182a67f81d4fe56e40f39cc255433d [0,2,0,0,0,0|1,0,1]=4 12115 B13R0.147 CC(CO)CCNCCCCCC=O f5b30ae4f117b9ae1689a41c6b6216a6 [0,2,0,0,0,0|1,0,1]=4 12116 B13R0.147 CC(CO)CCNCCCCCCCl 29a09ae1b37a05391dcb6f041b107609 [0,2,0,0,0,0|1,0,0]=3 12117 B13R0.147 CC(CO)CCNCCCCCCF 80f700c2494b40a1b6bff4bca60f3ab1 [0,2,0,0,0,0|1,0,0]=3 12118 B13R0.147 CC(CO)CCNCCCCCCO 7afbe9c3871af4aa73b6df31b0de8882 [0,2,0,0,0,0|1,0,0]=3 12119 B13R0.147 CC(CO)CCNCCCOCCO d68bc7e3811eda9eb013fbf0552c171e [0,2,0,0,0,0|2,0,0]=4 12120 B13R0.147 CC(CO)CCNCCOCCCO 013c37b32260895749febf1794461e8a [0,2,0,0,0,0|2,0,0]=4 12121 B13R0.147 CC(CO)CNCCCCCCC#N e7bb6bdac0055c4605ad1247cf365b65 [0,2,0,0,0,0|1,0,1]=4 12122 B13R0.147 CC(CO)CNCCCCCCC=O fd5fa0b8aaeb594a289156375d6ceb03 [0,2,0,0,0,0|1,0,1]=4 12123 B13R0.147 CC(CO)CNCCCCCCCO 50dfcb879e513d2273b28f9bb65a2ac4 [0,2,0,0,0,0|1,0,0]=3 12124 B13R0.147 CC(CO)CNCCCCSCCO 39dce946fbcec508c6251f01043ee5bb [0,2,0,0,0,0|2,0,0]=4 12125 B13R0.147 CC(CO)CNCCCOCCCO 21a57c3d508dad17516cba22273e0f8b [0,2,0,0,0,0|2,0,0]=4 12126 B13R0.147 CC(CO)NCCCCCCCCO b1dc3b83f55b51fee9aa0c5c6ce2daaa [0,2,0,0,0,0|1,0,0]=3 12127 B13R0.147 CC/C=C\CCCCCNC(C)CO 41772e7ed8cf54fc95bb6e2b748c006b [0,2,0,0,0,0|0,0,2]=4 12128 B13R0.147 CC/C=C\CCCCCN[C@@H](C)CO bad10969e1f11c1b7da99cfd8acd63f2 [0,2,0,0,0,0|0,0,2]=4 12129 B13R0.147 CC/C=C\CCCCCN[C@H](C)CO 12410fd8d7a471e633b57e86b653ca26 [0,2,0,0,0,0|0,0,2]=4 12130 B13R0.147 CC/C=C\CCCCOCC(C)OC 85185e121bfb8bac5014e8da5082e7a7 [0,2,0,0,0,0|0,0,2]=4 12131 B13R0.147 CC/C=C\CCCCOCC(O)CO b469c16503ceeadc3baac9ebb04ed56d [0,2,0,0,0,0|0,0,2]=4 12132 B13R0.147 CC/C=C\CCCCOC[C@@H](C)OC 42ee5badca29a4e776dd70bb2032c6a7 [0,2,0,0,0,0|0,0,2]=4 12133 B13R0.147 CC/C=C\CCCCOC[C@@H](O)CO ed365e5a95f699cc17b43a24c9964ddd [0,2,0,0,0,0|0,0,2]=4 12134 B13R0.147 CC/C=C\CCCCOC[C@H](C)OC 05fd50fde2ffa2765205157a9f8253c8 [0,2,0,0,0,0|0,0,2]=4 12135 B13R0.147 CC/C=C\CCCCOC[C@H](O)CO a137e17c3c2ef3375bc6f20e3d2fa7c9 [0,2,0,0,0,0|0,0,2]=4 12136 B13R0.147 CC/C=C\CCNCCCC(C)CO 76510fc56db68bb7b34e416d9fa5245f [0,2,0,0,0,0|0,0,2]=4 12137 B13R0.147 CCC(C)CCCCCOCCCF 7e1e1c1c73cf96e5c0c253ddfe35378c [0,2,0,0,0,0|2,0,0]=4 12138 B13R0.147 CCC(C)CCCCCOCCCS eba9f2ddb335005406dcc9570eabcf0d [0,2,0,0,0,0|2,0,0]=4 12139 B13R0.147 CCC(C)CCCCCOCCOC 73566d9ebdbbce07faa2e5d1bc13fe94 [0,2,0,0,0,0|2,0,0]=4 12140 B13R0.147 CCC(C)CCCCCOCCSC c2b10f20b6eb73477c18c5aa177423bd [0,2,0,0,0,0|2,0,0]=4 12141 B13R0.147 CCC(C)CCCCOCCCCF d227a5f6c4f8d29fea0d8c23a1ea6593 [0,2,0,0,0,0|2,0,0]=4 12142 B13R0.147 CCC(C)CCCCOCCCOC a2bd72399331a7bfab8a68fca652390e [0,2,0,0,0,0|2,0,0]=4 12143 B13R0.147 CCC(C)CCCCOCCCSC 6e95a1dfe52ff81c5d55e7bd0595437b [0,2,0,0,0,0|2,0,0]=4 12144 B13R0.147 CCC(C)CCCOCCCCCF a9edc4bbe23012274a72ac3333abf2a4 [0,2,0,0,0,0|2,0,0]=4 12145 B13R0.147 CCC(C)CCCOCCCCOC 1fb6277a098b814ad3bb95a939b86c3e [0,2,0,0,0,0|2,0,0]=4 12146 B13R0.147 CCC(C)CCNCCCCCCCl 4a32dd569979076be9fe88604ea8bf0c [0,2,0,0,0,0|2,0,0]=4 12147 B13R0.147 CCC(C)CCNCCCCCCF 1e9b14b81655fdeaeb957fef14c7002c [0,2,0,0,0,0|2,0,0]=4 12148 B13R0.147 CCC(C)CCNCCCCCCO cd85dd851c30b05b4f755f0fdbc11d3e [0,2,0,0,0,0|2,0,0]=4 12149 B13R0.147 CCC(C)CCNCCCCCOC 9b1768e6955d7e0a4f4d91ccd6706f72 [0,2,0,0,0,0|2,0,0]=4 12150 B13R0.147 CCC(C)CCOCCCCCCF cbe75187ac9843eb6fb1be94652f68ee [0,2,0,0,0,0|2,0,0]=4 12151 B13R0.147 CCC(C)CCOCCCCCCS 625d7c9f798db19dfb92ac04ca8f0793 [0,2,0,0,0,0|2,0,0]=4 12152 B13R0.147 CCC(C)CCOCCCCCOC d3e2db0da3452cf9ad30cdf343b2e0e5 [0,2,0,0,0,0|2,0,0]=4 12153 B13R0.147 CCC(C)CNCCCCCCCO edb301d8834bc7bf4661ac5852090c03 [0,2,0,0,0,0|2,0,0]=4 12154 B13R0.147 CCC(C)CNCCCCCCOC f0385b1197d7fbce05d82048bef6aff6 [0,2,0,0,0,0|2,0,0]=4 12155 B13R0.147 CCC(C)COCCCCCCOC f54158251b0fba63b615a6ba8a3174c9 [0,2,0,0,0,0|2,0,0]=4 12156 B13R0.147 CCC(C)NCCCCCCCCO 7210376f05f64b70a783c5b0aecb0af1 [0,2,0,0,0,0|2,0,0]=4 12157 B13R0.147 CCC(O)CNCCCCCCC#N b1cc8d2657a884a7c725fb652ace1d6f [0,2,0,0,0,0|1,0,1]=4 12158 B13R0.147 CCC(O)CNCCCCCCC=O 51ff73ee518b2795ea88e21806a1d492 [0,2,0,0,0,0|1,0,1]=4 12159 B13R0.147 CCC(O)CNCCCCCCCO 939e987bda9e036188a62b99f80abd18 [0,2,0,0,0,0|1,0,0]=3 12160 B13R0.147 CCC(O)CNCCCCCCOC 9033c25c0112cdca9811284f095ee749 [0,2,0,0,0,0|1,0,0]=3 12161 B13R0.147 CCC(O)CNCCCCSCCO c4a0c0eee4ca6a5b983e639cf69621e4 [0,2,0,0,0,0|2,0,0]=4 12162 B13R0.147 CCC(O)CNCCCOCCCO e29f1863050a746966b3214f0b7ca021 [0,2,0,0,0,0|2,0,0]=4 12163 B13R0.147 CCC(O)CNCCCOCCOC 52ae96215eaaa2d197dfb87c379e4ca7 [0,2,0,0,0,0|2,0,0]=4 12164 B13R0.147 CCC(O)CNCCCOCCSC e4fdb56eef10081d105261bbd4d03f62 [0,2,0,0,0,0|2,0,0]=4 12165 B13R0.147 CCC(S)CCOCCCCCCF bbb95aae64a7634d5f57d7ed69e4585c [0,2,0,0,0,0|1,1,0]=4 12166 B13R0.147 CCC(S)CCOCCCCCOC 2bc76dcb8e8eca406fb187208fa3a80e [0,2,0,0,0,0|1,1,0]=4 12167 B13R0.147 CCC/C=C/CCCOCC(C)OC f82f091fc1a633b290f00899d339bbf3 [0,2,0,0,0,0|0,0,2]=4 12168 B13R0.147 CCC/C=C/CCCOCC(O)CO 483856d2c02376743995c7cc8879e682 [0,2,0,0,0,0|0,0,2]=4 12169 B13R0.147 CCC/C=C/CCCOC[C@@H](C)OC c32eb1977afa909a473108dd9212327b [0,2,0,0,0,0|0,0,2]=4 12170 B13R0.147 CCC/C=C/CCCOC[C@@H](O)CO 6d5a25fbe17f362f5339b0d67d5f3185 [0,2,0,0,0,0|0,0,2]=4 12171 B13R0.147 CCC/C=C/CCCOC[C@H](C)OC 02ab95393e0a844ea8e4615c1e51ea5d [0,2,0,0,0,0|0,0,2]=4 12172 B13R0.147 CCC/C=C/CCCOC[C@H](O)CO dc416c74c2e64f37197790e8c7a375fd [0,2,0,0,0,0|0,0,2]=4 12173 B13R0.147 CCC/C=C/CNCCCC(C)CO 8d12d722514e4fdc30bab84bc183158a [0,2,0,0,0,0|0,0,2]=4 12174 B13R0.147 CCC/C=C\CCCOCC(C)OC 72fd7a6d5f16f230f3ac891d5d50ca52 [0,2,0,0,0,0|0,0,2]=4 12175 B13R0.147 CCC/C=C\CCCOCC(O)CO 1bbb416700e28176d1d02e910a232bba [0,2,0,0,0,0|0,0,2]=4 12176 B13R0.147 CCC/C=C\CCCOC[C@@H](C)OC 9da78a62dfb060ae7904e78548e9fb78 [0,2,0,0,0,0|0,0,2]=4 12177 B13R0.147 CCC/C=C\CCCOC[C@@H](O)CO 2397cdde97df25716518f635fee342bf [0,2,0,0,0,0|0,0,2]=4 12178 B13R0.147 CCC/C=C\CCCOC[C@H](C)OC dc4d8bdc9dedf9a9fc1d22576f7f9b0a [0,2,0,0,0,0|0,0,2]=4 12179 B13R0.147 CCC/C=C\CCCOC[C@H](O)CO 1c69a38ec465b621ba8275362f308277 [0,2,0,0,0,0|0,0,2]=4 12180 B13R0.147 CCC/C=C\CNCCCC(C)CO bde320a33e86a615c414393f70f2f2bb [0,2,0,0,0,0|0,0,2]=4 12181 B13R0.147 CCCC/C=C/CNCCC(C)CO 213d54bab09a40a255125c3382a84408 [0,2,0,0,0,0|0,0,2]=4 12182 B13R0.147 CCCC/C=C/CNCCC(O)CO 7fae06fc72364f9d41024e5b22191d3f [0,2,0,0,0,0|0,0,2]=4 12183 B13R0.147 CCCC/C=C/CNCC[C@@H](C)CO 1fa97dad38c84b4740e688dc58d7e81d [0,2,0,0,0,0|0,0,2]=4 12184 B13R0.147 CCCC/C=C/COCCC(C)OC 2ec4c89cd1f3a2125f3915def0604a84 [0,2,0,0,0,0|0,0,2]=4 12185 B13R0.147 CCCC/C=C\CCOCC(C)OC d20fad41fffa4da893f3ac3a45949584 [0,2,0,0,0,0|0,0,2]=4 12186 B13R0.147 CCCC/C=C\CCOCC(O)CO cf0dd355ab387435e64875b0d4391d78 [0,2,0,0,0,0|0,0,2]=4 12187 B13R0.147 CCCC/C=C\CCOC[C@@H](C)OC bf7debae14198f089f09a4ef2f0e4f3f [0,2,0,0,0,0|0,0,2]=4 12188 B13R0.147 CCCC/C=C\CCOC[C@@H](O)CO 0dd11ba949f047d53aa5a89ba9dc3829 [0,2,0,0,0,0|0,0,2]=4 12189 B13R0.147 CCCC/C=C\CCOC[C@H](C)OC 25de4b239a34b77a044760bd0790ad19 [0,2,0,0,0,0|0,0,2]=4 12190 B13R0.147 CCCC/C=C\CCOC[C@H](O)CO d0565650ad97aa2edbb14478e7e10da5 [0,2,0,0,0,0|0,0,2]=4 12191 B13R0.147 CCCC/C=C\CNCCC(C)CO fa6a323ae7087fc8a50108b4ec626cf0 [0,2,0,0,0,0|0,0,2]=4 12192 B13R0.147 CCCC/C=C\CNCCC(O)CO 1902d09ad334036d545d06376d8334be [0,2,0,0,0,0|0,0,2]=4 12193 B13R0.147 CCCC/C=C\CNCC[C@@H](C)CO a75ddef62e95f2f5cacd1d48c19b13b1 [0,2,0,0,0,0|0,0,2]=4 12194 B13R0.147 CCCC/C=C\COCCC(C)OC bd9008093d5b4613b22d8136cf798be6 [0,2,0,0,0,0|0,0,2]=4 12195 B13R0.147 CCCCC#CCCOCC(C)OC 4ff450ddea21c38cd05d83a12d7270c9 [0,2,0,0,0,0|0,0,2]=4 12196 B13R0.147 CCCCC#CCCOCC(O)CO 02bf24064a200e54b12ed5194199aaf6 [0,2,0,0,0,0|0,0,2]=4 12197 B13R0.147 CCCCC#CCCOC[C@@H](C)OC 5c4a72079e8eb664518e0fa23685da66 [0,2,0,0,0,0|0,0,2]=4 12198 B13R0.147 CCCCC#CCCOC[C@@H](O)CO 2bd20d62d31cf6b9e81015ff55e037e3 [0,2,0,0,0,0|0,0,2]=4 12199 B13R0.147 CCCCC#CCCOC[C@H](C)OC 6c50ccc339fdf09ae3b8389e21a8ffa0 [0,2,0,0,0,0|0,0,2]=4 12200 B13R0.147 CCCCC#CCCOC[C@H](O)CO 1884e6ad8be53fa5c6360193200c3716 [0,2,0,0,0,0|0,0,2]=4 12201 B13R0.147 CCCCC/C=C/COCC(C)OC f86c645cf2873ff5f14ab781e76aff99 [0,2,0,0,0,0|0,0,2]=4 12202 B13R0.147 CCCCC/C=C/COCC(O)CO 1f1041a19a152da6de481371601753b8 [0,2,0,0,0,0|0,0,2]=4 12203 B13R0.147 CCCCC/C=C/COC[C@@H](C)OC 07cbed8193448edd7d6048630618d0dc [0,2,0,0,0,0|0,0,2]=4 12204 B13R0.147 CCCCC/C=C/COC[C@@H](O)CO cb932b98d26f6c9fb13f2673a6da2a12 [0,2,0,0,0,0|0,0,2]=4 12205 B13R0.147 CCCCC/C=C/COC[C@H](C)OC ada52217b17c02f5c08f954ed625e67c [0,2,0,0,0,0|0,0,2]=4 12206 B13R0.147 CCCCC/C=C/COC[C@H](O)CO b2cd41c8051005d339e201cc1ffef130 [0,2,0,0,0,0|0,0,2]=4 12207 B13R0.147 CCCCCC#CCOCC(C)OC 003760b8b06b9b8ba37cc0b4f8baad3d [0,2,0,0,0,0|0,0,2]=4 12208 B13R0.147 CCCCCC#CCOCC(O)CO 25f65665c7a46502c208de8c17f8df0b [0,2,0,0,0,0|0,0,2]=4 12209 B13R0.147 CCCCCC#CCOC[C@@H](C)OC bb4feb30336ddbec597e753999f18f1e [0,2,0,0,0,0|0,0,2]=4 12210 B13R0.147 CCCCCC#CCOC[C@@H](O)CO 766e87ac9ed0093858969807e3d24621 [0,2,0,0,0,0|0,0,2]=4 12211 B13R0.147 CCCCCC#CCOC[C@H](C)OC 89cbaf13781b09cced67f504721a705e [0,2,0,0,0,0|0,0,2]=4 12212 B13R0.147 CCCCCC#CCOC[C@H](O)CO 3370c153b45ff32134f4ce7e210b7000 [0,2,0,0,0,0|0,0,2]=4 12213 B13R0.147 CCCCCCCCCCN(C)C=O 82f6c324db670ca9d0c004e79ec60e78 [0,2,0,0,0,0|1,0,1]=4 12214 B13R0.147 CCCCCCCCCCN(C)CC 5bb7e8561c0158041cdaf962ead4afdc [0,2,0,0,0,0|2,0,0]=4 12215 B13R0.147 CCCCCCCCCCN(C)CF 6016c51e26092559e6e2c75706d5713c [0,2,0,0,0,0|2,0,0]=4 12216 B13R0.147 CCCCCCCCCCN(C)CO 348e9b3cba5235ffbf669bbfe6bc6e4d [0,2,0,0,0,0|1,0,0]=3 12217 B13R0.147 CCCCCCCCCNC(=O)CC 22ef5d3798469cc75ce8300df7dac3ff [0,2,0,0,0,0|0,0,2]=4 12218 B13R0.147 CCCCCCCCCNC(=O)CF 55b238b89cbabebda54ac6f90a2f593f [0,2,0,0,0,0|0,0,2]=4 12219 B13R0.147 CCCCCCCCCNC(=O)CO 92c25d5e3b910d35b28c819015c37d24 [0,2,0,0,0,0|0,0,2]=4 12220 B13R0.147 CCCCCCCCCNC(=O)CS eb36a40d539976cbe2168f2f74abeadf [0,2,0,0,0,0|0,0,2]=4 12221 B13R0.147 CCCCCCCCCNC(C)C#N aeeffdd9b136b37b81657e907462acbe [0,2,0,0,0,0|1,0,0]=3 12222 B13R0.147 CCCCCCCCCNC(C)C=O 6da36e5d19937bebb2882503fe2a720f [0,2,0,0,0,0|0,0,1]=3 12223 B13R0.147 CCCCCCCCCNC(C)CC 61cbcef32767be2261a0eb17db31f932 [0,2,0,0,0,0|1,0,0]=3 12224 B13R0.147 CCCCCCCCCNC(C)CO e615512f763ca358e8ca8dbc5a1e4819 [0,2,0,0,0,0|0,0,0]=2 12225 B13R0.147 CCCCCCCCCN[C@@H](C)CC 0fa90308afec46028d78d7595325215d [0,2,0,0,0,0|1,0,0]=3 12226 B13R0.147 CCCCCCCCCN[C@@H](C)CO 04d33e16dfc697b387400370e5753bd4 [0,2,0,0,0,0|0,0,0]=2 12227 B13R0.147 CCCCCCCCCN[C@H](C)C=O b8b5d97c73c96206b66e70c26e40b68c [0,2,0,0,0,0|0,0,1]=3 12228 B13R0.147 CCCCCCCCCN[C@H](C)CC 9ad2266d96552bf9d7cd5b37d72eb736 [0,2,0,0,0,0|1,0,0]=3 12229 B13R0.147 CCCCCCCCCN[C@H](C)CO e0542c8aa4e021605f5df5d77cbe7605 [0,2,0,0,0,0|0,0,0]=2 12230 B13R0.147 CCCCCCCCCOC(C)C#N 554e02753d5740e40b8ae6ba615c42b8 [0,2,0,0,0,0|1,0,0]=3 12231 B13R0.147 CCCCCCCCCOC(C)C=O 185d406105a69023fd5732c4571ddcdd [0,2,0,0,0,0|0,0,1]=3 12232 B13R0.147 CCCCCCCCCOC(C)CC 129d3b3bededad4aaced738e1a38bc5f [0,2,0,0,0,0|1,0,0]=3 12233 B13R0.147 CCCCCCCCCOC(C)CF 3077f66e2815dc062c156fbab8f98c42 [0,2,0,0,0,0|1,0,0]=3 12234 B13R0.147 CCCCCCCCCOC(C)CS f79f5d9133109a4b5f4036efc7b017d0 [0,2,0,0,0,0|0,1,0]=3 12235 B13R0.147 CCCCCCCCCO[C@@H](C)CC 95847a69cfbf7f2d5afbdf9f7b3b6122 [0,2,0,0,0,0|1,0,0]=3 12236 B13R0.147 CCCCCCCCCO[C@H](C)C=O d48bc04d771a4d886a6d14a8ac7765cb [0,2,0,0,0,0|0,0,1]=3 12237 B13R0.147 CCCCCCCCCO[C@H](C)CC 2b917bda28770b07bea89f3f9e0a756b [0,2,0,0,0,0|1,0,0]=3 12238 B13R0.147 CCCCCCCCCO[C@H](C)CS 4bc88877d41b35603401f220e6df4136 [0,2,0,0,0,0|0,1,0]=3 12239 B13R0.147 CCCCCCCCNCC(=O)CC baf0ee8c7f5c169c254b280e2cc7130e [0,2,0,0,0,0|0,0,2]=4 12240 B13R0.147 CCCCCCCCNCC(=O)CO f586ce7a669e24502f466e4e7886aee3 [0,2,0,0,0,0|0,0,2]=4 12241 B13R0.147 CCCCCCCCNCC(=O)NC 8d3185a51a7f12cf803f072615487cc5 [0,2,0,0,0,0|0,0,2]=4 12242 B13R0.147 CCCCCCCCNCC(=O)NO ff56059b567ccba4cc7bbd233161257b [0,2,0,0,0,0|1,0,1]=4 12243 B13R0.147 CCCCCCCCNCC(=O)OC 2ae9ea9c59c8976c9984601465b5b02d [0,2,0,0,0,0|0,0,2]=4 12244 B13R0.147 CCCCCCCCNCC(Br)CBr f3f48c01bb4452cb89503bcc9c7efba8 [0,2,0,0,0,0|1,0,0]=3 12245 B13R0.147 CCCCCCCCNCC(C)C#N 2bae3b7a4c9bd8e94d6f598e90d367bf [0,2,0,0,0,0|1,0,0]=3 12246 B13R0.147 CCCCCCCCNCC(C)CC 8a51c3cb18d43ece5cfee9a50bbae348 [0,2,0,0,0,0|1,0,0]=3 12247 B13R0.147 CCCCCCCCNCC(C)CO 9aefe401d73daff7eb00de7477219dd8 [0,2,0,0,0,0|0,0,0]=2 12248 B13R0.147 CCCCCCCCNCC(C)OC 83013ee6c033a4a80cde4f3145dd7c0d [0,2,0,0,0,0|0,0,0]=2 12249 B13R0.147 CCCCCCCCNCC(F)CO 98129e1a220b7a6ab3c3bbd52bf01fd1 [0,2,0,0,0,0|1,0,0]=3 12250 B13R0.147 CCCCCCCCNCC(O)CC 2ab834300d0a7e181771499d51a89b57 [0,2,0,0,0,0|0,0,0]=2 12251 B13R0.147 CCCCCCCCNCC(O)CF 5005f9fd70cfe3c4e15e043b3468a581 [0,2,0,0,0,0|0,0,0]=2 12252 B13R0.147 CCCCCCCCNCC(O)CO 374b79ceabc57d3b98e6d4d0375a6698 [0,2,0,0,0,0|0,0,0]=2 12253 B13R0.147 CCCCCCCCNC[C@@H](C)CC 816375aab95be8a5210305ab7b4e4487 [0,2,0,0,0,0|1,0,0]=3 12254 B13R0.147 CCCCCCCCNC[C@@H](C)CO 95cf363db8406396abd18326da7b745f [0,2,0,0,0,0|0,0,0]=2 12255 B13R0.147 CCCCCCCCNC[C@@H](C)OC be6a2a5119af4bcf38750e6264d16035 [0,2,0,0,0,0|0,0,0]=2 12256 B13R0.147 CCCCCCCCNC[C@@H](F)CO 4a2f58eb388e6836f0e5e4c638f657e2 [0,2,0,0,0,0|1,0,0]=3 12257 B13R0.147 CCCCCCCCNC[C@@H](O)CO 7a82ffae7f4b34231269482a75272373 [0,2,0,0,0,0|0,0,0]=2 12258 B13R0.147 CCCCCCCCNC[C@H](C)CC a8c769a2f4e69743286e4d847721fa31 [0,2,0,0,0,0|1,0,0]=3 12259 B13R0.147 CCCCCCCCNC[C@H](C)CO 607e12a1ef01df2d5207c8bfde50bf30 [0,2,0,0,0,0|0,0,0]=2 12260 B13R0.147 CCCCCCCCNC[C@H](C)OC 9960446797c2948b089200a9cd030b79 [0,2,0,0,0,0|0,0,0]=2 12261 B13R0.147 CCCCCCCCNC[C@H](F)CO 829bae360fd8b3e7f52474c1bddc9bbb [0,2,0,0,0,0|1,0,0]=3 12262 B13R0.147 CCCCCCCCNC[C@H](O)CC bea6baae13f6e8e4bea251bed0a0b265 [0,2,0,0,0,0|0,0,0]=2 12263 B13R0.147 CCCCCCCCNC[C@H](O)CO c0a89ce2312cb7d2e7e4a842dc6e9a16 [0,2,0,0,0,0|0,0,0]=2 12264 B13R0.147 CCCCCCCCOC/C(=C/I)/C cffea21b7c40e941f6791ad1985a72f9 [0,2,0,0,0,0|1,0,1]=4 12265 B13R0.147 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155dc892d0fbfeab6f5495b22611b7fe [0,2,0,0,0,0|0,0,0]=2 12288 B13R0.147 CCCCCCCNCCC(O)CO 8bd422c93cc865ccc2883ac76ae9bdff [0,2,0,0,0,0|0,0,0]=2 12289 B13R0.147 CCCCCCCNCCS(=O)CC 9223955314b14fcde61ebf3f8c180223 [0,2,0,0,0,0|1,0,1]=4 12290 B13R0.147 CCCCCCCNCC[C@@H](C)CO 909bd8564c4053a1fc420ece4e2b1cc2 [0,2,0,0,0,0|0,0,0]=2 12291 B13R0.147 CCCCCCCOCCC(=O)NC 5d1b6a9a3f2ed0d80d8ac88655812413 [0,2,0,0,0,0|0,0,2]=4 12292 B13R0.147 CCCCCCCOCCC(=O)OC 71cd9b89c3422aa8005afc8ac30b8e5e [0,2,0,0,0,0|0,0,2]=4 12293 B13R0.147 CCCCCCCOCCC(C)CC da15231f108a5db874667dd2aa1e8a5d [0,2,0,0,0,0|1,0,0]=3 12294 B13R0.147 CCCCCCCOCCC(C)OC 160b4947e7e7c96cd79339d638d84d1f [0,2,0,0,0,0|0,0,0]=2 12295 B13R0.147 CCCCCCCOCCC(S)CC 3009d6d1743b43adc8bbe05a0d243d05 [0,2,0,0,0,0|0,1,0]=3 12296 B13R0.147 CCCCCCCOCCN(C)C#N 639263a09274d54a629693e9bfa78a12 [0,2,0,0,0,0|2,0,0]=4 12297 B13R0.147 CCCCCCCOCCN(C)C=O 4d80362d3cc9561bba6ba1408fd8b2d6 [0,2,0,0,0,0|1,0,1]=4 12298 B13R0.147 CCCCCCCOCC[C@@H](C)CC 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38412ea04eb9ab7407613f46d68585f2 [0,2,0,0,0,0|2,0,0]=4 12310 B13R0.147 CCCCCCOCCOC(C)C=O 6dee894d3e7a907de952525cc1682ef7 [0,2,0,0,0,0|1,0,1]=4 12311 B13R0.147 CCCCCCOCCOC(C)CC 1da7fd644d5ea710e4205fc0df9f4421 [0,2,0,0,0,0|2,0,0]=4 12312 B13R0.147 CCCCCCOCCO[C@H](C)C=O 908c4f20ce56ea86e05ef5e46d87c6a3 [0,2,0,0,0,0|1,0,1]=4 12313 B13R0.147 CCCCCNCCCCC(=O)CC 90b728a095ade7586124fa525c7f53e7 [0,2,0,0,0,0|0,0,2]=4 12314 B13R0.147 CCCCCNCCCCC(=O)OC 46a7e105511c0c93f9cb151aa4f15e47 [0,2,0,0,0,0|0,0,2]=4 12315 B13R0.147 CCCCCOCCCCC(=O)CC e2ac128e37c582a4e7d20ec42c0aa585 [0,2,0,0,0,0|0,0,2]=4 12316 B13R0.147 CCCCCOCCCCC(=O)OC 980807aea6e63d008afe797fc55d3688 [0,2,0,0,0,0|0,0,2]=4 12317 B13R0.147 CCCCCOCCCCC(C)CC bfad4f010ef67e4aecd51db522fb620e [0,2,0,0,0,0|1,0,0]=3 12318 B13R0.147 CCCCCOCCCC[C@@H](C)CC 966345126cc2fbbf031017b2296b3574 [0,2,0,0,0,0|1,0,0]=3 12319 B13R0.147 CCCCCOCCCOC(C)C#N 5c70e78e6bb1b23975c960a472603010 [0,2,0,0,0,0|2,0,0]=4 12320 B13R0.147 CCCCCOCCCOC(C)C=O 3d10a52b2d30bfdf96eb50ef3be52832 [0,2,0,0,0,0|1,0,1]=4 12321 B13R0.147 CCCCCOCCCOC(C)CC ea9ad9d5f05260abe9a3bf8446710c41 [0,2,0,0,0,0|2,0,0]=4 12322 B13R0.147 CCCCCOCCCO[C@H](C)C=O ae1b0ae412eac582188d85c5b3f1853c [0,2,0,0,0,0|1,0,1]=4 12323 B13R0.147 CCCCCOCCOCC(C)C#N ae3586d6a129d6c32e11d7486449c550 [0,2,0,0,0,0|2,0,0]=4 12324 B13R0.147 CCCCCOCCOCC(C)CC 67df79ecf4d4889559f771963b8cb797 [0,2,0,0,0,0|2,0,0]=4 12325 B13R0.147 CCCCCOCCOCC(C)OC 599ed874a3ff26311f35cdc5c0c172ff [0,2,0,0,0,0|1,0,0]=3 12326 B13R0.147 CCCCCOCCOCC(O)CO a6ac3546a46d3b604745d52c8330be86 [0,2,0,0,0,0|1,0,0]=3 12327 B13R0.147 CCCCCOCCOC[C@@H](C)CC 0b4bb14b5525aef3f56320b42e4f8c0a [0,2,0,0,0,0|2,0,0]=4 12328 B13R0.147 CCCCCOCCOC[C@@H](C)OC cf3ae91804a7195cacd6aff7e68f1c75 [0,2,0,0,0,0|1,0,0]=3 12329 B13R0.147 CCCCCOCCOC[C@@H](O)CO 570cb89388ef661c0678fbf4120132fe [0,2,0,0,0,0|1,0,0]=3 12330 B13R0.147 CCCCCOCCOC[C@H](C)CC e283bb1ac99db472b23d0aec0fb741c7 [0,2,0,0,0,0|2,0,0]=4 12331 B13R0.147 CCCCCOCCOC[C@H](C)OC 97420f55438838180ccf86f8cd1bcbde [0,2,0,0,0,0|1,0,0]=3 12332 B13R0.147 CCCCCOCCOC[C@H](O)CO d924b6b25812ab2d19b7c7bf1274a206 [0,2,0,0,0,0|1,0,0]=3 12333 B13R0.147 CCCCNCCCCCC(=O)OC a815ffae1e1916161e83c058cacea182 [0,2,0,0,0,0|0,0,2]=4 12334 B13R0.147 CCCCOCCCCCC(=O)OC 970a443bfeac90c9af69acf488d88f4a [0,2,0,0,0,0|0,0,2]=4 12335 B13R0.147 CCCCOCCCCCC(C)CC 62c88c55ca8dc3e276c671f5dd01e933 [0,2,0,0,0,0|1,0,0]=3 12336 B13R0.147 CCCCOCCCCC[C@@H](C)CC aace44dd3f342b1d148edcdb9f0883df [0,2,0,0,0,0|1,0,0]=3 12337 B13R0.147 CCCCOCCCNCC(C)C#N e72a951eeea5fd7eae3bcf85cf66e800 [0,2,0,0,0,0|2,0,0]=4 12338 B13R0.147 CCCCOCCCNCC(C)CC 2722ab680d184fa7aedfcf341979430c [0,2,0,0,0,0|2,0,0]=4 12339 B13R0.147 CCCCOCCCNCC(C)CO 578469a9615815b01254c1de602036a6 [0,2,0,0,0,0|1,0,0]=3 12340 B13R0.147 CCCCOCCCNCC(C)OC 8d8d7f17bf74d3e0049701af65b45006 [0,2,0,0,0,0|1,0,0]=3 12341 B13R0.147 CCCCOCCCNCC(O)CC 72f4cc0672522a5e4ef2546247401030 [0,2,0,0,0,0|1,0,0]=3 12342 B13R0.147 CCCCOCCCNCC(O)CF 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CCCCOCCNCCC(O)CO 154f49bfc0669f82be87e4774034111a [0,2,0,0,0,0|1,0,0]=3 12365 B13R0.147 CCCCOCCNCC[C@@H](C)CO dcf957d91dfbb3e5be0568fb642fea42 [0,2,0,0,0,0|1,0,0]=3 12366 B13R0.147 CCCCOCCOCCC(C)CC 640375e70a729df4d091da9d8e85ab0a [0,2,0,0,0,0|2,0,0]=4 12367 B13R0.147 CCCCOCCOCCC(C)OC 510bfba2fdcc3c1c7e62e18d60b02582 [0,2,0,0,0,0|1,0,0]=3 12368 B13R0.147 CCCCOCCOCCC(S)CC 8d5b42bdc3d9b05cfb467dceedcd312e [0,2,0,0,0,0|1,1,0]=4 12369 B13R0.147 CCCCOCCOCC[C@@H](C)CC db625732de9a36df2438233b482a73d9 [0,2,0,0,0,0|2,0,0]=4 12370 B13R0.147 CCCCOCNCCCC(C)CO c39da68f746bcb6d85c54bb0e4e6d79f [0,2,0,0,0,0|1,0,0]=3 12371 B13R0.147 CCCCOCOCCCC(C)CC feeb016c4e11510a4c3ab5b38867a398 [0,2,0,0,0,0|2,0,0]=4 12372 B13R0.147 CCCCOCOCCC[C@@H](C)CC f6b16657b2f95b1c217afacdf54d108d [0,2,0,0,0,0|2,0,0]=4 12373 B13R0.147 CCCCSCCOCCC(C)CC e913c5fecd3cd987610dd2a1c4351da6 [0,2,0,0,0,0|2,0,0]=4 12374 B13R0.147 CCCNCCCCCCC(=O)OC 62f8a1b7de961688139cc6bfc52af8c3 [0,2,0,0,0,0|0,0,2]=4 12375 B13R0.147 CCCOCCCCCCC(=O)OC f22704949f18012fcce5f0588f5c567c [0,2,0,0,0,0|0,0,2]=4 12376 B13R0.147 CCCOCCCNCCC(C)CC 0f130ddf6229aca04a7997acf719a0e8 [0,2,0,0,0,0|2,0,0]=4 12377 B13R0.147 CCCOCCCNCCC(C)CO c6cdd94663525d49e426f4be1f9336a3 [0,2,0,0,0,0|1,0,0]=3 12378 B13R0.147 CCCOCCCNCCC(O)CO 152934cb91ab0a1b074262ecedae41d1 [0,2,0,0,0,0|1,0,0]=3 12379 B13R0.147 CCCOCCCNCC[C@@H](C)CO f0190b429acee4a15cc6714c7880a416 [0,2,0,0,0,0|1,0,0]=3 12380 B13R0.147 CCCOCCCOCCC(C)CC befca63e095425f600663ba71e7bb557 [0,2,0,0,0,0|2,0,0]=4 12381 B13R0.147 CCCOCCCOCCC(C)OC 0e0881cc753bc9b0849e52c8efbcd25d [0,2,0,0,0,0|1,0,0]=3 12382 B13R0.147 CCCOCCCOCCC(S)CC 98c93181a13912b2329d61388d9a1f69 [0,2,0,0,0,0|1,1,0]=4 12383 B13R0.147 CCCOCCCOCC[C@@H](C)CC 8431255faa62d9013d0f51856231032d [0,2,0,0,0,0|2,0,0]=4 12384 B13R0.147 CCCOCCNCCCC(C)CO 9aeefae737319a263706611a36f2f05a [0,2,0,0,0,0|1,0,0]=3 12385 B13R0.147 CCCOCCOCCCC(C)CC 8052b3568298f5ee0c1499a6ed9638e8 [0,2,0,0,0,0|2,0,0]=4 12386 B13R0.147 CCCOCCOCCC[C@@H](C)CC 96535086bdd3bbccc91398fcca7d44d1 [0,2,0,0,0,0|2,0,0]=4 12387 B13R0.147 CCCSCCCCNCC(C)C#N 30f3ddcf39b087194e0c623b1f4fb9b7 [0,2,0,0,0,0|2,0,0]=4 12388 B13R0.147 CCCSCCCCNCC(C)CC 5f6d0b4d22f70f55e88927290adb3207 [0,2,0,0,0,0|2,0,0]=4 12389 B13R0.147 CCCSCCCCNCC(C)CO dec42a6222942e76c6fea81059fc42f7 [0,2,0,0,0,0|1,0,0]=3 12390 B13R0.147 CCCSCCCCNCC(C)OC 5bc0e642c76288f60e01636679ea8c19 [0,2,0,0,0,0|1,0,0]=3 12391 B13R0.147 CCCSCCCCNCC(O)CC 6f077a4075bf59717acb4f4275c46f3a [0,2,0,0,0,0|1,0,0]=3 12392 B13R0.147 CCCSCCCCNCC(O)CF 96ec31c97d8b78d600bae37d0cf72b50 [0,2,0,0,0,0|1,0,0]=3 12393 B13R0.147 CCCSCCCCNCC(O)CO 77074b034da36f49ad635e93f437d17a [0,2,0,0,0,0|1,0,0]=3 12394 B13R0.147 CCCSCCCCNC[C@@H](C)CC b2e69b53da360c81ecb1cc8973981852 [0,2,0,0,0,0|2,0,0]=4 12395 B13R0.147 CCCSCCCCNC[C@@H](C)CO c42560f6443f7a1f275b8ce49ae25a82 [0,2,0,0,0,0|1,0,0]=3 12396 B13R0.147 CCCSCCCCNC[C@@H](C)OC 016a93ec2b453d7f6e6751361173e167 [0,2,0,0,0,0|1,0,0]=3 12397 B13R0.147 CCCSCCCCNC[C@@H](O)CO 651097eaf102c8e512f627f4f16f38a4 [0,2,0,0,0,0|1,0,0]=3 12398 B13R0.147 CCCSCCCCNC[C@H](C)CC 7aeb6ef1bef2e0db76ad3022b1c84247 [0,2,0,0,0,0|2,0,0]=4 12399 B13R0.147 CCCSCCCCNC[C@H](C)CO 0ee40838ca004f1c155bab25c9eab0d5 [0,2,0,0,0,0|1,0,0]=3 12400 B13R0.147 CCCSCCCCNC[C@H](C)OC 1d1b48e51a00bcac890501314dc08556 [0,2,0,0,0,0|1,0,0]=3 12401 B13R0.147 CCCSCCCCNC[C@H](O)CO 67f591d856ac5202f5f75dafa8f6f419 [0,2,0,0,0,0|1,0,0]=3 12402 B13R0.147 CCN(C)CCCCCCCCCO 48b8e5143c0fc38af1200deabf80bafe [0,2,0,0,0,0|2,0,0]=4 12403 B13R0.147 CCNCCCCCCCC(=O)OC 7489671079ef4bbb11b756d13d5984fb [0,2,0,0,0,0|0,0,2]=4 12404 B13R0.147 CCOCCCCCCCC(=O)OC f0bf047e1cf69e0c5d7b51c202029115 [0,2,0,0,0,0|0,0,2]=4 12405 B13R0.147 CCOCCCNCCCC(C)CO 36f005ad5f2292aff1c88445dc927614 [0,2,0,0,0,0|1,0,0]=3 12406 B13R0.147 CCOCCCOCCCC(C)CC 08c946e58ec4388615fe478cfeae56c5 [0,2,0,0,0,0|2,0,0]=4 12407 B13R0.147 CCOCCCOCCC[C@@H](C)CC 5c155f6f6cf526b03cd84de762e95195 [0,2,0,0,0,0|2,0,0]=4 12408 B13R0.147 CCOCCOCCCCC(C)CC 27045d935948e7bef467b600bafa8c72 [0,2,0,0,0,0|2,0,0]=4 12409 B13R0.147 CCOCCOCCCC[C@@H](C)CC 94c82ed394e3410a0e985a2863fbac92 [0,2,0,0,0,0|2,0,0]=4 12410 B13R0.147 CCOCCOCCNCC(C)CO 5f59ad0e0d1688f7e795675c09ec2a78 [0,2,0,0,0,0|2,0,0]=4 12411 B13R0.147 CCOCCOCCNCC(C)OC 61f49f4277b06b82762d59ae224a1027 [0,2,0,0,0,0|2,0,0]=4 12412 B13R0.147 CCOCCOCCNCC(O)CC 8eea594697499e54580bed239956beca [0,2,0,0,0,0|2,0,0]=4 12413 B13R0.147 CCOCCOCCNCC(O)CF 1ad81f42edb2b4dbfab8317633f91e72 [0,2,0,0,0,0|2,0,0]=4 12414 B13R0.147 CCOCCOCCNCC(O)CO 7dc7233d4efdc8dcfa52527cc1afe2a3 [0,2,0,0,0,0|2,0,0]=4 12415 B13R0.147 CCOCCOCCNC[C@@H](C)CO 9876d19426a8f6ae93093b48fe7a4196 [0,2,0,0,0,0|2,0,0]=4 12416 B13R0.147 CCOCCOCCNC[C@@H](C)OC 5fe15f51e88c704d41bf68a2c0039b83 [0,2,0,0,0,0|2,0,0]=4 12417 B13R0.147 CCOCCOCCNC[C@@H](O)CO f595f7d53947539e8bf549b3e49e291b [0,2,0,0,0,0|2,0,0]=4 12418 B13R0.147 CCOCCOCCNC[C@H](C)CO 16c8bd64de24e1456062c588cc8c6545 [0,2,0,0,0,0|2,0,0]=4 12419 B13R0.147 CCOCCOCCNC[C@H](C)OC d860c6595a24376ed2785300699667c2 [0,2,0,0,0,0|2,0,0]=4 12420 B13R0.147 CCOCCOCCNC[C@H](O)CC 2e74c5a30233fa523e27a29825b299bd [0,2,0,0,0,0|2,0,0]=4 12421 B13R0.147 CCOCCOCCNC[C@H](O)CO a54b37feada92808154dac5cef70c9a2 [0,2,0,0,0,0|2,0,0]=4 12422 B13R0.147 CCOCCOCCOCC(C)OC bca7ee4a1830eb107e613f7b4534de19 [0,2,0,0,0,0|2,0,0]=4 12423 B13R0.147 CCOCCOCCOCC(O)CO 4c3c8edd2d1e3c6e488efaa3dfc016d9 [0,2,0,0,0,0|2,0,0]=4 12424 B13R0.147 CCOCCOCCOC[C@@H](C)OC 177c0cd1a44fc86ef15520d9636cd5e8 [0,2,0,0,0,0|2,0,0]=4 12425 B13R0.147 CCOCCOCCOC[C@@H](O)CO d345c49448905d1d13dbd0c7dec89978 [0,2,0,0,0,0|2,0,0]=4 12426 B13R0.147 CCOCCOCCOC[C@H](C)OC a4391ef82f2f93451895f5bbfddf0572 [0,2,0,0,0,0|2,0,0]=4 12427 B13R0.147 CCOCCOCCOC[C@H](O)CO e86d0bcd75502d26839fcc874e103a13 [0,2,0,0,0,0|2,0,0]=4 12428 B13R0.147 CCOCOCCCCCC(C)CC 30c8c57589bdc7ece83c1f43dfac561b [0,2,0,0,0,0|2,0,0]=4 12429 B13R0.147 CCOCOCCCCC[C@@H](C)CC 334c4cc5d3d5fec4f7e832d30fa80d1b [0,2,0,0,0,0|2,0,0]=4 12430 B13R0.147 CCSCCCCNCCC(C)CC 069ba68ab0a95778d9103a9246f67a32 [0,2,0,0,0,0|2,0,0]=4 12431 B13R0.147 CCSCCCCNCCC(C)CO 16ee8449edfdf456a8be56de3d7f39a7 [0,2,0,0,0,0|1,0,0]=3 12432 B13R0.147 CCSCCCNCCCC(C)CO 3518cac0f3ea9dffdcecaa3b87496186 [0,2,0,0,0,0|1,0,0]=3 12433 B13R0.147 CCSCCCOCCCC(C)CC 359826562dfb7dc8e4b37feb1bc0982b [0,2,0,0,0,0|2,0,0]=4 12434 B13R0.147 CCSCCCOCCC[C@@H](C)CC 032795cec2ea21376c33422e46a511cf [0,2,0,0,0,0|2,0,0]=4 12435 B13R0.147 CCSCCOCCCCC(C)CC 38478336e23469089334a7cb69541275 [0,2,0,0,0,0|2,0,0]=4 12436 B13R0.147 CCSCCOCCCC[C@@H](C)CC 9374614dec97e969cae9bb7762d2db83 [0,2,0,0,0,0|2,0,0]=4 12437 B13R0.147 CC[C@@H](C)CNCCCCCCCO 012eb931a20c9cde53b84d2814d2e9f8 [0,2,0,0,0,0|2,0,0]=4 12438 B13R0.147 CC[C@@H](C)COCCCCCCOC 0c0d9953cbfbc32896cbdccb10101d6c [0,2,0,0,0,0|2,0,0]=4 12439 B13R0.147 CC[C@@H](C)NCCCCCCCCO f570992c7c51705708994b1f6fb0a9a9 [0,2,0,0,0,0|2,0,0]=4 12440 B13R0.147 CC[C@@H](O)CNCCCCCCC#N a20b27304b42f9ad6edabbf5546c8d9e [0,2,0,0,0,0|1,0,1]=4 12441 B13R0.147 CC[C@@H](O)CNCCCCCCC=O 0f7c41e6218ec6d74725c60f5b6bab59 [0,2,0,0,0,0|1,0,1]=4 12442 B13R0.147 CC[C@@H](O)CNCCCCCCCO 5ccaaad05be53ab9cfd6786c2d776362 [0,2,0,0,0,0|1,0,0]=3 12443 B13R0.147 CC[C@@H](O)CNCCCCCCOC 31ad2b4e65671ee7869a9aa9c05a7c53 [0,2,0,0,0,0|1,0,0]=3 12444 B13R0.147 CC[C@@H](O)CNCCCOCCCO b7c598c683776c285d667771d5b21249 [0,2,0,0,0,0|2,0,0]=4 12445 B13R0.147 CC[C@@H](O)CNCCCOCCOC 533db96b56c333bffc0ebc01f6c06b5a [0,2,0,0,0,0|2,0,0]=4 12446 B13R0.147 CC[C@H](C)CCCCCOCCCF 907b0fe081404b7fe5fffa2e81aad917 [0,2,0,0,0,0|2,0,0]=4 12447 B13R0.147 CC[C@H](C)CCCCCOCCCS acb9c8c14483f9ace61a53e3e1a4f491 [0,2,0,0,0,0|2,0,0]=4 12448 B13R0.147 CC[C@H](C)CCCCCOCCOC fe6530747c658d326abe1ac79a2d8a8d [0,2,0,0,0,0|2,0,0]=4 12449 B13R0.147 CC[C@H](C)CCCCCOCCSC f35290337e4a9c912602eee63bf5726b [0,2,0,0,0,0|2,0,0]=4 12450 B13R0.147 CC[C@H](C)CCCCOCCCCF 9c58d542398a0248fde24d650c9baea8 [0,2,0,0,0,0|2,0,0]=4 12451 B13R0.147 CC[C@H](C)CCCCOCCCOC ada90ed244e791b0cdfa6eb6999775dd [0,2,0,0,0,0|2,0,0]=4 12452 B13R0.147 CC[C@H](C)CCCCOCCCSC ed170daf697b2c895acf508c60ee85af [0,2,0,0,0,0|2,0,0]=4 12453 B13R0.147 CC[C@H](C)CCCOCCCCCF 54bb99701e148a211ccc4511a1ed8d73 [0,2,0,0,0,0|2,0,0]=4 12454 B13R0.147 CC[C@H](C)CCCOCCCCOC 10b29e816f46cb73b8e4423cd89c3084 [0,2,0,0,0,0|2,0,0]=4 12455 B13R0.147 CC[C@H](C)CCOCCCCCCF 4aaeb412a56d27e952a413cbf35aa468 [0,2,0,0,0,0|2,0,0]=4 12456 B13R0.147 CC[C@H](C)CCOCCCCCOC c66bcf771b594bb7b621a9dd3b650bb9 [0,2,0,0,0,0|2,0,0]=4 12457 B13R0.147 CC[C@H](C)CNCCCCCCCO d82ded72d15d78202d6749c0dc9af2c3 [0,2,0,0,0,0|2,0,0]=4 12458 B13R0.147 CC[C@H](C)CNCCCCCCOC f93a95b28f126faecbb0a2c011f365f9 [0,2,0,0,0,0|2,0,0]=4 12459 B13R0.147 CC[C@H](C)COCCCCCCOC 12032e8ce670f79e12492de449d1c05f [0,2,0,0,0,0|2,0,0]=4 12460 B13R0.147 CC[C@H](C)NCCCCCCCCO f68ada16bce7a2a5201dc16afffeeb4a [0,2,0,0,0,0|2,0,0]=4 12461 B13R0.147 CN(C=O)CCCCCCCCCO 0d2ae7c80ccf985796dd92057248a02b [0,2,0,0,0,0|1,0,1]=4 12462 B13R0.147 CN(CF)CCCCCCCCCO 0d0c43d532857924bbf4a7351ad85d45 [0,2,0,0,0,0|2,0,0]=4 12463 B13R0.147 CN(CO)CCCCCCCCCO e654e9c8b4cd72db421361722b191099 [0,2,0,0,0,0|1,0,0]=3 12464 B13R0.147 COC(C)CCOCCCCCC#N 407a5180ec556d06d7814c59c9240e16 [0,2,0,0,0,0|1,0,1]=4 12465 B13R0.147 COC(C)CCOCCCCCC=O e23bf72e2a7e8b2a3576203b260874b7 [0,2,0,0,0,0|1,0,1]=4 12466 B13R0.147 COC(C)CCOCCCCCCF edd696c9ec8f711129fd6daf8558538d [0,2,0,0,0,0|1,0,0]=3 12467 B13R0.147 COC(C)CNCCCCCCCO 7ed5782ee8eaf6c23e82ca78c1d85e45 [0,2,0,0,0,0|1,0,0]=3 12468 B13R0.147 COC(C)CNCCCCSCCO 845b9718db3e128bb25f010a607026a1 [0,2,0,0,0,0|2,0,0]=4 12469 B13R0.147 COC(C)CNCCCOCCCO d1d674b847b3769d7caa583b716a4aab [0,2,0,0,0,0|2,0,0]=4 12470 B13R0.147 COC(C)CNCCCOCCSC 1f450e8b653d9b144e816735abe504a3 [0,2,0,0,0,0|2,0,0]=4 12471 B13R0.147 COC(C)COCCCCCCC#N 93c0e2fdedc3e09f92d1e5ecd5f04812 [0,2,0,0,0,0|1,0,1]=4 12472 B13R0.147 COC(C)COCCCCCCC=O c51b66ca8fe73936b03d524d4a2392be [0,2,0,0,0,0|1,0,1]=4 12473 B13R0.147 COCCCCCCNCC(Br)CBr 768fc45083068a33bb093d41c086c28c [0,2,0,0,0,0|2,0,0]=4 12474 B13R0.147 COCCCCCCNCC(C)C#N 3c9aeaacc3b066e274039ce650ff01df [0,2,0,0,0,0|2,0,0]=4 12475 B13R0.147 COCCCCCCNCC(C)CO e4fae65c967f011da6f2fce6888ee928 [0,2,0,0,0,0|1,0,0]=3 12476 B13R0.147 COCCCCCCNCC(F)CO 83175325896bf82ba440a91acb86fc50 [0,2,0,0,0,0|2,0,0]=4 12477 B13R0.147 COCCCCCCNCC(O)CO 90087a956223cda056112060cab9b8dd [0,2,0,0,0,0|1,0,0]=3 12478 B13R0.147 COCCCCCCNC[C@@H](C)OC 4dd49c2e5523dca5e13635558dfff10c [0,2,0,0,0,0|1,0,0]=3 12479 B13R0.147 COCCCCCCNC[C@@H](F)CO 7b2ee163080bc604512145b9db27d654 [0,2,0,0,0,0|2,0,0]=4 12480 B13R0.147 COCCCCCCNC[C@@H](O)CO 79e2842516f71004b62c2b64e02b7dec [0,2,0,0,0,0|1,0,0]=3 12481 B13R0.147 COCCCCCCNC[C@H](C)CO ca53a12ed6172b2648e96b9a6c8e5d44 [0,2,0,0,0,0|1,0,0]=3 12482 B13R0.147 COCCCCCCNC[C@H](C)OC 339f7f25d4a7535c22dda7c9467fcfc7 [0,2,0,0,0,0|1,0,0]=3 12483 B13R0.147 COCCCCCCNC[C@H](F)CO 044c9fcf780d66b3a1419c83991c500c [0,2,0,0,0,0|2,0,0]=4 12484 B13R0.147 COCCCCCCNC[C@H](O)CO 661b546bd22d9d6c04529f0cb86742c4 [0,2,0,0,0,0|1,0,0]=3 12485 B13R0.147 COCCCCCCOCC(Br)CBr c38aca5891283cdd0acb159313c279ff [0,2,0,0,0,0|2,0,0]=4 12486 B13R0.147 COCCCCCCOCC(C)C#N a48bd32789fe9fdfd12e8f15be29caf2 [0,2,0,0,0,0|2,0,0]=4 12487 B13R0.147 COCCCCCCOCC(C)OC 4827651d57a1ffd8380abecf3abeb7b8 [0,2,0,0,0,0|1,0,0]=3 12488 B13R0.147 COCCCCCCOCC(Cl)CCl a43d0befbc7fb557b19be7e0fcbe2798 [0,2,0,0,0,0|2,0,0]=4 12489 B13R0.147 COCCCCCCOCC(O)CO 711cfd8fcd7d4822fba621f2088ffe94 [0,2,0,0,0,0|1,0,0]=3 12490 B13R0.147 COCCCCCCOCC(S)CS d991df19d91d90a7a4e41b661e360e08 [0,2,0,0,0,0|1,1,0]=4 12491 B13R0.147 COCCCCCCOC[C@@H](C)OC db58e7d0564ddc619ce82064e8d516c4 [0,2,0,0,0,0|1,0,0]=3 12492 B13R0.147 COCCCCCCOC[C@@H](O)CO 004ebfca9a5843fd332cfbbbda2e5df4 [0,2,0,0,0,0|1,0,0]=3 12493 B13R0.147 COCCCCCCOC[C@H](C)OC 9d99e61328a6b44871a15c1124514c12 [0,2,0,0,0,0|1,0,0]=3 12494 B13R0.147 COCCCCCCOC[C@H](O)CO c5f49a6b842ed7d7736f194eaa6fbb80 [0,2,0,0,0,0|1,0,0]=3 12495 B13R0.147 COCCCCCNCCC(C)CO 9200fe705e5d618dbdefe59a8e326270 [0,2,0,0,0,0|1,0,0]=3 12496 B13R0.147 COCCCCCNCCC(O)CO 03bef8499ca1a676196f82106ef83ad2 [0,2,0,0,0,0|1,0,0]=3 12497 B13R0.147 COCCCCCNCC[C@@H](C)CO 1641b61e89eef2e002de06abd060cb04 [0,2,0,0,0,0|1,0,0]=3 12498 B13R0.147 COCCCCCOCCC(C)OC eee9a6a2636f7812c05e5debd433408a [0,2,0,0,0,0|1,0,0]=3 12499 B13R0.147 COCCCCNCCCC(C)CO 11975bbf9d5007370e6fe806c8eb235e [0,2,0,0,0,0|1,0,0]=3 12500 B13R0.147 COCCOCCCCNC(C)CO 5701e07f30b541d6a100d6e295257225 [0,2,0,0,0,0|2,0,0]=4 12501 B13R0.147 COCCOCCCCN[C@@H](C)CO f77f2652147ef963050c5ae496dc528e [0,2,0,0,0,0|2,0,0]=4 12502 B13R0.147 COCCOCCCCN[C@H](C)CO 0634746b79b60703dd28935663546bba [0,2,0,0,0,0|2,0,0]=4 12503 B13R0.147 COCCOCCCNCC(C)CO 0d3b68a0d4b3993d17845cd3bf7942d3 [0,2,0,0,0,0|2,0,0]=4 12504 B13R0.147 COCCOCCCNCC(C)OC 88dd505e1c359d39a655001358e69d25 [0,2,0,0,0,0|2,0,0]=4 12505 B13R0.147 COCCOCCCNCC(O)CF 4c3c91f2b065b168be4c575b577f8c97 [0,2,0,0,0,0|2,0,0]=4 12506 B13R0.147 COCCOCCCNCC(O)CO 0fd390d868726115afdecadbffc3921a [0,2,0,0,0,0|2,0,0]=4 12507 B13R0.147 COCCOCCCNC[C@@H](C)CO e70c28e118d20e5d7eae5a88d6a4a23d [0,2,0,0,0,0|2,0,0]=4 12508 B13R0.147 COCCOCCCNC[C@@H](C)OC f22a9cf991d79419863afe8768c3f44d [0,2,0,0,0,0|2,0,0]=4 12509 B13R0.147 COCCOCCCNC[C@@H](O)CO 5c103514d6332cf00d66a3165b265b8d [0,2,0,0,0,0|2,0,0]=4 12510 B13R0.147 COCCOCCCNC[C@H](C)CO 52824b14843905dc3a51f0835782d851 [0,2,0,0,0,0|2,0,0]=4 12511 B13R0.147 COCCOCCCNC[C@H](C)OC f080fd448d38667cdb5ff249581b85f4 [0,2,0,0,0,0|2,0,0]=4 12512 B13R0.147 COCCOCCCNC[C@H](O)CO 4ec1ae4530b1ad64c629b87a033d4b33 [0,2,0,0,0,0|2,0,0]=4 12513 B13R0.147 COCCOCCCOCC(C)OC 97ef98fc6ddbe85ed71a09874d2be5bc [0,2,0,0,0,0|2,0,0]=4 12514 B13R0.147 COCCOCCCOCC(O)CO 601be8015a5a2d9217d6d63eb1592dd7 [0,2,0,0,0,0|2,0,0]=4 12515 B13R0.147 COCCOCCCOC[C@@H](C)OC 73ad8ffd9ffac69150558f77ee843667 [0,2,0,0,0,0|2,0,0]=4 12516 B13R0.147 COCCOCCCOC[C@@H](O)CO 6ffcf132860bafa0009963928e4c2e74 [0,2,0,0,0,0|2,0,0]=4 12517 B13R0.147 COCCOCCCOC[C@H](C)OC 8d40cc8f200fc1f1556e82bfb36847a8 [0,2,0,0,0,0|2,0,0]=4 12518 B13R0.147 COCCOCCCOC[C@H](O)CO 2364cd0fb2198ebb3815378cabe2fdbe [0,2,0,0,0,0|2,0,0]=4 12519 B13R0.147 COCCOCCNCCC(C)CO 54231fdf469996a4b2346323683ae4bc [0,2,0,0,0,0|2,0,0]=4 12520 B13R0.147 COCCOCCNCCC(O)CO d7bcb3841b111658fbe6d96fc5c08cec [0,2,0,0,0,0|2,0,0]=4 12521 B13R0.147 COCCOCCNCC[C@@H](C)CO c702350da758df94abf3f90a89de04da [0,2,0,0,0,0|2,0,0]=4 12522 B13R0.147 COCCOCCOCCC(C)OC 0c12c534337969e0a9b763c90c7cbeb8 [0,2,0,0,0,0|2,0,0]=4 12523 B13R0.147 COCCOCNCCCC(C)CO 0bd35a61510a62d3059b9e5b972534ae [0,2,0,0,0,0|2,0,0]=4 12524 B13R0.147 COCOCCNCCCC(C)CO 216e2a1ef59a650c31798afe472e7682 [0,2,0,0,0,0|2,0,0]=4 12525 B13R0.147 CO[C@@H](C)CNCCCCCCC#N 2870d974c7d5d6213360dc5acf320d9a [0,2,0,0,0,0|1,0,1]=4 12526 B13R0.147 CO[C@@H](C)CNCCCCCCC=O 089d9fca66abbf1069c9efc760c7d7b5 [0,2,0,0,0,0|1,0,1]=4 12527 B13R0.147 CO[C@@H](C)CNCCCCCCCO f5b2324858f809ffb49061937cc3e502 [0,2,0,0,0,0|1,0,0]=3 12528 B13R0.147 CO[C@@H](C)CNCCCCSCCO 425a662f62cdfa8e194abe75b00e3cd9 [0,2,0,0,0,0|2,0,0]=4 12529 B13R0.147 CO[C@@H](C)CNCCCOCCCO 20772590cb6e101154151a19e35ff66a [0,2,0,0,0,0|2,0,0]=4 12530 B13R0.147 CO[C@@H](C)CNCCCOCCSC 1e49fe32644220e316779ee1e4a4044d [0,2,0,0,0,0|2,0,0]=4 12531 B13R0.147 CO[C@@H](C)COCCCCCCC#N 5825d1f9da3899b6e327bf8561218004 [0,2,0,0,0,0|1,0,1]=4 12532 B13R0.147 CO[C@@H](C)COCCCCCCC=O ef49a809e5d83f5b178e9dab9d6a7d45 [0,2,0,0,0,0|1,0,1]=4 12533 B13R0.147 CO[C@H](C)CNCCCCCCC#N 65a3cf8e711e38a97b63c13e9381f070 [0,2,0,0,0,0|1,0,1]=4 12534 B13R0.147 CO[C@H](C)CNCCCCCCC=O 4c12b3699f1b136de3dd6f9b787d40f2 [0,2,0,0,0,0|1,0,1]=4 12535 B13R0.147 CO[C@H](C)CNCCCCCCCO 9fd1223c1452664ad0a20cbdf1a03d08 [0,2,0,0,0,0|1,0,0]=3 12536 B13R0.147 CO[C@H](C)CNCCCCSCCO d679c6e76fa6adc42704de249f0aee34 [0,2,0,0,0,0|2,0,0]=4 12537 B13R0.147 CO[C@H](C)CNCCCOCCCO 4877a570c416aefaea4f517bf4b4b3aa [0,2,0,0,0,0|2,0,0]=4 12538 B13R0.147 CO[C@H](C)CNCCCOCCSC b211bd26591bffd3e5128db508787b62 [0,2,0,0,0,0|2,0,0]=4 12539 B13R0.147 CO[C@H](C)COCCCCCCC#N 4579cfba78bc9e2e208cc18068cc1638 [0,2,0,0,0,0|1,0,1]=4 12540 B13R0.147 CO[C@H](C)COCCCCCCC=O 4f4ff0a9dd600aa590139f894fb6111f [0,2,0,0,0,0|1,0,1]=4 12541 B13R0.147 CSCCOCCCNCC(C)CO 82a312f4f57718b36d87d9ddd4870084 [0,2,0,0,0,0|2,0,0]=4 12542 B13R0.147 CSCCOCCCNCC(O)CF 90669786fcff90eb3ac0e40b3e695b81 [0,2,0,0,0,0|2,0,0]=4 12543 B13R0.147 CSCCOCCCNCC(O)CO 4b38cb9a133b175c72a049deac97a3f6 [0,2,0,0,0,0|2,0,0]=4 12544 B13R0.147 CSCCOCCCNC[C@@H](C)CO 0e64a62c143d3eb9aacd175097a025d4 [0,2,0,0,0,0|2,0,0]=4 12545 B13R0.147 CSCCOCCCNC[C@@H](O)CO be2cff152ab5a02c5ce0850ede5e5e8b [0,2,0,0,0,0|2,0,0]=4 12546 B13R0.147 CSCCOCCCNC[C@H](C)CO 6fa4a0ef47beddf0dea92d78b2bcd7fd [0,2,0,0,0,0|2,0,0]=4 12547 B13R0.147 CSCCOCCCNC[C@H](O)CO 2b501308aac981cca72694a799e8b396 [0,2,0,0,0,0|2,0,0]=4 12548 B13R0.147 C[C@@H](CO)CCNCCCCCC#N bed959c69d68437ad3063c1e2310c6f0 [0,2,0,0,0,0|1,0,1]=4 12549 B13R0.147 C[C@@H](CO)CCNCCCCCC=O 3ed6ae0765468c64a8a1cd5d6540905c [0,2,0,0,0,0|1,0,1]=4 12550 B13R0.147 C[C@@H](CO)CCNCCCCCCF 2c1ff901dc35591ca4017fb3779a5b96 [0,2,0,0,0,0|1,0,0]=3 12551 B13R0.147 C[C@@H](CO)CCNCCCCCCO 06c3ecec46eb3c19c461e8764b90ca5d [0,2,0,0,0,0|1,0,0]=3 12552 B13R0.147 C[C@@H](CO)CNCCCCCCCO e4af33f637f05e66b7c22662b474f128 [0,2,0,0,0,0|1,0,0]=3 12553 B13R0.147 C[C@@H](CO)CNCCCCSCCO 2f0a7f09e2a47256b7c254ceb93b6aa8 [0,2,0,0,0,0|2,0,0]=4 12554 B13R0.147 C[C@@H](CO)CNCCCOCCCO bd498b11749c46c6fe55f9807d10cf50 [0,2,0,0,0,0|2,0,0]=4 12555 B13R0.147 C[C@@H](CO)NCCCCCCCCO d931ddbbf40c4b659a02eacc88583fba [0,2,0,0,0,0|1,0,0]=3 12556 B13R0.147 C[C@H](C=O)NCCCCCCCCO 0f30ae399848e1eb5688e558d9ad3f7b [0,2,0,0,0,0|1,0,1]=4 12557 B13R0.147 C[C@H](CO)CNCCCCCCC#N 48eab72251c1cc0e724c77eb182f7396 [0,2,0,0,0,0|1,0,1]=4 12558 B13R0.147 C[C@H](CO)CNCCCCCCC=O 663f3889eb666abea35f83d9e7e0a898 [0,2,0,0,0,0|1,0,1]=4 12559 B13R0.147 C[C@H](CO)CNCCCCCCCO f06e30d530bcdce519536e3751e2722f [0,2,0,0,0,0|1,0,0]=3 12560 B13R0.147 C[C@H](CO)CNCCCCSCCO af89e58ab4b0570cf3e97ef3b09dc4c7 [0,2,0,0,0,0|2,0,0]=4 12561 B13R0.147 C[C@H](CO)CNCCCOCCCO 9ae21063394e9c5dc169575debc18d66 [0,2,0,0,0,0|2,0,0]=4 12562 B13R0.147 C[C@H](CO)NCCCCCCCCO 8233dd150becb03da1cccde641401c4c [0,2,0,0,0,0|1,0,0]=3 12563 B13R0.147 N#CCCCCCCNCC(O)CO 1eb6f933fb061566de5c861763b761c3 [0,2,0,0,0,0|1,0,1]=4 12564 B13R0.147 N#CCCCCCCNC[C@@H](O)CO 02e02643287c2436afe3847697883d1d [0,2,0,0,0,0|1,0,1]=4 12565 B13R0.147 N#CCCCCCCNC[C@H](O)CO 5c4088e271b528f99660c6eb1d777ada [0,2,0,0,0,0|1,0,1]=4 12566 B13R0.147 N#CCCCCCNCCC(O)CO a8ab87f4f0959f241acec01e57a47643 [0,2,0,0,0,0|1,0,1]=4 12567 B13R0.147 O=CCCCCCCNCC(O)CO e199772b497f69ec4b181e12f6d2fa9a [0,2,0,0,0,0|1,0,1]=4 12568 B13R0.147 O=CCCCCCCNC[C@@H](O)CO 7f1ad680a13f23b0d77506f1c7c554ca [0,2,0,0,0,0|1,0,1]=4 12569 B13R0.147 O=CCCCCCCNC[C@H](O)CO 95cca0394db5ef2abf1381d3c9392ec4 [0,2,0,0,0,0|1,0,1]=4 12570 B13R0.147 O=CCCCCCNCCC(O)CO b7620190f02537ddcc9201a0336f3ae3 [0,2,0,0,0,0|1,0,1]=4 12571 B13R0.147 OCC(O)CCNCCCCCCF 22e5efb38b96d3724cc0ec0fe625241b [0,2,0,0,0,0|1,0,0]=3 12572 B13R0.147 OCCCCCCCNCC(Br)CBr c6c470fb48d66815ba480252872794be [0,2,0,0,0,0|2,0,0]=4 12573 B13R0.147 OCCCCCCCNCC(F)CO e0bb55a046fc647ea239fe13908b6349 [0,2,0,0,0,0|2,0,0]=4 12574 B13R0.147 OCCCCCCCNCC(O)CF 1dc3031eaf64abb92c0b61c446450741 [0,2,0,0,0,0|1,0,0]=3 12575 B13R0.147 OCCCCCCCNCC(O)CO 2cbb1668b5f195add80947ce63795081 [0,2,0,0,0,0|1,0,0]=3 12576 B13R0.147 OCCCCCCCNC[C@@H](F)CO f6eb5dea4a8caf4822774ca4ee57df9d [0,2,0,0,0,0|2,0,0]=4 12577 B13R0.147 OCCCCCCCNC[C@@H](O)CO 9040f34578d5a850af1b7db503aebb85 [0,2,0,0,0,0|1,0,0]=3 12578 B13R0.147 OCCCCCCCNC[C@H](F)CO 9e015ce1522181a38932fd809acd4306 [0,2,0,0,0,0|2,0,0]=4 12579 B13R0.147 OCCCCCCCNC[C@H](O)CO 5ba2ffad3fd342cf5792517f9d073e09 [0,2,0,0,0,0|1,0,0]=3 12580 B13R0.147 OCCCCCCNCCC(O)CO 5eb0591646367b7ef21b0ed6cf9f10dd [0,2,0,0,0,0|1,0,0]=3 12581 B13R0.147 OCCCOCCCNCC(O)CF ac2f98aae156d59e91b8266eca6bce4d [0,2,0,0,0,0|2,0,0]=4 12582 B13R0.147 OCCCOCCCNCC(O)CO 85b5dca2fd893875268691db0fa80fe2 [0,2,0,0,0,0|2,0,0]=4 12583 B13R0.147 OCCCOCCCNC[C@@H](O)CO 7b9bb15d4b68ffa4e871463372d83ebf [0,2,0,0,0,0|2,0,0]=4 12584 B13R0.147 OCCCOCCCNC[C@H](O)CO 883af1ef3cae6512931260aa59b1ead6 [0,2,0,0,0,0|2,0,0]=4 12585 B13R0.147 OCCSCCCCNCC(O)CF 9c191b075b6fa2771ecfcc1107d179fe [0,2,0,0,0,0|2,0,0]=4 12586 B13R0.147 OCCSCCCCNCC(O)CO d6780b93b2e16f3e9bce3419546e33e8 [0,2,0,0,0,0|2,0,0]=4 12587 B13R0.147 OCCSCCCCNC[C@@H](O)CO 1cf2ebdbdc1f946579a3a25627029cdc [0,2,0,0,0,0|2,0,0]=4 12588 B13R0.147 OCCSCCCCNC[C@H](O)CO 9893b639c75ef51867372e6a7aa8674f [0,2,0,0,0,0|2,0,0]=4 12589 B13R0.150 C#CCCCCCCNC(C)C(C)O 83e25bd8ddbb48bf4e68244fdbdec26e [0,2,0,0,0,0|0,0,2]=4 12590 B13R0.150 C=C(I)[C@H](C)CNCCCCCCC bed6d2189f65576781d2b50e11506824 [0,2,0,0,0,0|2,0,0]=4 12591 B13R0.150 C=C(I)[C@H](C)COCCCCCCC e28a8af84a9f3e87a0de2c0e8507d2c8 [0,2,0,0,0,0|2,0,0]=4 12592 B13R0.150 C=CCCCCCCNC(C)C(C)O 7e2073068946b9d4454dc5203960e60d [0,2,0,0,0,0|0,0,2]=4 12593 B13R0.150 CC(C)C(C)CCOCCCCCF db1f27244a84de02029a13a0db44a966 [0,2,0,0,0,0|2,0,0]=4 12594 B13R0.150 CC(C)C(C)CNCCCCCCCl 57e17e1356f75d93dd06dbf0d549f593 [0,2,0,0,0,0|2,0,0]=4 12595 B13R0.150 CC(C)C(C)CNCCCCCCO 6ed45fbcd0bdcbc0c1bedce241f66384 [0,2,0,0,0,0|2,0,0]=4 12596 B13R0.150 CC(C)C(C)COCCCCCCF d4112dd8e5d0209e493db723c7d13761 [0,2,0,0,0,0|2,0,0]=4 12597 B13R0.150 CC(C)C(C)COCCCCCCS 99935fa006a683a21f9f2ef85a3bb84c [0,2,0,0,0,0|2,0,0]=4 12598 B13R0.150 CC(C)C(C)NCCCCCCCO cf1e575041583e50f2d9aa961aafc304 [0,2,0,0,0,0|2,0,0]=4 12599 B13R0.150 CC(C)C(O)CNCCCCCCF 69ed7259ee2e4226b57a5f8c7b1c5d0c [0,2,0,0,0,0|2,0,0]=4 12600 B13R0.150 CC(C)C(O)CNCCCCCCO 6f5befd0b28ccd33fbd8648408f6004b [0,2,0,0,0,0|2,0,0]=4 12601 B13R0.150 CC(C)N(C)CCCCCCCCO 60e532fdc740cc264231f55a83ec7caa [0,2,0,0,0,0|2,0,0]=4 12602 B13R0.150 CC(C)[C@@H](C)NCCCCCCCO 975ae7506826305ca32a77a067a75fee [0,2,0,0,0,0|2,0,0]=4 12603 B13R0.150 CC(C)[C@H](C)NCCCCCCCO 461b0ace54c324ebfc59a40e71a3f2c1 [0,2,0,0,0,0|2,0,0]=4 12604 B13R0.150 CC(CCCNCCCCCl)C(=O)O ef4c968bd84a96a47f68e39b6b5a99ed [0,2,0,0,0,0|2,0,0]=4 12605 B13R0.150 CC(CCCNCCCCO)C(=O)O d2831c0515a7b3826d00b415c4a2b67e [0,2,0,0,0,0|2,0,0]=4 12606 B13R0.150 CC(CCCNCCCCS)C(=O)O eea6d655ac550d16dec78e53f3e01b14 [0,2,0,0,0,0|2,0,0]=4 12607 B13R0.150 CC(CCCOCCCCF)C(=O)O cb25041974d5ad8e4475cd5e47944eed [0,2,0,0,0,0|2,0,0]=4 12608 B13R0.150 CC(CCCOCCCCS)C(=O)O d190c1636241533a6b129cb55798efb1 [0,2,0,0,0,0|2,0,0]=4 12609 B13R0.150 CC(CNCCCCCCCl)C(=O)O 99ff17a72f69dba6090ba1ef79063cdb [0,2,0,0,0,0|2,0,0]=4 12610 B13R0.150 CC(CNCCCCCCF)C(=O)O f9151c5ed56155d5220ad7987fe2258d [0,2,0,0,0,0|2,0,0]=4 12611 B13R0.150 CC(CNCCCCCCO)C(=O)O 704b913840e868c21e4f31f7c73363bd [0,2,0,0,0,0|2,0,0]=4 12612 B13R0.150 CC(COCCCCCCF)C(=O)O 2d5e0f0e990e83907d7a156216e210e6 [0,2,0,0,0,0|2,0,0]=4 12613 B13R0.150 CC(COCCCCCCS)C(=O)O 3349025727b2ebe146bd6dc85fcdd342 [0,2,0,0,0,0|2,0,0]=4 12614 B13R0.150 CC(NCCCCCCCO)C(=O)O cd67b3bdd9b465604db20b8b96861895 [0,2,0,0,0,0|2,0,0]=4 12615 B13R0.150 CC(O)C(=O)NCCCCCCCO 0a63cd2e6a618c21b25385a113d15e7e [0,2,0,0,0,0|1,0,1]=4 12616 B13R0.150 CC(O)C(C)NCCCCCCC#N efe85895a22fa82c2e40b9b58acf3ec3 [0,2,0,0,0,0|1,0,1]=4 12617 B13R0.150 CC(O)C(C)NCCCCCCC=O b9285d828fb1ef9eb29f33b443343df0 [0,2,0,0,0,0|1,0,1]=4 12618 B13R0.150 CC(O)C(C)NCCCCCCCO fd2909f072903ade266a049c50b69053 [0,2,0,0,0,0|1,0,0]=3 12619 B13R0.150 CC(O)C(C)NCCCOCCCO 9ade345ef493b261094795926aae05ca [0,2,0,0,0,0|2,0,0]=4 12620 B13R0.150 CCCCCCCCCN(C)C(=O)C 4ce46f667b929d4e88e4fb2596f1be91 [0,2,0,0,0,0|0,0,2]=4 12621 B13R0.150 CCCCCCCCCN(C)C(C)C b00990833f29c6af8dcb25a776267706 [0,2,0,0,0,0|1,0,0]=3 12622 B13R0.150 CCCCCCCCNC(=O)C(C)F 07713a6c7977a543a6db7169019fca47 [0,2,0,0,0,0|1,0,1]=4 12623 B13R0.150 CCCCCCCCNC(=O)C(C)O f185ca071ff17d7f856ab232d8c5b59e [0,2,0,0,0,0|0,0,1]=3 12624 B13R0.150 CCCCCCCCNC(=O)C(C)S f44db3dff6aa35bdda12834f9f240325 [0,2,0,0,0,0|0,1,1]=4 12625 B13R0.150 CCCCCCCCNC(=O)C(O)O 58e54bf3a84435b63072b6ff45a30dad [0,2,0,0,0,0|1,0,1]=4 12626 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)F cbf9adc913ddc642eb41ccd9d11877e4 [0,2,0,0,0,0|1,0,1]=4 12627 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)O 0ad26fd6a6b567d0bc6fda38f7af2a80 [0,2,0,0,0,0|0,0,1]=3 12628 B13R0.150 CCCCCCCCNC(=O)[C@H](C)F 6f5314c007db2d3e0c5dcdaff5b4f56f [0,2,0,0,0,0|1,0,1]=4 12629 B13R0.150 CCCCCCCCNC(=O)[C@H](C)O cfe57bc7060da09c84e60ea2a5d79103 [0,2,0,0,0,0|0,0,1]=3 12630 B13R0.150 CCCCCCCCNC(C)C(=O)C 1459bbc92e7b5f7a17fec002ab964f33 [0,2,0,0,0,0|0,0,2]=4 12631 B13R0.150 CCCCCCCCNC(C)C(=O)N e4ebda6bc259d729321b6fc987deb3ca [0,2,0,0,0,0|1,0,1]=4 12632 B13R0.150 CCCCCCCCNC(C)C(=O)O d6f8c027e017a35ea863c40c5d5e872c [0,2,0,0,0,0|1,0,0]=3 12633 B13R0.150 CCCCCCCCNC(C)C(C)C e4b0a5cc95a59bfd8fca4a016c068498 [0,2,0,0,0,0|1,0,0]=3 12634 B13R0.150 CCCCCCCCNC(C)C(C)O b62cd6976b8bc788bf42842f898deb68 [0,2,0,0,0,0|0,0,0]=2 12635 B13R0.150 CCCCCCCCNC(O)C(=O)O e546ba7c5e506f16bd015ac0879efd87 [0,2,0,0,0,0|1,0,1]=4 12636 B13R0.150 CCCCCCCCN[C@@H](C)C(=O)N bc9e8436504e86e63e9b03076c7fb73a [0,2,0,0,0,0|1,0,1]=4 12637 B13R0.150 CCCCCCCCN[C@@H](C)C(=O)O 11e9c5e9510985757cd7889be10666e1 [0,2,0,0,0,0|1,0,0]=3 12638 B13R0.150 CCCCCCCCN[C@@H](C)C(C)C ec9727ddefb605482929c69a8dd8adcb [0,2,0,0,0,0|1,0,0]=3 12639 B13R0.150 CCCCCCCCN[C@@H](C)C(F)F 82c454da402c209cd13baeb92e0db5bd [0,2,0,0,0,0|2,0,0]=4 12640 B13R0.150 CCCCCCCCN[C@H](C)C(=O)N 4687529fa34b5e1df5b0c2206425e96d [0,2,0,0,0,0|1,0,1]=4 12641 B13R0.150 CCCCCCCCN[C@H](C)C(=O)O 1a584b7f3d283b1272f089a9e087d74c [0,2,0,0,0,0|1,0,0]=3 12642 B13R0.150 CCCCCCCCN[C@H](C)C(C)C 29cd00ed59188ddf126c74f210e85c32 [0,2,0,0,0,0|1,0,0]=3 12643 B13R0.150 CCCCCCCCN[C@H](C)C(F)F 82ce868eca8d8b5e51c1494addcbbc04 [0,2,0,0,0,0|2,0,0]=4 12644 B13R0.150 CCCCCCCCOC(C)C(=O)C 8cd3dddbc051d1eac5b7c1ae3cb72370 [0,2,0,0,0,0|0,0,2]=4 12645 B13R0.150 CCCCCCCCOC(C)C(=O)N fb1c2911358bf8399a54150413405891 [0,2,0,0,0,0|1,0,1]=4 12646 B13R0.150 CCCCCCCCOC(C)C(=O)O a716d333fb0c41371267c962cbd1e272 [0,2,0,0,0,0|1,0,0]=3 12647 B13R0.150 CCCCCCCCOC(C)C(C)C 88a2f38ef2bf07f6003d14ae5348c908 [0,2,0,0,0,0|1,0,0]=3 12648 B13R0.150 CCCCCCCCOC(C)C(C)S 2f75ef7ce0010b57bd153d2ecdc3831c [0,2,0,0,0,0|0,1,0]=3 12649 B13R0.150 CCCCCCCCOC(C)C(F)F 448b2bf28879318580449bf81f654e13 [0,2,0,0,0,0|2,0,0]=4 12650 B13R0.150 CCCCCCCCOC(F)C(=O)O ac3e41ebc8f39d3691b31a06758489ae [0,2,0,0,0,0|1,0,1]=4 12651 B13R0.150 CCCCCCCCO[C@@H](C)C(=O)N 489257109e9c334c82869eaa66d92ba2 [0,2,0,0,0,0|1,0,1]=4 12652 B13R0.150 CCCCCCCCO[C@@H](C)C(=O)O 9b78cd33b9e14c788888377db6793d99 [0,2,0,0,0,0|1,0,0]=3 12653 B13R0.150 CCCCCCCCO[C@@H](C)C(C)C 443b42cd67532f3225e1483b0161e8a4 [0,2,0,0,0,0|1,0,0]=3 12654 B13R0.150 CCCCCCCCO[C@@H](F)C(=O)O 42464b0788ea66d7d3ff94e507967e5e [0,2,0,0,0,0|1,0,1]=4 12655 B13R0.150 CCCCCCCCO[C@H](C)C(=O)N d57262cfbd0a8b535e7aae105c971af7 [0,2,0,0,0,0|1,0,1]=4 12656 B13R0.150 CCCCCCCCO[C@H](C)C(=O)O 3e6aed0c549b4e4b0ed51f9f9d86fe45 [0,2,0,0,0,0|1,0,0]=3 12657 B13R0.150 CCCCCCCCO[C@H](C)C(C)C 6c982c4a0cdedea49ed9fdee94cd4e55 [0,2,0,0,0,0|1,0,0]=3 12658 B13R0.150 CCCCCCCNCC(=O)C(C)C 12f148f9a4570d4c8ffe36540439cda7 [0,2,0,0,0,0|1,0,1]=4 12659 B13R0.150 CCCCCCCNCC(C)C(=O)O 8fae718df4f726dec88ceff796d9e3f2 [0,2,0,0,0,0|1,0,0]=3 12660 B13R0.150 CCCCCCCNCC(C)C(C)C 2cca3233befb272c58e81b21c957f108 [0,2,0,0,0,0|1,0,0]=3 12661 B13R0.150 CCCCCCCNCC(C)N(C)C a271ec647ec322bd9d0287db42e96370 [0,2,0,0,0,0|2,0,0]=4 12662 B13R0.150 CCCCCCCNCC(F)C(=O)O cb164482781e5eaee0bf7a307b0b488f [0,2,0,0,0,0|1,0,1]=4 12663 B13R0.150 CCCCCCCNCC(O)C(=O)O 292bb8647835e1f860f4cb5d50d8f66f [0,2,0,0,0,0|1,0,1]=4 12664 B13R0.150 CCCCCCCNCC(O)C(C)C 9db0b0a7ec73de1da64839249cb714c0 [0,2,0,0,0,0|1,0,0]=3 12665 B13R0.150 CCCCCCCNCC(O)C(F)F 58078c89c90b221bd9d62fb2fba471fc [0,2,0,0,0,0|1,0,0]=3 12666 B13R0.150 CCCCCCCNC[C@@H](C)C(=O)O caf085d52da9e90d96a4bce72dd420c3 [0,2,0,0,0,0|1,0,0]=3 12667 B13R0.150 CCCCCCCNC[C@@H](O)C(=O)O 3111ea96af3c7259c2c3091e1aa2fa02 [0,2,0,0,0,0|1,0,1]=4 12668 B13R0.150 CCCCCCCNC[C@H](C)C(=O)O 07ee835fc48175fd2eb4608811fc5a6c [0,2,0,0,0,0|1,0,0]=3 12669 B13R0.150 CCCCCCCNC[C@H](O)C(=O)O b475f6f9855425df956a3f3e3ea1ce80 [0,2,0,0,0,0|1,0,1]=4 12670 B13R0.150 CCCCCCCOCC(=O)C(C)C 5025f96df0e4ff1d439f24c95a8b92ef [0,2,0,0,0,0|1,0,1]=4 12671 B13R0.150 CCCCCCCOCC(C)C(=O)C db03c1e910e53f26bdaea57c8ac89903 [0,2,0,0,0,0|0,0,2]=4 12672 B13R0.150 CCCCCCCOCC(C)C(=O)O 63fc77a9f95e574aeaf922188d62d9f3 [0,2,0,0,0,0|1,0,0]=3 12673 B13R0.150 CCCCCCCOCC(C)C(C)C 52854ec4d67eecf224e58b0761b0e870 [0,2,0,0,0,0|1,0,0]=3 12674 B13R0.150 CCCCCCCOCC(C)N(C)C ac384760f3690501f5798a3533aad1b7 [0,2,0,0,0,0|2,0,0]=4 12675 B13R0.150 CCCCCCCOCC(C)[N+](=O)[O-] 6f694f22d470ff96afef76e15dbd314d [0,2,0,0,0,0|1,0,1]=4 12676 B13R0.150 CCCCCCCOC[C@@H](C)C(=O)O 99f3bb8c28e5646c045c65e0194a920b [0,2,0,0,0,0|1,0,0]=3 12677 B13R0.150 CCCCCCCOC[C@@H](C)N(C)C f301d3cbe06e64a8fb770db6ed87857a [0,2,0,0,0,0|2,0,0]=4 12678 B13R0.150 CCCCCCCOC[C@H](C)C(=O)O b6cdd13af5729a0209f9601268c3f1cb [0,2,0,0,0,0|1,0,0]=3 12679 B13R0.150 CCCCCCCOC[C@H](C)N(C)C 02d5f77bbb5db512e7530c8616cfe919 [0,2,0,0,0,0|2,0,0]=4 12680 B13R0.150 CCCCCCNCCC(C)N(C)C ed4a50037dbe28ed1ef335ccce57cdb7 [0,2,0,0,0,0|2,0,0]=4 12681 B13R0.150 CCCCCCNCCC(F)C(=O)O f55a1e4c0034f19c1e0afc74baac971f [0,2,0,0,0,0|1,0,1]=4 12682 B13R0.150 CCCCCCNCCC(O)C(=O)O f191f5a2f362f13d4ab7448ee969fba1 [0,2,0,0,0,0|1,0,1]=4 12683 B13R0.150 CCCCCCNCCN(C)C(C)C 5635f48fe1767a27f9747daece394ac9 [0,2,0,0,0,0|2,0,0]=4 12684 B13R0.150 CCCCCCNCC[C@@H](C)N(C)C 6913029f5d3140bcd314ee2de6a05c3c [0,2,0,0,0,0|2,0,0]=4 12685 B13R0.150 CCCCCCNCC[C@H](C)N(C)C fd97285901c0a302fd36659baae37cda [0,2,0,0,0,0|2,0,0]=4 12686 B13R0.150 CCCCCCNCC[C@H](O)C(=O)O ffd07623f824e77dd96930c0f6d57bec [0,2,0,0,0,0|1,0,1]=4 12687 B13R0.150 CCCCCCOCCC(C)C(C)C 166475d6cffbf643687eebb792f03db2 [0,2,0,0,0,0|1,0,0]=3 12688 B13R0.150 CCCCCCOCCC(C)N(C)C c28a84316fc483b0b0dae0430f79ca08 [0,2,0,0,0,0|2,0,0]=4 12689 B13R0.150 CCCCCNCCCC(C)C(=O)O 688463c2404f39b11301b956735ec733 [0,2,0,0,0,0|1,0,0]=3 12690 B13R0.150 CCCCCOCCCC(C)C(=O)O eee1f42447d71872ede78795a01692d0 [0,2,0,0,0,0|1,0,0]=3 12691 B13R0.150 CCCCCOCCOC(C)C(=O)O 0b16b7613627a4f0b7f6b4ebb73392a3 [0,2,0,0,0,0|2,0,0]=4 12692 B13R0.150 CCCCCOCCOC(C)C(C)C 5237a4b47778ab9b8246bf79da417610 [0,2,0,0,0,0|2,0,0]=4 12693 B13R0.150 CCCCCOCCO[C@@H](C)C(=O)O db87f3ffe4de4ceb5acf3ef76e6dadc8 [0,2,0,0,0,0|2,0,0]=4 12694 B13R0.150 CCCCCOCCO[C@H](C)C(=O)O ba36aceb19f2e6b1b02f9c28b0bb5504 [0,2,0,0,0,0|2,0,0]=4 12695 B13R0.150 CCCCNCCSCC(C)C(=O)O a85dca0ea3ea7fb2dc1c79d90babbad8 [0,2,0,0,0,0|2,0,0]=4 12696 B13R0.150 CCCCOCCCNC(=O)C(C)O 05a3e621c8cf6118d6bea03fdae68a46 [0,2,0,0,0,0|1,0,1]=4 12697 B13R0.150 CCCCOCCCNC(=O)[C@@H](C)O 9180bd3f09a6d6daedea754fbe6fa466 [0,2,0,0,0,0|1,0,1]=4 12698 B13R0.150 CCCCOCCCNC(=O)[C@H](C)O 44084305da0666dd316f94c404839c08 [0,2,0,0,0,0|1,0,1]=4 12699 B13R0.150 CCCCOCCCNC(C)C(=O)O fffe24a3ad43eabb4eed239be4444feb [0,2,0,0,0,0|2,0,0]=4 12700 B13R0.150 CCCCOCCCNC(C)C(C)C ca34ea39ed1d59cdb4d27aea71871f96 [0,2,0,0,0,0|2,0,0]=4 12701 B13R0.150 CCCCOCCCN[C@@H](C)C(=O)O e49f2e1558acc942d0d7f2f177353f89 [0,2,0,0,0,0|2,0,0]=4 12702 B13R0.150 CCCCOCCCN[C@H](C)C(=O)O fd4a732b8d6ea3404077107024615eda [0,2,0,0,0,0|2,0,0]=4 12703 B13R0.150 CCCCOCCCOC(C)C(C)C ccc63e146c8ef7250fbeac64f5b8369b [0,2,0,0,0,0|2,0,0]=4 12704 B13R0.150 CCCCOCCNCC(C)C(=O)O b12ec01b111292fad8e8363cb2229cbe [0,2,0,0,0,0|2,0,0]=4 12705 B13R0.150 CCCCOCCNCC(C)C(C)C 19a9200642982602d879a63f060966c9 [0,2,0,0,0,0|2,0,0]=4 12706 B13R0.150 CCCCOCCNCC(O)C(C)C 6902e8280081d77a0054fafd53350a82 [0,2,0,0,0,0|2,0,0]=4 12707 B13R0.150 CCCCOCCNCC(O)C(F)F 28a9507aae49c57c78e2c6b1472c433a [0,2,0,0,0,0|2,0,0]=4 12708 B13R0.150 CCCCOCCNC[C@@H](C)C(=O)O 8a15e25f8f6e2fd6f2715196bc720e1d [0,2,0,0,0,0|2,0,0]=4 12709 B13R0.150 CCCCOCCNC[C@H](C)C(=O)O 20d98449107c2b6698428165d22f9b2e [0,2,0,0,0,0|2,0,0]=4 12710 B13R0.150 CCCCOCCOCC(C)C(=O)O ec831a5cdf447ac506e039bc6e54cd00 [0,2,0,0,0,0|2,0,0]=4 12711 B13R0.150 CCCCOCCOCC(C)C(C)C be38b91e4b42c6c94a924ba249eb85dc [0,2,0,0,0,0|2,0,0]=4 12712 B13R0.150 CCCCOCCOC[C@@H](C)C(=O)O e2ed40b3a7ef7b1e21e5c32a0a476f95 [0,2,0,0,0,0|2,0,0]=4 12713 B13R0.150 CCCCOCCOC[C@H](C)C(=O)O e78f352064beea09f266d8a97f34ffa4 [0,2,0,0,0,0|2,0,0]=4 12714 B13R0.150 CCCCOCOCCC(C)C(C)C bce196c2d3bedbdb6f6761defe1f9f0e [0,2,0,0,0,0|2,0,0]=4 12715 B13R0.150 CCCCSCCOCC(C)C(=O)O de4af2e5666a0754e8c18da6ed89f3ce [0,2,0,0,0,0|2,0,0]=4 12716 B13R0.150 CCCCSCCOCC(C)C(C)C 5b9118d10e5772296b70920a8354d9de [0,2,0,0,0,0|2,0,0]=4 12717 B13R0.150 CCCOCCCNCC(C)C(=O)O cbecb0ba058558a61f8958efc9b2d17b [0,2,0,0,0,0|2,0,0]=4 12718 B13R0.150 CCCOCCCNCC(C)C(C)C e14ea778e71761be0e42919f00391542 [0,2,0,0,0,0|2,0,0]=4 12719 B13R0.150 CCCOCCCNCC(O)C(C)C 1748d1131f1fb17c04883d9b223dcc33 [0,2,0,0,0,0|2,0,0]=4 12720 B13R0.150 CCCOCCCNCC(O)C(F)F ddbc453c126d864e65fc4e4e5c57d6e1 [0,2,0,0,0,0|2,0,0]=4 12721 B13R0.150 CCCOCCCNC[C@@H](C)C(=O)O 0cd80c94e93298138ecc3de1c0641e52 [0,2,0,0,0,0|2,0,0]=4 12722 B13R0.150 CCCOCCCNC[C@H](C)C(=O)O 6828393ec8f3a7acf80e2f53cd457044 [0,2,0,0,0,0|2,0,0]=4 12723 B13R0.150 CCCOCCCOCC(C)C(=O)O fae363b7487cf52a9afb16d52f664bae [0,2,0,0,0,0|2,0,0]=4 12724 B13R0.150 CCCOCCCOCC(C)C(C)C 4576173a4fa5c1a33d91c263897166dd [0,2,0,0,0,0|2,0,0]=4 12725 B13R0.150 CCCOCCCOC[C@@H](C)C(=O)O f7cd39b38ea93f41302543bd42ca39d3 [0,2,0,0,0,0|2,0,0]=4 12726 B13R0.150 CCCOCCCOC[C@H](C)C(=O)O a9c80cfdb3d9b9f7c6663b500844d097 [0,2,0,0,0,0|2,0,0]=4 12727 B13R0.150 CCCOCCOCCC(C)C(C)C 12d14997cd9195f943729f37c8206a2d [0,2,0,0,0,0|2,0,0]=4 12728 B13R0.150 CCCSCCCCNC(=O)C(C)O e3234c07772f3a7e389fedde318b6e86 [0,2,0,0,0,0|1,0,1]=4 12729 B13R0.150 CCCSCCCCNC(=O)[C@@H](C)O 785a209803713b5e04e071f246a8b873 [0,2,0,0,0,0|1,0,1]=4 12730 B13R0.150 CCCSCCCCNC(=O)[C@H](C)O 4df59a116dee4fbdcfa827dd01ffa91b [0,2,0,0,0,0|1,0,1]=4 12731 B13R0.150 CCCSCCCCNC(C)C(C)C 0ad3ace271946bf1a81ce8b330e57881 [0,2,0,0,0,0|2,0,0]=4 12732 B13R0.150 CCOCCCOCCC(C)C(C)C 72b126433757cf7ebeacf1eb0144c8c8 [0,2,0,0,0,0|2,0,0]=4 12733 B13R0.150 CCOCCNCCCC(C)C(=O)O b52f17e0799c9eb9c7353a88daa2b09b [0,2,0,0,0,0|2,0,0]=4 12734 B13R0.150 CCOCCOCCCC(C)C(=O)O 46f0c7e8a9d6a3d88c5d2a4727ac3f2b [0,2,0,0,0,0|2,0,0]=4 12735 B13R0.150 CCOCCOCCNC(C)C(C)O 949ffd098a0dc271286ecb6376af409f [0,2,0,0,0,0|2,0,0]=4 12736 B13R0.150 CCSCCCCNCC(C)C(=O)O 13045afe6caf948f6e9fb778df1d4789 [0,2,0,0,0,0|2,0,0]=4 12737 B13R0.150 CCSCCCCNCC(C)C(C)C 8519a2360035dffe3a3dd8b2f638274d [0,2,0,0,0,0|2,0,0]=4 12738 B13R0.150 CCSCCCCNCC(O)C(F)F 80343318cc9394c5585fc9c05f6bb919 [0,2,0,0,0,0|2,0,0]=4 12739 B13R0.150 CCSCCCOCCC(C)C(C)C 30adb9f0139d194753bfbc1982cb30e7 [0,2,0,0,0,0|2,0,0]=4 12740 B13R0.150 CCSCCNCCCC(C)C(=O)O 661815e576aa6474fa5d63973ed091ab [0,2,0,0,0,0|2,0,0]=4 12741 B13R0.150 CCSCCOCCCC(C)C(=O)O f1758d56bb602d352106aad6fdff3604 [0,2,0,0,0,0|2,0,0]=4 12742 B13R0.150 COCCCCCCNC(C)C(=O)O a18eab3b74be6d1788b609a6b3bdeee0 [0,2,0,0,0,0|2,0,0]=4 12743 B13R0.150 COCCCCCCNC(C)C(C)C 8f72b5927a770b90f1831e4a2dd96d49 [0,2,0,0,0,0|2,0,0]=4 12744 B13R0.150 COCCCCCCNC(C)C(C)O 317c30f4dbf7cbb0395fce893583f1de [0,2,0,0,0,0|1,0,0]=3 12745 B13R0.150 COCCCCCCN[C@@H](C)C(=O)O 271893d1741e5305aa84b2a1b7d906cf [0,2,0,0,0,0|2,0,0]=4 12746 B13R0.150 COCCCCCCN[C@@H](C)C(C)C b9255ea3bbae8415fd55ce7ade8508fb [0,2,0,0,0,0|2,0,0]=4 12747 B13R0.150 COCCCCCCN[C@H](C)C(=O)O 1e9e1aa7d73b2829047bbad9601f6668 [0,2,0,0,0,0|2,0,0]=4 12748 B13R0.150 COCCCCCCN[C@H](C)C(C)C 3c13a1593cfc9c910d0a0abd176ab81c [0,2,0,0,0,0|2,0,0]=4 12749 B13R0.150 COCCCCCCOC(C)C(=O)O 11ffba4f0403134e09bdae1088d0f9b4 [0,2,0,0,0,0|2,0,0]=4 12750 B13R0.150 COCCCCCCOC(C)C(C)C 3a70c1ce51443d24ab94d35ebc9376aa [0,2,0,0,0,0|2,0,0]=4 12751 B13R0.150 COCCCCCCOC(C)C(C)S cfad8b2079e7675abb441f9ec296efc1 [0,2,0,0,0,0|1,1,0]=4 12752 B13R0.150 COCCCCCCO[C@@H](C)C(=O)O d48e4afbca6c0595c8562f4c165cb99f [0,2,0,0,0,0|2,0,0]=4 12753 B13R0.150 COCCCCCCO[C@@H](C)C(C)C 64b6b8907c91dc953cdef853e919e4c1 [0,2,0,0,0,0|2,0,0]=4 12754 B13R0.150 COCCCCCCO[C@H](C)C(=O)O 27be50c81349571ee5f841ed815bc81e [0,2,0,0,0,0|2,0,0]=4 12755 B13R0.150 COCCCCCCO[C@H](C)C(C)C 7f9be5a7c65aac167f5c87870f917f46 [0,2,0,0,0,0|2,0,0]=4 12756 B13R0.150 COCCCCCNCC(C)C(=O)O 39babc9f573719f91674e83f7c6c3c97 [0,2,0,0,0,0|2,0,0]=4 12757 B13R0.150 COCCCCCNCC(C)C(C)C 01217afc0c529d9feac05f806f4df522 [0,2,0,0,0,0|2,0,0]=4 12758 B13R0.150 COCCCCCNCC(O)C(C)C 31a4f66a4bca2d15681bae3e0ec62d26 [0,2,0,0,0,0|2,0,0]=4 12759 B13R0.150 COCCCCCNCC(O)C(F)F 01af9082d5ffde416f6c9099ebc42acf [0,2,0,0,0,0|2,0,0]=4 12760 B13R0.150 COCCCCCNC[C@@H](C)C(=O)O 9a878670967f4705ba28e4facdc590a2 [0,2,0,0,0,0|2,0,0]=4 12761 B13R0.150 COCCCCCNC[C@H](C)C(=O)O 58f88e5d6b1da309c713143ecf45c497 [0,2,0,0,0,0|2,0,0]=4 12762 B13R0.150 COCCCCCOCC(C)C(=O)O ff7da287faf858ca64bc4ec425c1e69c [0,2,0,0,0,0|2,0,0]=4 12763 B13R0.150 COCCCCCOCC(C)C(C)C 0603c50ba04005a2d21c9e9ffe0d5b2f [0,2,0,0,0,0|2,0,0]=4 12764 B13R0.150 COCCCCCOC[C@@H](C)C(=O)O 138624d1b36fc9905cc0f824457c827d [0,2,0,0,0,0|2,0,0]=4 12765 B13R0.150 COCCCCCOC[C@H](C)C(=O)O c9f9535806f195f6449f37e12ada799e [0,2,0,0,0,0|2,0,0]=4 12766 B13R0.150 COCCCCOCCC(C)C(C)C 0e8d0089b30268f54967bd1f5cb40a2b [0,2,0,0,0,0|2,0,0]=4 12767 B13R0.150 COCCCNCCCC(C)C(=O)O 56e2c8ca5b7b405721bba67889b1e02f [0,2,0,0,0,0|2,0,0]=4 12768 B13R0.150 COCCCOCCCC(C)C(=O)O 8028ebbe4f4bce82d7cb431a2a1b5d53 [0,2,0,0,0,0|2,0,0]=4 12769 B13R0.150 COCCOCCCNC(C)C(C)O 2e88910fdb960c54bf6aa817e7a9cd8e [0,2,0,0,0,0|2,0,0]=4 12770 B13R0.150 CSCCCNCCCC(C)C(=O)O 9f4a4b17bf2d8daf106875e161d5b33d [0,2,0,0,0,0|2,0,0]=4 12771 B13R0.150 CSCCCOCCCC(C)C(=O)O d52b6580064a3e9c9146e8d36de4283d [0,2,0,0,0,0|2,0,0]=4 12772 B13R0.150 C[C@@H](CNCCCCCCF)C(=O)O 36da831bbd1db4e23392551891fff8c9 [0,2,0,0,0,0|2,0,0]=4 12773 B13R0.150 C[C@@H](CNCCCCCCO)C(=O)O 637eedfaac436abf77f1f20c0f77a2cd [0,2,0,0,0,0|2,0,0]=4 12774 B13R0.150 C[C@@H](COCCCCCCF)C(=O)O 513ef0df6e83616857d309adef72e8d7 [0,2,0,0,0,0|2,0,0]=4 12775 B13R0.150 C[C@@H](NCCCCCCCO)C(=O)O e5e6892210e6f2d6c78d604a2bf09c7e [0,2,0,0,0,0|2,0,0]=4 12776 B13R0.150 C[C@@H](O)C(=O)NCCCCCCCO 0ac15fad8b7f7c5793b4d0f31167519d [0,2,0,0,0,0|1,0,1]=4 12777 B13R0.150 C[C@H](CNCCCCCCF)C(=O)O 64b16c48a4acd5c826da7982b00f0127 [0,2,0,0,0,0|2,0,0]=4 12778 B13R0.150 C[C@H](CNCCCCCCO)C(=O)O f48163bca3f92743e9eeb0dc119dc8d1 [0,2,0,0,0,0|2,0,0]=4 12779 B13R0.150 C[C@H](COCCCCCCF)C(=O)O 566bfeb5f5f192229b86d2550a8e5295 [0,2,0,0,0,0|2,0,0]=4 12780 B13R0.150 C[C@H](NCCCCCCCO)C(=O)O ec72f1fe9561b477e8ca8bfa4feab27b [0,2,0,0,0,0|2,0,0]=4 12781 B13R0.150 C[C@H](O)C(=O)NCCCCCCCO 6eb3af4c83d74ac3345456e43244b979 [0,2,0,0,0,0|1,0,1]=4 12782 B13R0.150 OC(CNCCCCCCCl)C(F)F 1c3575d1eac65177463ba71e0ba71696 [0,2,0,0,0,0|2,0,0]=4 12783 B13R0.150 OC(CNCCCCCCF)C(F)F c0ea7da8f056f66b38d2fd8747d42872 [0,2,0,0,0,0|2,0,0]=4 12784 B13R0.150 OCCCCCCNCC(O)C(F)F 39b258cd1d06999257c02c3501feecc2 [0,2,0,0,0,0|2,0,0]=4 12785 B13R0.154 C#CCCCCCN(C)CCC(C)O d8afb395111d0b4db3635e22da5a9369 [0,2,0,0,0,0|0,0,2]=4 12786 B13R0.154 C=C(C)CCN(C)CCCCCCC 9af44fb5eee082952e59c85fa9dccdaa [0,2,0,0,0,0|1,0,1]=4 12787 B13R0.154 C=C(C)CN[C@@H](C)CCCCCCC ce545fbd54f31cc8fd8c842eea477644 [0,2,0,0,0,0|1,0,1]=4 12788 B13R0.154 C=C(C)COC(C)CCCCCCC 9052ab673f6f75bb8d98c1e1e2e0f6ba [0,2,0,0,0,0|1,0,1]=4 12789 B13R0.154 C=CCCCCCN(C)CCC(C)O 5e026ce2d435e19d0a149c3151e5e12e [0,2,0,0,0,0|0,0,2]=4 12790 B13R0.154 CC(C)CCC(C)CNCCCCCl 52ff8a1577401aa95211a0640076ad17 [0,2,0,0,0,0|2,0,0]=4 12791 B13R0.154 CC(C)CCC(C)CNCCCCO 3791256eecc4109d1dab1b8513317d32 [0,2,0,0,0,0|2,0,0]=4 12792 B13R0.154 CC(C)CCC(C)CNCCCCS e1ad23d75e632dae26b2f1f3f40eaca4 [0,2,0,0,0,0|2,0,0]=4 12793 B13R0.154 CC(C)CCC(C)COCCCCF 96b84043d2c3ea3e33c6f31f0a685b55 [0,2,0,0,0,0|2,0,0]=4 12794 B13R0.154 CC(C)CCC(C)COCCCCS bd8d354a24bf94c494872e5aa3c0a042 [0,2,0,0,0,0|2,0,0]=4 12795 B13R0.154 CC(C)CCC(C)NCCCCCCl 4d6b6b85df6b6c3e332175a62c2c14b0 [0,2,0,0,0,0|2,0,0]=4 12796 B13R0.154 CC(C)CCC(C)NCCCCCF 86d1f8e8b89dfe94bacf2c23d39004a5 [0,2,0,0,0,0|2,0,0]=4 12797 B13R0.154 CC(C)CCC(C)NCCCCCO 268d86b93738abd86182dd326c3fe4bb [0,2,0,0,0,0|2,0,0]=4 12798 B13R0.154 CC(C)CCC(C)OCCCCCF a9160c05d15f18416eeb1ba88247c171 [0,2,0,0,0,0|2,0,0]=4 12799 B13R0.154 CC(C)CCN(C)CCCCCCF 48555b8257aef8147e3813140b4d1998 [0,2,0,0,0,0|2,0,0]=4 12800 B13R0.154 CC(C)CCN(C)CCCCCCO aa33717e7eaedfb681588791bc3b7ba6 [0,2,0,0,0,0|2,0,0]=4 12801 B13R0.154 CC(O)CCC(=O)NCCCCCCl c085ab1262c06eae9f125a4ba1874901 [0,2,0,0,0,0|1,0,1]=4 12802 B13R0.154 CC(O)CCC(=O)NCCCCCO 3e7d2a9d8a3379846d7ef8a94e4153de [0,2,0,0,0,0|1,0,1]=4 12803 B13R0.154 CC(O)CCN(C)CCCCCC#N 08b64b7472225e3c31175f3f9d05caa8 [0,2,0,0,0,0|1,0,1]=4 12804 B13R0.154 CC(O)CCN(C)CCCCCC=O 69cf865cf99d1a4f4fd17daa8db7a36e [0,2,0,0,0,0|1,0,1]=4 12805 B13R0.154 CC(O)CCN(C)CCCCCCF ff4b89756e2af2b44cd152647d8975e7 [0,2,0,0,0,0|1,0,0]=3 12806 B13R0.154 CC(O)CCN(C)CCCCCCO 3c21fc1dee6bf58cf88054edc7250f96 [0,2,0,0,0,0|1,0,0]=3 12807 B13R0.154 CC(O)CNC(=O)CCCCCCF 5424099043665a4526151d26a518976c [0,2,0,0,0,0|1,0,1]=4 12808 B13R0.154 CC(O)CNC(=O)CCCCCCO cb046afa67ab99b71ae85272e7b39f4b [0,2,0,0,0,0|1,0,1]=4 12809 B13R0.154 CC(O)CNC(=O)CCCCCCS 9fc9126c6b4a3d402b202de498f93e9e [0,2,0,0,0,0|1,0,1]=4 12810 B13R0.154 CCCC/C=C/CN(C)CCC(C)O 7fa874989f46d5c336e9b1808c4daf28 [0,2,0,0,0,0|0,0,2]=4 12811 B13R0.154 CCCC/C=C\CN(C)CCC(C)O cffe3f2bee3ec664e031ed370e78b9a1 [0,2,0,0,0,0|0,0,2]=4 12812 B13R0.154 CCCCCCCC(=O)NCC(C)C d825ac6cd38055a6a285254f1c1cf68c [0,2,0,0,0,0|1,0,1]=4 12813 B13R0.154 CCCCCCCC(=O)NCC(C)O 15b12f6480198cd69becce71f6b27fd3 [0,2,0,0,0,0|0,0,1]=3 12814 B13R0.154 CCCCCCCC(=O)NC[C@@H](C)O 9b821dbc8c2413833fde4cee62ab6eec [0,2,0,0,0,0|0,0,1]=3 12815 B13R0.154 CCCCCCCC(=O)NC[C@H](C)O 7079c43b3a87debffb9f2e06e6894187 [0,2,0,0,0,0|0,0,1]=3 12816 B13R0.154 CCCCCCCC(C)COC(C)C 2c1a29cb9c1136d9b60eecc72a686ffa [0,2,0,0,0,0|1,0,0]=3 12817 B13R0.154 CCCCCCCC(C)OCC(=O)O 1ae5d9b72f4d57d4439a54b928da9274 [0,2,0,0,0,0|1,0,1]=4 12818 B13R0.154 CCCCCCCC(C)OCC(C)C 470cd95b435228009396ce408eb28340 [0,2,0,0,0,0|1,0,0]=3 12819 B13R0.154 CCCCCCCC(C)OCC(F)F 4aab5e970f46df0711861521a2765044 [0,2,0,0,0,0|2,0,0]=4 12820 B13R0.154 CCCCCCCC(C)OCN(C)C a7685d7dd3ebebe650d840e354fe52d8 [0,2,0,0,0,0|2,0,0]=4 12821 B13R0.154 CCCCCCCN(C)CCC(=O)C 0cb8f34ff1125519044a034383fe5343 [0,2,0,0,0,0|0,0,2]=4 12822 B13R0.154 CCCCCCCN(C)CCC(=O)O 0729fda7a278c705196a35fd75ccfa11 [0,2,0,0,0,0|1,0,1]=4 12823 B13R0.154 CCCCCCCN(C)CCC(C)C ec736bc8338cdb433312a9318f6f3c71 [0,2,0,0,0,0|1,0,0]=3 12824 B13R0.154 CCCCCCCN(C)CCC(C)O 6c466d2fe15c8d348a363f80f4bd1087 [0,2,0,0,0,0|0,0,0]=2 12825 B13R0.154 CCCCCCCN(C)CCC(F)F 9c4535c0f319d247fac1a2a065d208ab [0,2,0,0,0,0|2,0,0]=4 12826 B13R0.154 CCCCCCCN(C)CCN(C)C e2987d60eb90563817612190fb04ebca [0,2,0,0,0,0|2,0,0]=4 12827 B13R0.154 CCCCCCCN(C)CCS(=O)C a408a8e96a96724bd0b5ca00904bf3fd [0,2,0,0,0,0|1,0,1]=4 12828 B13R0.154 CCCCCCCN(C)COC(C)C 38658027dad8b2169302c852f4b466da [0,2,0,0,0,0|2,0,0]=4 12829 B13R0.154 CCCCCCC[C@H](C)NCC(=O)O 9e1e45c318b05b14bec31e33d52f4e68 [0,2,0,0,0,0|1,0,1]=4 12830 B13R0.154 CCCCCCC[C@H](C)NCC(C)C 3ae966d2021c1c0e67c0253ab9e298f7 [0,2,0,0,0,0|1,0,0]=3 12831 B13R0.154 CCCCCCC[C@H](C)NCC(C)O 00616b1dc9653066bcef139dcc0d6418 [0,2,0,0,0,0|0,0,0]=2 12832 B13R0.154 CCCCCCC[C@H](C)NCC(F)F 556b6685273853e265ce5f25b3fdc63b [0,2,0,0,0,0|2,0,0]=4 12833 B13R0.154 CCCCCCC[C@H](C)NCN(C)C c1bd93417680338423d59c4d54e2b74d [0,2,0,0,0,0|2,0,0]=4 12834 B13R0.154 CCCCCCC[C@H](C)NC[C@@H](C)O bbfbef1ee9403742d79e7578fcb49e74 [0,2,0,0,0,0|0,0,0]=2 12835 B13R0.154 CCCCCCC[C@H](C)NC[C@H](C)O 01e536d648ccae417b04762758da853a [0,2,0,0,0,0|0,0,0]=2 12836 B13R0.154 CCCCCCNC(=O)CCC(C)C 7f6d618c5aff4af5e3147258c5d62a2b [0,2,0,0,0,0|1,0,1]=4 12837 B13R0.154 CCCCCCNC(=O)CCC(C)O 43fea56a6d1b59daba80a7faaa98236f [0,2,0,0,0,0|0,0,1]=3 12838 B13R0.154 CCCCCCNC(=O)CCC(C)S 033b15bf7830ebe6370d0768c729357a [0,2,0,0,0,0|0,1,1]=4 12839 B13R0.154 CCCCCCNC(=O)CC[C@H](C)S 6e4d08e7e0b05fd203eb77b6cf931e49 [0,2,0,0,0,0|0,1,1]=4 12840 B13R0.154 CCCCCCNC(=O)NCC(C)O e8332d6b0b4907d2485be107049bd85e [0,2,0,0,0,0|1,0,1]=4 12841 B13R0.154 CCCCCCNC(=O)NC[C@@H](C)O f30e1e3738ee1427926087738ec31ff5 [0,2,0,0,0,0|1,0,1]=4 12842 B13R0.154 CCCCCCNC(=O)NC[C@H](C)O faac69a72af13792293159e14a2572b2 [0,2,0,0,0,0|1,0,1]=4 12843 B13R0.154 CCCCCCNC(=S)NCC(C)O c475356dd196b40cb5b046e30c7ce4d0 [0,2,0,0,0,0|1,0,1]=4 12844 B13R0.154 CCCCCCNC(=S)NC[C@@H](C)O 7a2769d1ca443a7b0646abfcde1c1b66 [0,2,0,0,0,0|1,0,1]=4 12845 B13R0.154 CCCCCCNC(=S)NC[C@H](C)O 1f41cd1313a3f5f4aa19fe4415a13086 [0,2,0,0,0,0|1,0,1]=4 12846 B13R0.154 CCCCCCNC(C)CCC(=O)O 0fe521212c707af72f224b8db3351481 [0,2,0,0,0,0|1,0,1]=4 12847 B13R0.154 CCCCCCNC(C)CCC(C)C d43f58d75e7c3a6b9208af758bb0ba6e [0,2,0,0,0,0|1,0,0]=3 12848 B13R0.154 CCCCCCNC(C)CCN(C)C ec82ef92107a2d729ac8a1ff425a577f [0,2,0,0,0,0|2,0,0]=4 12849 B13R0.154 CCCCCCN[C@@H](C)CCC(=O)O eaa55d56af0939019681b6e70deb2865 [0,2,0,0,0,0|1,0,1]=4 12850 B13R0.154 CCCCCCN[C@@H](C)CCN(C)C 63c1759ab40b40e473a4a93503b62904 [0,2,0,0,0,0|2,0,0]=4 12851 B13R0.154 CCCCCCN[C@H](C)CCN(C)C fd1f413dcc1b871568784e114b27109d [0,2,0,0,0,0|2,0,0]=4 12852 B13R0.154 CCCCCCOC(C)CCC(=O)O 432a920140873079061a0a02d1212975 [0,2,0,0,0,0|1,0,1]=4 12853 B13R0.154 CCCCCCOC(C)CCC(C)C a309034b12272365873a41b2fb8f82cf [0,2,0,0,0,0|1,0,0]=3 12854 B13R0.154 CCCCCCOC(C)CCN(C)C 00ffa645dea9158a3fe214431962f6c8 [0,2,0,0,0,0|2,0,0]=4 12855 B13R0.154 CCCCCCOC(C)COC(C)C f5ab5b5aede273953def256e715d5842 [0,2,0,0,0,0|2,0,0]=4 12856 B13R0.154 CCCCCCO[C@@H](C)COC(C)C 3ccbdeeb26c1a172afb90349bac7f729 [0,2,0,0,0,0|2,0,0]=4 12857 B13R0.154 CCCCCNCC(C)CCC(C)C 3794876c6b5c46c22f3d23f344b276ab [0,2,0,0,0,0|1,0,0]=3 12858 B13R0.154 CCCCCNCC(O)COC(C)C 37806bb17c2d089f143ce2aa65a3d70a [0,2,0,0,0,0|2,0,0]=4 12859 B13R0.154 CCCCCOCC(C)CCC(C)C 5b4d1d052984d67badfa0a235e66a70f [0,2,0,0,0,0|1,0,0]=3 12860 B13R0.154 CCCCOCCC(=O)NCC(C)O 2acba14b3cd5086242af3725008874b8 [0,2,0,0,0,0|1,0,1]=4 12861 B13R0.154 CCCCOCCC(=O)NC[C@@H](C)O a2d8699498dd674b3cfdc39352f503de [0,2,0,0,0,0|1,0,1]=4 12862 B13R0.154 CCCCOCCC(=O)NC[C@H](C)O 96a95a59ef0b52700c0aceccf508135a [0,2,0,0,0,0|1,0,1]=4 12863 B13R0.154 CCCCOCCN(C)CCC(C)C 5b8427f848555c1d070bcf8b8847cf9b [0,2,0,0,0,0|2,0,0]=4 12864 B13R0.154 CCCCOCCN(C)CCC(C)O e9c1fbf79f26ab040a69a93f6503c18d [0,2,0,0,0,0|1,0,0]=3 12865 B13R0.154 CCCCOCNC(C)CCC(C)C 9bbc3e398fff89142fa0a2de3978b530 [0,2,0,0,0,0|2,0,0]=4 12866 B13R0.154 CCCCOCOC(C)CCC(C)C a652a793adc6994542d30905fd844407 [0,2,0,0,0,0|2,0,0]=4 12867 B13R0.154 CCCOCCCN(C)CCC(C)C f18bd0507a8537292368b65aa9f35541 [0,2,0,0,0,0|2,0,0]=4 12868 B13R0.154 CCCOCCCN(C)CCC(C)O 6d035581ed22be4144cbef532aa414cf [0,2,0,0,0,0|1,0,0]=3 12869 B13R0.154 CCCOCCNC(=O)CCC(C)O 6730909d74bbb5fdebc909b0cccc7c13 [0,2,0,0,0,0|1,0,1]=4 12870 B13R0.154 CCCOCCNC(C)CCC(C)C a2a0f59dd43f07bbc1ecbd86c613ba6a [0,2,0,0,0,0|2,0,0]=4 12871 B13R0.154 CCCOCCOC(C)CCC(C)C b07a942d64a7b7347d505a48a3d533b8 [0,2,0,0,0,0|2,0,0]=4 12872 B13R0.154 CCCSCCOC(C)CCC(C)C 30b62101b46eade3928451078440f3bd [0,2,0,0,0,0|2,0,0]=4 12873 B13R0.154 CCOCCCCC(=O)NCC(C)O 200a733af6c99b64881bc9f6c294aea9 [0,2,0,0,0,0|1,0,1]=4 12874 B13R0.154 CCOCCCCC(=O)NC[C@@H](C)O 60a6781e62e725b0548c4735c1de81cd [0,2,0,0,0,0|1,0,1]=4 12875 B13R0.154 CCOCCCCC(=O)NC[C@H](C)O dd252e3e97c0f340386929133dbc9db2 [0,2,0,0,0,0|1,0,1]=4 12876 B13R0.154 CCOCCCNC(=O)CCC(C)O 23f575848864804f5b30f3dd75dd69cc [0,2,0,0,0,0|1,0,1]=4 12877 B13R0.154 CCOCCCNC(C)CCC(C)C e78dcd2de2133451143c17709a2070bc [0,2,0,0,0,0|2,0,0]=4 12878 B13R0.154 CCOCCCOC(C)CCC(C)C b98c78473747f2ccf86b5e8c76b87346 [0,2,0,0,0,0|2,0,0]=4 12879 B13R0.154 CCOCCNCC(C)CCC(C)C 9c9c0ec5c7bd4e00796a48ff133c9738 [0,2,0,0,0,0|2,0,0]=4 12880 B13R0.154 CCOCCOCC(C)CCC(C)C fc4759e544b9dd48b58de749bc19d9a6 [0,2,0,0,0,0|2,0,0]=4 12881 B13R0.154 CCSCCCNC(C)CCC(C)C ecbdf43e8287ca45ca9a53405bb613b2 [0,2,0,0,0,0|2,0,0]=4 12882 B13R0.154 CCSCCCOC(C)CCC(C)C babd52d22acb0fa42bcf8158285931df [0,2,0,0,0,0|2,0,0]=4 12883 B13R0.154 CCSCCNCC(C)CCC(C)C 4f5200de98c318dd07c362793aecc98e [0,2,0,0,0,0|2,0,0]=4 12884 B13R0.154 CCSCCOCC(C)CCC(C)C 330652ab74ddc846fa9836f3157ef3de [0,2,0,0,0,0|2,0,0]=4 12885 B13R0.154 COCCCCCC(=O)NCC(C)O 5d88d06d8f33b3963b0a7055d3350729 [0,2,0,0,0,0|1,0,1]=4 12886 B13R0.154 COCCCCCC(=O)NC[C@@H](C)O 9ae09a2ea0e6375d5e692457f603baca [0,2,0,0,0,0|1,0,1]=4 12887 B13R0.154 COCCCCCC(=O)NC[C@H](C)O af564232c022a285eb41da463cfc33e4 [0,2,0,0,0,0|1,0,1]=4 12888 B13R0.154 COCCCCCN(C)CCC(C)C 6794b816067d58a9ff15b16fcd855a1b [0,2,0,0,0,0|2,0,0]=4 12889 B13R0.154 COCCCCCN(C)CCC(C)O 050589534719fb24230b2f76c1098ac5 [0,2,0,0,0,0|1,0,0]=3 12890 B13R0.154 COCCCCNC(=O)CCC(C)O be2dc15ae5a310fd0381a41c5fb94808 [0,2,0,0,0,0|1,0,1]=4 12891 B13R0.154 COCCCCNC(C)CCC(C)C 759e2224f14470b995d0b626ca1afa7c [0,2,0,0,0,0|2,0,0]=4 12892 B13R0.154 COCCCCOC(C)CCC(C)C ba573d3b43d9dcbc5f8c5e0e2b8cd1f7 [0,2,0,0,0,0|2,0,0]=4 12893 B13R0.154 COCCCNCC(C)CCC(C)C 84395aba8ad1b510d77dd92e6eace037 [0,2,0,0,0,0|2,0,0]=4 12894 B13R0.154 COCCCOCC(C)CCC(C)C 1c47566cfe537b9e31017a7efe1162b9 [0,2,0,0,0,0|2,0,0]=4 12895 B13R0.154 COCCOCCN(C)CCC(C)O 68722b0fe23751da23a2e521dec379c7 [0,2,0,0,0,0|2,0,0]=4 12896 B13R0.154 CSCCCCNC(=O)CCC(C)O 8e1ae62bc9dad8bed558ec8eac25edd9 [0,2,0,0,0,0|1,0,1]=4 12897 B13R0.154 CSCCCCNC(C)CCC(C)C 6f5ae50344ebcef4599d06d5aa3ac402 [0,2,0,0,0,0|2,0,0]=4 12898 B13R0.154 CSCCCCOC(C)CCC(C)C 9fb58d10c4f853b125327348a4941845 [0,2,0,0,0,0|2,0,0]=4 12899 B13R0.154 CSCCCNCC(C)CCC(C)C d8bb15bd21d0b670454ab874b76abff2 [0,2,0,0,0,0|2,0,0]=4 12900 B13R0.154 CSCCCOCC(C)CCC(C)C 8fd32609944d4ade20ddf200f680d81d [0,2,0,0,0,0|2,0,0]=4 12901 B13R0.154 C[C@@H](O)CNC(=O)CCCCCCF 120158d80e470023f8bf84146a1b8e97 [0,2,0,0,0,0|1,0,1]=4 12902 B13R0.154 C[C@@H](O)CNC(=O)CCCCCCO 544da1a7ba0a5dc566ff3e26a7144d76 [0,2,0,0,0,0|1,0,1]=4 12903 B13R0.154 C[C@@H](O)CNC(=O)CCCCCCS 24218bcba3c65d03dc7885e0e7cd756a [0,2,0,0,0,0|1,0,1]=4 12904 B13R0.154 C[C@H](O)CNC(=O)CCCCCCF 237af86108659415baab90b77000365f [0,2,0,0,0,0|1,0,1]=4 12905 B13R0.154 C[C@H](O)CNC(=O)CCCCCCO da077430f9d81d5d11e4bdc2a590ee12 [0,2,0,0,0,0|1,0,1]=4 12906 B13R0.154 C[C@H](O)CNC(=O)CCCCCCS abd1472709e348093bc93a0cd0c1c167 [0,2,0,0,0,0|1,0,1]=4 12907 B13R0.179 C=C(C)CCCOCCCCC(C)C fa6b18226b30955afb92863078fbfaf5 [0,2,0,0,0,0|1,0,1]=4 12908 B13R0.179 C=C(C)CCNCCCCCC(C)C f899fdd3c75293054ce5dea3412e342b [0,2,0,0,0,0|1,0,1]=4 12909 B13R0.179 C=C(C)CCOCCCCCC(C)C 0c89032bf500f4d456e9b5be38fb7bef [0,2,0,0,0,0|1,0,1]=4 12910 B13R0.179 C=C(C)CNCCCCCCC(C)C d317c84887fdd09218c9bb996996377e [0,2,0,0,0,0|1,0,1]=4 12911 B13R0.179 C=C(C)COCCCCCCC(C)C f323da6a8406642648fc1ebb181f1d30 [0,2,0,0,0,0|1,0,1]=4 12912 B13R0.179 CC(=O)CCCCCCCOC(C)C f933978800bb44e13ca94ccaa760acc4 [0,2,0,0,0,0|0,0,2]=4 12913 B13R0.179 CC(=O)CCCCCNCCC(C)C 66e102749886408e5027a9e017d20c53 [0,2,0,0,0,0|0,0,2]=4 12914 B13R0.179 CC(=O)CCCCCNCCC(C)O 06e3d6355ae36368d72dbdde0caae833 [0,2,0,0,0,0|0,0,1]=3 12915 B13R0.179 CC(=O)CCCCCNCC[C@@H](C)O 29b9a1f963a39a558b2597a23d0cf412 [0,2,0,0,0,0|0,0,1]=3 12916 B13R0.179 CC(=O)CCCCCNCC[C@H](C)O 05b0efb21f7caa6f77d43206ac6a6162 [0,2,0,0,0,0|0,0,1]=3 12917 B13R0.179 CC(=O)CCCCCOCCC(C)C 5d1c9d3ee3a925364180f2936223fd00 [0,2,0,0,0,0|0,0,2]=4 12918 B13R0.179 CC(=O)CCCCNCCCC(C)C f26dacc6e6cc963cf52fc10025026c8b [0,2,0,0,0,0|0,0,2]=4 12919 B13R0.179 CC(=O)CCCCOCCCC(C)C ccf90b05b24dca4e5330bd74999e460d [0,2,0,0,0,0|0,0,2]=4 12920 B13R0.179 CC(=O)CCCOCCCCC(C)C 201419bb6239931829fb270db0df2ad9 [0,2,0,0,0,0|0,0,2]=4 12921 B13R0.179 CC(=O)CCNCCCCCC(C)C 02e4be4ab4a7b8d769df149229698d0c [0,2,0,0,0,0|0,0,2]=4 12922 B13R0.179 CC(=O)CCOCCCCCC(C)C adc90eec746472cfc489318a9c3c698f [0,2,0,0,0,0|0,0,2]=4 12923 B13R0.179 CC(=O)NCCCCCNCC(C)O a3acc3b4e7ede8925da759a6e51b2d27 [0,2,0,0,0,0|1,0,1]=4 12924 B13R0.179 CC(=O)NCCCCCNC[C@@H](C)O 8bbb473677b24873d5a17aa864a6cc14 [0,2,0,0,0,0|1,0,1]=4 12925 B13R0.179 CC(=O)NCCCCCNC[C@H](C)O 5b63350b055a8103704e591f281669f9 [0,2,0,0,0,0|1,0,1]=4 12926 B13R0.179 CC(=O)NCCCCNCCC(C)O 5a64b132a9cbe5651fe977ae9132117d [0,2,0,0,0,0|1,0,1]=4 12927 B13R0.179 CC(=O)NCCCNCCCC(C)O 8c5069b4536f4e50692decd7291ef53c [0,2,0,0,0,0|1,0,1]=4 12928 B13R0.179 CC(=O)NCCNCCCCC(C)O 767f3d2f677ddf0d6fea4c3461b791bf [0,2,0,0,0,0|1,0,1]=4 12929 B13R0.179 CC(=O)NCCNCCCC[C@@H](C)O f5161cc9577a7b6f4160ca156dd773f0 [0,2,0,0,0,0|1,0,1]=4 12930 B13R0.179 CC(=O)OCCCCCNCC(C)O 7f8b52f3dcb2ca020f4c4118fc2a4d25 [0,2,0,0,0,0|1,0,1]=4 12931 B13R0.179 CC(=O)OCCCCCNC[C@@H](C)O 9cfe4575ed8ad68181f327309a743dc3 [0,2,0,0,0,0|1,0,1]=4 12932 B13R0.179 CC(=O)OCCCCCNC[C@H](C)O d932e3359040cc56394f9f71f414a56d [0,2,0,0,0,0|1,0,1]=4 12933 B13R0.179 CC(=O)OCCCCNCCC(C)O a452e36f077ae0c6cb29f42227272b07 [0,2,0,0,0,0|1,0,1]=4 12934 B13R0.179 CC(=O)OCCCCNCC[C@@H](C)O fe8e28173f087760a30d675a43829d9c [0,2,0,0,0,0|1,0,1]=4 12935 B13R0.179 CC(=O)OCCCCNCC[C@H](C)O 715ee8d3aad8e3cdd8aefd056d4c0201 [0,2,0,0,0,0|1,0,1]=4 12936 B13R0.179 CC(=O)SCCCCNCCC(C)O 3d0288771056983fbf0a7bd81412ed7f [0,2,0,0,0,0|1,0,1]=4 12937 B13R0.179 CC(=O)SCCCCNCC[C@@H](C)O 665d79404b544faaf5b70ff884b6361d [0,2,0,0,0,0|1,0,1]=4 12938 B13R0.179 CC(=O)SCCCCNCC[C@H](C)O 26821c795684322163c4c3a73888dcac [0,2,0,0,0,0|1,0,1]=4 12939 B13R0.179 CC(C)CCCCCCCOC(C)C 6372bcd09a9b29502a17c8d26d61cf33 [0,2,0,0,0,0|1,0,0]=3 12940 B13R0.179 CC(C)CCCCCCNCC(=O)O 1b8c90b0b08db363ee8d358868835aee [0,2,0,0,0,0|1,0,1]=4 12941 B13R0.179 CC(C)CCCCCCNCC(C)C b372a752f17eeef34502fdcf3c1d89f9 [0,2,0,0,0,0|1,0,0]=3 12942 B13R0.179 CC(C)CCCCCCNCC(C)O 0b27d32dc82c303c963d0ec5c88faa4d [0,2,0,0,0,0|0,0,0]=2 12943 B13R0.179 CC(C)CCCCCCNCC(F)F ca115276df238c145ed9443041d3f78d [0,2,0,0,0,0|2,0,0]=4 12944 B13R0.179 CC(C)CCCCCCNCN(C)C c7ea06052b3a41cd06f5f7d412382bd0 [0,2,0,0,0,0|2,0,0]=4 12945 B13R0.179 CC(C)CCCCCCNC[C@@H](C)O 61f1d99a3fa169ff9afd061ef0dba9ab [0,2,0,0,0,0|0,0,0]=2 12946 B13R0.179 CC(C)CCCCCCNC[C@H](C)O 03daafd1e926349a505e84b477d7bb6f [0,2,0,0,0,0|0,0,0]=2 12947 B13R0.179 CC(C)CCCCCCOCC(=O)O 8d2103d938c77bfb4f939c52f50b3c95 [0,2,0,0,0,0|1,0,1]=4 12948 B13R0.179 CC(C)CCCCCCOCC(C)C a164f2c5f07b1aff2513f68c97f8bba2 [0,2,0,0,0,0|1,0,0]=3 12949 B13R0.179 CC(C)CCCCCCOCC(F)F 0db63fa268a4273913b1d1159dba622c [0,2,0,0,0,0|2,0,0]=4 12950 B13R0.179 CC(C)CCCCCCOCN(C)C 15b9cadbf150b92be9cf9d8574f26ed8 [0,2,0,0,0,0|2,0,0]=4 12951 B13R0.179 CC(C)CCCCCNCCC(=O)O ac11dd5f89c7f1fb6cd36112b1a3408c [0,2,0,0,0,0|1,0,1]=4 12952 B13R0.179 CC(C)CCCCCNCCC(C)C 3660a31fa68a18fa5800c4b258c4425d [0,2,0,0,0,0|1,0,0]=3 12953 B13R0.179 CC(C)CCCCCNCCC(C)O 4a4795bcbcbf9d89bb57f8611c7a33fd [0,2,0,0,0,0|0,0,0]=2 12954 B13R0.179 CC(C)CCCCCNCCC(F)F 9304a1d2f9bec3d02be9b6a057c5a8fc [0,2,0,0,0,0|2,0,0]=4 12955 B13R0.179 CC(C)CCCCCNCCN(C)C 3144f230fa33aaedbafd7769d52a6d21 [0,2,0,0,0,0|2,0,0]=4 12956 B13R0.179 CC(C)CCCCCNCCS(=O)C 4cba77889398a9b2f7b631df31947969 [0,2,0,0,0,0|1,0,1]=4 12957 B13R0.179 CC(C)CCCCCNCCS(=O)O b560a95f8bcb760897ba105ffa10a003 [0,2,0,0,0,0|2,0,0]=4 12958 B13R0.179 CC(C)CCCCCNCC[C@@H](C)O 6fcb068b04dd80869d711d494829cae5 [0,2,0,0,0,0|0,0,0]=2 12959 B13R0.179 CC(C)CCCCCNCC[C@H](C)O cca035a17668832b25d9905fe10ead7f [0,2,0,0,0,0|0,0,0]=2 12960 B13R0.179 CC(C)CCCCCNCOC(C)C c4e2783841a8b66d2b9c19a6cb07d164 [0,2,0,0,0,0|2,0,0]=4 12961 B13R0.179 CC(C)CCCCCOCCC(=O)O 7ee59644de728b5bf8cbee321fd2403e [0,2,0,0,0,0|1,0,1]=4 12962 B13R0.179 CC(C)CCCCCOCCC(C)C e0b122a42a75ec663fc62f1b099b2c76 [0,2,0,0,0,0|1,0,0]=3 12963 B13R0.179 CC(C)CCCCCOCCC(F)F e8b297a8ce336dc4519767390eccf059 [0,2,0,0,0,0|2,0,0]=4 12964 B13R0.179 CC(C)CCCCCOCCN(C)C f3435b54d1fe83197813dc1c81f01989 [0,2,0,0,0,0|2,0,0]=4 12965 B13R0.179 CC(C)CCCCCOCCS(=O)C bf80b68589f939cdcefe64633c6c0b1b [0,2,0,0,0,0|1,0,1]=4 12966 B13R0.179 CC(C)CCCCCOCOC(C)C d49c4cf240f5b58c7df234ad274cb8bb [0,2,0,0,0,0|2,0,0]=4 12967 B13R0.179 CC(C)CCCCNCCCC(=O)O 79ec125e4584341029d3e70752328150 [0,2,0,0,0,0|1,0,1]=4 12968 B13R0.179 CC(C)CCCCNCCCC(C)C 28d0ac2e547d6ce8d49e0480327b3a4c [0,2,0,0,0,0|1,0,0]=3 12969 B13R0.179 CC(C)CCCCNCCCN(C)C ede02a52c64d674ca887ad9df80e1ab9 [0,2,0,0,0,0|2,0,0]=4 12970 B13R0.179 CC(C)CCCCNCCCS(=O)C eeabce6a1528dab4e588deac18111f50 [0,2,0,0,0,0|1,0,1]=4 12971 B13R0.179 CC(C)CCCCNCCOC(C)C 8975b70c0aefa0a52314e296b4ce7729 [0,2,0,0,0,0|2,0,0]=4 12972 B13R0.179 CC(C)CCCCOCCCC(C)C 5a5ad14761e8dd3c183591acd8b91312 [0,2,0,0,0,0|1,0,0]=3 12973 B13R0.179 CC(C)CCCCOCCCN(C)C f1ba19707dc692a667128441bf3487eb [0,2,0,0,0,0|2,0,0]=4 12974 B13R0.179 CC(C)CCCCOCCOC(C)C 09ac09b1371f8b4c3dab128d35e17e4e [0,2,0,0,0,0|2,0,0]=4 12975 B13R0.179 CC(C)CCCCOCCSC(C)C 454fdc5beb9bcacd4793655123c6f2ec [0,2,0,0,0,0|2,0,0]=4 12976 B13R0.179 CC(C)CCCNCCCCC(=O)O 227d7f944f5ee831a1ba159238aaa234 [0,2,0,0,0,0|1,0,1]=4 12977 B13R0.179 CC(C)CCCNCCCCC(C)O 495cfb9466f1dc19b98a0e3ee7a1df0d [0,2,0,0,0,0|0,0,0]=2 12978 B13R0.179 CC(C)CCCNCCCCC(F)F 478048dcbadb00fdb0aba74a86bd7d55 [0,2,0,0,0,0|2,0,0]=4 12979 B13R0.179 CC(C)CCCNCCCCN(C)C bda74e3ba16842131ac0d05bb3aa6ec2 [0,2,0,0,0,0|2,0,0]=4 12980 B13R0.179 CC(C)CCCNCCCC[C@@H](C)O 8dc295972edb218dd9b42a1a75973209 [0,2,0,0,0,0|0,0,0]=2 12981 B13R0.179 CC(C)CCCNCCCOC(C)C a1569d594ee84c11b1a19a88acd15ab1 [0,2,0,0,0,0|2,0,0]=4 12982 B13R0.179 CC(C)CCCNCCCSC(C)C 757f05fd5dc2edc81d7a9e78f22df000 [0,2,0,0,0,0|2,0,0]=4 12983 B13R0.179 CC(C)CCCNCCOCC(C)C a08ef7d6790d5c8b6592087229bd554c [0,2,0,0,0,0|2,0,0]=4 12984 B13R0.179 CC(C)CCCOCCCCC(=O)O a1e66ff054f2143e5f523f5847297b71 [0,2,0,0,0,0|1,0,1]=4 12985 B13R0.179 CC(C)CCCOCCCCN(C)C ad65cd91e346da3f6433e59a4410d9d7 [0,2,0,0,0,0|2,0,0]=4 12986 B13R0.179 CC(C)CCCOCCCOC(C)C 490b762f661604c3b3a4802b1727f659 [0,2,0,0,0,0|2,0,0]=4 12987 B13R0.179 CC(C)CCCOCCCSC(C)C 252191aaf7520daeffd7f975065ac460 [0,2,0,0,0,0|2,0,0]=4 12988 B13R0.179 CC(C)CCCOCCOCC(C)C 6320b1a09c05876affb27703ac0b881a [0,2,0,0,0,0|2,0,0]=4 12989 B13R0.179 CC(C)CCCOCCSCC(C)C 4dd1c5f37822728aa2fa2b49406fdd86 [0,2,0,0,0,0|2,0,0]=4 12990 B13R0.179 CC(C)CCNCCCCCC(=O)O 729724f3f72012fa3ef699368634b3da [0,2,0,0,0,0|1,0,1]=4 12991 B13R0.179 CC(C)CCNCCCCCC(F)F 18cdf06ce8b6bb29a5a7f1800a41dfc3 [0,2,0,0,0,0|2,0,0]=4 12992 B13R0.179 CC(C)CCNCCCCCN(C)C 6c7438559737da8cf6740caadd00b8f4 [0,2,0,0,0,0|2,0,0]=4 12993 B13R0.179 CC(C)CCNCCCOCC(C)C 5585c256f45f60657a63093a29601a91 [0,2,0,0,0,0|2,0,0]=4 12994 B13R0.179 CC(C)CCOCCCCCC(=O)O cba1eabd6d73c346d4c7a4c955ea69b0 [0,2,0,0,0,0|1,0,1]=4 12995 B13R0.179 CC(C)CCOCCCCCC(F)F 1aa429f599ccdd555cfd79916d474a64 [0,2,0,0,0,0|2,0,0]=4 12996 B13R0.179 CC(C)CCOCCCCCN(C)C cbd9364f29cf6c4cb33a8fc232a84044 [0,2,0,0,0,0|2,0,0]=4 12997 B13R0.179 CC(C)CCOCCCOCC(C)C cce36836eb216dd2baa198b918dd36a4 [0,2,0,0,0,0|2,0,0]=4 12998 B13R0.179 CC(C)CCOCCCSCC(C)C c7b6a011cfbde963e7d9135290c3c7da [0,2,0,0,0,0|2,0,0]=4 12999 B13R0.179 CC(C)CNCCCCCCC(=O)O d47e1d8331fc2051a56cfedd3db0f322 [0,2,0,0,0,0|1,0,1]=4 13000 B13R0.179 CC(C)CNCCCCCCN(C)C 5962f7aa8ad01290dbc92499aa1e9d41 [0,2,0,0,0,0|2,0,0]=4 13001 B13R0.179 CC(C)CNCCCCSCC(C)C d5a4dafc99b028717dc756295942d680 [0,2,0,0,0,0|2,0,0]=4 13002 B13R0.179 CC(C)COCCCCCCC(=O)O a43c0cc6c31bbb70a9aea9db9fca7d70 [0,2,0,0,0,0|1,0,1]=4 13003 B13R0.179 CC(C)COCCCCCCN(C)C c3e0d30ff9240f3021f409863afabdf0 [0,2,0,0,0,0|2,0,0]=4 13004 B13R0.179 CC(C)COCCCNCCC(C)O 1240320a6a0a21031d80774742795b5e [0,2,0,0,0,0|1,0,0]=3 13005 B13R0.179 CC(C)CSCCCCNCC(C)O 0411e8b9f6bab33a77a2d4593bf2cd97 [0,2,0,0,0,0|1,0,0]=3 13006 B13R0.179 CC(C)CSCCCCNC[C@@H](C)O 580a929efae5765f253a239b983d4e68 [0,2,0,0,0,0|1,0,0]=3 13007 B13R0.179 CC(C)CSCCCCNC[C@H](C)O 9bc38c5f5b8e1d2b1941f97701a8ea90 [0,2,0,0,0,0|1,0,0]=3 13008 B13R0.179 CC(C)NCCCCCCCC(=O)O 102660ebd4c46a633e7cee4da3975718 [0,2,0,0,0,0|1,0,1]=4 13009 B13R0.179 CC(C)NCCCCCCCN(C)C 533ca5b5fd24ff0f6465cb05c27d6ef2 [0,2,0,0,0,0|2,0,0]=4 13010 B13R0.179 CC(C)OCCCCCCCC(=O)O abd3339ecc6ef64d250891ee67b6775d [0,2,0,0,0,0|1,0,1]=4 13011 B13R0.179 CC(C)OCCNCCCC[C@@H](C)O 58d4478c7da0aaa6f274a5aaf6e1ac89 [0,2,0,0,0,0|1,0,0]=3 13012 B13R0.179 CC(O)CCCCNCCCC(=O)N d5fe96863b6e498e762e4ae854eee057 [0,2,0,0,0,0|1,0,1]=4 13013 B13R0.179 CC(O)CCCCNCCCN(C)C 6240dd2610d58de888daf50d8a747af4 [0,2,0,0,0,0|1,0,0]=3 13014 B13R0.179 CC(O)CCCCNCCCS(=O)C fcfb0088f0e347302ff63c35678437d5 [0,2,0,0,0,0|1,0,0]=3 13015 B13R0.179 CC(O)CCCCNCCOC(C)C 9431ab1ea5e6bce160f09aef5b9ca16c [0,2,0,0,0,0|1,0,0]=3 13016 B13R0.179 CC(O)CCCCNCCOC(F)F 90eb875795a2ce6d0d48bb7459b21b63 [0,2,0,0,0,0|2,0,0]=4 13017 B13R0.179 CC(O)CCCNCCCCC(=O)N a684b1c1a0ff86b2816fd3d576d60ad1 [0,2,0,0,0,0|1,0,1]=4 13018 B13R0.179 CC(O)CCCNCCCCC(=O)O dc45622694d5b41af8b38041c82a59a2 [0,2,0,0,0,0|1,0,1]=4 13019 B13R0.179 CC(O)CCCNCCCCC(F)F 0ae5d21937a371af3a3e1e1264fddca5 [0,2,0,0,0,0|1,0,0]=3 13020 B13R0.179 CC(O)CCCNCCCCN(C)C 2fd3d0294626a364889d854f93e9c14f [0,2,0,0,0,0|1,0,0]=3 13021 B13R0.179 CC(O)CCCNCCCOC(C)C 6d320452d9d0fc4c3d356c394467aa1f [0,2,0,0,0,0|1,0,0]=3 13022 B13R0.179 CC(O)CCCNCCCOC(F)F 9037ce966133fc4a1e0130e4249d3eaa [0,2,0,0,0,0|2,0,0]=4 13023 B13R0.179 CC(O)CCCNCCCSC(C)C fe9f2191ee40f758ac550d9f9e761ecc [0,2,0,0,0,0|1,0,0]=3 13024 B13R0.179 CC(O)CCNCCCCCC(=O)N cf4d6305a27fac86ec41fec8634fdeca [0,2,0,0,0,0|1,0,1]=4 13025 B13R0.179 CC(O)CCNCCCCCC(=O)O bac108ec00ab50d4c4a248dd43b5277c [0,2,0,0,0,0|1,0,1]=4 13026 B13R0.179 CC(O)CCNCCCCCC(F)F ad1738c91be8ac5eff301f3a1a81753a [0,2,0,0,0,0|1,0,0]=3 13027 B13R0.179 CC(O)CCNCCCCCN(C)C 2532b652ac2807b036384a9462e17ce2 [0,2,0,0,0,0|1,0,0]=3 13028 B13R0.179 CC(O)CCNCCCCOC(F)F 99ec8788fbb9783cd7777211acdf439d [0,2,0,0,0,0|2,0,0]=4 13029 B13R0.179 CC(O)CCNCCOCCN(C)C e04e903d3f130f6051878ff69b29f096 [0,2,0,0,0,0|2,0,0]=4 13030 B13R0.179 CC(O)CNCCCCCCC(=O)O d3792fded51856a1e32ae2153b3df6ba [0,2,0,0,0,0|1,0,1]=4 13031 B13R0.179 CC(O)CNCCCCCCN(C)C 976608b4d57321279cf2d6134866d2ff [0,2,0,0,0,0|1,0,0]=3 13032 B13R0.179 C[C@@H](O)CCCCNCCCC(=O)N 814208abda4fd293423cb651dc41505e [0,2,0,0,0,0|1,0,1]=4 13033 B13R0.179 C[C@@H](O)CCCCNCCCN(C)C caa0785b62f3032a9653343259a6687e [0,2,0,0,0,0|1,0,0]=3 13034 B13R0.179 C[C@@H](O)CCCCNCCCS(=O)C 16813dc2909bc899d25c85628c6f2e89 [0,2,0,0,0,0|1,0,0]=3 13035 B13R0.179 C[C@@H](O)CCCCNCCOC(F)F fdea1ebf067f6b756fba2b5b520c57d3 [0,2,0,0,0,0|2,0,0]=4 13036 B13R0.179 C[C@@H](O)CCNCCCCCC(=O)N 02e973083b10db7ffd8296241a4f13eb [0,2,0,0,0,0|1,0,1]=4 13037 B13R0.179 C[C@@H](O)CCNCCCCCC(F)F 13dc5e5c71db472540bcbe6d727b9a4d [0,2,0,0,0,0|1,0,0]=3 13038 B13R0.179 C[C@@H](O)CNCCCCCCC(=O)O 6363b4ef0c13454441903321553a3c09 [0,2,0,0,0,0|1,0,1]=4 13039 B13R0.179 C[C@@H](O)CNCCCCCCN(C)C 3bdd44029e58effd765dc63c22fcb616 [0,2,0,0,0,0|1,0,0]=3 13040 B13R0.179 C[C@H](O)CCNCCCCCC(=O)N afa7150f11db4916827d5e1bf7d3fa21 [0,2,0,0,0,0|1,0,1]=4 13041 B13R0.179 C[C@H](O)CCNCCCCCC(F)F a056fa0713fedbc1d3cf8d679d224813 [0,2,0,0,0,0|1,0,0]=3 13042 B13R0.179 C[C@H](O)CNCCCCCCC(=O)O 78710d06e18008dbc445f874aa57e851 [0,2,0,0,0,0|1,0,1]=4 13043 B13R0.179 C[C@H](O)CNCCCCCCN(C)C d74449b9f2f74b566ac1593ba744d3d7 [0,2,0,0,0,0|1,0,0]=3 13044 B13R0.202 C#CC(C)NCCCCCCC(C)C 82e905317022487c833353cd0b0482b5 [0,2,0,0,0,0|2,0,0]=4 13045 B13R0.202 C#CC(C)OCCCCCCC(C)C deff390d28ea6c0c7d49b716ee431e98 [0,2,0,0,0,0|2,0,0]=4 13046 B13R0.202 C#CC(O)CCCCCNCC(C)C e1d5816a395e5f890c4bd79a90f4ae35 [0,2,0,0,0,0|1,0,1]=4 13047 B13R0.202 C#CC(O)CCCCCNCC(C)O 6f3ff979041cc6d59a3ca022f1875b8f [0,2,0,0,0,0|0,0,2]=4 13048 B13R0.202 C#CC(O)CCCCCNC[C@@H](C)O ae5ab2714226349b917d467929a694e8 [0,2,0,0,0,0|0,0,2]=4 13049 B13R0.202 C#CC(O)CCCCCNC[C@H](C)O 11c5f248e7d85d8d235c557da2aad047 [0,2,0,0,0,0|0,0,2]=4 13050 B13R0.202 C=C(C)CCCNCCCC(C)CO dd14d196ea269c78fe0d2cd73f1d6beb [0,2,0,0,0,0|1,0,1]=4 13051 B13R0.202 C=C(C)CCCOCCCC(C)CC 21db222bf1adf1775ae3259b718a64ed [0,2,0,0,0,0|1,0,1]=4 13052 B13R0.202 C=C(C)CCCOCCC[C@@H](C)CC f3149533e81ae7a8f091ee4e620fef7d [0,2,0,0,0,0|1,0,1]=4 13053 B13R0.202 C=C(C)CCOCCCCC(C)CC 7fc3b9e85f38190557c728f5dcf35ebf [0,2,0,0,0,0|1,0,1]=4 13054 B13R0.202 C=C(C)CCOCCCC[C@@H](C)CC c92b00f1ad33229d24ce95825b46ad6c [0,2,0,0,0,0|1,0,1]=4 13055 B13R0.202 C=C(C)COCCCCCC(C)CC bc25720c33947123601a70e7c8ddcb13 [0,2,0,0,0,0|1,0,1]=4 13056 B13R0.202 C=C(C)COCCCCC[C@@H](C)CC 28a6390c22596dfb250221b98f65905e [0,2,0,0,0,0|1,0,1]=4 13057 B13R0.202 C=C(CC)CNCCCCCC(C)C a0b407eb8d16edc439cbf665099890f1 [0,2,0,0,0,0|1,0,1]=4 13058 B13R0.202 C=C(CC)COCCCCCC(C)C 2b61095ea819393945d02aafa732a73a [0,2,0,0,0,0|1,0,1]=4 13059 B13R0.202 C=CC(C)COCCCCCC(C)C b98cdecde3662f8919deb5a1e5be95d6 [0,2,0,0,0,0|2,0,0]=4 13060 B13R0.202 C=CC(C)NCCCCCCC(C)C 0160cedebb644221b9a41f3cdfa5bc9f [0,2,0,0,0,0|2,0,0]=4 13061 B13R0.202 C=CC(C)OCCCCCCC(C)C e23c72a68d261f07ecf1538a9162e549 [0,2,0,0,0,0|2,0,0]=4 13062 B13R0.202 C=CC(O)CNCCCCCC(C)C c7051a0aca7e4b3e1d3a503aae0b14c3 [0,2,0,0,0,0|1,0,1]=4 13063 B13R0.202 CC(=O)CCCCCNCC(C)CO 536f20657692017cee2ae4add9725eeb [0,2,0,0,0,0|1,0,1]=4 13064 B13R0.202 CC(=O)CCCCCNCC(O)CO 2d7ce0b2fb078457c6c76e3a52e12c23 [0,2,0,0,0,0|1,0,1]=4 13065 B13R0.202 CC(=O)CCCCCNC[C@@H](O)CO 28337c33ff2a4562ef925f1309d7fe47 [0,2,0,0,0,0|1,0,1]=4 13066 B13R0.202 CC(=O)CCCCCNC[C@H](C)CO 3da34fb727ae0ccc26cb9b768594627a [0,2,0,0,0,0|1,0,1]=4 13067 B13R0.202 CC(=O)CCCCCNC[C@H](O)CO ad861973ea2b34a1069b0ee11130ebe2 [0,2,0,0,0,0|1,0,1]=4 13068 B13R0.202 CC(=O)CCCCNCCC(C)CO 57f1a85ba7d0be7f9306acc0c2a3cd7e [0,2,0,0,0,0|1,0,1]=4 13069 B13R0.202 CC(=O)CCCCNCCC(O)CO 137cf00c11154fb9b571c1d5880ff04f [0,2,0,0,0,0|1,0,1]=4 13070 B13R0.202 CC(=O)CCCCNCC[C@@H](C)CO c23f8ce375d16b347d0d3318490134cd [0,2,0,0,0,0|1,0,1]=4 13071 B13R0.202 CC(=O)CCCNCCCC(C)CO 3dc93947fe5314f31afe2ca7864b8ce7 [0,2,0,0,0,0|1,0,1]=4 13072 B13R0.202 CC(C)CCCCCCNC(C)C#N a95a83210d8c3998b25a031766d2ea24 [0,2,0,0,0,0|2,0,0]=4 13073 B13R0.202 CC(C)CCCCCCNC(C)C=O fc1da830c03a77863d9195a4196403fb [0,2,0,0,0,0|1,0,1]=4 13074 B13R0.202 CC(C)CCCCCCNC(C)CO 93731db6c5d9e164007ea8116bad1d71 [0,2,0,0,0,0|1,0,0]=3 13075 B13R0.202 CC(C)CCCCCCN[C@@H](C)CO 0ac4d09e782dd83001a74fbc3a37beb6 [0,2,0,0,0,0|1,0,0]=3 13076 B13R0.202 CC(C)CCCCCCN[C@H](C)C=O 819b29ac0a23264987d64570cb9a9c44 [0,2,0,0,0,0|1,0,1]=4 13077 B13R0.202 CC(C)CCCCCCN[C@H](C)CO bf2c60c95a3aa9d6ec66e02596fb2806 [0,2,0,0,0,0|1,0,0]=3 13078 B13R0.202 CC(C)CCCCCCOC(C)C#N 96ebec54750a94f5f2559e910a3e6dbf [0,2,0,0,0,0|2,0,0]=4 13079 B13R0.202 CC(C)CCCCCCOC(C)C=O 85c38d8a3c9db75453a1ea377477d791 [0,2,0,0,0,0|1,0,1]=4 13080 B13R0.202 CC(C)CCCCCCO[C@H](C)C=O a8a2474bfe5c03b00a5f3d271c41e097 [0,2,0,0,0,0|1,0,1]=4 13081 B13R0.202 CC(C)CCCCCNCC(Br)CBr 945d0f99c5d16ed4bd3aa5b6a2cd93a7 [0,2,0,0,0,0|2,0,0]=4 13082 B13R0.202 CC(C)CCCCCNCC(C)C#N 2e7263872d7a3db469fa6059f6558c2e [0,2,0,0,0,0|2,0,0]=4 13083 B13R0.202 CC(C)CCCCCNCC(C)CO 0549d86a665dc221e0f2778b2b83b80c [0,2,0,0,0,0|1,0,0]=3 13084 B13R0.202 CC(C)CCCCCNCC(F)CO 9397468b81a7dd626e582de5ed4bb517 [0,2,0,0,0,0|2,0,0]=4 13085 B13R0.202 CC(C)CCCCCNCC(O)CF d75eb5ea50b325d564d2b8c06ef8e977 [0,2,0,0,0,0|1,0,0]=3 13086 B13R0.202 CC(C)CCCCCNCC(O)CO b99064d3016cc2bad0b930f320cebcf3 [0,2,0,0,0,0|1,0,0]=3 13087 B13R0.202 CC(C)CCCCCNC[C@@H](C)CO cb9a6ef6f7386815eaea543b80c5d6a0 [0,2,0,0,0,0|1,0,0]=3 13088 B13R0.202 CC(C)CCCCCNC[C@@H](F)CO c75119a248cac3e356406084267ac866 [0,2,0,0,0,0|2,0,0]=4 13089 B13R0.202 CC(C)CCCCCNC[C@@H](O)CO c64769d7f3993faebdd84accd3a72c5a [0,2,0,0,0,0|1,0,0]=3 13090 B13R0.202 CC(C)CCCCCNC[C@H](C)CO fd66e9ce542df47714fd7102e08dda7c [0,2,0,0,0,0|1,0,0]=3 13091 B13R0.202 CC(C)CCCCCNC[C@H](F)CO a745c0a6ebc7225f6273cc1158a67a7a [0,2,0,0,0,0|2,0,0]=4 13092 B13R0.202 CC(C)CCCCCNC[C@H](O)CO 5e2aca935c84a5f3692053fdbd437a09 [0,2,0,0,0,0|1,0,0]=3 13093 B13R0.202 CC(C)CCCCCOCC(Br)CBr 5c0c650d4316682a0d22474e924195e9 [0,2,0,0,0,0|2,0,0]=4 13094 B13R0.202 CC(C)CCCCCOCC(C)C#N 859f21e823c7d1a2c27f6d74888f4e5e [0,2,0,0,0,0|2,0,0]=4 13095 B13R0.202 CC(C)CCCCCOCC(Cl)CCl 0e4cddff4a0ade9693d4363d007ed372 [0,2,0,0,0,0|2,0,0]=4 13096 B13R0.202 CC(C)CCCCCOCC(O)CO 614bca327d1ec2e6d6ec8a7590d9aa09 [0,2,0,0,0,0|1,0,0]=3 13097 B13R0.202 CC(C)CCCCCOCC(S)CS d3df846982c1958ca8eb3c238da051bf [0,2,0,0,0,0|1,1,0]=4 13098 B13R0.202 CC(C)CCCCCOC[C@@H](O)CO ff0a65abd248a004a3c09690af8a676f [0,2,0,0,0,0|1,0,0]=3 13099 B13R0.202 CC(C)CCCCCOC[C@H](O)CO f33a0774bc0f15b5ac769c1599883033 [0,2,0,0,0,0|1,0,0]=3 13100 B13R0.202 CC(C)CCCCNCCC(C)CO d1a0573804bfd9643da829e1c86ecbfd [0,2,0,0,0,0|1,0,0]=3 13101 B13R0.202 CC(C)CCCCNCCC(O)CO 31ef2c8c66f923ed7859fd3b1d0a7d44 [0,2,0,0,0,0|1,0,0]=3 13102 B13R0.202 CC(C)CCCCNCC[C@@H](C)CO 1ba6ac44b2f724704e9b110773a15dc0 [0,2,0,0,0,0|1,0,0]=3 13103 B13R0.202 CC(C)CCCNCCCC(C)CO 7d472b7063493f385e7f3f104df21bdd [0,2,0,0,0,0|1,0,0]=3 13104 B13R0.202 CC(C)COCCCNCC(C)CO 0bb5e7fbf4d8dd0efde9de139243d262 [0,2,0,0,0,0|2,0,0]=4 13105 B13R0.202 CC(C)COCCCNCC(O)CF ce6460d77ddaaa3b30381886e5a320d6 [0,2,0,0,0,0|2,0,0]=4 13106 B13R0.202 CC(C)COCCCNCC(O)CO 775d3cd84ec61fe0e12c7790b17bcae4 [0,2,0,0,0,0|2,0,0]=4 13107 B13R0.202 CC(C)COCCCNC[C@@H](C)CO 2b24dcc60d8e38a9b8f69d8b809c0fee [0,2,0,0,0,0|2,0,0]=4 13108 B13R0.202 CC(C)COCCCNC[C@@H](O)CO fa925a904cae9722510563f5ac3ff701 [0,2,0,0,0,0|2,0,0]=4 13109 B13R0.202 CC(C)COCCCNC[C@H](C)CO 11651a4cb39ab073feab7520c7b563af [0,2,0,0,0,0|2,0,0]=4 13110 B13R0.202 CC(C)COCCCNC[C@H](O)CO 4aebcae37dee9b51a7838ad999fa9dc8 [0,2,0,0,0,0|2,0,0]=4 13111 B13R0.202 CC(C)COCCCOCC(O)CO cba78531c658de725cb1b7d7c6a8cf21 [0,2,0,0,0,0|2,0,0]=4 13112 B13R0.202 CC(C)COCCCOC[C@@H](O)CO a48c4a48745c577aac8f1640ea10e899 [0,2,0,0,0,0|2,0,0]=4 13113 B13R0.202 CC(C)COCCCOC[C@H](O)CO f775a54be45d4486e7bc18f4a2233d6d [0,2,0,0,0,0|2,0,0]=4 13114 B13R0.202 CC(C)COCCNCCC(C)CO 1c5746b1d49800160cfcdd16540b6ead [0,2,0,0,0,0|2,0,0]=4 13115 B13R0.202 CC(C)COCCNCCC(O)CO 6d058e5e60450a042175f6f166c0c38d [0,2,0,0,0,0|2,0,0]=4 13116 B13R0.202 CC(C)COCCNCC[C@@H](C)CO efc30c89a9e28e41a8d72ba10b7fd40b [0,2,0,0,0,0|2,0,0]=4 13117 B13R0.202 CC(C)CSCCCCNC(C)CO 38bc784012c40bf121f9a669e0a7df31 [0,2,0,0,0,0|2,0,0]=4 13118 B13R0.202 CC(C)CSCCCCN[C@@H](C)CO 4dff7ade5ec2bc5cd363493af4c45f86 [0,2,0,0,0,0|2,0,0]=4 13119 B13R0.202 CC(C)CSCCCCN[C@H](C)CO 997209504348735fbdccdf8f9f3ae44c [0,2,0,0,0,0|2,0,0]=4 13120 B13R0.202 CC(C)CSCCCOCC(O)CO 635127bcdb17c0b928bd22d992c8eb2d [0,2,0,0,0,0|2,0,0]=4 13121 B13R0.202 CC(C)CSCCCOC[C@@H](O)CO b618e87a9a3b3c9cea58e3fb78fa8ea7 [0,2,0,0,0,0|2,0,0]=4 13122 B13R0.202 CC(C)CSCCCOC[C@H](O)CO 162fc5f4119c0d8287b47c7af371a713 [0,2,0,0,0,0|2,0,0]=4 13123 B13R0.202 CC(CO)CCCNCCCN(C)C f19b1ff820e05dfb8bb65bcb47ef1ea0 [0,2,0,0,0,0|2,0,0]=4 13124 B13R0.202 CC(CO)CCCNCCOC(C)C 58afd3e5c27743ef31bf009c79a2bcba [0,2,0,0,0,0|2,0,0]=4 13125 B13R0.202 CC(CO)CCCNCCSC(C)C 766cfe01ae70cdc1ab1531d7e8273849 [0,2,0,0,0,0|2,0,0]=4 13126 B13R0.202 CC(CO)CCNCCCCC(F)F 4a66a7a0dac3c2ca9d64b79c34d29534 [0,2,0,0,0,0|2,0,0]=4 13127 B13R0.202 CC(CO)CCNCCCCN(C)C 95c27ce65a994986055f37580a81b316 [0,2,0,0,0,0|2,0,0]=4 13128 B13R0.202 CC(CO)CCNCCCC[C@@H](C)O e585f80a285fb62916d5e35504051bd4 [0,2,0,0,0,0|1,0,0]=3 13129 B13R0.202 CC(CO)CCNCCCOC(C)C f1d738087881cf9618dbed05d5744f0f [0,2,0,0,0,0|2,0,0]=4 13130 B13R0.202 CC(CO)CCNCCCSC(C)C d98023c10d7e1c1e055a54008efed0b6 [0,2,0,0,0,0|2,0,0]=4 13131 B13R0.202 CC(CO)CNCCCCCC(F)F 4035d25fa11f85350fe9d6e0d52a243e [0,2,0,0,0,0|2,0,0]=4 13132 B13R0.202 CC(CO)CNCCCCCN(C)C 626e5d07d52dd4721391776d53216be1 [0,2,0,0,0,0|2,0,0]=4 13133 B13R0.202 CC(CO)NCCCCCCN(C)C e2d6b50892e36144bbb58b985aa5dc14 [0,2,0,0,0,0|2,0,0]=4 13134 B13R0.202 CC(O)CCCCNCCC(C)CO d8fa4c90ecbe4cb705fec273b05b44d0 [0,2,0,0,0,0|1,0,0]=3 13135 B13R0.202 CC(O)CCCCNCCC(O)CO ab40216b2d96a2d7d49e5272ca1313c8 [0,2,0,0,0,0|1,0,0]=3 13136 B13R0.202 CC(O)CCCCNCC[C@@H](C)CO 5efdcf50be439a225acfb2977e6616b2 [0,2,0,0,0,0|1,0,0]=3 13137 B13R0.202 CC(O)CCCNCCCC(C)CO 298894761edabedd2479ed21a1dfbbbf [0,2,0,0,0,0|1,0,0]=3 13138 B13R0.202 CCC(=O)CCCCNCCC(C)C 7590efba4e00804b3653bc56a63f5218 [0,2,0,0,0,0|1,0,1]=4 13139 B13R0.202 CCC(=O)CCCCNCCC(C)O 2a7a3218a7a38467a58b67bce5660c00 [0,2,0,0,0,0|0,0,1]=3 13140 B13R0.202 CCC(=O)CCCCNCC[C@@H](C)O 0f0e4818d5e1ddd49fef4e714d7089ae [0,2,0,0,0,0|0,0,1]=3 13141 B13R0.202 CCC(=O)CCCCNCC[C@H](C)O aa74ec3c1c711f181334a5c84bf073fc [0,2,0,0,0,0|0,0,1]=3 13142 B13R0.202 CCC(=O)CCCCOCCC(C)C eeedc5325e55bf9094b675d25c097e64 [0,2,0,0,0,0|1,0,1]=4 13143 B13R0.202 CCC(=O)CNCCCCCC(C)C 99b4c6afc62c4d394eb4263b12fb7e87 [0,2,0,0,0,0|1,0,1]=4 13144 B13R0.202 CCC(=O)COCCCCCC(C)C 58fffbaccd721de6c2f67bc09f79ee83 [0,2,0,0,0,0|1,0,1]=4 13145 B13R0.202 CCC(=O)NCCCCCCC(C)C eb2cf4b8f942fa40545e00d0f9280378 [0,2,0,0,0,0|1,0,1]=4 13146 B13R0.202 CCC(=O)NCCNCCCC(C)O da68796facd1ad174739e4054d5a2e2b [0,2,0,0,0,0|1,0,1]=4 13147 B13R0.202 CCC(C)CCCCCOCC(=O)O 926dd9773fa2a85d66e5b123b84c5dd9 [0,2,0,0,0,0|1,0,1]=4 13148 B13R0.202 CCC(C)CCCCCOCC(C)C 339fbee0d2af90f008d266c3e8d4b061 [0,2,0,0,0,0|1,0,0]=3 13149 B13R0.202 CCC(C)CCCCCOCC(F)F 1862cbab821848e117b15f5e3104a7e8 [0,2,0,0,0,0|2,0,0]=4 13150 B13R0.202 CCC(C)CCCCCOCN(C)C 09ea5c568c16908d20e3a056ef9609af [0,2,0,0,0,0|2,0,0]=4 13151 B13R0.202 CCC(C)CCCCOCCC(=O)C 54f18a81a1c174c3f4745676ad2d60ba [0,2,0,0,0,0|0,0,2]=4 13152 B13R0.202 CCC(C)CCCCOCCC(=O)O e349cac23b68b34796b1edaa3218c47b [0,2,0,0,0,0|1,0,1]=4 13153 B13R0.202 CCC(C)CCCCOCCC(C)C 6b4ecad45e6c3ba9bcda3773ce069e6d [0,2,0,0,0,0|1,0,0]=3 13154 B13R0.202 CCC(C)CCCCOCCN(C)C c474a6dbfdc8c5c40d4a9e2d9470d81a [0,2,0,0,0,0|2,0,0]=4 13155 B13R0.202 CCC(C)CCCCOCCS(=O)C a46f29a1fb3a08a85e189a5f2288814a [0,2,0,0,0,0|1,0,1]=4 13156 B13R0.202 CCC(C)CCCCOCOC(C)C 8293d82e92b4b1423aae9eeef8cd3dc5 [0,2,0,0,0,0|2,0,0]=4 13157 B13R0.202 CCC(C)CCCOCCCC(=O)C c7ac7ff5d053a1969bb42d0da41ad481 [0,2,0,0,0,0|0,0,2]=4 13158 B13R0.202 CCC(C)CCCOCCCC(C)C a2c41022a625f3a64ba8a9b5a0a97e6d [0,2,0,0,0,0|1,0,0]=3 13159 B13R0.202 CCC(C)CCCOCCCN(C)C f52a7b04ddd113b9b4ef8a8641d25bdd [0,2,0,0,0,0|2,0,0]=4 13160 B13R0.202 CCC(C)CCCOCCOC(C)C be2b536441dc9768e89674c0b2418539 [0,2,0,0,0,0|2,0,0]=4 13161 B13R0.202 CCC(C)CCCOCCSC(C)C 949fd5ab8e786d8fe9f6c302e07a7004 [0,2,0,0,0,0|2,0,0]=4 13162 B13R0.202 CCC(C)CCNCCCCC(=O)C 48fac8c19ce2ed315f4816b362da1578 [0,2,0,0,0,0|0,0,2]=4 13163 B13R0.202 CCC(C)CCNCCCCC(=O)O 2c2e9bc19196ce2332247b914388b22d [0,2,0,0,0,0|1,0,1]=4 13164 B13R0.202 CCC(C)CCNCCCCC(C)C 04510deb6d83f5c57df89d68119c960b [0,2,0,0,0,0|1,0,0]=3 13165 B13R0.202 CCC(C)CCNCCCCC(C)O 3fccb1d77f9dad5193d5084808ad1ce4 [0,2,0,0,0,0|0,0,0]=2 13166 B13R0.202 CCC(C)CCNCCCCC(F)F f4c95f3f9ff44b05f6d52a3a809b692d [0,2,0,0,0,0|2,0,0]=4 13167 B13R0.202 CCC(C)CCNCCCCN(C)C 2d6594e81af15041acf3d3611d1f2abe [0,2,0,0,0,0|2,0,0]=4 13168 B13R0.202 CCC(C)CCNCCCC[C@@H](C)O 8ba3ff92a830e5f07801a5bb51d86ce4 [0,2,0,0,0,0|0,0,0]=2 13169 B13R0.202 CCC(C)CCNCCCOC(C)C eda9431aa1ee7a90036512fe9815252a [0,2,0,0,0,0|2,0,0]=4 13170 B13R0.202 CCC(C)CCNCCCSC(C)C f13955f38a25cf0662bbe069df3ef287 [0,2,0,0,0,0|2,0,0]=4 13171 B13R0.202 CCC(C)CCNCCOCC(C)C 38316efe80aa13531d9410d1854354e8 [0,2,0,0,0,0|2,0,0]=4 13172 B13R0.202 CCC(C)CCOCCCCC(=O)C 5cd3e8475ac851c6e612fad2be5b556d [0,2,0,0,0,0|0,0,2]=4 13173 B13R0.202 CCC(C)CCOCCCCC(=O)O 5d8d6098c7ff5f00b7d0ec54081d7d0a [0,2,0,0,0,0|1,0,1]=4 13174 B13R0.202 CCC(C)CCOCCCCC(C)C c166a0d896246a15420a7472f317915b [0,2,0,0,0,0|1,0,0]=3 13175 B13R0.202 CCC(C)CCOCCCCN(C)C 17d4f4ece7895851d00cf80d86e5b0b7 [0,2,0,0,0,0|2,0,0]=4 13176 B13R0.202 CCC(C)CCOCCCOC(C)C 8e5ade5944c6f784818a32dad9af1de9 [0,2,0,0,0,0|2,0,0]=4 13177 B13R0.202 CCC(C)CCOCCCSC(C)C c41040672a65ded98c644ad361122da3 [0,2,0,0,0,0|2,0,0]=4 13178 B13R0.202 CCC(C)CCOCCOCC(C)C 492740d23c0b189372ed0d0089e80769 [0,2,0,0,0,0|2,0,0]=4 13179 B13R0.202 CCC(C)CCOCCSCC(C)C 49a6b4930b672c81a182699a993b10b4 [0,2,0,0,0,0|2,0,0]=4 13180 B13R0.202 CCC(C)CNCCCCCC(=O)C 085eb50541ca48da4ad9f6b2c650cdfc [0,2,0,0,0,0|0,0,2]=4 13181 B13R0.202 CCC(C)CNCCCCCC(=O)O f0762d0d7d0199a3e278e1d18fd7b9e2 [0,2,0,0,0,0|1,0,1]=4 13182 B13R0.202 CCC(C)CNCCCCCC(C)C aebc9b674f37afb84e030cc5067f9263 [0,2,0,0,0,0|1,0,0]=3 13183 B13R0.202 CCC(C)CNCCCCCC(F)F 6dd3d7e57dd609f38e03c02c511ce168 [0,2,0,0,0,0|2,0,0]=4 13184 B13R0.202 CCC(C)CNCCCCCN(C)C 9e3b7640f9480e9435d4598784c321fb [0,2,0,0,0,0|2,0,0]=4 13185 B13R0.202 CCC(C)CNCCCOCC(C)C 87392993980d0f8dbb0357f77dc2e79e [0,2,0,0,0,0|2,0,0]=4 13186 B13R0.202 CCC(C)COCCCCCC(=O)C 91a9652dc9a61fd7771f45f3969844c0 [0,2,0,0,0,0|0,0,2]=4 13187 B13R0.202 CCC(C)COCCCCCC(=O)O 0d8938020f60603da5780242a513504b [0,2,0,0,0,0|1,0,1]=4 13188 B13R0.202 CCC(C)COCCCCCC(C)C 4afbca4ea519e5dafe89658af50d1d43 [0,2,0,0,0,0|1,0,0]=3 13189 B13R0.202 CCC(C)COCCCCCC(F)F bfe74c6ef319b216410bb66e68129856 [0,2,0,0,0,0|2,0,0]=4 13190 B13R0.202 CCC(C)COCCCCCN(C)C f6be45246dd5ce43b15070149e6e33ca [0,2,0,0,0,0|2,0,0]=4 13191 B13R0.202 CCC(C)COCCCOCC(C)C 123dd96f6b224781053e64e112cf50f3 [0,2,0,0,0,0|2,0,0]=4 13192 B13R0.202 CCC(C)COCCCSCC(C)C 72e5181b61c2846ede3ba152776a4f56 [0,2,0,0,0,0|2,0,0]=4 13193 B13R0.202 CCC(C)NCCCCCCC(=O)O c9a0605fb4dac6b80e99b2cca621df49 [0,2,0,0,0,0|1,0,1]=4 13194 B13R0.202 CCC(C)NCCCCCCC(C)C dd10b47ff03333c877a94e428da8886a [0,2,0,0,0,0|1,0,0]=3 13195 B13R0.202 CCC(C)NCCCCCCN(C)C 564784b133e6231a7bb7b8d9f0d3ed41 [0,2,0,0,0,0|2,0,0]=4 13196 B13R0.202 CCC(C)NCCCCSCC(C)C 779388d5157761fbcaca56d2a283a65c [0,2,0,0,0,0|2,0,0]=4 13197 B13R0.202 CCC(C)OCCCCCCC(=O)O cee2aee3bdfe7f490277d7aac3f426fe [0,2,0,0,0,0|1,0,1]=4 13198 B13R0.202 CCC(C)OCCCCCCC(C)C 6507b534f6d6d62471d90fdf785556b9 [0,2,0,0,0,0|1,0,0]=3 13199 B13R0.202 CCC(C)OCCCCCCN(C)C c5408e444436497804d5201b1ba5afc9 [0,2,0,0,0,0|2,0,0]=4 13200 B13R0.202 CCC(O)CNCCCCCC(=O)C d532b794415396ab6cd2b3066b4ca476 [0,2,0,0,0,0|0,0,2]=4 13201 B13R0.202 CCC(O)CNCCCCCC(=O)O 9cb659addd6fc27e028dcdc558d3ee4d [0,2,0,0,0,0|1,0,1]=4 13202 B13R0.202 CCC(O)CNCCCCCC(C)C 26426aae1aaf3d0b470d9c423282c2c4 [0,2,0,0,0,0|1,0,0]=3 13203 B13R0.202 CCC(O)CNCCCCCC(F)F eb2969230767b7d2520f643f61923f6c [0,2,0,0,0,0|2,0,0]=4 13204 B13R0.202 CCC(O)CNCCCCCN(C)C 42f7e27d757b9acf1dea07a069728b7f [0,2,0,0,0,0|2,0,0]=4 13205 B13R0.202 CCC(O)CNCCCOCC(C)C 4c5a5c77d6da7275ad0c83d87732b52d [0,2,0,0,0,0|2,0,0]=4 13206 B13R0.202 CCC(S)CCOCCCCC(=O)C 24f708aebd1bb74c2e115731148aa9fe [0,2,0,0,0,0|0,0,2]=4 13207 B13R0.202 CCC(S)CCOCCCCC(=O)O 51faddd23de53feb4b0981d3820a0a24 [0,2,0,0,0,0|1,0,1]=4 13208 B13R0.202 CCC(S)CCOCCCCC(C)C d659f18d0059d447e5cdea05b8a4d582 [0,2,0,0,0,0|1,0,0]=3 13209 B13R0.202 CCC(S)CCOCCCCN(C)C 1e3359ba4c201e52f44318366b8bbc2f [0,2,0,0,0,0|2,0,0]=4 13210 B13R0.202 CCC(S)CCOCCOCC(C)C 1590e376c7510abc06c374877113b598 [0,2,0,0,0,0|2,0,0]=4 13211 B13R0.202 CCN(C)CCCCCCCC(=O)O 1e552a237f38420a20a16485c8f0f263 [0,2,0,0,0,0|1,0,1]=4 13212 B13R0.202 CCN(C)CCCNCCCC(C)C c783de438d43247fa0daf5f075777eec [0,2,0,0,0,0|2,0,0]=4 13213 B13R0.202 CCN(C)CCCNCCCC(C)O 27e8f04df1abd0e6adae13f49f23dc80 [0,2,0,0,0,0|1,0,0]=3 13214 B13R0.202 CCN(C)CCCOCCCC(C)C fdf2b162ef2e3cc542ad0c5648d2d8d3 [0,2,0,0,0,0|2,0,0]=4 13215 B13R0.202 CCS(=O)CCOCCCCC(C)C 61f404245d90fd3598bc2abac1015e1a [0,2,0,0,0,0|2,0,0]=4 13216 B13R0.202 CC[C@@H](C)CNCCCCCC(=O)O f9d8b71ae5ec712d10a11cc43204b0f0 [0,2,0,0,0,0|1,0,1]=4 13217 B13R0.202 CC[C@@H](C)CNCCCCCC(C)C 8d46042c9db9727b96a6bd780a332f09 [0,2,0,0,0,0|1,0,0]=3 13218 B13R0.202 CC[C@@H](C)CNCCCCCN(C)C 28b8e1c60b990e8c98f7ca4f5e5de446 [0,2,0,0,0,0|2,0,0]=4 13219 B13R0.202 CC[C@@H](C)CNCCCOCC(C)C 329575f820e95f30538e54a49ee0f967 [0,2,0,0,0,0|2,0,0]=4 13220 B13R0.202 CC[C@@H](C)COCCCCCC(=O)C 622101a81009cfa9088010217c1ce685 [0,2,0,0,0,0|0,0,2]=4 13221 B13R0.202 CC[C@@H](C)COCCCCCC(=O)O 6436d268261ab433cf23d9a08e03219f [0,2,0,0,0,0|1,0,1]=4 13222 B13R0.202 CC[C@@H](C)COCCCCCC(C)C ba4f48499b6468a97bba72893694de18 [0,2,0,0,0,0|1,0,0]=3 13223 B13R0.202 CC[C@@H](C)COCCCCCC(F)F fd3600b5982ea2a5a2d9d47773051d7f [0,2,0,0,0,0|2,0,0]=4 13224 B13R0.202 CC[C@@H](C)COCCCCCN(C)C cd697651a02aa9f5829b1bbc0146cb02 [0,2,0,0,0,0|2,0,0]=4 13225 B13R0.202 CC[C@@H](C)COCCCOCC(C)C 103d684b64575c25cc702f44252de181 [0,2,0,0,0,0|2,0,0]=4 13226 B13R0.202 CC[C@@H](C)COCCCSCC(C)C 0ed40e5194eab4b4b1348034ed7302b1 [0,2,0,0,0,0|2,0,0]=4 13227 B13R0.202 CC[C@@H](O)CNCCCCCC(=O)C c5d013cf4119b03b91368f66be904b11 [0,2,0,0,0,0|0,0,2]=4 13228 B13R0.202 CC[C@@H](O)CNCCCCCC(=O)O 6d006527d7e8a8adfc8177ab38e36dd0 [0,2,0,0,0,0|1,0,1]=4 13229 B13R0.202 CC[C@@H](O)CNCCCCCC(C)C b9f4945ec58abf70908fe5d0b3fb4160 [0,2,0,0,0,0|1,0,0]=3 13230 B13R0.202 CC[C@@H](O)CNCCCCCC(F)F 4a48571f45fec1e2ba7c2cbe39f104d9 [0,2,0,0,0,0|2,0,0]=4 13231 B13R0.202 CC[C@H](C)CCCCCOCC(=O)O 0235bcbfae97e436213a72c5b439dc65 [0,2,0,0,0,0|1,0,1]=4 13232 B13R0.202 CC[C@H](C)CCCCCOCC(C)C bbff0758bc6d6da42373b5b7286aa7b7 [0,2,0,0,0,0|1,0,0]=3 13233 B13R0.202 CC[C@H](C)CCCCCOCC(F)F c90992d1832118fc0cd64afa5b50376f [0,2,0,0,0,0|2,0,0]=4 13234 B13R0.202 CC[C@H](C)CCCCCOCN(C)C 0f40808aaecac60e1abdca664b26b6ec [0,2,0,0,0,0|2,0,0]=4 13235 B13R0.202 CC[C@H](C)CCCCOCCC(=O)C e2ee2d6c0fd97222e8e88f00cea6d3ff [0,2,0,0,0,0|0,0,2]=4 13236 B13R0.202 CC[C@H](C)CCCCOCCC(=O)O 632eacd5eb349e1deb17ad2f023935be [0,2,0,0,0,0|1,0,1]=4 13237 B13R0.202 CC[C@H](C)CCCCOCCC(C)C f2684211ea9d33c667a48f6e638da82f [0,2,0,0,0,0|1,0,0]=3 13238 B13R0.202 CC[C@H](C)CCCCOCCN(C)C 4d1232c018977f79d83addab182fee5f [0,2,0,0,0,0|2,0,0]=4 13239 B13R0.202 CC[C@H](C)CCCCOCCS(=O)C df1ed1a15a84978aee41d2db6e8682ab [0,2,0,0,0,0|1,0,1]=4 13240 B13R0.202 CC[C@H](C)CCCCOCOC(C)C 5da4eeab4fcdafa599d6352cb47dddcb [0,2,0,0,0,0|2,0,0]=4 13241 B13R0.202 CC[C@H](C)CCCOCCCC(=O)C cc34c485ce0a73837730da368a79a841 [0,2,0,0,0,0|0,0,2]=4 13242 B13R0.202 CC[C@H](C)CCCOCCCC(C)C f4e33a76f0a2fd7be4b8b62a977e5536 [0,2,0,0,0,0|1,0,0]=3 13243 B13R0.202 CC[C@H](C)CCCOCCCN(C)C 6b4a8baf1a868e84bbd12576d6ae7c72 [0,2,0,0,0,0|2,0,0]=4 13244 B13R0.202 CC[C@H](C)CCCOCCOC(C)C fb40614d7053cce51efd9510df16b9ee [0,2,0,0,0,0|2,0,0]=4 13245 B13R0.202 CC[C@H](C)CCCOCCSC(C)C 10d8c12ba114e0a7e93b3d1608db5a98 [0,2,0,0,0,0|2,0,0]=4 13246 B13R0.202 CC[C@H](C)CCOCCCCC(=O)C 458426a7058c02733e1d663bab6dfda7 [0,2,0,0,0,0|0,0,2]=4 13247 B13R0.202 CC[C@H](C)CCOCCCCC(=O)O 911969ee0523a8fc220d5d98d6812889 [0,2,0,0,0,0|1,0,1]=4 13248 B13R0.202 CC[C@H](C)CCOCCCCC(C)C 7be43c4f0b757531c4f910d0911b1ff3 [0,2,0,0,0,0|1,0,0]=3 13249 B13R0.202 CC[C@H](C)CCOCCCCN(C)C 87d58ed51418f82e8c4f1f095fa180c4 [0,2,0,0,0,0|2,0,0]=4 13250 B13R0.202 CC[C@H](C)CCOCCOCC(C)C c2489a912f4e542231437e6e230915f7 [0,2,0,0,0,0|2,0,0]=4 13251 B13R0.202 CC[C@H](C)CNCCCCCC(=O)C e35f4bc4c4c9b4394216905f313dda9f [0,2,0,0,0,0|0,0,2]=4 13252 B13R0.202 CC[C@H](C)CNCCCCCC(=O)O 118368c503f4765c395fee35fd723b76 [0,2,0,0,0,0|1,0,1]=4 13253 B13R0.202 CC[C@H](C)CNCCCCCC(C)C 2b1a4c1be6543f878b65731978b57268 [0,2,0,0,0,0|1,0,0]=3 13254 B13R0.202 CC[C@H](C)CNCCCCCC(F)F b16da6a899adae154d5ef85ba4d01b52 [0,2,0,0,0,0|2,0,0]=4 13255 B13R0.202 CC[C@H](C)CNCCCCCN(C)C 6c4104d322449d86fcfa642da47fc858 [0,2,0,0,0,0|2,0,0]=4 13256 B13R0.202 CC[C@H](C)CNCCCOCC(C)C eab92c08108950deaac43320e692ff33 [0,2,0,0,0,0|2,0,0]=4 13257 B13R0.202 CC[C@H](C)COCCCCCC(=O)C ecc47713aa67e21a57988c14fcde8fec [0,2,0,0,0,0|0,0,2]=4 13258 B13R0.202 CC[C@H](C)COCCCCCC(=O)O 6eac032dbf3f73e5f4406eca41efa6c5 [0,2,0,0,0,0|1,0,1]=4 13259 B13R0.202 CC[C@H](C)COCCCCCC(C)C 3dc30293249dc37cd59e8c2d56ac6aa0 [0,2,0,0,0,0|1,0,0]=3 13260 B13R0.202 CC[C@H](C)COCCCCCC(F)F 10b8c68546da98c38a28565424ec8cb8 [0,2,0,0,0,0|2,0,0]=4 13261 B13R0.202 CC[C@H](C)COCCCCCN(C)C 053b20f3fa02ede65fb83de3dd52582a [0,2,0,0,0,0|2,0,0]=4 13262 B13R0.202 CC[C@H](C)COCCCOCC(C)C bc07ec7f26a19c5430ad35dd15a57214 [0,2,0,0,0,0|2,0,0]=4 13263 B13R0.202 CC[C@H](C)COCCCSCC(C)C ed0c2ff58f45ecf3c893f08c6cbcb7e8 [0,2,0,0,0,0|2,0,0]=4 13264 B13R0.202 CN(C)CCCCCNCC(O)CF 56709cc279272d8e46374e5d0c767a12 [0,2,0,0,0,0|2,0,0]=4 13265 B13R0.202 CN(C)CCCCCNCC(O)CO 6c162cd9ba25099f2acb9de731a2ec09 [0,2,0,0,0,0|2,0,0]=4 13266 B13R0.202 CN(C)CCCCCNC[C@@H](O)CO 395ed233e2f51532de637a551b16e3d0 [0,2,0,0,0,0|2,0,0]=4 13267 B13R0.202 CN(C)CCCCCNC[C@H](O)CO e7e0d423ee7e088230554de5157495ae [0,2,0,0,0,0|2,0,0]=4 13268 B13R0.202 CN(C)CCCCCOCC(O)CO 22d27a1f82f614635b552e789f056bf7 [0,2,0,0,0,0|2,0,0]=4 13269 B13R0.202 CN(C)CCCCCOC[C@@H](O)CO 2aa008d3417b5f8a1c9e6eb4a4b06c3c [0,2,0,0,0,0|2,0,0]=4 13270 B13R0.202 CN(C)CCCCCOC[C@H](O)CO bbcb1ded272c6378f1ac08f5179512d0 [0,2,0,0,0,0|2,0,0]=4 13271 B13R0.202 CN(C)CCCCNCCC(O)CO 9d707abddaa7f1479e4f45963ef1303a [0,2,0,0,0,0|2,0,0]=4 13272 B13R0.202 CNC(=O)CCNCCCCC(C)O 94b93b348f20101da885e66ca981d0c8 [0,2,0,0,0,0|1,0,1]=4 13273 B13R0.202 CNC(=O)CCNCCCC[C@@H](C)O 1af09bce6e16bb2ae41fe1b46fa4fce8 [0,2,0,0,0,0|1,0,1]=4 13274 B13R0.202 COC(=O)CCCCCNCC(C)O 044ce6e17a4ce5ac4cfe65b1fb9f2436 [0,2,0,0,0,0|1,0,1]=4 13275 B13R0.202 COC(=O)CCCCCNC[C@@H](C)O f930ca8614e6bd54dff6e74cf2d37d4e [0,2,0,0,0,0|1,0,1]=4 13276 B13R0.202 COC(=O)CCCCCNC[C@H](C)O 1024404445b933d891a09b8cb6dba741 [0,2,0,0,0,0|1,0,1]=4 13277 B13R0.202 COC(=O)CCCCNCCC(C)O 3b0970821808f5ed8d3b303c537ff3b9 [0,2,0,0,0,0|1,0,1]=4 13278 B13R0.202 COC(=O)CCCCNCC[C@@H](C)O 6bc8af2beaf59b3378aff3ca3ae1abdf [0,2,0,0,0,0|1,0,1]=4 13279 B13R0.202 COC(=O)CCCCNCC[C@H](C)O b642393821d9c9c490af818b5404b312 [0,2,0,0,0,0|1,0,1]=4 13280 B13R0.202 COC(=O)CCCNCCCC(C)O bcf11727ef3f28e63ac8f3d62d987e56 [0,2,0,0,0,0|1,0,1]=4 13281 B13R0.202 COC(=O)CCNCCCCC(C)O b6275be8e4bc39fbba2119e165cac213 [0,2,0,0,0,0|1,0,1]=4 13282 B13R0.202 COC(=O)CCNCCCC[C@@H](C)O 726ecf9fce18bd8583f55f9bc9eb9eca [0,2,0,0,0,0|1,0,1]=4 13283 B13R0.202 COC(C)CCOCCCCC(=O)C 1cebc286eba275abcb548be9ddf9ba34 [0,2,0,0,0,0|1,0,1]=4 13284 B13R0.202 COC(C)CCOCCCCC(C)C f1774eac80887916927ff2c8880b7521 [0,2,0,0,0,0|1,0,0]=3 13285 B13R0.202 COC(C)CCOCCCCN(C)C 8056917cf52a27c8281a213a3a3162c4 [0,2,0,0,0,0|2,0,0]=4 13286 B13R0.202 COC(C)CCOCCOCC(C)C 793d468cbfa36ee6259793cca311f8b2 [0,2,0,0,0,0|2,0,0]=4 13287 B13R0.202 COC(C)CNCCCCCC(C)C 462eeea6f9e384b1ddd3dd4a4dd30fe6 [0,2,0,0,0,0|1,0,0]=3 13288 B13R0.202 COC(C)CNCCCCCN(C)C 89862968454cda3c0a3647c08bc8ef5c [0,2,0,0,0,0|2,0,0]=4 13289 B13R0.202 COC(C)CNCCCOCC(C)C 2486d882bcb495693db392132149b93d [0,2,0,0,0,0|2,0,0]=4 13290 B13R0.202 COC(C)COCCCCCC(=O)C 3b6398431960c89d90591ff5b662a90d [0,2,0,0,0,0|1,0,1]=4 13291 B13R0.202 COC(C)COCCCCCC(C)C e894d5d545758709bec357670ce9ce1c [0,2,0,0,0,0|1,0,0]=3 13292 B13R0.202 COC(C)COCCCCCC(F)F 0a26ad2d4302acf9a5a47745aba4d15b [0,2,0,0,0,0|2,0,0]=4 13293 B13R0.202 COC(C)COCCCCCN(C)C 7ee6028deaea33504c6e2fda35850ee1 [0,2,0,0,0,0|2,0,0]=4 13294 B13R0.202 COC(C)COCCCOCC(C)C 05712163fc07808af5ec6144bf26c2f4 [0,2,0,0,0,0|2,0,0]=4 13295 B13R0.202 COC(C)COCCCSCC(C)C 17e22bd300470d421eb41b4bc507a3c6 [0,2,0,0,0,0|2,0,0]=4 13296 B13R0.202 CO[C@@H](C)CNCCCCCC(=O)C c4b63649ea981a1b12a19d2f8194918e [0,2,0,0,0,0|1,0,1]=4 13297 B13R0.202 CO[C@@H](C)CNCCCCCC(C)C 699ecd1b30da525238a68b6a607a8e3d [0,2,0,0,0,0|1,0,0]=3 13298 B13R0.202 CO[C@@H](C)CNCCCCCC(F)F b3683aa2ea978adf8976178cb323e989 [0,2,0,0,0,0|2,0,0]=4 13299 B13R0.202 CO[C@@H](C)CNCCCCCN(C)C 444baf72956d4793d25b549883175e0e [0,2,0,0,0,0|2,0,0]=4 13300 B13R0.202 CO[C@@H](C)CNCCCOCC(C)C 8e54bd4308f266cbe0de605f9e81faf1 [0,2,0,0,0,0|2,0,0]=4 13301 B13R0.202 CO[C@@H](C)COCCCCCC(=O)C 82de2721a940ccd84fd3bece4d73629e [0,2,0,0,0,0|1,0,1]=4 13302 B13R0.202 CO[C@@H](C)COCCCCCC(C)C 6003d9575cef63c96a0089da7577f6dc [0,2,0,0,0,0|1,0,0]=3 13303 B13R0.202 CO[C@@H](C)COCCCCCC(F)F 5eea7a2d4421a2b3ee4582d5a34ecbe1 [0,2,0,0,0,0|2,0,0]=4 13304 B13R0.202 CO[C@@H](C)COCCCCCN(C)C f6a61ac366d6bed3656bf5098bfe3b5d [0,2,0,0,0,0|2,0,0]=4 13305 B13R0.202 CO[C@@H](C)COCCCOCC(C)C 2b549fcea46f081790c48c8bc83dc916 [0,2,0,0,0,0|2,0,0]=4 13306 B13R0.202 CO[C@@H](C)COCCCSCC(C)C bfe988f2fede7c123e1f230939c31c9e [0,2,0,0,0,0|2,0,0]=4 13307 B13R0.202 CO[C@H](C)CNCCCCCC(=O)C ab4449e9d1ef72329ae6a702a5ce9241 [0,2,0,0,0,0|1,0,1]=4 13308 B13R0.202 CO[C@H](C)CNCCCCCC(C)C 2829562d3d5f22b9fff692c7f5b61f20 [0,2,0,0,0,0|1,0,0]=3 13309 B13R0.202 CO[C@H](C)CNCCCCCC(F)F 106fb3ff461c018d6b01887e25daea3c [0,2,0,0,0,0|2,0,0]=4 13310 B13R0.202 CO[C@H](C)CNCCCCCN(C)C 880d586736ec8a4769e9932e3eca91aa [0,2,0,0,0,0|2,0,0]=4 13311 B13R0.202 CO[C@H](C)CNCCCOCC(C)C a38e9f07bba000e4a8fc8cf133b9c367 [0,2,0,0,0,0|2,0,0]=4 13312 B13R0.202 CO[C@H](C)COCCCCCC(=O)C a68af72c63e08c67db1ec2443284d510 [0,2,0,0,0,0|1,0,1]=4 13313 B13R0.202 CO[C@H](C)COCCCCCC(C)C 8d0dad5ffda926fa905afb8cedb191ce [0,2,0,0,0,0|1,0,0]=3 13314 B13R0.202 CO[C@H](C)COCCCCCC(F)F 8b67e342ffc5c123bfde52172773de53 [0,2,0,0,0,0|2,0,0]=4 13315 B13R0.202 CO[C@H](C)COCCCCCN(C)C 2479ffd122747a94b9c32f6cb3d2fca2 [0,2,0,0,0,0|2,0,0]=4 13316 B13R0.202 CO[C@H](C)COCCCOCC(C)C 928e1db0871cafb2165a47ef5264336c [0,2,0,0,0,0|2,0,0]=4 13317 B13R0.202 CO[C@H](C)COCCCSCC(C)C 0a4892a4edeefaaedd1662208fd06412 [0,2,0,0,0,0|2,0,0]=4 13318 B13R0.202 C[C@@H](CO)CCNCCCCN(C)C 5637c597f4e635671911c579dbab2360 [0,2,0,0,0,0|2,0,0]=4 13319 B13R0.202 C[C@@H](CO)CCNCCCC[C@@H](C)O 2a09348f9a95e91f28ad531c7b3b0c5f [0,2,0,0,0,0|1,0,0]=3 13320 B13R0.202 C[C@@H](CO)CNCCCCCN(C)C 5cc878c25c7ea705e552e1753cbfe8a1 [0,2,0,0,0,0|2,0,0]=4 13321 B13R0.202 C[C@@H](CO)NCCCCCCN(C)C d1fe327bdf3cb1d4b344af1a4e19e266 [0,2,0,0,0,0|2,0,0]=4 13322 B13R0.202 C[C@@H](O)CCCCNCCC(O)CO 4ae5e984c0b6c572aa99206f2992299b [0,2,0,0,0,0|1,0,0]=3 13323 B13R0.202 C[C@H](CO)CNCCCCCC(F)F 8dff1fcbc9277de95c0ba80be8673319 [0,2,0,0,0,0|2,0,0]=4 13324 B13R0.202 C[C@H](CO)CNCCCCCN(C)C 67083b09dcb0c31e51e0fea9c28742a4 [0,2,0,0,0,0|2,0,0]=4 13325 B13R0.202 C[C@H](CO)NCCCCCCN(C)C d72101c8da4eaeb6442d63ebc7fe9aeb [0,2,0,0,0,0|2,0,0]=4 13326 B13R0.202 OCC(O)CNCCCCCC(F)F ee08588d342bbd488ce9edd1ed4f75e6 [0,2,0,0,0,0|2,0,0]=4 13327 B13R0.202 OC[C@@H](O)CNCCCCCC(F)F fd63c99ad3b62102b265b92a2955bfbf [0,2,0,0,0,0|2,0,0]=4 13328 B13R0.202 OC[C@H](O)CNCCCCCC(F)F 57b9e7a44847d0f0707b9cde4bc65e17 [0,2,0,0,0,0|2,0,0]=4 13329 B13R0.2 C#CCC(C)OCCCCCCCC 937c55822be9b79266ea778fad5bebb2 [0,2,0,0,0,0|2,0,0]=4 13330 B13R0.2 C#CCN(C)CCCCCCCCC ba95a438b80e8c29cc0cd52a295909b8 [0,2,0,0,0,0|2,0,0]=4 13331 B13R0.2 C/C=C/C(C)OCCCCCCCC d9747d0c0d408af061c92e2b7e752941 [0,2,0,0,0,0|2,0,0]=4 13332 B13R0.2 C=CCC(C)CNCCCCCCC 9e016555b415726614654cc907cd3be3 [0,2,0,0,0,0|2,0,0]=4 13333 B13R0.2 C=CCC(C)COCCCCCCC b28ba158299beb6f620112599b978627 [0,2,0,0,0,0|2,0,0]=4 13334 B13R0.2 C=CCC(C)OCCCCCCCC 86eaae340742b9a7ac2a90522c881ca2 [0,2,0,0,0,0|2,0,0]=4 13335 B13R0.2 C=CCC(O)CNCCCCCCC 059f14438aa0f68162cdc68bb5744d7d [0,2,0,0,0,0|1,0,0]=3 13336 B13R0.2 C=CCC(O)CNCCCCCCF a36e10c6e717564cdcaad2ce4bad43b9 [0,2,0,0,0,0|2,0,0]=4 13337 B13R0.2 C=CCC(O)CNCCCCCCO 00fd18e1801c1f0a43fdc9f68f22d7bb [0,2,0,0,0,0|2,0,0]=4 13338 B13R0.2 C=CCC(O)CNCCCCCOC 7b3f6654d0e9ca3f56c011dc991d647f [0,2,0,0,0,0|2,0,0]=4 13339 B13R0.2 C=CCC(O)CNCCCOCCC 00a476ba7bc42cc220ac554b3d1b39da [0,2,0,0,0,0|2,0,0]=4 13340 B13R0.2 C=CCC(O)CNCCOCCCC f5a0a8d3c7544666ac4ea0e6bb87a853 [0,2,0,0,0,0|2,0,0]=4 13341 B13R0.2 C=CCN(C)CCCCCCCCC da3eebe8ef8969666fcc0666ff4d42fb [0,2,0,0,0,0|2,0,0]=4 13342 B13R0.2 C=CC[C@@H](C)OCCCCCCCC 675246291751cc2c6f95dcaf4ceefe13 [0,2,0,0,0,0|2,0,0]=4 13343 B13R0.2 C=CC[C@H](C)OCCCCCCCC c2e644049b31b286baeb5b7da51a3476 [0,2,0,0,0,0|2,0,0]=4 13344 B13R0.2 CC#CC(C)OCCCCCCCC d6bbfd5db0bda740669d4b63b50ec20c [0,2,0,0,0,0|2,0,0]=4 13345 B13R0.2 CC(CCO)CNCCCCCCF ce2a332848487c548d64d11f9a5dac90 [0,2,0,0,0,0|2,0,0]=4 13346 B13R0.2 CC(CCO)CNCCCCCCO d95358d54ed452c40f5b7eb2e2fb5947 [0,2,0,0,0,0|2,0,0]=4 13347 B13R0.2 CC(CCO)NCCCCCCCO 8b9266b788f4d3172c764f41e1e8ecb1 [0,2,0,0,0,0|2,0,0]=4 13348 B13R0.2 CC=CC(C)OCCCCCCCC 722238189d6d583fbe51bb1394897b60 [0,2,0,0,0,0|2,0,0]=4 13349 B13R0.2 CCCC(O)CNCCCCCCF 2cfbc03c2b908073e43b069ba06af2a8 [0,2,0,0,0,0|2,0,0]=4 13350 B13R0.2 CCCC(O)CNCCCCCCO c246910355e8b4e43db290520e7ac449 [0,2,0,0,0,0|2,0,0]=4 13351 B13R0.2 CCCC(O)CNCCCCCOC 1659b09a18bd75615567e1fbe5e2ef36 [0,2,0,0,0,0|2,0,0]=4 13352 B13R0.2 CCCCCCCCCC(C)OCC 7a0341b8dd17316efdf4f1cab1c9b4d8 [0,2,0,0,0,0|0,0,0]=2 13353 B13R0.2 CCCCCCCCCC(C)OCF 3f7c3c73009d111994e17002f7a1aa42 [0,2,0,0,0,0|0,0,0]=2 13354 B13R0.2 CCCCCCCCCN(C)CC#N 038c50d2ce3310899811d6779e358485 [0,2,0,0,0,0|2,0,0]=4 13355 B13R0.2 CCCCCCCCCN(C)CC=O be51d1783974737cf1b2336405d1cec0 [0,2,0,0,0,0|1,0,1]=4 13356 B13R0.2 CCCCCCCCCN(C)CCC c1ccda68f754339cd2e4bb896a7b84cd [0,2,0,0,0,0|2,0,0]=4 13357 B13R0.2 CCCCCCCCCN(C)CCF d6e8a16e0673f4d68f996849ed2fb64d [0,2,0,0,0,0|2,0,0]=4 13358 B13R0.2 CCCCCCCCCN(C)CCO e86a6ec2d45cc3087c2f98ff67146fe4 [0,2,0,0,0,0|1,0,0]=3 13359 B13R0.2 CCCCCCCCCN(C)CCS 6116b4926bf68382e72bc3f2f8c011b7 [0,2,0,0,0,0|1,1,0]=4 13360 B13R0.2 CCCCCCCCCN(C)COC 109463908101ed291492e18ca8421e24 [0,2,0,0,0,0|1,0,0]=3 13361 B13R0.2 CCCCCCCCCN(C)CSC 45a8aef9ac32f7fd3e9045829569ed7a [0,2,0,0,0,0|1,1,0]=4 13362 B13R0.2 CCCCCCCCC[C@@H](C)OCC da8c08fd7fd32791b035c43a670549d7 [0,2,0,0,0,0|0,0,0]=2 13363 B13R0.2 CCCCCCCCC[C@@H](C)OCF 926199d481a6f4a55efe9b230bd8edfd [0,2,0,0,0,0|0,0,0]=2 13364 B13R0.2 CCCCCCCCNC(C)CC#N 43c2f98492d4ce910965ff8783dbf7c4 [0,2,0,0,0,0|2,0,0]=4 13365 B13R0.2 CCCCCCCCNC(C)CCC 2b1f88ea1ecd2942058262879bc8be93 [0,2,0,0,0,0|2,0,0]=4 13366 B13R0.2 CCCCCCCCNC(C)CCO a0ab0f0005439106082a8a3ac73ff74f [0,2,0,0,0,0|1,0,0]=3 13367 B13R0.2 CCCCCCCCNC(C)COC 2c830abebd4f40d5656285750345a342 [0,2,0,0,0,0|1,0,0]=3 13368 B13R0.2 CCCCCCCCN[C@@H](C)CCC 1fc0e9844e0d90c3c9bd2836fd8e91ae [0,2,0,0,0,0|2,0,0]=4 13369 B13R0.2 CCCCCCCCN[C@@H](C)CCO e7d24df107dfedac4094efcd2970dc1a [0,2,0,0,0,0|1,0,0]=3 13370 B13R0.2 CCCCCCCCN[C@@H](C)COC aad4872dc72ced7f23e49e1e3e2eed53 [0,2,0,0,0,0|1,0,0]=3 13371 B13R0.2 CCCCCCCCN[C@H](C)CCO 11d8f10109220d8e5d4b44f26e76758b [0,2,0,0,0,0|1,0,0]=3 13372 B13R0.2 CCCCCCCCN[C@H](C)COC 98172b27a867b8537dc469d4a3d22a7b [0,2,0,0,0,0|1,0,0]=3 13373 B13R0.2 CCCCCCCCOC(C)CC#N f33a81ecaf438de8d17eeb3ceb7615f6 [0,2,0,0,0,0|2,0,0]=4 13374 B13R0.2 CCCCCCCCOC(C)CCC f961eb6a0beecb605e28527549a8cb92 [0,2,0,0,0,0|2,0,0]=4 13375 B13R0.2 CCCCCCCCOC(C)COC 810123b756b50ec0092cce9a7d6d9c31 [0,2,0,0,0,0|1,0,0]=3 13376 B13R0.2 CCCCCCCCOC(C)CSC bb30abc4f0e32ec80e8ac8eaac8ea912 [0,2,0,0,0,0|1,1,0]=4 13377 B13R0.2 CCCCCCCCO[C@@H](C)CC#N 7dc8a8dd07beed6b269dc50190fcae0b [0,2,0,0,0,0|2,0,0]=4 13378 B13R0.2 CCCCCCCCO[C@@H](C)CCC 4f36f3698ef38b64dd4a76436fa5157e [0,2,0,0,0,0|2,0,0]=4 13379 B13R0.2 CCCCCCCCO[C@@H](C)COC 766c6c59414a859c6d46be238978348c [0,2,0,0,0,0|1,0,0]=3 13380 B13R0.2 CCCCCCCCO[C@H](C)CC#N 8618c69aa4b5abf12bf17389708ae3f4 [0,2,0,0,0,0|2,0,0]=4 13381 B13R0.2 CCCCCCCCO[C@H](C)CCC 3d57e3b7fb670dccbf462b28ee2f9f24 [0,2,0,0,0,0|2,0,0]=4 13382 B13R0.2 CCCCCCCCO[C@H](C)COC 9c65ade9075cea060f3bc65f98b52534 [0,2,0,0,0,0|1,0,0]=3 13383 B13R0.2 CCCCCCCNCC(C)CCC 5ae782e698c69ac08cfb4c934b22c1df [0,2,0,0,0,0|2,0,0]=4 13384 B13R0.2 CCCCCCCNCC(C)CCO 77ab520e6728338f97c217388605d237 [0,2,0,0,0,0|1,0,0]=3 13385 B13R0.2 CCCCCCCNCC(C)OCC a50d8a5e5eb0dbd0b145220372f5d48b [0,2,0,0,0,0|1,0,0]=3 13386 B13R0.2 CCCCCCCNCC(O)CC#N c2d46b1f79166335a9aa96c74e0142d2 [0,2,0,0,0,0|1,0,0]=3 13387 B13R0.2 CCCCCCCNCC(O)CCC 9e17c5713d8b4ae3716b17629d4734a6 [0,2,0,0,0,0|1,0,0]=3 13388 B13R0.2 CCCCCCCNCC(O)COC 9598fd2a0fba0f8700e0a3d2cdcb85cf [0,2,0,0,0,0|1,0,0]=3 13389 B13R0.2 CCCCCCCNC[C@@H](O)CC#N 3c369dd49310c1de88eade6af10bc97f [0,2,0,0,0,0|1,0,0]=3 13390 B13R0.2 CCCCCCCNC[C@@H](O)CCO 87e0fd350dadfecd26e39a6d5e18a760 [0,2,0,0,0,0|1,0,0]=3 13391 B13R0.2 CCCCCCCNC[C@H](O)CC#N 4227574e98b9fd5c0a4cada6a45957bf [0,2,0,0,0,0|1,0,0]=3 13392 B13R0.2 CCCCCCCNC[C@H](O)COC bcbdc914e5b1da628ee280efd9d82b4f [0,2,0,0,0,0|1,0,0]=3 13393 B13R0.2 CCCCCCCOCC(C)CCC e53f7ab3dbfd9707f67879e0eab0a6b2 [0,2,0,0,0,0|2,0,0]=4 13394 B13R0.2 CCCCCCCOCC(C)OCC 09610f54ce743a9836bdcaf7cca3608e [0,2,0,0,0,0|1,0,0]=3 13395 B13R0.2 CCCCCCCOC[C@@H](O)CCO 0726915f64936645b98900d3b484a985 [0,2,0,0,0,0|1,0,0]=3 13396 B13R0.2 CCCCCCNCCN(C)CCO 7e50554f1a1c9465081d8b7e1012df2b [0,2,0,0,0,0|2,0,0]=4 13397 B13R0.2 CCCCCCOCCC(C)CCC 80102a8f16dc607d17f7291cdb43983d [0,2,0,0,0,0|2,0,0]=4 13398 B13R0.2 CCCCCCOCCC(S)CCC 5449c2fe34f40a803f02c423d863c7ad [0,2,0,0,0,0|1,1,0]=4 13399 B13R0.2 CCCCCNCCCN(C)CCO dad9ff585479176fcad98bd9d7c7015d [0,2,0,0,0,0|2,0,0]=4 13400 B13R0.2 CCCCCOCCCC(C)CCC 9e370c4d17ba093634679993f8382be3 [0,2,0,0,0,0|2,0,0]=4 13401 B13R0.2 CCCCCOCCOC(C)COC fbff34d053d523af189582ee0128d1b4 [0,2,0,0,0,0|2,0,0]=4 13402 B13R0.2 CCCCOCCCNC(C)CCO 1d0801b1bc1e780b0958e1452f4d8498 [0,2,0,0,0,0|2,0,0]=4 13403 B13R0.2 CCCCOCCCNC(C)COC cc7fcc8f8acfd7b6fd12144c691eee3b [0,2,0,0,0,0|2,0,0]=4 13404 B13R0.2 CCCCOCCCOC(C)COC 56cf8f12448900e69eeddf51872cdda2 [0,2,0,0,0,0|2,0,0]=4 13405 B13R0.2 CCCCOCCNCC(C)CCO 45930efb9e84fabdcf60c6db7e4d6607 [0,2,0,0,0,0|2,0,0]=4 13406 B13R0.2 CCCCOCCNCC(C)OCC e164a7607ffdf58c95c99a83ae6b7ad8 [0,2,0,0,0,0|2,0,0]=4 13407 B13R0.2 CCCCOCCNCC(O)CC#N f051e40937eec7caa2aec2061d26b4d1 [0,2,0,0,0,0|2,0,0]=4 13408 B13R0.2 CCCCOCCNCC(O)CCC 4fae9dfc8e95b8c02564daf1071ca256 [0,2,0,0,0,0|2,0,0]=4 13409 B13R0.2 CCCCOCCNCC(O)COC a5b2ba9bf34b858b2f29d89d266658f0 [0,2,0,0,0,0|2,0,0]=4 13410 B13R0.2 CCCCOCCNC[C@@H](O)CC#N 140698b3c478b75c770293ebdad596ab [0,2,0,0,0,0|2,0,0]=4 13411 B13R0.2 CCCCOCCNC[C@@H](O)CCO 70be2b257a6dbbef25f4b8410b0e687a [0,2,0,0,0,0|2,0,0]=4 13412 B13R0.2 CCCCOCCNC[C@H](O)CC#N a72907b3fe761eca24c14cd519ab11cb [0,2,0,0,0,0|2,0,0]=4 13413 B13R0.2 CCCCOCCNC[C@H](O)COC 403650739c82e6affb51d4eb1d846ee9 [0,2,0,0,0,0|2,0,0]=4 13414 B13R0.2 CCCCOCCOCC(C)COC a31037d1f7f35b444c6fd2df490411e7 [0,2,0,0,0,0|2,0,0]=4 13415 B13R0.2 CCCCOCCOCC(C)OCC e0b48563da788f2e752ade86e196e8d2 [0,2,0,0,0,0|2,0,0]=4 13416 B13R0.2 CCCCOCCOC[C@@H](C)COC 96ac85fd44daff664a0315efac27f381 [0,2,0,0,0,0|2,0,0]=4 13417 B13R0.2 CCCCOCCOC[C@@H](O)CCO 604726e72e651508cacde4f6e3fd8096 [0,2,0,0,0,0|2,0,0]=4 13418 B13R0.2 CCCCSCCOC[C@@H](O)CCO d364f1bfd68b638f1b770bd36d28859e [0,2,0,0,0,0|2,0,0]=4 13419 B13R0.2 CCCOCCCNCC(C)CCO 69adcc6deeda96ea86248f06eeb52142 [0,2,0,0,0,0|2,0,0]=4 13420 B13R0.2 CCCOCCCNCC(C)OCC 233e694e0200cdf37216912512748e45 [0,2,0,0,0,0|2,0,0]=4 13421 B13R0.2 CCCOCCCNCC(O)CC#N 8ce8fc6430329933c69f0d77107095ae [0,2,0,0,0,0|2,0,0]=4 13422 B13R0.2 CCCOCCCNCC(O)CCC 1881ae4b54e9a59d4697314ab572f706 [0,2,0,0,0,0|2,0,0]=4 13423 B13R0.2 CCCOCCCNCC(O)COC 5c080a279de4051fb2aef0e3734336f9 [0,2,0,0,0,0|2,0,0]=4 13424 B13R0.2 CCCOCCCNC[C@@H](O)CC#N a5c4276d51ba51a4c70bbd06f0ab5fa8 [0,2,0,0,0,0|2,0,0]=4 13425 B13R0.2 CCCOCCCNC[C@@H](O)CCO 58dac178b71acde91f7b56536bddcdac [0,2,0,0,0,0|2,0,0]=4 13426 B13R0.2 CCCOCCCNC[C@H](O)CC#N aa7947797da48e1ce056ac010bdd0368 [0,2,0,0,0,0|2,0,0]=4 13427 B13R0.2 CCCOCCCNC[C@H](O)COC 1c8b1b291334f20ee0e3c66e01acd997 [0,2,0,0,0,0|2,0,0]=4 13428 B13R0.2 CCCOCCCOCC(C)COC 12a1051a30a98107f1fee350b6a01b7e [0,2,0,0,0,0|2,0,0]=4 13429 B13R0.2 CCCOCCCOCC(C)OCC d654a29ec07eb50df3a38c9e74c97fda [0,2,0,0,0,0|2,0,0]=4 13430 B13R0.2 CCCOCCCOC[C@@H](C)COC 42a745757e99f690eda5855156d9a7ef [0,2,0,0,0,0|2,0,0]=4 13431 B13R0.2 CCCSCCCCNC(C)CCO 8d7cdd989c74f2e3e77065dd3c8e3eaf [0,2,0,0,0,0|2,0,0]=4 13432 B13R0.2 CCCSCCCCNC(C)COC 7c8fb4a0fc4895ea04efc2d4088bd4a9 [0,2,0,0,0,0|2,0,0]=4 13433 B13R0.2 CCOC(C)CNCCCCCCF caadedfa1d8a9a297516fdc00a19ae05 [0,2,0,0,0,0|2,0,0]=4 13434 B13R0.2 CCOC(C)CNCCCCCCO 61c288f755f88066e0e9218170c97500 [0,2,0,0,0,0|2,0,0]=4 13435 B13R0.2 CCOC(C)CNCCCCCOC f136959aaeb770efd12bb682e972b9a8 [0,2,0,0,0,0|2,0,0]=4 13436 B13R0.2 CCOC(C)COCCCCCCF e3053f2eacdb62ebdfff68b231432ee5 [0,2,0,0,0,0|2,0,0]=4 13437 B13R0.2 CCOC(C)COCCCCCOC 9037308f70dcfb964c46bfb14a6b2ac9 [0,2,0,0,0,0|2,0,0]=4 13438 B13R0.2 CCSCCCCNCC(O)CC#N 61460c0a3a03c952142183e117f9ddbe [0,2,0,0,0,0|2,0,0]=4 13439 B13R0.2 CCSCCCCNCC(O)COC 86c1ac431f5d79e58710011e2d412f34 [0,2,0,0,0,0|2,0,0]=4 13440 B13R0.2 CCSCCCCNC[C@@H](O)CC#N 774816d64f90c39a26a89ffc75cb17e1 [0,2,0,0,0,0|2,0,0]=4 13441 B13R0.2 CCSCCCCNC[C@@H](O)CCO 1b5ffc69dfad0be92119526c990965aa [0,2,0,0,0,0|2,0,0]=4 13442 B13R0.2 CCSCCCCNC[C@H](O)CC#N 0abd216d1ee564cfcd6f26d16e2b7a79 [0,2,0,0,0,0|2,0,0]=4 13443 B13R0.2 CN(CCO)CCCCCCCCO e77b45bed7e9f030f8eddd521b95c715 [0,2,0,0,0,0|2,0,0]=4 13444 B13R0.2 COCC(C)NCCCCCCCO 460f05d77b437a43f2675d6cbb29a655 [0,2,0,0,0,0|2,0,0]=4 13445 B13R0.2 COCC(O)CNCCCCCCCl 69df84adcedb1cef0064711a398eb8e8 [0,2,0,0,0,0|2,0,0]=4 13446 B13R0.2 COCC(O)CNCCCCCCF 80a99491767fd8af15f54287c7cc9ec3 [0,2,0,0,0,0|2,0,0]=4 13447 B13R0.2 COCC(O)CNCCCCCCO 5cde5a4c134c65d74490230ef2ef7a94 [0,2,0,0,0,0|2,0,0]=4 13448 B13R0.2 COCCCCCCNC(C)CCO 3534544127c8fbcb7dba3478826eaff3 [0,2,0,0,0,0|2,0,0]=4 13449 B13R0.2 COCCCCCCNC(C)COC 9d33b9bf462d78445881a6c1b2c048d3 [0,2,0,0,0,0|2,0,0]=4 13450 B13R0.2 COCCCCCCN[C@@H](C)CCO 2346abadd9999cfab48b12199bc20338 [0,2,0,0,0,0|2,0,0]=4 13451 B13R0.2 COCCCCCCN[C@@H](C)COC 5883da39d0b3a115c1c2044083daab8c [0,2,0,0,0,0|2,0,0]=4 13452 B13R0.2 COCCCCCCN[C@H](C)CCO 1b6b984c298248cf35eccb6205bdb392 [0,2,0,0,0,0|2,0,0]=4 13453 B13R0.2 COCCCCCCN[C@H](C)COC 8f83958db39bcc238bc6ff69f7479c30 [0,2,0,0,0,0|2,0,0]=4 13454 B13R0.2 COCCCCCCOC(C)COC a8171fe5581d5ebaea63d82714b01aca [0,2,0,0,0,0|2,0,0]=4 13455 B13R0.2 COCCCCCCO[C@@H](C)COC 4e270fa20701f0afdc534a919933f773 [0,2,0,0,0,0|2,0,0]=4 13456 B13R0.2 COCCCCCCO[C@H](C)COC 9a9052bdc66c9f188c79f7c26449d5cf [0,2,0,0,0,0|2,0,0]=4 13457 B13R0.2 COCCCCCNCC(C)CCO 22eff1e0538a277b65dce69dd5bb0049 [0,2,0,0,0,0|2,0,0]=4 13458 B13R0.2 COCCCCCNCC(O)CC#N 096ccec88b815e0b9b01605215b0c297 [0,2,0,0,0,0|2,0,0]=4 13459 B13R0.2 COCCCCCNCC(O)COC af202a841c9c2ee5be82f102df5e0423 [0,2,0,0,0,0|2,0,0]=4 13460 B13R0.2 COCCCCCNC[C@@H](O)CC#N d75387205cd8e9587e2def4fb439bc8a [0,2,0,0,0,0|2,0,0]=4 13461 B13R0.2 COCCCCCNC[C@@H](O)CCO 0eca8d06909bdb14deef10b64b97b841 [0,2,0,0,0,0|2,0,0]=4 13462 B13R0.2 COCCCCCNC[C@H](O)CC#N fdeb38ce311dbbc4f6f8db1780e5e3d4 [0,2,0,0,0,0|2,0,0]=4 13463 B13R0.2 COCCCCCNC[C@H](O)COC 6248aca2b04789582be916dd917f6588 [0,2,0,0,0,0|2,0,0]=4 13464 B13R0.2 COCCCCCOCC(C)COC 7afd665ceaf3e97725ffc484fb9738ea [0,2,0,0,0,0|2,0,0]=4 13465 B13R0.2 COCCCCCOC[C@@H](C)COC 0f6904bd85949f4520aa0a8d4a80c78a [0,2,0,0,0,0|2,0,0]=4 13466 B13R0.2 COC[C@@H](C)NCCCCCCCO 88da47a5608e34115110e7e58ca1520c [0,2,0,0,0,0|2,0,0]=4 13467 B13R0.2 COC[C@@H](O)CNCCCCCCF 5fc80bc4628b57fe9127663178fcde11 [0,2,0,0,0,0|2,0,0]=4 13468 B13R0.2 COC[C@@H](O)CNCCCCCCO 356626310f6dcc51d65ebbc667b6f45d [0,2,0,0,0,0|2,0,0]=4 13469 B13R0.2 COC[C@H](C)NCCCCCCCO 3a919030bba65febaec2b88658a454a9 [0,2,0,0,0,0|2,0,0]=4 13470 B13R0.2 C[C@@H](CCO)NCCCCCCCO fd956b6a81e8796bc3d81bb5832d0778 [0,2,0,0,0,0|2,0,0]=4 13471 B13R0.2 C[C@H](CCO)NCCCCCCCO 80670860a3d967c8dae868b0238fb862 [0,2,0,0,0,0|2,0,0]=4 13472 B13R0.2 N#CCC(O)CNCCCCCCCl 9aabe52668907bf959086f4e8746f988 [0,2,0,0,0,0|2,0,0]=4 13473 B13R0.2 N#CCC(O)CNCCCCCCO 9c440d2cc129c06095a3809975724fd6 [0,2,0,0,0,0|2,0,0]=4 13474 B13R0.2 N#CC[C@@H](O)CNCCCCCCCl b013ff9d5229086da939e7e6224d4366 [0,2,0,0,0,0|2,0,0]=4 13475 B13R0.2 N#CC[C@@H](O)CNCCCCCCO 8fd4c9a54541bac87402349cf5f6204c [0,2,0,0,0,0|2,0,0]=4 13476 B13R0.2 N#CC[C@H](O)CNCCCCCCCl e03cfe4b91970e525a994bad7905bfa5 [0,2,0,0,0,0|2,0,0]=4 13477 B13R0.2 N#CC[C@H](O)CNCCCCCCO bc5bae00e82f8f853abfd50792863912 [0,2,0,0,0,0|2,0,0]=4 13478 B13R0.2 OCCCCCCNC[C@@H](O)CCO 5d385240f50df7bbf21a261279589e90 [0,2,0,0,0,0|2,0,0]=4 13479 B13R0.2 OCC[C@H](O)CNCCCCCCCl fdeeaafe1822d9b99b41e32f2e99a1d3 [0,2,0,0,0,0|2,0,0]=4 13480 B13R0.2 OCC[C@H](O)COCCCCCCF 8474c042804ffa358dbbf000c13c3cdf [0,2,0,0,0,0|2,0,0]=4 13481 B13R0.2 OCC[C@H](O)COCCCCCCS ce36f36a137e65a2b2046e03a550e0c5 [0,2,0,0,0,0|2,0,0]=4 13482 B13R0.87 C#CC(O)CCCCCN(C)CCC 65fc42dc7c4564a010ec332cbca59e5e [0,2,0,0,0,0|1,0,1]=4 13483 B13R0.87 CC(CO)CCCNC[C@@H](O)CCO 29c16669ef11d3249fff4f872c9563f0 [0,2,0,0,0,0|2,0,0]=4 13484 B13R0.87 CCCC(=O)CNCCCC(C)CO c31a4f1b7a4ba676b2a2a3242d21333c [0,2,0,0,0,0|1,0,1]=4 13485 B13R0.87 CCCC(C)CCCOCC(C)C#N be9dec3d9bbcd2f618c0d99eb1b7718f [0,2,0,0,0,0|2,0,0]=4 13486 B13R0.87 CCCC(C)CCCOCC(C)CC cf58307ae3c0a29769645600a0f48104 [0,2,0,0,0,0|2,0,0]=4 13487 B13R0.87 CCCC(C)CCCOCC(C)OC aa950e9f4f281d0894523457166c2017 [0,2,0,0,0,0|1,0,0]=3 13488 B13R0.87 CCCC(C)CCCOCC(O)CO 0829a92a5e826fc19cbd30505995517a [0,2,0,0,0,0|1,0,0]=3 13489 B13R0.87 CCCC(C)CCCOC[C@@H](C)CC 6b35d78779564aeda5ac24574347a97f [0,2,0,0,0,0|2,0,0]=4 13490 B13R0.87 CCCC(C)CCCOC[C@@H](C)OC 3140865c8381b875e8d13db53726d70c [0,2,0,0,0,0|1,0,0]=3 13491 B13R0.87 CCCC(C)CCCOC[C@@H](O)CO e2810928bcfd4a3243e9ef44a2775fb0 [0,2,0,0,0,0|1,0,0]=3 13492 B13R0.87 CCCC(C)CCCOC[C@H](C)CC 0f2ef0e4f5febb03e65c84678a77bd76 [0,2,0,0,0,0|2,0,0]=4 13493 B13R0.87 CCCC(C)CCCOC[C@H](C)OC f653ab8dc7157fb676de7444b49aab7a [0,2,0,0,0,0|1,0,0]=3 13494 B13R0.87 CCCC(C)CCCOC[C@H](O)CO cb683793667a6a3a19dc21fcb3da778a [0,2,0,0,0,0|1,0,0]=3 13495 B13R0.87 CCCC(C)CCOCCC(C)CC b9dc46dde64cc95e9e40fe45a6d18b2c [0,2,0,0,0,0|2,0,0]=4 13496 B13R0.87 CCCC(C)CNCCCC(C)CO 17fedcec712d38c1e6d88139f7be8218 [0,2,0,0,0,0|1,0,0]=3 13497 B13R0.87 CCCC(C)COCCCC(C)CC 61c23dd14ea2d25a77ebb504a8651fbc [0,2,0,0,0,0|2,0,0]=4 13498 B13R0.87 CCCC(C)COCCC[C@@H](C)CC b112e206d3f310485dc57d10dcef0169 [0,2,0,0,0,0|2,0,0]=4 13499 B13R0.87 CCCC(C)OCCCCC(C)CC 05f06f9b0d9854930a3cf4b9358e9489 [0,2,0,0,0,0|2,0,0]=4 13500 B13R0.87 CCCC(C)OCCCC[C@@H](C)CC 7346a4e3a42011921506a0ff535d480b [0,2,0,0,0,0|2,0,0]=4 13501 B13R0.87 CCCC(S)CCOCCC(C)CC 07d083fdf8072d851f3379505ad5b1b5 [0,2,0,0,0,0|2,0,0]=4 13502 B13R0.87 COCC(O)CNCCCC(C)CO f7798c4fde596f155f05ace3e7eb2e9b [0,2,0,0,0,0|2,0,0]=4 13503 B13R0.340 C#CC(C)N(C)CCCCCCCC 07dadbfc7d50c167fd3b36c880c71027 [0,2,0,0,0,0|2,0,0]=4 13504 B13R0.340 C=CC(C)N(C)CCCCCCCC c2404b53db8eb8ff61438ecd0889d19b [0,2,0,0,0,0|2,0,0]=4 13505 B13R0.340 C=C[C@@H](C)[C@@H](C)OCCCCCCC 1ec88ae9ac69f8141b978c5f57fa29b0 [0,2,0,0,0,0|2,0,0]=4 13506 B13R0.340 C=C[C@@H](C)[C@H](C)OCCCCCCC ad564b26c9159ea7545b05f22a1d2241 [0,2,0,0,0,0|2,0,0]=4 13507 B13R0.340 C=C[C@H](C)[C@@H](C)OCCCCCCC e5a1ac40089d623cc9a8a093815fa77e [0,2,0,0,0,0|2,0,0]=4 13508 B13R0.340 C=C[C@H](C)[C@H](C)OCCCCCCC b458235c7c5afb02f418f5ee332a1c1f [0,2,0,0,0,0|2,0,0]=4 13509 B13R0.340 CCCCCCCCN(C)C(C)C=O d82584a537049caa3998520a38a53535 [0,2,0,0,0,0|1,0,1]=4 13510 B13R0.340 CCCCCCCCN(C)C(C)CC b540347f05ef2ed88daaa3565df9bead [0,2,0,0,0,0|2,0,0]=4 13511 B13R0.340 CCCCCCCCN(C)C(C)CO 46efac2c86b525f6b318f60991333648 [0,2,0,0,0,0|1,0,0]=3 13512 B13R0.340 CCCCCCCCN(C)[C@@H](C)CO 7c7f61be0f2b0f8e714daf520119113a [0,2,0,0,0,0|1,0,0]=3 13513 B13R0.340 CCCCCCCCN(C)[C@H](C)C=O 8d8047cd37f695dc7078522893cc75c8 [0,2,0,0,0,0|1,0,1]=4 13514 B13R0.340 CCCCCCCCN(C)[C@H](C)CO 17363275bcbd404f16e37a85a9d1b758 [0,2,0,0,0,0|1,0,0]=3 13515 B13R0.340 CCCCCCCNC(=O)C(C)OC 11232c4d3d8f3931f5576e7ef8a74109 [0,2,0,0,0,0|1,0,1]=4 13516 B13R0.340 CCCCCCCNC(=O)C(O)CC 681ca70eab4d0e1da3028d625382074e [0,2,0,0,0,0|1,0,1]=4 13517 B13R0.340 CCCCCCCNC(=O)C(O)CO badad6e1b6f4f4416592bf2ec77e0b94 [0,2,0,0,0,0|1,0,1]=4 13518 B13R0.340 CCCCCCCNC(=O)[C@@H](C)OC 859fa5e81f6439739da74d45179b1327 [0,2,0,0,0,0|1,0,1]=4 13519 B13R0.340 CCCCCCCNC(=O)[C@@H](O)CC 0d2ebf734aa89ae555aebe01ac37fb7f [0,2,0,0,0,0|1,0,1]=4 13520 B13R0.340 CCCCCCCNC(=O)[C@@H](O)CO 19a701c92fe05ed67fd2b6b87c995fb0 [0,2,0,0,0,0|1,0,1]=4 13521 B13R0.340 CCCCCCCNC(=O)[C@H](C)OC 14554636ad925679ed8fdbd8b241c93d [0,2,0,0,0,0|1,0,1]=4 13522 B13R0.340 CCCCCCCNC(=O)[C@H](O)CC 74fb679eaf2f759e436507d8907eec58 [0,2,0,0,0,0|1,0,1]=4 13523 B13R0.340 CCCCCCCNC(=O)[C@H](O)CF 37707369bdee32367de06eddac1f2096 [0,2,0,0,0,0|1,0,1]=4 13524 B13R0.340 CCCCCCCNC(C)C(C)CC 17897eb97517d4f7efe2e78b3d50c67b [0,2,0,0,0,0|2,0,0]=4 13525 B13R0.340 CCCCCCCOC(C)C(C)CC 6c3e2752e45a81b11f0d4c88631610cd [0,2,0,0,0,0|2,0,0]=4 13526 B13R0.340 CCCCCCCOC(C)C(C)OC 35e505f8e6697f76dc3b7d5e360e9820 [0,2,0,0,0,0|1,0,0]=3 13527 B13R0.340 CCCCCCOCC(C)C(S)CC 0c68cdddd0aa650c8cef20b526b1c762 [0,2,0,0,0,0|1,1,0]=4 13528 B13R0.340 CCCCOCCOC(C)C(C)OC 847ef3b4a3ab0ef6e1b81b4ae6a1d053 [0,2,0,0,0,0|2,0,0]=4 13529 B13R0.340 CCCOCCCOC(C)C(C)OC 67aa4496533082e08bcc8ae847eae39e [0,2,0,0,0,0|2,0,0]=4 13530 B13R0.340 COC(C)C(C)OCCCCCCF 2808310577b1c0e814b9f163535d7957 [0,2,0,0,0,0|2,0,0]=4 13531 B13R0.340 COCCCCCCN(C)C(C)CO 71fc6ca563cb99563b729c08bbb80486 [0,2,0,0,0,0|2,0,0]=4 13532 B13R0.340 COCCCCCCN(C)[C@@H](C)CO 3c564402748d40e035f8c9cf143bbd92 [0,2,0,0,0,0|2,0,0]=4 13533 B13R0.340 COCCCCCCN(C)[C@H](C)CO 287ee21fed3c793fb8ff809310e1b264 [0,2,0,0,0,0|2,0,0]=4 13534 B13R0.340 COCCCCCOC(C)C(C)OC 307c0b862ed301baba6390986c839689 [0,2,0,0,0,0|2,0,0]=4 13535 B13R0.412 C#CC(CC)OCCCCCCCC 21e4b10692043da863d2ca69d478327f [0,2,0,0,0,0|2,0,0]=4 13536 B13R0.412 C=CC(CC)OCCCCCCCC e3d4668c49abfa87b78a77fe8d20f4ac [0,2,0,0,0,0|2,0,0]=4 13537 B13R0.412 C=C[C@@H](CO)NCCCCCCCC 4c254d1a71a8cf7805ffd43f0146893a [0,2,0,0,0,0|1,0,1]=4 13538 B13R0.412 CCC(CO)CNCCCCCCCl 4e23f23ba6f02bcf33552c869c081865 [0,2,0,0,0,0|2,0,0]=4 13539 B13R0.412 CCC(CO)CNCCCCCCF 148780baa3366aa3bf8a0f44ffcd6a83 [0,2,0,0,0,0|2,0,0]=4 13540 B13R0.412 CCC(CO)CNCCCCCCO 6a919ffbef1ebbcd91606bfe12b2916a [0,2,0,0,0,0|2,0,0]=4 13541 B13R0.412 CCC(CO)CNCCCCCOC 3612a269d435e5227dd84f1945779284 [0,2,0,0,0,0|2,0,0]=4 13542 B13R0.412 CCC(CO)NCCCCCCCO 94c056dd6c4c02011483e7dbbefe737c [0,2,0,0,0,0|2,0,0]=4 13543 B13R0.412 CCC(CO)NCCCCCCOC 3c7e9368c2393480f39a4fe46b1b1aa0 [0,2,0,0,0,0|2,0,0]=4 13544 B13R0.412 CCC(COCCCCCCF)OC 6f6585a66d969093dedcb85352e3253c [0,2,0,0,0,0|2,0,0]=4 13545 B13R0.412 CCC(COCCCCCOC)OC 7109b85c9bbcfeb68fb6c056886095c8 [0,2,0,0,0,0|2,0,0]=4 13546 B13R0.412 CCCCCCCCNC(C=O)CC 34320c0bc59ff34af199c50d9474fa05 [0,2,0,0,0,0|1,0,1]=4 13547 B13R0.412 CCCCCCCCNC(CC)CC 25ff1e6d25a70b6612b25aa4ac84266f [0,2,0,0,0,0|2,0,0]=4 13548 B13R0.412 CCCCCCCCNC(CC)CO 08780e0e860095efd07ff558ae9a68cf [0,2,0,0,0,0|1,0,0]=3 13549 B13R0.412 CCCCCCCCNC(CO)CO 5fd63855bf35cbdec1f9fffab0470581 [0,2,0,0,0,0|1,0,0]=3 13550 B13R0.412 CCCCCCCCN[C@@H](CC)CO bf0d2e700b57a6954458114063ca9949 [0,2,0,0,0,0|1,0,0]=3 13551 B13R0.412 CCCCCCCCN[C@H](CC)CO c60aad1734a391f9b4ecd97159d39821 [0,2,0,0,0,0|1,0,0]=3 13552 B13R0.412 CCCCCCCCOC(C#N)CC d8c6eb444f2be46ec6ac6ff71641ec13 [0,2,0,0,0,0|2,0,0]=4 13553 B13R0.412 CCCCCCCCOC(C=O)CC 45901462edf05691631bed608e60a8ef [0,2,0,0,0,0|1,0,1]=4 13554 B13R0.412 CCCCCCCCOC(CBr)CBr ee0756101ecdf98759f7bbc955cb89c1 [0,2,0,0,0,0|2,0,0]=4 13555 B13R0.412 CCCCCCCCOC(CC)CC 066f2d4e51a8de80c8ed23ed78c34f57 [0,2,0,0,0,0|2,0,0]=4 13556 B13R0.412 CCCCCCCCOC(CCl)CBr 18a91060cf069197cb89ad344f5bc0ad [0,2,0,0,0,0|2,0,0]=4 13557 B13R0.412 CCCCCCCCOC(CCl)CCl 2531d0b69b7d61516e3142db3a606ef3 [0,2,0,0,0,0|2,0,0]=4 13558 B13R0.412 CCCCCCCCOC(CF)CF 4d8427367e37e66b0a7371a2e6cfb8a6 [0,2,0,0,0,0|2,0,0]=4 13559 B13R0.412 CCCCCCCCOC(CO)CO e16e550f9be00a7ae092d383c4b180da [0,2,0,0,0,0|1,0,0]=3 13560 B13R0.412 CCCCCCCCO[C@@H](CCl)CI f414e5b1655966cd3577a32b2f365d79 [0,2,0,0,0,0|2,0,0]=4 13561 B13R0.412 CCCCCCCCO[C@H](CCl)CI 56926fc907e5316a81943fed98f43c7b [0,2,0,0,0,0|2,0,0]=4 13562 B13R0.412 CCCCCCCNCC(CC)CC cfa925d5109a746ade93a4ceb747213d [0,2,0,0,0,0|2,0,0]=4 13563 B13R0.412 CCCCCCCNCC(CC)CO 0dd73b76324f8db463b5a14fa1463e9a [0,2,0,0,0,0|1,0,0]=3 13564 B13R0.412 CCCCCCCNCC(CO)CO b1b96d6474966ac81b28e0f93b1c1813 [0,2,0,0,0,0|1,0,0]=3 13565 B13R0.412 CCCCCCCNCC(OC)OC 24134ab0772fce290e0aaaa2dc69f419 [0,2,0,0,0,0|1,0,0]=3 13566 B13R0.412 CCCCCCCNC[C@H](CO)OC c1589e19a023d2cc507ae10d187aa400 [0,2,0,0,0,0|1,0,0]=3 13567 B13R0.412 CCCCCCCOCC(CBr)CBr 3f45da9dffc843b90f8e75f32cfa8700 [0,2,0,0,0,0|2,0,0]=4 13568 B13R0.412 CCCCCCCOCC(CC)CC 7c78ac32a1af9b27c6f0a8cbfb553b8e [0,2,0,0,0,0|2,0,0]=4 13569 B13R0.412 CCCCCCCOCC(CC)OC 875a546f21145a2fdae6b0ba9d1144c2 [0,2,0,0,0,0|1,0,0]=3 13570 B13R0.412 CCCCCCCOCC(OC)OC 292f2c2b3dfd32958d6ee4b76b8bae15 [0,2,0,0,0,0|1,0,0]=3 13571 B13R0.412 CCCCCCNCCC(CC)CC d964ae086ad5c6f5a4c7e8105f6e0872 [0,2,0,0,0,0|2,0,0]=4 13572 B13R0.412 CCCCCCNCCC(CO)CO ccf267360b0492d5690cd32eaf2a914d [0,2,0,0,0,0|1,0,0]=3 13573 B13R0.412 CCCCCCNCCC(OC)OC 459b12bd2607830121d64a5fda1b2a95 [0,2,0,0,0,0|1,0,0]=3 13574 B13R0.412 CCCCCCOCCC(OC)OC 5f11c6e1dd9fdda17922d9831879c94a [0,2,0,0,0,0|1,0,0]=3 13575 B13R0.412 CCCCCNCCCC(OC)OC 4356cc24263d58b4b9cdf52abc0f78e3 [0,2,0,0,0,0|1,0,0]=3 13576 B13R0.412 CCCCCOCCCC(OC)OC 34797fcbe6bcf10a8fc45b0da51782ad [0,2,0,0,0,0|1,0,0]=3 13577 B13R0.412 CCCCCOCCOC(CO)CO a34ffd65b427b6bdb11eab5d2d532ca3 [0,2,0,0,0,0|2,0,0]=4 13578 B13R0.412 CCCCNCCCCC(CO)CO 6d6e5a83105094afe76e659f329df282 [0,2,0,0,0,0|1,0,0]=3 13579 B13R0.412 CCCCNCCCCC(OC)OC c3ed5445f7ff69912630e0d7881c0b5a [0,2,0,0,0,0|1,0,0]=3 13580 B13R0.412 CCCCNCCOCC(OC)OC 87952ec4d51d51b4785b13e78b9b31ec [0,2,0,0,0,0|2,0,0]=4 13581 B13R0.412 CCCCOCCCNC(CC)CO c4200a43f9f306649ef87f8e87b947e2 [0,2,0,0,0,0|2,0,0]=4 13582 B13R0.412 CCCCOCCCNC(CO)CO 2a86429750ed9f54db5cd347e71dfe20 [0,2,0,0,0,0|2,0,0]=4 13583 B13R0.412 CCCCOCCCOC(CO)CO fb680b974d7b260b0d5064d190fdc400 [0,2,0,0,0,0|2,0,0]=4 13584 B13R0.412 CCCCOCCNCC(CC)CO 43621a81ccaa05a86a0d8f9b2fc8d57c [0,2,0,0,0,0|2,0,0]=4 13585 B13R0.412 CCCCOCCNCC(CO)CO 26f707fbf96a24cd78593eab82349d74 [0,2,0,0,0,0|2,0,0]=4 13586 B13R0.412 CCCCOCCNCC(OC)OC 504c82aeee972dfba90e4f7b787f3462 [0,2,0,0,0,0|2,0,0]=4 13587 B13R0.412 CCCCOCCNC[C@H](CO)OC b522d8b27658945e63e70a57a8a13f99 [0,2,0,0,0,0|2,0,0]=4 13588 B13R0.412 CCCCOCCOCC(CC)OC bc3f6b1dcc15fba77a8f7a429f318439 [0,2,0,0,0,0|2,0,0]=4 13589 B13R0.412 CCCCOCCOCC(OC)OC 1adeec94796e8f2f6101207e9a76f00a [0,2,0,0,0,0|2,0,0]=4 13590 B13R0.412 CCCCOCNCCC(CO)CO 954bcb8282ebd1c50b339b154d15ec53 [0,2,0,0,0,0|2,0,0]=4 13591 B13R0.412 CCCCOCNCCC(OC)OC 0c02d766dd135769005b80f3d8c4a200 [0,2,0,0,0,0|2,0,0]=4 13592 B13R0.412 CCCCSCCOCC(OC)OC 9ea004a655cfa8a0e76d956330cf563e [0,2,0,0,0,0|2,0,0]=4 13593 B13R0.412 CCCOCCCNCC(CC)CO d1039e1a92df8253c0810c5192007b18 [0,2,0,0,0,0|2,0,0]=4 13594 B13R0.412 CCCOCCCNCC(CO)CO 8ebc9a3491581ac7711e8310c86c5dc0 [0,2,0,0,0,0|2,0,0]=4 13595 B13R0.412 CCCOCCCNCC(OC)OC db7eb2a67f18bc38ad8d75bb238cc498 [0,2,0,0,0,0|2,0,0]=4 13596 B13R0.412 CCCOCCCNC[C@H](CO)OC 47c8cbb2d5b07eb193d61bed86f3dc74 [0,2,0,0,0,0|2,0,0]=4 13597 B13R0.412 CCCOCCCOCC(CC)OC 8ca2e059a58a1825e8e4e23b184a35cd [0,2,0,0,0,0|2,0,0]=4 13598 B13R0.412 CCCOCCCOCC(OC)OC 8a2ba71e33a20a0e0f487ae445b98813 [0,2,0,0,0,0|2,0,0]=4 13599 B13R0.412 CCCOCCNCCC(CO)CO 82df90de4f352e25de1184b30fec8156 [0,2,0,0,0,0|2,0,0]=4 13600 B13R0.412 CCCOCCNCCC(OC)OC 352e1d569de14d2c6c637b049551112f [0,2,0,0,0,0|2,0,0]=4 13601 B13R0.412 CCCOCCOCCC(OC)OC 1a2f8621350deb4276f9b5879ede1e7e [0,2,0,0,0,0|2,0,0]=4 13602 B13R0.412 CCCSCCCCNC(CC)CO 86a374befc191bd961338408f95ea591 [0,2,0,0,0,0|2,0,0]=4 13603 B13R0.412 CCCSCCCCNC(CO)CO 829e6f11b129a8aa9221e2c47958b76d [0,2,0,0,0,0|2,0,0]=4 13604 B13R0.412 CCCSCCOCCC(OC)OC 11b409686ffabecd9a11b1a03e7244b9 [0,2,0,0,0,0|2,0,0]=4 13605 B13R0.412 CCOCCCNCCC(CO)CO 15d7a5457a200d27747cc0454e7a6c61 [0,2,0,0,0,0|2,0,0]=4 13606 B13R0.412 CCOCCCNCCC(OC)OC 7894fb05590f0b7d426b3cd4d1219296 [0,2,0,0,0,0|2,0,0]=4 13607 B13R0.412 CCOCCCOCCC(OC)OC 3727815e8d45543d8136caa677e6c005 [0,2,0,0,0,0|2,0,0]=4 13608 B13R0.412 CCOCCNCCCC(OC)OC 847f4d29fa241f0d22a66bfe50d575cb [0,2,0,0,0,0|2,0,0]=4 13609 B13R0.412 CCOCCOCCCC(OC)OC cf92dd1dab08d210cbe3c773f5368827 [0,2,0,0,0,0|2,0,0]=4 13610 B13R0.412 CCOCNCCCCC(CO)CO 171a0bfc39aab3c22ef7845fe46fb5a5 [0,2,0,0,0,0|2,0,0]=4 13611 B13R0.412 CCOCNCCCCC(OC)OC 44866158bbff735e9f73df2ec876a59c [0,2,0,0,0,0|2,0,0]=4 13612 B13R0.412 CCSCCCCNCC(CC)CO eaeb80011cbac0eeb628ac54bf245c6b [0,2,0,0,0,0|2,0,0]=4 13613 B13R0.412 CCSCCCCNCC(OC)OC 79a0cffbaa6a526d5581f5d7a80a21bc [0,2,0,0,0,0|2,0,0]=4 13614 B13R0.412 CCSCCCNCCC(CO)CO 32e119d503eb35cd2892c1b3ece9880f [0,2,0,0,0,0|2,0,0]=4 13615 B13R0.412 CCSCCCNCCC(OC)OC 1fbaf7fd882fb5ef02bc6241f434d417 [0,2,0,0,0,0|2,0,0]=4 13616 B13R0.412 CCSCCCOCCC(OC)OC 562267ba56602643dfe7586bee0b3ab1 [0,2,0,0,0,0|2,0,0]=4 13617 B13R0.412 CCSCCNCCCC(OC)OC c0bd099c8b43a6feaf4e1caf7da2e177 [0,2,0,0,0,0|2,0,0]=4 13618 B13R0.412 CCSCCOCCCC(OC)OC bbd32ab72cee1e7fb329854eb1485d8a [0,2,0,0,0,0|2,0,0]=4 13619 B13R0.412 CC[C@@H](CO)NCCCCCCCO 5099a8c55c6fd9c7b88f35d898fd3165 [0,2,0,0,0,0|2,0,0]=4 13620 B13R0.412 CC[C@@H](CO)NCCCCCCOC 5108ae297fb02fac89ba76753a1669b9 [0,2,0,0,0,0|2,0,0]=4 13621 B13R0.412 CC[C@H](CO)NCCCCCCCO 64957eaa5801ffd62b975f312f003f5e [0,2,0,0,0,0|2,0,0]=4 13622 B13R0.412 CC[C@H](CO)NCCCCCCOC 00561918dd56c32eaf2f61b794110d69 [0,2,0,0,0,0|2,0,0]=4 13623 B13R0.412 COC(CCCCNCCCF)OC 87ff8b2c600a4ed5cf0452d259f86835 [0,2,0,0,0,0|2,0,0]=4 13624 B13R0.412 COC(CCCCNCCCO)OC 3232318376022d7a131ba388d135da6a [0,2,0,0,0,0|2,0,0]=4 13625 B13R0.412 COC(CCCCNCCCS)OC 43b276a4d40d7842d66ed004e047651a [0,2,0,0,0,0|2,0,0]=4 13626 B13R0.412 COC(CCCCNCCSC)OC 069a07c947ec0e28d089dbc4c4c190f5 [0,2,0,0,0,0|2,0,0]=4 13627 B13R0.412 COC(CCCNCCCCCl)OC 3702fe922ff3204d4a334e76e3bbe074 [0,2,0,0,0,0|2,0,0]=4 13628 B13R0.412 COC(CCCNCCCCF)OC 846eb830883939da557f9dd254651f69 [0,2,0,0,0,0|2,0,0]=4 13629 B13R0.412 COC(CCCNCCCCO)OC 04136578fc536e24a2e2ba1a2b0a2e81 [0,2,0,0,0,0|2,0,0]=4 13630 B13R0.412 COC(CCCNCCCCS)OC 88bc5c5821f1c56cec65f32f61554630 [0,2,0,0,0,0|2,0,0]=4 13631 B13R0.412 COC(CCCNCCCSC)OC f94ea501ccf051f3359dc8593f32a596 [0,2,0,0,0,0|2,0,0]=4 13632 B13R0.412 COC(CCCOCCCCF)OC a9cc1e68e091dfb944a7503b98a7ad56 [0,2,0,0,0,0|2,0,0]=4 13633 B13R0.412 COC(CCCOCCCCS)OC f5a3b0368a60c02924ad2ca8016bffa9 [0,2,0,0,0,0|2,0,0]=4 13634 B13R0.412 COC(CCCOCCCSC)OC e3de0f6c27c6bf505a12febe2d4b78f7 [0,2,0,0,0,0|2,0,0]=4 13635 B13R0.412 COC(CCNCCCCCCl)OC 4a31e95b8093fd9c30ab14c2f86a0595 [0,2,0,0,0,0|2,0,0]=4 13636 B13R0.412 COC(CCNCCCCCF)OC f39224227c5f53fe374fb4b42094dceb [0,2,0,0,0,0|2,0,0]=4 13637 B13R0.412 COC(CCNCCCCCO)OC a60aba38ebaec91767c6b9dff47e7379 [0,2,0,0,0,0|2,0,0]=4 13638 B13R0.412 COC(CCNCCCCSC)OC 38312874ec2524c8cc00a912c4ff4712 [0,2,0,0,0,0|2,0,0]=4 13639 B13R0.412 COC(CCOCCCCSC)OC 57bf15ef09dbbed648bbbb69f4e8658b [0,2,0,0,0,0|2,0,0]=4 13640 B13R0.412 COC(CNCCCCCCCl)OC 14b140ad4c1c2b079792ecdeb4e96ada [0,2,0,0,0,0|2,0,0]=4 13641 B13R0.412 COC(CNCCCCCCF)OC c6330f02ccf2f5980047dc65092041ec [0,2,0,0,0,0|2,0,0]=4 13642 B13R0.412 COC(CNCCCCCCO)OC 68a42ad96489d232cf601520394aa956 [0,2,0,0,0,0|2,0,0]=4 13643 B13R0.412 COC(COCCCCCCF)OC f0991d9f70b8b516a3d9c9f10e1cf505 [0,2,0,0,0,0|2,0,0]=4 13644 B13R0.412 COC(COCCCCCCS)OC f1fbc2c4a1db79c2d5bfb3213da678b9 [0,2,0,0,0,0|2,0,0]=4 13645 B13R0.412 COCCCCCCNC(CO)CO d9dacacb1571424973dd82a07ccd99f9 [0,2,0,0,0,0|2,0,0]=4 13646 B13R0.412 COCCCCCCOC(CO)CO c04ce59c5e2eaa1b3f53bfe8bf889c8a [0,2,0,0,0,0|2,0,0]=4 13647 B13R0.412 COCCCCCNCC(CO)CO f8e5b53ba18caa458b49fcfc01441c58 [0,2,0,0,0,0|2,0,0]=4 13648 B13R0.412 COCCCCCNCC(OC)OC 646e509ad1080e617c720af7a6f0d526 [0,2,0,0,0,0|2,0,0]=4 13649 B13R0.412 COCCCCCNC[C@H](CO)OC d835a2cf670197be7f7348827f14023b [0,2,0,0,0,0|2,0,0]=4 13650 B13R0.412 COCCCCCOCC(OC)OC a83a676fa7a674b537f10200650c7d49 [0,2,0,0,0,0|2,0,0]=4 13651 B13R0.412 COCCCCNCCC(CO)CO 05edafa98af79400c6869d9ff43cbf29 [0,2,0,0,0,0|2,0,0]=4 13652 B13R0.412 COCCCCNCCC(OC)OC 7e70676e5b22155a7c3b6fb6bb91dbc6 [0,2,0,0,0,0|2,0,0]=4 13653 B13R0.412 COCCCCOCCC(OC)OC 2caf302f002045f22fb23a2581b05a91 [0,2,0,0,0,0|2,0,0]=4 13654 B13R0.412 COCCCNCCCC(OC)OC 1317db9725b1a28ee5972ed7986c8c36 [0,2,0,0,0,0|2,0,0]=4 13655 B13R0.412 COCCCOCCCC(OC)OC bb597d76713f60c719383589c3920e0d [0,2,0,0,0,0|2,0,0]=4 13656 B13R0.412 COCCNCCCCC(CO)CO b2b2951445cf7992c47dabd5f754f537 [0,2,0,0,0,0|2,0,0]=4 13657 B13R0.412 COCCNCCCCC(OC)OC 256854f9c729afc618ada18354817349 [0,2,0,0,0,0|2,0,0]=4 13658 B13R0.412 CO[C@@H](CO)CNCCCCCCF 64f6951a5a0d0b33f8189999cd4213f8 [0,2,0,0,0,0|2,0,0]=4 13659 B13R0.412 CO[C@@H](CO)CNCCCCCCO d3ebb1b72219bfa71069e65be7d54e1d [0,2,0,0,0,0|2,0,0]=4 13660 B13R0.412 CSCCNCCCCC(CO)CO a19981256df844171005430591cb0782 [0,2,0,0,0,0|2,0,0]=4 13661 B13R0.412 OCC(CO)CCCCNCCCF ad205632f1dcbe3b59cd1ad9dd7fa102 [0,2,0,0,0,0|2,0,0]=4 13662 B13R0.412 OCC(CO)CCCCNCCCS fbb65a213f48d86da07a3623d699ee2d [0,2,0,0,0,0|2,0,0]=4 13663 B13R0.412 OCC(CO)CCNCCCCCF 028d347de49253851725821c72004395 [0,2,0,0,0,0|2,0,0]=4 13664 B13R0.412 OCC(CO)CNCCCCCCF 8e95c4b0979ec609b98f4336ec291351 [0,2,0,0,0,0|2,0,0]=4 13665 B13R0.412 OCCCCCCCNC(CO)CO 72d15431a2d52a7500fa9c3699dee41a [0,2,0,0,0,0|2,0,0]=4 13666 B13R0.412 OCCCCCCNCC(CO)CO e22f73cb0319c89de88d8a9e014f3843 [0,2,0,0,0,0|2,0,0]=4 13667 B13R0.412 OCCCCCNCCC(CO)CO fc5d2e2419679ba2769d3987e425a23a [0,2,0,0,0,0|2,0,0]=4 13668 B13R0.412 OCCCNCCCCC(CO)CO 50ace7a53303df60252d369cde8a5dbd [0,2,0,0,0,0|2,0,0]=4 13669 B13R0.1170 C#CC(C)OCC(C)CCCCCC eb6a3ec614a9f0b8d43fd7a949d0ff63 [0,2,0,0,0,0|2,0,0]=4 13670 B13R0.1170 C=CC(C)COC(C)CCCCCC 92d2fc72c2bcb7571870028280b5028b [0,2,0,0,0,0|2,0,0]=4 13671 B13R0.1170 C=CC(C)OCC(C)CCCCCC 342b8fb4a1922c869167f8f379493fcd [0,2,0,0,0,0|2,0,0]=4 13672 B13R0.1170 C=CC(O)CNC(C)CCCCCC f130cc7d3aa6dd781a6ca8c1605372d9 [0,2,0,0,0,0|1,0,1]=4 13673 B13R0.1170 CC(CO)CCN(C)CCCCCO 5acd196ebb6917389c87f63b8ccbe39c [0,2,0,0,0,0|2,0,0]=4 13674 B13R0.1170 CCCCCCC(=O)NCC(C)CO c699df193618ae157aad6ac7c99adcd8 [0,2,0,0,0,0|1,0,1]=4 13675 B13R0.1170 CCCCCCC(=O)NCC(O)CC 2231c29ecdebb23688eb1f70a9d6dac2 [0,2,0,0,0,0|1,0,1]=4 13676 B13R0.1170 CCCCCCC(=O)NCC(O)CO 0b6b973a2236361f99b82d3293ff718a [0,2,0,0,0,0|1,0,1]=4 13677 B13R0.1170 CCCCCCC(=O)NC[C@@H](C)OC 37e84dbc2507714017ff1d09e6567a32 [0,2,0,0,0,0|1,0,1]=4 13678 B13R0.1170 CCCCCCC(=O)NC[C@@H](O)CO bcc24351107d8be9780fe0a3b2223586 [0,2,0,0,0,0|1,0,1]=4 13679 B13R0.1170 CCCCCCC(=O)NC[C@H](C)CO e6034b8f0624d52aeff506f61a4cb30b [0,2,0,0,0,0|1,0,1]=4 13680 B13R0.1170 CCCCCCC(=O)NC[C@H](C)OC 3ce8efc5fe7f39c5320f9c1b13feafb5 [0,2,0,0,0,0|1,0,1]=4 13681 B13R0.1170 CCCCCCC(=O)NC[C@H](O)CC d8554728b25b2bd1ecdfde8603da174c [0,2,0,0,0,0|1,0,1]=4 13682 B13R0.1170 CCCCCCC(=O)NC[C@H](O)CO edc2b4ff371f3d11c8feeda593488940 [0,2,0,0,0,0|1,0,1]=4 13683 B13R0.1170 CCCCCCC(C)COC(C)C#N ea65156332bce6aa9615f8617181f6f6 [0,2,0,0,0,0|2,0,0]=4 13684 B13R0.1170 CCCCCCC(C)COC(C)C=O 9960861adebe01b99c4269d2a02db1d0 [0,2,0,0,0,0|1,0,1]=4 13685 B13R0.1170 CCCCCCC(C)COC(C)CC 904cd341074e7f9dfdbae239f0b9373b [0,2,0,0,0,0|2,0,0]=4 13686 B13R0.1170 CCCCCCC(C)CO[C@H](C)C=O dd2f7f884878ce16307dfcefe93d2714 [0,2,0,0,0,0|1,0,1]=4 13687 B13R0.1170 CCCCCCC(C)NCC(Br)CBr bde0108e3511bcac602a74847972ef52 [0,2,0,0,0,0|2,0,0]=4 13688 B13R0.1170 CCCCCCC(C)NCC(C)C#N 9a8fcf729db6d4540f1d14d04465f010 [0,2,0,0,0,0|2,0,0]=4 13689 B13R0.1170 CCCCCCC(C)NCC(C)CC a6fee0fc58fd7a98c98c509b933312e9 [0,2,0,0,0,0|2,0,0]=4 13690 B13R0.1170 CCCCCCC(C)NCC(C)CO 75b0781b8914fcff17327a349474e60d [0,2,0,0,0,0|1,0,0]=3 13691 B13R0.1170 CCCCCCC(C)NCC(C)OC 7f4829197ce699bab0b557cad586fe35 [0,2,0,0,0,0|1,0,0]=3 13692 B13R0.1170 CCCCCCC(C)NCC(F)CO 6a8cdbfb85d8a87f2b2cce5f02d76102 [0,2,0,0,0,0|2,0,0]=4 13693 B13R0.1170 CCCCCCC(C)NCC(O)CC fde2db14ecc5e654d052787fab0dd0de [0,2,0,0,0,0|1,0,0]=3 13694 B13R0.1170 CCCCCCC(C)NCC(O)CF 29c757a4092490684ebb64d1313bd154 [0,2,0,0,0,0|1,0,0]=3 13695 B13R0.1170 CCCCCCC(C)NCC(O)CO ccc6c42ca53f14e8a7fac949eda37cd3 [0,2,0,0,0,0|1,0,0]=3 13696 B13R0.1170 CCCCCCC(C)NC[C@@H](C)CC 70839e001b6fda26bfb984ff07b32c4e [0,2,0,0,0,0|2,0,0]=4 13697 B13R0.1170 CCCCCCC(C)NC[C@@H](C)CO ed487663e2fa15656c186c8541721d37 [0,2,0,0,0,0|1,0,0]=3 13698 B13R0.1170 CCCCCCC(C)NC[C@@H](C)OC 3f1c5eaa63329f078d8aac27a2c9ccf5 [0,2,0,0,0,0|1,0,0]=3 13699 B13R0.1170 CCCCCCC(C)NC[C@@H](F)CO cd9aa9247e59cae9776d34ffa4b31e83 [0,2,0,0,0,0|2,0,0]=4 13700 B13R0.1170 CCCCCCC(C)NC[C@@H](O)CO 7f3719e351936d78052299882c22df0d [0,2,0,0,0,0|1,0,0]=3 13701 B13R0.1170 CCCCCCC(C)NC[C@H](C)CC 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B13R0.1170 CCCCCCC(C)OCC(O)CO 34c85cf9b8eb7e7bbf30b5f9c41b4a43 [0,2,0,0,0,0|1,0,0]=3 13713 B13R0.1170 CCCCCCC(C)OCC(S)CS 5901cfce3c9256fd277fdc91f29cba47 [0,2,0,0,0,0|1,1,0]=4 13714 B13R0.1170 CCCCCCC(C)OC[C@@H](C)CC 67b242632cff3541bc220391cc40d27f [0,2,0,0,0,0|2,0,0]=4 13715 B13R0.1170 CCCCCCC(C)OC[C@@H](C)OC cf7cb8f2b7d4f667d7b52a93bd61993b [0,2,0,0,0,0|1,0,0]=3 13716 B13R0.1170 CCCCCCC(C)OC[C@@H](O)CO 5e9249c3881379cfb04395d68ee4c6da [0,2,0,0,0,0|1,0,0]=3 13717 B13R0.1170 CCCCCCC(C)OC[C@H](C)CC 911f891da68c7c1eeb5e8f0eebe0bc79 [0,2,0,0,0,0|2,0,0]=4 13718 B13R0.1170 CCCCCCC(C)OC[C@H](C)OC 9fe23cd2c03f894acf0fad2826d56f1f [0,2,0,0,0,0|1,0,0]=3 13719 B13R0.1170 CCCCCCC(C)OC[C@H](O)CO 6faf351140d2fa0c79c21f7a0f254586 [0,2,0,0,0,0|1,0,0]=3 13720 B13R0.1170 CCCCCCN(C)CCC(C)CC 7e6acaff4a8404e229cb2886cfab1613 [0,2,0,0,0,0|2,0,0]=4 13721 B13R0.1170 CCCCCCN(C)CCC(C)CO 58db2b35cbb54fa5763d603bfa84b443 [0,2,0,0,0,0|1,0,0]=3 13722 B13R0.1170 CCCCCC[C@@H](C)NCC(C)C#N 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0a802adf58ecdb3e19efa44ac425c509 [0,2,0,0,0,0|1,0,0]=3 13753 B13R0.1170 CCCCCC[C@H](C)NCC(O)CO 32dcce4506405a8f28732de3ba575707 [0,2,0,0,0,0|1,0,0]=3 13754 B13R0.1170 CCCCCC[C@H](C)NC[C@@H](C)CC ac36bd7260846c784246b0a5f2376ae7 [0,2,0,0,0,0|2,0,0]=4 13755 B13R0.1170 CCCCCC[C@H](C)NC[C@@H](C)CO b6f84f0286158b371b8805b36d1bd219 [0,2,0,0,0,0|1,0,0]=3 13756 B13R0.1170 CCCCCC[C@H](C)NC[C@@H](C)OC e0bb8b437da165027a16528642e30eeb [0,2,0,0,0,0|1,0,0]=3 13757 B13R0.1170 CCCCCC[C@H](C)NC[C@@H](O)CO 5b1f58840bd65aaeb4cb93c9cd2a50bb [0,2,0,0,0,0|1,0,0]=3 13758 B13R0.1170 CCCCCC[C@H](C)NC[C@H](C)CC 070e9e90cc4f9ad25216c1cfaf39bf9e [0,2,0,0,0,0|2,0,0]=4 13759 B13R0.1170 CCCCCC[C@H](C)NC[C@H](C)CO 8fc1741c1b0df64c640c1af7e5513f45 [0,2,0,0,0,0|1,0,0]=3 13760 B13R0.1170 CCCCCC[C@H](C)NC[C@H](C)OC 2f6486d0c4f54a984a32367d8b5afe60 [0,2,0,0,0,0|1,0,0]=3 13761 B13R0.1170 CCCCCC[C@H](C)NC[C@H](O)CO eea4a3a1d639a8536ed5f9e5de75e8ce [0,2,0,0,0,0|1,0,0]=3 13762 B13R0.1170 CCCCCC[C@H](C)OCC(C)C#N 1b644458dbb135b0c100ecfc85bbf06c [0,2,0,0,0,0|2,0,0]=4 13763 B13R0.1170 CCCCCC[C@H](C)OCC(C)CC 1e732c688c65edbe43ebb48d653b02e7 [0,2,0,0,0,0|2,0,0]=4 13764 B13R0.1170 CCCCCC[C@H](C)OCC(C)OC d9cb0504ba7fb86e15911756635ae347 [0,2,0,0,0,0|1,0,0]=3 13765 B13R0.1170 CCCCCC[C@H](C)OCC(O)CO ec2c062112a7a980e6348ad3e68b14fc [0,2,0,0,0,0|1,0,0]=3 13766 B13R0.1170 CCCCCC[C@H](C)OC[C@@H](C)CC 2ad4b4e2cb40612ddfe2a33614bea5eb [0,2,0,0,0,0|2,0,0]=4 13767 B13R0.1170 CCCCCC[C@H](C)OC[C@@H](C)OC 377c9f396d8851d1f93a75d53eeb18cd [0,2,0,0,0,0|1,0,0]=3 13768 B13R0.1170 CCCCCC[C@H](C)OC[C@@H](O)CO f7cf60b3cb4e81884f24e934388464f1 [0,2,0,0,0,0|1,0,0]=3 13769 B13R0.1170 CCCCCC[C@H](C)OC[C@H](C)CC b2d71aba9872ac67ec5ebc413e594af3 [0,2,0,0,0,0|2,0,0]=4 13770 B13R0.1170 CCCCCC[C@H](C)OC[C@H](C)OC 00928f029880c66b5b59238e3b90303a [0,2,0,0,0,0|1,0,0]=3 13771 B13R0.1170 CCCCCC[C@H](C)OC[C@H](O)CO bf7ea6c6994837db5f7dd3da634e8c98 [0,2,0,0,0,0|1,0,0]=3 13772 B13R0.1170 CCCCCOC(C)CCC(C)CC 07952c4a533fe6c1c82c5167431ca858 [0,2,0,0,0,0|2,0,0]=4 13773 B13R0.1170 CCCCOCC(C)CCC(C)CC 8cea30d5a509c32b6a6e4684b47d3395 [0,2,0,0,0,0|2,0,0]=4 13774 B13R0.1170 CCCCOCC(C)OCC(C)OC adfd66a7053b71d7751b878dea48ee24 [0,2,0,0,0,0|2,0,0]=4 13775 B13R0.1170 CCCCOCC(C)OCC(O)CO 90cf4405d3baa05933f48aa2501d01d3 [0,2,0,0,0,0|2,0,0]=4 13776 B13R0.1170 CCCCOCC(C)OC[C@@H](C)OC e33dba956debb31e7c86ab8cdeb09f68 [0,2,0,0,0,0|2,0,0]=4 13777 B13R0.1170 CCCCOCC(C)OC[C@@H](O)CO c1c3577802e83f8d03e6ca2a5a4a73db [0,2,0,0,0,0|2,0,0]=4 13778 B13R0.1170 CCCCOCC(C)OC[C@H](C)OC adc0d466776c40c1266105dd44b7cb95 [0,2,0,0,0,0|2,0,0]=4 13779 B13R0.1170 CCCCOCC(C)OC[C@H](O)CO c379c42c82431e12987df35ba094c34c [0,2,0,0,0,0|2,0,0]=4 13780 B13R0.1170 COCCCCN(C)CCC(C)CO 79acaaf6594cbf6228cc808a40bcb272 [0,2,0,0,0,0|2,0,0]=4 13781 B13R0.61 C#CC(OCCCCCCC)C(C)C dadcb7a9c07204aed4b44c98a55091bf [0,2,0,0,0,0|2,0,0]=4 13782 B13R0.61 C=CC(OCCCCCCC)C(C)C be9b29ee2d8b470e34042f9045bcf9aa [0,2,0,0,0,0|2,0,0]=4 13783 B13R0.61 CC(O)C(CO)NCCCCCCF 2400349d828f08033650bf6bf00703fa [0,2,0,0,0,0|2,0,0]=4 13784 B13R0.61 CC(O)C(CO)NCCCCCCO fe9fa1e8378c81c691012d6d83b2b889 [0,2,0,0,0,0|2,0,0]=4 13785 B13R0.61 CCCCCCCCN(CC)C(C)C a7488f09d7094fa682405a5e53148ab6 [0,2,0,0,0,0|2,0,0]=4 13786 B13R0.61 CCCCCCCNC(C=O)C(C)C da32e92d3be1bd379908e96495b9b968 [0,2,0,0,0,0|2,0,0]=4 13787 B13R0.61 CCCCCCCNC(CC)C(C)C c5d53f14c7a56fa68cdac1f2edd4582b [0,2,0,0,0,0|2,0,0]=4 13788 B13R0.61 CCCCCCCNC(CO)C(C)C d23689bdfcf5605436072eec216ff4ac [0,2,0,0,0,0|2,0,0]=4 13789 B13R0.61 CCCCCCCNC(CO)C(C)O 4ab48617c6f88ccc02c783de6b1eec0b [0,2,0,0,0,0|1,0,0]=3 13790 B13R0.61 CCCCCCCN[C@@H](CC)[C@@H](C)O 8da50ab89de13ca2e69200f9e15ffc76 [0,2,0,0,0,0|1,0,0]=3 13791 B13R0.61 CCCCCCCN[C@@H](CO)C(C)C 1dc17f0126c53e80c18d30a624c40f9e [0,2,0,0,0,0|2,0,0]=4 13792 B13R0.61 CCCCCCCN[C@@H](CO)[C@@H](C)O 5ea7ffe129c10d14ececdffef44f411d [0,2,0,0,0,0|1,0,0]=3 13793 B13R0.61 CCCCCCCN[C@@H](CO)[C@H](C)O 45140b9822381b22e38183e5dfb2b6f6 [0,2,0,0,0,0|1,0,0]=3 13794 B13R0.61 CCCCCCCN[C@H](CC)[C@@H](C)O 4a1769aef064e4aa09d72b9e107fb8b6 [0,2,0,0,0,0|1,0,0]=3 13795 B13R0.61 CCCCCCCN[C@H](CC)[C@H](C)O 996a5118c0906c785a779df07929c8bc [0,2,0,0,0,0|1,0,0]=3 13796 B13R0.61 CCCCCCCN[C@H](CO)C(C)C df2f055810eea2e99e246e5f878d42fd [0,2,0,0,0,0|2,0,0]=4 13797 B13R0.61 CCCCCCCN[C@H](CO)[C@@H](C)O d40496caafc01ed18da830b7d470b3a2 [0,2,0,0,0,0|1,0,0]=3 13798 B13R0.61 CCCCCCCN[C@H](CO)[C@H](C)O 598bcb2a8e32e362b4233aa74bf0991d [0,2,0,0,0,0|1,0,0]=3 13799 B13R0.61 CCCCCCCOC(C#N)C(C)C 5b8844e1341f12c23cdcb1a98c9f5439 [0,2,0,0,0,0|2,0,0]=4 13800 B13R0.61 CCCCCCCOC(C=O)C(C)C 5df50241897b81da7483f06f99886053 [0,2,0,0,0,0|2,0,0]=4 13801 B13R0.61 CCCCCCCOC(CC)C(C)C 1a5a57e990db7c708ed602454180d89b [0,2,0,0,0,0|2,0,0]=4 13802 B13R0.61 CCCCCCNCC(CO)C(C)C 8475329da6f7c9d9e242de7db12b2ad6 [0,2,0,0,0,0|2,0,0]=4 13803 B13R0.61 CCCCCCOCC(CC)C(C)C e9c308cfd5abac1284c3e6b1bc1464a9 [0,2,0,0,0,0|2,0,0]=4 13804 B13R0.61 CCCCCCOC[C@H](OC)C(C)C 4d0091f88b369c4143fcb66a63012641 [0,2,0,0,0,0|2,0,0]=4 13805 B13R0.61 CCCCCOCCC(CC)C(C)C 2bb96f424d37aee57b67cb747383cfc6 [0,2,0,0,0,0|2,0,0]=4 13806 B13R0.61 CCCCOCCNC(CO)C(C)O f33fc1573475b23cfae3e364bcd1f44b [0,2,0,0,0,0|2,0,0]=4 13807 B13R0.61 CCCCOCCN[C@@H](CC)[C@@H](C)O 36e12645af3c2a61f1c6f96c81b0985b [0,2,0,0,0,0|2,0,0]=4 13808 B13R0.61 CCCCOCCN[C@@H](CO)[C@@H](C)O d8d9f667e144d80506d32952cb2c6c2f [0,2,0,0,0,0|2,0,0]=4 13809 B13R0.61 CCCCOCCN[C@@H](CO)[C@H](C)O 1864e6b4cd6f9445b3c1f0c4e6c2f6ce [0,2,0,0,0,0|2,0,0]=4 13810 B13R0.61 CCCCOCCN[C@H](CC)[C@@H](C)O 198e6747bc7d10cc7b792a30fa2b61f1 [0,2,0,0,0,0|2,0,0]=4 13811 B13R0.61 CCCCOCCN[C@H](CC)[C@H](C)O 08b5da380da6b36ae05dbca0e154ff9a [0,2,0,0,0,0|2,0,0]=4 13812 B13R0.61 CCCCOCCN[C@H](CO)[C@@H](C)O 9eec4bb6b63823282fbad91c8318f774 [0,2,0,0,0,0|2,0,0]=4 13813 B13R0.61 CCCCOCCN[C@H](CO)[C@H](C)O 61c6bd631d02490461f48ce47e254bde [0,2,0,0,0,0|2,0,0]=4 13814 B13R0.61 CCCOCCCNC(CO)C(C)O a203f8c79fb303f0a1471c010d13a5f1 [0,2,0,0,0,0|2,0,0]=4 13815 B13R0.61 CCCOCCCN[C@@H](CC)[C@@H](C)O b8d8927a2870b3cb0f741efbac392db1 [0,2,0,0,0,0|2,0,0]=4 13816 B13R0.61 CCCOCCCN[C@@H](CO)[C@@H](C)O 7d3472be0ccf277e8f42611127cfda16 [0,2,0,0,0,0|2,0,0]=4 13817 B13R0.61 CCCOCCCN[C@@H](CO)[C@H](C)O 563ff6e049f9f4aa686988539c522233 [0,2,0,0,0,0|2,0,0]=4 13818 B13R0.61 CCCOCCCN[C@H](CC)[C@@H](C)O c2bde1f8d8f29ea41ca0991d73837ce9 [0,2,0,0,0,0|2,0,0]=4 13819 B13R0.61 CCCOCCCN[C@H](CC)[C@H](C)O d4801d00bc254908f357e0c827823838 [0,2,0,0,0,0|2,0,0]=4 13820 B13R0.61 CCCOCCCN[C@H](CO)[C@@H](C)O af65285c7070d80921d8b77feaa88351 [0,2,0,0,0,0|2,0,0]=4 13821 B13R0.61 CCCOCCCN[C@H](CO)[C@H](C)O 67f3d7f92ae6124b5f1b6d8eed4629ce [0,2,0,0,0,0|2,0,0]=4 13822 B13R0.61 CC[C@@H](NCCCCCCF)[C@@H](C)O 60127cd2334efdd945c918ddec8448c7 [0,2,0,0,0,0|2,0,0]=4 13823 B13R0.61 CC[C@@H](NCCCCCCF)[C@H](C)O c02c61e5746a833f10c8608021d34667 [0,2,0,0,0,0|2,0,0]=4 13824 B13R0.61 CC[C@@H](NCCCCCCO)[C@@H](C)O e11e2e49ae13bf0bbe60a78d1bc01357 [0,2,0,0,0,0|2,0,0]=4 13825 B13R0.61 CC[C@@H](NCCCCCCO)[C@H](C)O 44e974c1bc49cbedc066fe86dd9f162f [0,2,0,0,0,0|2,0,0]=4 13826 B13R0.61 CC[C@@H](NCCCCCOC)[C@@H](C)O 7d412615719533cba836367a691f4edf [0,2,0,0,0,0|2,0,0]=4 13827 B13R0.61 CC[C@@H](NCCCCCOC)[C@H](C)O 92dd53f1760967d942ec7a1667079fef [0,2,0,0,0,0|2,0,0]=4 13828 B13R0.61 CC[C@H](NCCCCCCF)[C@@H](C)O d47044c06229380cf671abf070beeafb [0,2,0,0,0,0|2,0,0]=4 13829 B13R0.61 CC[C@H](NCCCCCCO)[C@@H](C)O 520b5baa0713014e8bfd48db270cbfe1 [0,2,0,0,0,0|2,0,0]=4 13830 B13R0.61 CC[C@H](NCCCCCOC)[C@@H](C)O 5379541d12613c72720fe54b8fe5b5ef [0,2,0,0,0,0|2,0,0]=4 13831 B13R0.61 COCCCCCNC(CO)C(C)O a0367e4b97689c03e24e8f0c7db1e36c [0,2,0,0,0,0|2,0,0]=4 13832 B13R0.61 COCCCCCN[C@@H](CO)[C@@H](C)O 49086df7193e0a4b13d4ee70b9d88830 [0,2,0,0,0,0|2,0,0]=4 13833 B13R0.61 COCCCCCN[C@@H](CO)[C@H](C)O 2a0b7592e1c946bdb3e080b0dd148913 [0,2,0,0,0,0|2,0,0]=4 13834 B13R0.61 COCCCCCN[C@H](CO)[C@@H](C)O 495821c201691f79f4e5955947861816 [0,2,0,0,0,0|2,0,0]=4 13835 B13R0.61 COCCCCCN[C@H](CO)[C@H](C)O 98fc3286de789d5e9d1d2a44db27ea6f [0,2,0,0,0,0|2,0,0]=4 13836 B13R0.61 C[C@@H](O)[C@@H](CO)NCCCCCCF f71ff7741faaeede2049cf01ed50f612 [0,2,0,0,0,0|2,0,0]=4 13837 B13R0.61 C[C@@H](O)[C@@H](CO)NCCCCCCO eac42e5e1fc403d07484e37a1dafebe5 [0,2,0,0,0,0|2,0,0]=4 13838 B13R0.61 C[C@@H](O)[C@H](CO)NCCCCCCF fabb13cabe705b31f20c13c3ee032971 [0,2,0,0,0,0|2,0,0]=4 13839 B13R0.61 C[C@@H](O)[C@H](CO)NCCCCCCO b4e348a0d8ca9c91ac2ae88014fb9831 [0,2,0,0,0,0|2,0,0]=4 13840 B13R0.61 C[C@H](O)[C@@H](CO)NCCCCCCF faca9d6473455b984c8ea50834066558 [0,2,0,0,0,0|2,0,0]=4 13841 B13R0.61 C[C@H](O)[C@@H](CO)NCCCCCCO 2e6750476b758ef42cd7a8212f0513fb [0,2,0,0,0,0|2,0,0]=4 13842 B13R0.61 C[C@H](O)[C@H](CO)NCCCCCCF 5d1d475fbc0648e90f599c6f02f51674 [0,2,0,0,0,0|2,0,0]=4 13843 B13R0.61 C[C@H](O)[C@H](CO)NCCCCCCO 7008b0c3c004b212b6ff413fe56157af [0,2,0,0,0,0|2,0,0]=4 13844 B13R0.91 CCCC(C)CCCOC(C)C(C)C 47142afa1d07142bdf7ecf1897818246 [0,2,0,0,0,0|2,0,0]=4 13845 B13R0.91 CCCC(C)CCOCC(C)C(C)C ad4410d547ffd77a097c01f0af0548e6 [0,2,0,0,0,0|2,0,0]=4 13846 B13R0.91 CCCC(C)COCCC(C)C(C)C 7624a42e4deccb23b0325764d93d3def [0,2,0,0,0,0|2,0,0]=4 13847 B13R0.91 CCCC(S)CCOCC(C)C(C)C 7b72dbeaeb62b4649e04eaeedc5165cb [0,2,0,0,0,0|2,0,0]=4 13848 B13R0.284 CCCCCCC(=O)NC(C)C(C)O 6950acd2d798549fa592bccdbdaa5c59 [0,2,0,0,0,0|1,0,1]=4 13849 B13R0.284 CCCCCCC(C)NC(=O)C(C)O 245e674248161cb89cf4f884b202bc90 [0,2,0,0,0,0|1,0,1]=4 13850 B13R0.284 CCCCCCC(C)NC(=O)[C@@H](C)O 14e97bbd6c0ed60f3a3af0beb5924f35 [0,2,0,0,0,0|1,0,1]=4 13851 B13R0.284 CCCCCCC(C)NC(=O)[C@H](C)O c1ee4b76fe3d8afd25f68dab2bdc9d92 [0,2,0,0,0,0|1,0,1]=4 13852 B13R0.284 CCCCCCC(C)NC(C)C(C)C 62dd653913a9448517446fbcf54b4b82 [0,2,0,0,0,0|2,0,0]=4 13853 B13R0.284 CCCCCCC(C)NC(C)C(C)O a9e249a4e1ad95a7e6095838f14bc5ae [0,2,0,0,0,0|1,0,0]=3 13854 B13R0.284 CCCCCCC(C)N[C@@H](C)C(C)C d764294a838fed9c617647d55a8cd304 [0,2,0,0,0,0|2,0,0]=4 13855 B13R0.284 CCCCCCC(C)N[C@H](C)C(C)C 025f1c06cf1823bac1a1d1522cda3bcd [0,2,0,0,0,0|2,0,0]=4 13856 B13R0.284 CCCCCCC(C)OC(C)C(C)C 72a801d2c97f4a174ed489a2a8e4d1af [0,2,0,0,0,0|2,0,0]=4 13857 B13R0.284 CCCCCCC(C)OC(C)C(C)S 6a58efcabb99d041ff65831ccd3d6b68 [0,2,0,0,0,0|1,1,0]=4 13858 B13R0.284 CCCCCCC(C)O[C@@H](C)C(C)C 068e7e6a100562b40a2b0ee43cd7a6eb [0,2,0,0,0,0|2,0,0]=4 13859 B13R0.284 CCCCCCC(C)O[C@H](C)C(C)C e37294cd02a56c4393278663ad579be1 [0,2,0,0,0,0|2,0,0]=4 13860 B13R0.284 CCCCCCN(C)CC(C)C(C)C c25a351938a904d58cfbb0945623931a [0,2,0,0,0,0|2,0,0]=4 13861 B13R0.284 CCCCCC[C@@H](C)NC(=O)C(C)O 3ff8b626872e69e504b06d38c844a95f [0,2,0,0,0,0|1,0,1]=4 13862 B13R0.284 CCCCCC[C@@H](C)NC(=O)[C@@H](C)O 8abcf0c28c4a87184c152645186f5db6 [0,2,0,0,0,0|1,0,1]=4 13863 B13R0.284 CCCCCC[C@@H](C)NC(=O)[C@H](C)O 25170bcc4eea121c030eadce7874edb8 [0,2,0,0,0,0|1,0,1]=4 13864 B13R0.284 CCCCCC[C@@H](C)NC(C)C(C)C 2fb29f96d004b69cbec62e44c10001ec [0,2,0,0,0,0|2,0,0]=4 13865 B13R0.284 CCCCCC[C@@H](C)OC(C)C(C)C 0a805257fe8b6401e98aa96647b66908 [0,2,0,0,0,0|2,0,0]=4 13866 B13R0.284 CCCCCC[C@H](C)NC(=O)C(C)O 7e4fed18d3f6781bc02cfa4ef7b3eaeb [0,2,0,0,0,0|1,0,1]=4 13867 B13R0.284 CCCCCC[C@H](C)NC(=O)[C@@H](C)O a1479cdaa12bfe9fe45db16580c8c725 [0,2,0,0,0,0|1,0,1]=4 13868 B13R0.284 CCCCCC[C@H](C)NC(=O)[C@H](C)O 5af78146a4efac083b0bb2d7485ff5cc [0,2,0,0,0,0|1,0,1]=4 13869 B13R0.284 CCCCCC[C@H](C)NC(C)C(C)C 9994ed8e4f184474256d0f001d344995 [0,2,0,0,0,0|2,0,0]=4 13870 B13R0.284 CCCCCC[C@H](C)OC(C)C(C)C 5cd59acc3bad1ef059b7ea5449b24dee [0,2,0,0,0,0|2,0,0]=4 13871 B13R0.413 CC(O)C(C)(C)CNCCCCCF e1d7379eb9de1f3088afa3703a1bda83 [0,2,0,0,0,0|2,0,0]=4 13872 B13R0.413 CC(O)C(C)(C)CNCCCCCO 04eedd7b2e564aa21ee7ac9e5621667a [0,2,0,0,0,0|2,0,0]=4 13873 B13R0.413 CC(O)C(C)(C)NCCCCCCF 9058e083fe4d688b9a18915dda62f21b [0,2,0,0,0,0|2,0,0]=4 13874 B13R0.413 CC(O)C(C)(C)NCCCCCCO 8a614482b089660b007a4334db15d808 [0,2,0,0,0,0|2,0,0]=4 13875 B13R0.413 CCCCCCCNC(C)(C)C(C)C 4741e19ec02fa8876dbaa7499e7cc6b6 [0,2,0,0,0,0|2,0,0]=4 13876 B13R0.413 CCCCCCCNC(C)(C)C(C)O e2ec13423f03a6f3bd4d96dad9d78871 [0,2,0,0,0,0|1,0,0]=3 13877 B13R0.413 CCCCCCNCC(C)(C)C(C)C b61c379781546413efdad761dcd0895b [0,2,0,0,0,0|2,0,0]=4 13878 B13R0.413 CCCCCCNCC(C)(C)C(C)O a7a436b1e9a3599775409104767e7cd7 [0,2,0,0,0,0|1,0,0]=3 13879 B13R0.413 CCCCCCOCC(C)(C)C(C)C e4573b329a15d5fc221d773dc0009e8f [0,2,0,0,0,0|2,0,0]=4 13880 B13R0.413 CCCCCCOCC(F)(F)C(C)C 7f45cadbcc7f0eeee94e7e23c23a4811 [0,2,0,0,0,0|2,0,0]=4 13881 B13R0.413 CCCCOCCNC(C)(C)C(C)O 9420fcf287b87e84b69c3f5e1e1f96ff [0,2,0,0,0,0|2,0,0]=4 13882 B13R0.413 CCCCOCNCC(C)(C)C(C)O 6eb3815cbcd195d23dd8c9ab9581f037 [0,2,0,0,0,0|2,0,0]=4 13883 B13R0.413 CCCOCCCNC(C)(C)C(C)O 9c856d7075ea2036864987d3481097f7 [0,2,0,0,0,0|2,0,0]=4 13884 B13R0.413 CCCOCCNCC(C)(C)C(C)O daafa8c3fe6520d3100ef8586c7b518e [0,2,0,0,0,0|2,0,0]=4 13885 B13R0.413 CCOCCCNCC(C)(C)C(C)O c3d2962c907691d92604cbbc49a6e4c7 [0,2,0,0,0,0|2,0,0]=4 13886 B13R0.413 CCSCCCNCC(C)(C)C(C)O bae5f275b48b9f6069a1ce6b144e0399 [0,2,0,0,0,0|2,0,0]=4 13887 B13R0.413 COCCCCCNC(C)(C)C(C)O e7970a90e6b378f95281309bc43548cd [0,2,0,0,0,0|2,0,0]=4 13888 B13R0.413 COCCCCNCC(C)(C)C(C)O 0021c5add6a06a93e4d1e21d8ae660d0 [0,2,0,0,0,0|2,0,0]=4 13889 B13R0.95 CCCC(C)CNC(C)CCC(C)C 40ce5da7c28f43d8b04b3b67a9cc4fc2 [0,2,0,0,0,0|2,0,0]=4 13890 B13R0.95 CCCC(C)COC(C)CCC(C)C f77e5eb3464e475bf6b9e1595820eecd [0,2,0,0,0,0|2,0,0]=4 13891 B13R0.95 CCCC(C)NCC(C)CCC(C)C e8f65235a25613213a32c33f857ce049 [0,2,0,0,0,0|2,0,0]=4 13892 B13R0.95 CCCC(C)OCC(C)CCC(C)C 131d64fa5998936d89dda84f6c3b593b [0,2,0,0,0,0|2,0,0]=4 13893 B13R0.95 CCCC(O)CNC(=O)CCC(C)O 18063f78df4b786640f72ca23cb587fd [0,2,0,0,0,0|1,0,1]=4 13894 B13R0.95 CCCC(O)CNC(C)CCC(C)C 19d49309899039b936d5541504cbab91 [0,2,0,0,0,0|2,0,0]=4 13895 B13R0.95 CCC[C@@H](C)CCC(=O)NCC(C)O da7864485a02c78386cefe0e9c9f2ef8 [0,2,0,0,0,0|1,0,1]=4 13896 B13R0.95 CCC[C@@H](C)CCC(=O)NC[C@@H](C)O d135b0e80337d4789d1334e39c25f0de [0,2,0,0,0,0|1,0,1]=4 13897 B13R0.95 CCC[C@@H](C)CCC(=O)NC[C@H](C)O e7a675833c6409dd3c33e7f7c92dc984 [0,2,0,0,0,0|1,0,1]=4 13898 B13R0.95 CCC[C@@H](C)OCC(C)CCC(C)C adc5b5afe5e5e2c1e6e90f4e49ab19c1 [0,2,0,0,0,0|2,0,0]=4 13899 B13R0.95 CCC[C@H](C)NCC(C)CCC(C)C 73f8c07f662f716e9f3834d016f5891f [0,2,0,0,0,0|2,0,0]=4 13900 B13R0.95 CCC[C@H](C)OCC(C)CCC(C)C 0b8242584c96d1d48840912dba97c676 [0,2,0,0,0,0|2,0,0]=4 13901 B13R0.285 C=CC(CCCCCC)OCC(C)C 3eefcded0e01e65db190d65b9efb51df [0,2,0,0,0,0|2,0,0]=4 13902 B13R0.285 CCCCCCC(CC)COC(C)C 89844ecee7684c98466cd79c2c50769f [0,2,0,0,0,0|2,0,0]=4 13903 B13R0.285 CCCCCCC(CC)OCC(C)C b32f27d031044282eb35b3a6d462e6cd [0,2,0,0,0,0|2,0,0]=4 13904 B13R0.1167 CCCCCCC(C)(C)COC(C)C ce6bf15bdc346da5e3ac41f54074286e [0,2,0,0,0,0|2,0,0]=4 13905 B13R0.231 CC(O)CCCCNC(C)(C)CCO 6fddafc6b4df99d71aed0b445831524b [0,2,0,0,0,0|2,0,0]=4 13906 B13R0.231 CCCC(C)(O)CNCCCC(C)C f072085d91071fe8332e2297e1b1a1c0 [0,2,0,0,0,0|2,0,0]=4 13907 B13R0.231 CCCC(C)(O)CNCCCC(C)O db12f8b7bbc68323f61715d23b439066 [0,2,0,0,0,0|1,0,0]=3 13908 B13R0.231 CCCC(C)(S)CCOCCC(C)C 75828b64e60fbfc8e22bcdd5c59feda9 [0,2,0,0,0,0|2,0,0]=4 13909 B13R0.231 COCC(C)(C)NCCCCC(C)O 8132907dc44b87680a06e6a9f43c02a2 [0,2,0,0,0,0|2,0,0]=4 13910 B13R0.231 COCC(C)(C)NCCCC[C@@H](C)O 384351136842867e22e5385707711161 [0,2,0,0,0,0|2,0,0]=4 13911 B13R0.231 COCC(C)(O)CNCCCC(C)O 8f174e088ffc3ab96a36c7a490edd2a2 [0,2,0,0,0,0|2,0,0]=4 13912 B13R0.231 CSCC(C)(C)NCCCCC(C)O 6ea91ab72368998370060feb0aeb554b [0,2,0,0,0,0|2,0,0]=4 13913 B13R0.231 CSCC(C)(C)NCCCC[C@@H](C)O 31f12e5d0e7b830d38f639cc2fa265dc [0,2,0,0,0,0|2,0,0]=4 13914 B13R0.231 C[C@@H](O)CCCCNC(C)(C)CCO 2472c776149d491fab00ebc603d7290a [0,2,0,0,0,0|2,0,0]=4 13915 B13R0.313 C#CC(CCC)OCCCCC(C)C e8ded854d19ede10fec5249f184d6214 [0,2,0,0,0,0|2,0,0]=4 13916 B13R0.313 C=CC(CCC)OCCCCC(C)C c73e7c6d4b67a64ea59aebc2483d25db [0,2,0,0,0,0|2,0,0]=4 13917 B13R0.313 CC(O)CCCCNC(CO)CCO 388592981256236b57613fa77b0ea288 [0,2,0,0,0,0|2,0,0]=4 13918 B13R0.313 CC(O)CCCCN[C@@H](CO)CCO 413bbcbeba4667e952c443fcf9778dfd [0,2,0,0,0,0|2,0,0]=4 13919 B13R0.313 CCC(COC)NCCCCC(C)O 126b3a77bb3a7bbc9b59bddd8069c690 [0,2,0,0,0,0|2,0,0]=4 13920 B13R0.313 CCC(COC)NCCCC[C@@H](C)O e2f5f36da1076ce2cce3116fbd920774 [0,2,0,0,0,0|2,0,0]=4 13921 B13R0.313 CCCC(C#N)OCCCCC(C)C 565bef4ddd947bbdaeb4b1234c824d85 [0,2,0,0,0,0|2,0,0]=4 13922 B13R0.313 CCCC(CC)COCCCC(C)C 415f02adfbd30d7c4f7d4e60f069204c [0,2,0,0,0,0|2,0,0]=4 13923 B13R0.313 CCCC(CC)OCCCCC(C)C 7eef6624a6113866988e7932d50b9f53 [0,2,0,0,0,0|2,0,0]=4 13924 B13R0.313 CCCC(CCOCCC(C)C)SC 30cde0f52e2c3a56d5fe5234e15a47c0 [0,2,0,0,0,0|2,0,0]=4 13925 B13R0.313 CCCC(CO)NCCCCC(C)C eade1268b85a012a777254d2e80195e9 [0,2,0,0,0,0|2,0,0]=4 13926 B13R0.313 CCCC(CO)NCCCCC(C)O d77882663ab8ab3abeb5c354b7701157 [0,2,0,0,0,0|1,0,0]=3 13927 B13R0.313 CCCC(CO)NCCCC[C@@H](C)O d3906fc55f34d4a4195ebcf75e3b1d9b [0,2,0,0,0,0|1,0,0]=3 13928 B13R0.313 CCCN(CC)CCCCCC(C)C d1927886542f0a885997879183b0d560 [0,2,0,0,0,0|2,0,0]=4 13929 B13R0.313 CCC[C@@H](CC)OCCCCC(C)C 4e33bc58195d3263ae19b7011c72e226 [0,2,0,0,0,0|2,0,0]=4 13930 B13R0.313 CCC[C@@H](CO)NCCCCC(C)C c82629606c06a9a65c5d7415c6aababa [0,2,0,0,0,0|2,0,0]=4 13931 B13R0.313 CCC[C@@H](CO)NCCCCC(C)O c082518bbf85d053f064d77c2ca473de [0,2,0,0,0,0|1,0,0]=3 13932 B13R0.313 CCC[C@@H](CO)NCCCC[C@@H](C)O 2a843ed7d857927717fa8b5f13ac331a [0,2,0,0,0,0|1,0,0]=3 13933 B13R0.313 CCC[C@H](CO)NCCCCC(C)C fc284264380fdd515fdb9949d3b5bf14 [0,2,0,0,0,0|2,0,0]=4 13934 B13R0.313 CCC[C@H](CO)NCCCCC(C)O d8a8e1e0ef844cf4955fbbdc04a51f6a [0,2,0,0,0,0|1,0,0]=3 13935 B13R0.313 CCC[C@H](CO)NCCCC[C@@H](C)O b97a2b474a1e575eee3b1e4514c3c438 [0,2,0,0,0,0|1,0,0]=3 13936 B13R0.313 COCC(CO)NCCCCC(C)O 4364b930743656e8c89d7b8f9bb37b27 [0,2,0,0,0,0|2,0,0]=4 13937 B13R0.313 COCC(CO)NCCCC[C@@H](C)O ecf770cb7f3c29df8e41a1d2f3e8e918 [0,2,0,0,0,0|2,0,0]=4 13938 B13R0.313 CSCC(CO)NCCCCC(C)O bdfbfe3de7764dac13f5d7cb5ae325d1 [0,2,0,0,0,0|2,0,0]=4 13939 B13R0.313 CSCC(CO)NCCCC[C@@H](C)O 4a8758d9f3ade15dfc183d3e97bda81c [0,2,0,0,0,0|2,0,0]=4 13940 B13R0.313 C[C@@H](O)CCCCNC(CO)CCO 5c899a0e2b9aff7322bff5a0830e30ff [0,2,0,0,0,0|2,0,0]=4 13941 B13R0.313 C[C@@H](O)CCCCN[C@@H](CO)CCO a6d92738a1a823b361f2b81680292245 [0,2,0,0,0,0|2,0,0]=4 13942 B11R1.24 CCCCN1CCCC(C1)C 816b5f6bdf97ab4163163811a8f399aa [1,0,0,1,0,0|2,0,0]=4 13943 B11R1.24 CCCCN1CCCC(C1)F 59e665c66f1819f4337a0f5a75ebfe3f [1,0,0,1,0,0|2,0,0]=4 13944 B11R1.24 CCCCN1CCCC(C1)O a13a79b54351a761d8066e1aee09f97c [1,0,0,1,0,0|1,0,0]=3 13945 B11R1.24 CCCCN1CCC[C@@H](C1)C c9eebf929a5dd2d06c8edaec1bbb5a4f [1,0,0,1,0,0|2,0,0]=4 13946 B11R1.24 CCCCN1CCC[C@@H](C1)F d2d8e1c7951dc00716fcffd2723f4aa7 [1,0,0,1,0,0|2,0,0]=4 13947 B11R1.24 CCCCN1CCC[C@@H](C1)O fbdac0af8fd499acec50df56a7ba829e [1,0,0,1,0,0|1,0,0]=3 13948 B11R1.24 CCCCN1CCC[C@H](C1)C 7b4578eae2af0c53b6409850286b2da7 [1,0,0,1,0,0|2,0,0]=4 13949 B11R1.24 CCCCN1CCC[C@H](C1)F a1d645eb1df83ff8926db9b96c5afdd8 [1,0,0,1,0,0|2,0,0]=4 13950 B11R1.24 CCCCN1CCC[C@H](C1)O e7e4354e46b2995126b20895f9fc7e1d [1,0,0,1,0,0|1,0,0]=3 13951 B11R1.24 CCCNC1CCCC(C1)C a81125382d678ebc8e9ba0cefc93cb8c [1,0,0,1,0,0|2,0,0]=4 13952 B11R1.24 CCCNC1CCCC(C1)O 811c3009a0c66f0fe81892da0c1a38ef [1,0,0,1,0,0|1,0,0]=3 13953 B11R1.24 CCCNC1COCC(C1)O e2f3805e8db53dd4bdb8d9520d0f886a [1,0,0,1,0,0|2,0,0]=4 13954 B11R1.24 CCCN[C@@H]1CCC[C@@H](C1)O 543b4bbf09e0778921287662b7e5eb66 [1,0,0,1,0,0|1,0,0]=3 13955 B11R1.24 CCCN[C@@H]1CCC[C@H](C1)C bffb35be013df57e1b8e8d70e8190332 [1,0,0,1,0,0|2,0,0]=4 13956 B11R1.24 CCCN[C@@H]1CCC[C@H](C1)O 45e532c5c8d8a723f96a2dffa9b74026 [1,0,0,1,0,0|1,0,0]=3 13957 B11R1.24 CCCN[C@@H]1COC[C@@H](C1)O 3df94c18b984f6f5073b302f168d06ec [1,0,0,1,0,0|2,0,0]=4 13958 B11R1.24 CCCN[C@H]1CCC[C@@H](C1)O 6f989413e30ada5271f6a296ee5ea92e [1,0,0,1,0,0|1,0,0]=3 13959 B11R1.24 CCCN[C@H]1CCC[C@H](C1)O a49bc53f294c95a93797df2c4ac2155c [1,0,0,1,0,0|1,0,0]=3 13960 B11R1.24 CCCN[C@H]1COC[C@H](C1)O 7cb56739c0b40708e97a84b73638fb87 [1,0,0,1,0,0|2,0,0]=4 13961 B11R1.24 CCCOC1CCCC(C1)C 51405fdb3ff3cc2adf7c96653b9e85c4 [1,0,0,1,0,0|2,0,0]=4 13962 B11R1.24 CCCO[C@@H]1CCC[C@@H](C1)C 6ab0223803e6a8aacec5c5bacc8264c3 [1,0,0,1,0,0|2,0,0]=4 13963 B11R1.24 CCCO[C@H]1CCC[C@@H](C1)C 6ac94074d08177dad0794af8039ca22e [1,0,0,1,0,0|2,0,0]=4 13964 B11R1.24 CCCO[C@H]1CCC[C@H](C1)C a9a57dcfebcc6debd037c1cce2e8fd54 [1,0,0,1,0,0|2,0,0]=4 13965 B11R1.24 CCNCC1CCCC(C1)C 753f4e6c16256594d8234251837360d7 [1,0,0,1,0,0|2,0,0]=4 13966 B11R1.24 CCNCC1CCCC(C1)O 59552859fe32530554ff42fbfb5e3e94 [1,0,0,1,0,0|1,0,0]=3 13967 B11R1.24 CCNC[C@H]1CCC[C@H](C1)O 86c891488cc5d20468f47dee60e90605 [1,0,0,1,0,0|1,0,0]=3 13968 B11R1.24 CCOCC1CCCC(C1)C 1b1d1f21e9bb615a91aa888f67e7d832 [1,0,0,1,0,0|2,0,0]=4 13969 B11R1.24 CCOCN1CCCC(C1)O 72598ccd50ecfe65dee28ca5ccdd64f7 [1,0,0,1,0,0|2,0,0]=4 13970 B11R1.24 CCOCN1CCC[C@@H](C1)O 977c154d5dcc3cdaf544ea0464d5fc62 [1,0,0,1,0,0|2,0,0]=4 13971 B11R1.24 CCOCN1CCC[C@H](C1)O 1f49c6d474909b50593c4c9711e6a2a6 [1,0,0,1,0,0|2,0,0]=4 13972 B11R1.24 COCCN1CCCC(C1)O 09f0e63b8969e8302a04de2e6646104b [1,0,0,1,0,0|2,0,0]=4 13973 B11R1.24 COCCN1CCC[C@@H](C1)O 10dcf3f175bc187e4259ec58def7a7a2 [1,0,0,1,0,0|2,0,0]=4 13974 B11R1.24 COCCN1CCC[C@H](C1)O 19eff92e2f642dbfe5e7bc73b8fb3d68 [1,0,0,1,0,0|2,0,0]=4 13975 B11R1.24 COCNC1CCCC(C1)O e0cb198b40f782294ec914b79fb13c15 [1,0,0,1,0,0|2,0,0]=4 13976 B11R1.24 COCN[C@@H]1CCC[C@@H](C1)O 700702de219a10b79f1f9d14e7d537fe [1,0,0,1,0,0|2,0,0]=4 13977 B11R1.24 COCN[C@@H]1CCC[C@H](C1)O a5c71d3a4b04dec187e24e53a39a3c12 [1,0,0,1,0,0|2,0,0]=4 13978 B11R1.24 COCN[C@H]1CCC[C@@H](C1)O d51af0ed92eb69fca31e5da3bc6d4f38 [1,0,0,1,0,0|2,0,0]=4 13979 B11R1.24 COCN[C@H]1CCC[C@H](C1)O 155ff1888891a556513602e6ff78c231 [1,0,0,1,0,0|2,0,0]=4 13980 B11R1.24 CSCCN1CCCC(C1)O e521d894acf55dbbfb9543ce879b570c [1,0,0,1,0,0|2,0,0]=4 13981 B11R1.24 CSCCN1CCC[C@@H](C1)O ac35c97c62b56a41dc6af0b539312c0b [1,0,0,1,0,0|2,0,0]=4 13982 B11R1.24 CSCCN1CCC[C@H](C1)O c29c379ff87f9acdb4c23bce9bf818d6 [1,0,0,1,0,0|2,0,0]=4 13983 B11R1.24 CSCNC1CCCC(C1)O 12993679f0fe76278bd0036c3e80a3ce [1,0,0,1,0,0|2,0,0]=4 13984 B11R1.24 CSCN[C@@H]1CCC[C@@H](C1)O 7b018d7235da08b9c8e3094b871e5417 [1,0,0,1,0,0|2,0,0]=4 13985 B11R1.24 CSCN[C@@H]1CCC[C@H](C1)O 6cdf48a41ae6c67eed523ab5a3c6e397 [1,0,0,1,0,0|2,0,0]=4 13986 B11R1.24 CSCN[C@H]1CCC[C@@H](C1)O 51a394fe2c02109ca2d90f86aff5336b [1,0,0,1,0,0|2,0,0]=4 13987 B11R1.24 CSCN[C@H]1CCC[C@H](C1)O 0ebc30b77faa5bd75bfc6c4067f7ba54 [1,0,0,1,0,0|2,0,0]=4 13988 B11R1.24 OC1CCCC(C1)CNCF 9aaf9bc9bfa4a5d2a60cc99e63ec600a [1,0,0,1,0,0|2,0,0]=4 13989 B11R1.24 OC1CCCC(C1)NCCF c54c3386ea1bfe95fc08fc131727a42d [1,0,0,1,0,0|2,0,0]=4 13990 B11R1.24 OC1CCCC(C1)NCCS e64c00fc633bc4fc3af9ef07ddad101e [1,0,0,1,0,0|2,0,0]=4 13991 B11R1.24 OC1CCCN(C1)CCCF e301bd4fbda62b1f134963f69e527483 [1,0,0,1,0,0|2,0,0]=4 13992 B11R1.24 OC1CCCN(C1)CCCS ffa43237c3b658b5d50a37c62c51aab6 [1,0,0,1,0,0|2,0,0]=4 13993 B11R1.24 OCCCN1CCCC(C1)O c871abe240838ed4da22288cdc8dbb11 [1,0,0,1,0,0|2,0,0]=4 13994 B11R1.24 OCCCN1CCC[C@@H](C1)O c12fa633d2295b210c71530b21dac81a [1,0,0,1,0,0|2,0,0]=4 13995 B11R1.24 OCCCN1CCC[C@H](C1)O 4e272065915ba1dba5b76997369aa2be [1,0,0,1,0,0|2,0,0]=4 13996 B11R1.24 OCCNC1CCCC(C1)O 6cf2056b76a22bd3b7417e171775d5e5 [1,0,0,1,0,0|2,0,0]=4 13997 B11R1.24 OCCN[C@@H]1CCC[C@@H](C1)O c2b96e606dd1c6ff20133af0dcb9064c [1,0,0,1,0,0|2,0,0]=4 13998 B11R1.24 OCCN[C@@H]1CCC[C@H](C1)O 81cae22b5dd571d64919245c437f0bf5 [1,0,0,1,0,0|2,0,0]=4 13999 B11R1.24 OCCN[C@H]1CCC[C@@H](C1)O 891829fb55643a2b673551b339c3f4eb [1,0,0,1,0,0|2,0,0]=4 14000 B11R1.24 OCCN[C@H]1CCC[C@H](C1)O d6caeb9db1203fd50f59a8a495a70343 [1,0,0,1,0,0|2,0,0]=4 14001 B11R1.24 OCNCC1CCCC(C1)O ade4ab86d24b0c5f264cca4360a750ba [1,0,0,1,0,0|2,0,0]=4 14002 B11R1.24 OCNC[C@H]1CCC[C@H](C1)O 5ebf7cb1ab1723277117b22836e1ec4e [1,0,0,1,0,0|2,0,0]=4 14003 B11R1.24 O[C@@H]1CCCN(C1)CCCF 4919ac23b86e66637ba36c769fab65d9 [1,0,0,1,0,0|2,0,0]=4 14004 B11R1.24 O[C@@H]1CCCN(C1)CCCS 31b53bbc2bf7a6847ce4d07eeebc2902 [1,0,0,1,0,0|2,0,0]=4 14005 B11R1.24 O[C@@H]1CCC[C@@H](C1)CNCF 1418d897f1a4b1c7285ecb11e7e5967d [1,0,0,1,0,0|2,0,0]=4 14006 B11R1.24 O[C@@H]1CCC[C@@H](C1)NCCF 1d7e52e92af32293cf534357a057ffac [1,0,0,1,0,0|2,0,0]=4 14007 B11R1.24 O[C@@H]1CCC[C@@H](C1)NCCS 3207f0b8d8a4372e83c23bb3432e4bff [1,0,0,1,0,0|2,0,0]=4 14008 B11R1.24 O[C@@H]1CCC[C@H](C1)NCCF 6e433354ffc1dbe58d996e491ef6860f [1,0,0,1,0,0|2,0,0]=4 14009 B11R1.24 O[C@@H]1CCC[C@H](C1)NCCS 3fa0b94941cc059d22464441746a636b [1,0,0,1,0,0|2,0,0]=4 14010 B11R1.24 O[C@H]1CCCN(C1)CCCF ad2e2fb2838a3e78430d179a107f801f [1,0,0,1,0,0|2,0,0]=4 14011 B11R1.24 O[C@H]1CCCN(C1)CCCS e4be07be27e46b5cc7927b73423bf903 [1,0,0,1,0,0|2,0,0]=4 14012 B11R1.24 O[C@H]1CCC[C@@H](C1)NCCF dfaa3a17823a711d2074238890b57d6e [1,0,0,1,0,0|2,0,0]=4 14013 B11R1.24 O[C@H]1CCC[C@@H](C1)NCCS f1f3769c10d2968fc45d5478489d3d38 [1,0,0,1,0,0|2,0,0]=4 14014 B11R1.24 O[C@H]1CCC[C@H](C1)NCCF 81509b1b80d89f2c6a546957dc422ce9 [1,0,0,1,0,0|2,0,0]=4 14015 B11R1.24 O[C@H]1CCC[C@H](C1)NCCS eec73e5a35932c87c78cfc8609f5e67e [1,0,0,1,0,0|2,0,0]=4 14016 B11R1.27 CC1CCC(O1)COCCF 1c413b20a42caec92df5871a5ebe9060 [1,0,0,1,0,0|2,0,0]=4 14017 B11R1.27 CC1CCC(O1)COCCS b572ab71cb2d94e94696cc79ba7c16e9 [1,0,0,1,0,0|2,0,0]=4 14018 B11R1.27 CCCCCN1CCC(C1)C fb2c748fd271d5b579dbb78daa840a82 [1,0,0,1,0,0|2,0,0]=4 14019 B11R1.27 CCCCCN1CCC(C1)F dcdf38a1ff0aed7c47c1296d6b732a5a [1,0,0,1,0,0|2,0,0]=4 14020 B11R1.27 CCCCCN1CCC(C1)O 660096ddac722e564b18325f84033519 [1,0,0,1,0,0|1,0,0]=3 14021 B11R1.27 CCCCCN1CC[C@@H](C1)F 07ccd4f8e9d1c0252346a257ee92e149 [1,0,0,1,0,0|2,0,0]=4 14022 B11R1.27 CCCCCN1CC[C@@H](C1)O 3f857e5b4f1bf1f28ca72d51565fac9a [1,0,0,1,0,0|1,0,0]=3 14023 B11R1.27 CCCCCN1CC[C@H](C1)F 6c274fcd91acde60c2d4bf57132fa3e6 [1,0,0,1,0,0|2,0,0]=4 14024 B11R1.27 CCCCCN1CC[C@H](C1)O c2d51d12d99d3cf79d5b992d16394bbb [1,0,0,1,0,0|1,0,0]=3 14025 B11R1.27 CCCCNC1CCC(C1)C 3f726e6ee48b884d766cc258fb188039 [1,0,0,1,0,0|2,0,0]=4 14026 B11R1.27 CCCCNC1CCC(C1)O 9779be9d468f275a75a474b7205d6fec [1,0,0,1,0,0|1,0,0]=3 14027 B11R1.27 CCCCN[C@@H]1CC[C@@H](C1)O 618052d677bb6e8e7b25993672363612 [1,0,0,1,0,0|1,0,0]=3 14028 B11R1.27 CCCCN[C@@H]1CC[C@H](C1)O 1603ca0ea566b98e9eb9775e24490ec8 [1,0,0,1,0,0|1,0,0]=3 14029 B11R1.27 CCCCN[C@H]1CC[C@@H](C1)O d58d5e17a6423379fd405f9d6cfdc172 [1,0,0,1,0,0|1,0,0]=3 14030 B11R1.27 CCCCN[C@H]1CC[C@H](C1)O 63d9dcebd98e728c12860738358fe144 [1,0,0,1,0,0|1,0,0]=3 14031 B11R1.27 CCCCOC1CCC(C1)C e0bdb5920e333bd129d6c771159bdc88 [1,0,0,1,0,0|2,0,0]=4 14032 B11R1.27 CCCCOC1CCC(C1)F f689e02074fa35241ee0991d4d0af9c2 [1,0,0,1,0,0|2,0,0]=4 14033 B11R1.27 CCCNCC1CCC(C1)O 69767a48d5e511dcb48e6df252c878ee [1,0,0,1,0,0|1,0,0]=3 14034 B11R1.27 CCCOCC1CCC(C1)C 819058e3ecf0d52c49ee3a150c8e2ef6 [1,0,0,1,0,0|2,0,0]=4 14035 B11R1.27 CCCOCC1CCC(C1)F 87719ac22c4738670ba9dd72d068fc80 [1,0,0,1,0,0|2,0,0]=4 14036 B11R1.27 CCCOCC1CCC(O1)C 7245c0506fa318f9ec0ffb8bd206fb82 [1,0,0,1,0,0|1,0,0]=3 14037 B11R1.27 CCCOC[C@@H]1CC[C@@H](O1)C dc1d7f544da463b9fa3fdd86a4095b16 [1,0,0,1,0,0|1,0,0]=3 14038 B11R1.27 CCCOC[C@@H]1CC[C@H](C1)F 9e171726fdb5a6aa8e0186feddd222a7 [1,0,0,1,0,0|2,0,0]=4 14039 B11R1.27 CCCOC[C@H]1CC[C@H](C1)F 849cfd95241dd12aab96c1eb141af76e [1,0,0,1,0,0|2,0,0]=4 14040 B11R1.27 CCNCCN1CCC(C1)O fd4c5f044fbd9018a830601cbba8f8f2 [1,0,0,1,0,0|2,0,0]=4 14041 B11R1.27 CCNCCN1CC[C@@H](C1)O 1a037b8878477fd6ccb02cc64b5b5a22 [1,0,0,1,0,0|2,0,0]=4 14042 B11R1.27 CCOCCN1CCC(C1)O 85ee71dbb504ae1f8e37e997b2b0a736 [1,0,0,1,0,0|2,0,0]=4 14043 B11R1.27 CCOCCN1CC[C@@H](C1)O 64c4aed3b7bb9c516add1da9b520e7ac [1,0,0,1,0,0|2,0,0]=4 14044 B11R1.27 CCOCCN1CC[C@H](C1)O 06645ded855fc94355732545303d75f6 [1,0,0,1,0,0|2,0,0]=4 14045 B11R1.27 CCOCNC1CCC(C1)O e38817e377a836096bc626a14457cb1e [1,0,0,1,0,0|2,0,0]=4 14046 B11R1.27 CCOCN[C@@H]1CC[C@@H](C1)O 2ca24a876eae2fc4be367f3dc1322c20 [1,0,0,1,0,0|2,0,0]=4 14047 B11R1.27 CCOCN[C@@H]1CC[C@H](C1)O 432115508c897732e09962e6fc9af028 [1,0,0,1,0,0|2,0,0]=4 14048 B11R1.27 CCOCN[C@H]1CC[C@@H](C1)O f23431488a0630f310cddac3fcaff26a [1,0,0,1,0,0|2,0,0]=4 14049 B11R1.27 CCOCN[C@H]1CC[C@H](C1)O 444d5c31feebefc3f80fa8d69011e576 [1,0,0,1,0,0|2,0,0]=4 14050 B11R1.27 CCSCCN1CCC(C1)O 895291d6343bb7dced23cec6793184e3 [1,0,0,1,0,0|2,0,0]=4 14051 B11R1.27 CCSCCN1CC[C@@H](C1)O 583121faef2fd366a711b9706a7f45f4 [1,0,0,1,0,0|2,0,0]=4 14052 B11R1.27 CCSCCN1CC[C@H](C1)O 70a33ad8237d4c6ae68b15908b91a0d7 [1,0,0,1,0,0|2,0,0]=4 14053 B11R1.27 COCCCN1CCC(C1)O 9c3cff6b4c07070b27a605fdf17cab8f [1,0,0,1,0,0|2,0,0]=4 14054 B11R1.27 COCCCN1CC[C@@H](C1)O 1f5d1eb2ecb3801f64714cd803805285 [1,0,0,1,0,0|2,0,0]=4 14055 B11R1.27 COCCCN1CC[C@H](C1)O 896a68b595ccc1f09bb6ad985255b952 [1,0,0,1,0,0|2,0,0]=4 14056 B11R1.27 COCCNC1CCC(C1)O 08d9ab99c123da5f7c23c4556f2cec5b [1,0,0,1,0,0|2,0,0]=4 14057 B11R1.27 COCCN[C@@H]1CC[C@@H](C1)O 07d0390d0db17fee93681f626a886e95 [1,0,0,1,0,0|2,0,0]=4 14058 B11R1.27 COCCN[C@@H]1CC[C@H](C1)O 51fb7e6f300583ab6cee9ea2be7f5c92 [1,0,0,1,0,0|2,0,0]=4 14059 B11R1.27 COCCN[C@H]1CC[C@@H](C1)O 1ac7d4c133b0208ba4374ed26232bd27 [1,0,0,1,0,0|2,0,0]=4 14060 B11R1.27 COCCN[C@H]1CC[C@H](C1)O a06fa4f54b825783de4d76c5957dfa91 [1,0,0,1,0,0|2,0,0]=4 14061 B11R1.27 COCNCC1CCC(C1)O af449e439bd5b5589372832162748d9c [1,0,0,1,0,0|2,0,0]=4 14062 B11R1.27 COCOCC1CCC(O1)C b86580239ae6f55d3e76bf6a67d04949 [1,0,0,1,0,0|2,0,0]=4 14063 B11R1.27 COCOC[C@@H]1CC[C@@H](O1)C 8b9fb183ff5c8c6c471418940919a792 [1,0,0,1,0,0|2,0,0]=4 14064 B11R1.27 CSCCCN1CCC(C1)O 759d73c3eb03ec761c32c10a509ea232 [1,0,0,1,0,0|2,0,0]=4 14065 B11R1.27 CSCCCN1CC[C@@H](C1)O ae32e64d1c4afcd52cc845e6513d8359 [1,0,0,1,0,0|2,0,0]=4 14066 B11R1.27 CSCCCN1CC[C@H](C1)O 502cf705aa3aaed1bef8781bc72b4567 [1,0,0,1,0,0|2,0,0]=4 14067 B11R1.27 CSCCNC1CCC(C1)O 5f7813c1546c50309261e831cd1672ba [1,0,0,1,0,0|2,0,0]=4 14068 B11R1.27 CSCCN[C@@H]1CC[C@@H](C1)O 0fae0baf6b4a73806ba61c0233179a8a [1,0,0,1,0,0|2,0,0]=4 14069 B11R1.27 CSCCN[C@@H]1CC[C@H](C1)O a4e0175f2699a5c656ed7822b2acf671 [1,0,0,1,0,0|2,0,0]=4 14070 B11R1.27 CSCCN[C@H]1CC[C@@H](C1)O 422f67654c26cb04ca7d65fd8f969333 [1,0,0,1,0,0|2,0,0]=4 14071 B11R1.27 CSCCN[C@H]1CC[C@H](C1)O fbc6f90f069e7705f9b7d2cd55381310 [1,0,0,1,0,0|2,0,0]=4 14072 B11R1.27 CSCNCC1CCC(C1)O 4c0159f4410637d69138b25fca5f6c50 [1,0,0,1,0,0|2,0,0]=4 14073 B11R1.27 CSCOCC1CCC(O1)C 80d2f9ecc7f9ccf057baaf55753ca301 [1,0,0,1,0,0|2,0,0]=4 14074 B11R1.27 CSCOC[C@@H]1CC[C@@H](O1)C d2fb52c0a1db763a55bde8d82de02d07 [1,0,0,1,0,0|2,0,0]=4 14075 B11R1.27 C[C@H]1CC[C@H](O1)COCCF e6194d905dff7c4a56813bb870a42536 [1,0,0,1,0,0|2,0,0]=4 14076 B11R1.27 C[C@H]1CC[C@H](O1)COCCS ae1d0659f14d013b4d33940a9e6fcac4 [1,0,0,1,0,0|2,0,0]=4 14077 B11R1.27 OC1CCC(C1)CNCCF 790809683177580701353bab25637d2f [1,0,0,1,0,0|2,0,0]=4 14078 B11R1.27 OC1CCC(C1)CNCCS 62c6dd750caffb316cb9cb7e41e96560 [1,0,0,1,0,0|2,0,0]=4 14079 B11R1.27 OC1CCC(C1)NCCCF e364317d32c29f25ddd6b4aa1a233707 [1,0,0,1,0,0|2,0,0]=4 14080 B11R1.27 OC1CCC(C1)NCCCS 07c16a633eaac070820ccf536c9c47e3 [1,0,0,1,0,0|2,0,0]=4 14081 B11R1.27 OC1CCN(C1)CCCCF 8238dc28a597fd8a32a5d1e8d094cab2 [1,0,0,1,0,0|2,0,0]=4 14082 B11R1.27 OCCCCN1CCC(C1)O 92c48e25294f3c94cabafb5c23354f97 [1,0,0,1,0,0|2,0,0]=4 14083 B11R1.27 OCCCCN1CC[C@@H](C1)O 9fe63ae5b1715424373da089fd2d2d3e [1,0,0,1,0,0|2,0,0]=4 14084 B11R1.27 OCCCCN1CC[C@H](C1)O 88fd23686d0b80b3b595eb706bc3009e [1,0,0,1,0,0|2,0,0]=4 14085 B11R1.27 OCCCNC1CCC(C1)O d51d398be3d1128808896fd95d61a2fa [1,0,0,1,0,0|2,0,0]=4 14086 B11R1.27 OCCCN[C@@H]1CC[C@@H](C1)O 6b4175dc78b3643b66c44aa5806c2738 [1,0,0,1,0,0|2,0,0]=4 14087 B11R1.27 OCCCN[C@@H]1CC[C@H](C1)O fe582bf36553d7e8f2b626a9c37d2c1d [1,0,0,1,0,0|2,0,0]=4 14088 B11R1.27 OCCCN[C@H]1CC[C@@H](C1)O e9479729adcab482b0100e1af7dbbbcc [1,0,0,1,0,0|2,0,0]=4 14089 B11R1.27 OCCCN[C@H]1CC[C@H](C1)O 3b982edd868658f8d23144132cd47d6a [1,0,0,1,0,0|2,0,0]=4 14090 B11R1.27 OCCNCC1CCC(C1)O 01d5b25a18f43d0ad30b90267eeb2eea [1,0,0,1,0,0|2,0,0]=4 14091 B11R1.27 O[C@@H]1CCN(C1)CCCCF 072c4c02032674fba5579c5d6d22654e [1,0,0,1,0,0|2,0,0]=4 14092 B11R1.27 O[C@@H]1CC[C@@H](C1)NCCCF c47ff1db02c2f18b60c607a3289fc515 [1,0,0,1,0,0|2,0,0]=4 14093 B11R1.27 O[C@@H]1CC[C@@H](C1)NCCCS 191566a7849332ddd734dc550d01a65d [1,0,0,1,0,0|2,0,0]=4 14094 B11R1.27 O[C@@H]1CC[C@H](C1)NCCCF aec9accb9a90b14ced3542cb59a8982b [1,0,0,1,0,0|2,0,0]=4 14095 B11R1.27 O[C@@H]1CC[C@H](C1)NCCCS 923eadb49da3e5eba7c7469755b0db51 [1,0,0,1,0,0|2,0,0]=4 14096 B11R1.27 O[C@H]1CCN(C1)CCCCF f845524f45c3c0dfe64456f168fa17d3 [1,0,0,1,0,0|2,0,0]=4 14097 B11R1.27 O[C@H]1CC[C@@H](C1)NCCCF 10a171c21f144cc23a639d7e7e0293a7 [1,0,0,1,0,0|2,0,0]=4 14098 B11R1.27 O[C@H]1CC[C@@H](C1)NCCCS d251245b5ed7c446113012c26a52b741 [1,0,0,1,0,0|2,0,0]=4 14099 B11R1.27 O[C@H]1CC[C@H](C1)NCCCF fd7560e15d67abf1799714c3c5577352 [1,0,0,1,0,0|2,0,0]=4 14100 B11R1.27 O[C@H]1CC[C@H](C1)NCCCS db2badb0a9b7d7742caa96835b524c9f [1,0,0,1,0,0|2,0,0]=4 14101 B11R1.46 CCCCCCNC1CC1C b45c8cc8aab0d0f6e85bc0878785f9a8 [1,0,0,1,0,0|2,0,0]=4 14102 B11R1.46 CCCCCCN[C@@H]1C[C@H]1F 8acf724c7f2baa9f149ae7e874015212 [1,0,0,1,0,0|2,0,0]=4 14103 B11R1.46 CCCCCCN[C@H]1C[C@@H]1F b340769e30fa852079a5cf8ad575a16f [1,0,0,1,0,0|2,0,0]=4 14104 B11R1.46 CCCCCCN[C@H]1C[C@H]1F b119eb7d37bb1343a31b736c7857aee4 [1,0,0,1,0,0|2,0,0]=4 14105 B11R1.46 CCCCCOCC1CC1C 1867a2f9dbe6833314b32cc2d43ad509 [1,0,0,1,0,0|2,0,0]=4 14106 B11R1.46 CCCCCOC[C@@H]1C[C@@H]1C c9abe658c8e69fcb1746924eb6d0236e [1,0,0,1,0,0|2,0,0]=4 14107 B11R1.46 CCCCCOC[C@@H]1C[C@@H]1F 376cdec18b650c56f31f2986c380d81e [1,0,0,1,0,0|2,0,0]=4 14108 B11R1.46 CCCCCOC[C@@H]1C[C@H]1C 7d4defcf022fc7cc6b4b23d1e7760c54 [1,0,0,1,0,0|2,0,0]=4 14109 B11R1.46 CCCCCOC[C@@H]1C[C@H]1F a29591ccf2621da1b5b68f0eda1453ae [1,0,0,1,0,0|2,0,0]=4 14110 B11R1.46 CCCCCOC[C@H]1C[C@@H]1C 8ae5ae826d447077c2e9d4f46186a74c [1,0,0,1,0,0|2,0,0]=4 14111 B11R1.46 CCCCCOC[C@H]1C[C@@H]1F 6519f584dbd05e8e1c2d2c8fba2b5452 [1,0,0,1,0,0|2,0,0]=4 14112 B11R1.46 CCCCCOC[C@H]1C[C@H]1F c8f45365b901a35123f2900db901d7d0 [1,0,0,1,0,0|2,0,0]=4 14113 B11R1.53 CCC1CCCCN1C(C)C b46c01505cd6f3a5d2a438f0d3c1c7eb [1,0,0,1,0,0|2,0,0]=4 14114 B11R1.53 CC[C@@H]1CCCCN1C(C)C 9dbd150ec601d34834808bc671a777ff [1,0,0,1,0,0|2,0,0]=4 14115 B11R1.53 CC[C@H]1CCCCN1C(C)C 15f180ee366d242beb7e8df8b01a4531 [1,0,0,1,0,0|2,0,0]=4 14116 B11R1.57 CC(O)CN1CCCC1CO 9265c7364d4a0702209dd506984785e0 [1,0,0,1,0,0|2,0,0]=4 14117 B11R1.57 CC(O)CN1CCC[C@@H]1CF fd88534c68cc9b88074b5bd71895fb90 [1,0,0,1,0,0|2,0,0]=4 14118 B11R1.57 CC(O)CN1CCC[C@@H]1CO bca95a4fd5d05f074bfac5ff3daf6920 [1,0,0,1,0,0|2,0,0]=4 14119 B11R1.57 CC(O)CN1CCC[C@H]1CF a8ce139439ef3380d52c88318af8a3c6 [1,0,0,1,0,0|2,0,0]=4 14120 B11R1.57 CC(O)CN1CCC[C@H]1CO 578761e2102ae27fc506e26627de8de8 [1,0,0,1,0,0|2,0,0]=4 14121 B11R1.57 CCC1CCCN1CC(C)C 1990dc38516a2124343f8fa433cd79c5 [1,0,0,1,0,0|2,0,0]=4 14122 B11R1.57 CCC1CCCN1CC(C)O b08912f4ae8ba9bd36687d6052586ea9 [1,0,0,1,0,0|1,0,0]=3 14123 B11R1.57 CCC1CCCN1C[C@@H](C)O 37a772954d12651c1774e8163cf8e38d [1,0,0,1,0,0|1,0,0]=3 14124 B11R1.57 CCC1CCCN1C[C@H](C)O bcb4994090664b7c43ab623961dcc860 [1,0,0,1,0,0|1,0,0]=3 14125 B11R1.57 CCN1CCCC1CC(C)C abe2f5c2462182020efee1ab28b7958f [1,0,0,1,0,0|2,0,0]=4 14126 B11R1.57 CC[C@@H]1CCCN1CC(C)C db1e90007326947555222bbc579f2e0f [1,0,0,1,0,0|2,0,0]=4 14127 B11R1.57 CC[C@@H]1CCCN1CC(C)O a86924fcd76aac7c9da8412c26b51e4f [1,0,0,1,0,0|1,0,0]=3 14128 B11R1.57 CC[C@@H]1CCCN1C[C@@H](C)O bfbf5a29cf72a1035f339352ff190511 [1,0,0,1,0,0|1,0,0]=3 14129 B11R1.57 CC[C@@H]1CCCN1C[C@H](C)O f8bdccf003dab62d373d76976e65cece [1,0,0,1,0,0|1,0,0]=3 14130 B11R1.57 CC[C@@H]1CCC[C@H]1NC(C)C 7d0ff8c8d45ce0f29a84581295e1d3f9 [1,0,0,1,0,0|2,0,0]=4 14131 B11R1.57 COC1CCCN1CC(C)O 01858c7f198ee042aca614a5833c3fc5 [1,0,0,1,0,0|2,0,0]=4 14132 B11R1.57 COC1CCCN1C[C@@H](C)O 478ca213424fd98310f6defb46f82d51 [1,0,0,1,0,0|2,0,0]=4 14133 B11R1.57 COC1CCCN1C[C@H](C)O bd6cb87d2a7764f647619c7ded540d98 [1,0,0,1,0,0|2,0,0]=4 14134 B11R1.57 C[C@@H](O)CN1CCCC1CO 9c98f50d8e72364dac46b9118c1f88b2 [1,0,0,1,0,0|2,0,0]=4 14135 B11R1.57 C[C@@H](O)CN1CCC[C@@H]1CF b25d732a296d13f3ec7a90958e8066fc [1,0,0,1,0,0|2,0,0]=4 14136 B11R1.57 C[C@@H](O)CN1CCC[C@@H]1CO afd0c895312596032de0a2ee193719fe [1,0,0,1,0,0|2,0,0]=4 14137 B11R1.57 C[C@@H](O)CN1CCC[C@H]1CF 25f1e531ecb79937ef2a69a3df314f24 [1,0,0,1,0,0|2,0,0]=4 14138 B11R1.57 C[C@@H](O)CN1CCC[C@H]1CO ee69ffc13ba4b5c4d1892253da6a7a5c [1,0,0,1,0,0|2,0,0]=4 14139 B11R1.57 C[C@H](O)CN1CCCC1CO 038da99a4d0ef888775c315f7b979c1c [1,0,0,1,0,0|2,0,0]=4 14140 B11R1.57 C[C@H](O)CN1CCC[C@@H]1CF b5b9fbf67542c69ba2ee1635e2428817 [1,0,0,1,0,0|2,0,0]=4 14141 B11R1.57 C[C@H](O)CN1CCC[C@@H]1CO d6071851ec79fe878f25e934448fe890 [1,0,0,1,0,0|2,0,0]=4 14142 B11R1.57 C[C@H](O)CN1CCC[C@H]1CF 59e65e8e6c85dbba5d20a94a4b0ece4d [1,0,0,1,0,0|2,0,0]=4 14143 B11R1.57 C[C@H](O)CN1CCC[C@H]1CO 6e0598eca64e2d1824e66898e399218d [1,0,0,1,0,0|2,0,0]=4 14144 B11R1.78 CCCCCCN1CC(C1)F 3cea3396146bd873ee8f6dd1fb81779a [1,0,0,1,0,0|2,0,0]=4 14145 B11R1.78 CCCCCCN1CC(C1)O 203f3a7957281dfcc6a09702bfe3c0ea [1,0,0,1,0,0|1,0,0]=3 14146 B11R1.78 CCCCCNC1CC(C1)F 76206566d5d8890ce3ab1e93cf0656df [1,0,0,1,0,0|2,0,0]=4 14147 B11R1.78 CCCCCNC1CC(C1)O 0e1240534de42c1f30071216e3d3604d [1,0,0,1,0,0|1,0,0]=3 14148 B11R1.78 CCCCCN[C@H]1C[C@@H](C1)F a955e2b3823a6901ca9c5ea440ad4fe9 [1,0,0,1,0,0|2,0,0]=4 14149 B11R1.78 CCCCCN[C@H]1C[C@@H](C1)O acc47d780c401a87868905dac9ccb1bf [1,0,0,1,0,0|1,0,0]=3 14150 B11R1.78 CCCCCN[C@H]1C[C@H](C1)F 5a3ecec1facad4a60e12c8964af05564 [1,0,0,1,0,0|2,0,0]=4 14151 B11R1.78 CCCCCN[C@H]1C[C@H](C1)O b7cb7976c792e6886a2b06603c52de03 [1,0,0,1,0,0|1,0,0]=3 14152 B11R1.78 CCCCCOC1CC(C1)C feffc5ca8a4e0a842a51106c8a8f9124 [1,0,0,1,0,0|2,0,0]=4 14153 B11R1.78 CCCCCOC1CC(C1)F da07d1a41d21e6df5fab3c4c686ab290 [1,0,0,1,0,0|2,0,0]=4 14154 B11R1.78 CCCCCO[C@H]1C[C@@H](C1)F f308b8172cae1ba5b7e57f6dc659aa97 [1,0,0,1,0,0|2,0,0]=4 14155 B11R1.78 CCCCCO[C@H]1C[C@H](C1)F 4a9d017cc087afcc74f07dac6c0ccd5c [1,0,0,1,0,0|2,0,0]=4 14156 B11R1.78 CCCCNCC1CC(C1)C e72f53f86e2babeba17483445de8087e [1,0,0,1,0,0|2,0,0]=4 14157 B11R1.78 CCCCNCC1CC(C1)O a5014d25cdd574b5f8ade28770779c87 [1,0,0,1,0,0|1,0,0]=3 14158 B11R1.78 CCCCNC[C@H]1C[C@@H](C1)O 35e74f8cb664fb86a4ad6e1c7e8416d2 [1,0,0,1,0,0|1,0,0]=3 14159 B11R1.78 CCCCNC[C@H]1C[C@H](C1)F c873a57fed62d593ffff4d711d7745db [1,0,0,1,0,0|2,0,0]=4 14160 B11R1.78 CCCCNC[C@H]1C[C@H](C1)O c2931436a7f713c4f8262fbbfe6ef6c1 [1,0,0,1,0,0|1,0,0]=3 14161 B11R1.78 CCCCOCC1CC(C1)C c6fcace3049168c35f1567573e0bfae9 [1,0,0,1,0,0|2,0,0]=4 14162 B11R1.78 CCCCOCC1CC(C1)F cbc5506647fc120f46432a13bb4d5fff [1,0,0,1,0,0|2,0,0]=4 14163 B11R1.78 CCCCOCN1CC(C1)O 660c941eccb148cdbb3d25fdb8d06f29 [1,0,0,1,0,0|2,0,0]=4 14164 B11R1.78 CCCCOC[C@H]1C[C@@H](C1)C fd8f5a8a790a18faf18b3b865ad51466 [1,0,0,1,0,0|2,0,0]=4 14165 B11R1.78 CCCCOC[C@H]1C[C@H](C1)F e190c103b54adb767fb8c0583cbf830a [1,0,0,1,0,0|2,0,0]=4 14166 B11R1.78 CCCNCCN1CC(C1)O 14b9d05dbc1b4b12efdb97b2012e19e9 [1,0,0,1,0,0|2,0,0]=4 14167 B11R1.78 CCCOCCN1CC(C1)O d856d09788d0176d9f39059cea0b02c6 [1,0,0,1,0,0|2,0,0]=4 14168 B11R1.78 CCNCCCN1CC(C1)O 35866092da5b1856d6dd33848fd179ab [1,0,0,1,0,0|2,0,0]=4 14169 B11R1.78 CCOCCCN1CC(C1)O 55612d3a503f772c000db2a31943d819 [1,0,0,1,0,0|2,0,0]=4 14170 B11R1.78 CCOCCNC1CC(C1)O 747e47ab108e2a0fc6c2708b352eb899 [1,0,0,1,0,0|2,0,0]=4 14171 B11R1.78 CCOCCN[C@H]1C[C@@H](C1)O d12b1b82f803a47f4ade60a85eca67ca [1,0,0,1,0,0|2,0,0]=4 14172 B11R1.78 CCOCCN[C@H]1C[C@H](C1)O 94ca4889349edd82caf848d8601fb335 [1,0,0,1,0,0|2,0,0]=4 14173 B11R1.78 CCOCNCC1CC(C1)O 0d2e65543043ec4f7a89a822ccf93bad [1,0,0,1,0,0|2,0,0]=4 14174 B11R1.78 CCOCNC[C@H]1C[C@@H](C1)O 3df169490eaef8917cd516f2f201a596 [1,0,0,1,0,0|2,0,0]=4 14175 B11R1.78 CCOCNC[C@H]1C[C@H](C1)O 0e36a5cc8363eaa760ef7cb6ea2c4992 [1,0,0,1,0,0|2,0,0]=4 14176 B11R1.78 CCSCCCN1CC(C1)O 0a30c8752b2f839c3e19cfc9e3badda7 [1,0,0,1,0,0|2,0,0]=4 14177 B11R1.78 CCSCCNC1CC(C1)O 5f783c15dfe47ea702207badb40a7254 [1,0,0,1,0,0|2,0,0]=4 14178 B11R1.78 CCSCCN[C@H]1C[C@@H](C1)O 5139c50cf23ab0d99652b54451123a3f [1,0,0,1,0,0|2,0,0]=4 14179 B11R1.78 CCSCCN[C@H]1C[C@H](C1)O cfe5274cbcd94388c41de680c88094a1 [1,0,0,1,0,0|2,0,0]=4 14180 B11R1.78 COCCCCN1CC(C1)O f215e34da864be5281007d849207e7a3 [1,0,0,1,0,0|2,0,0]=4 14181 B11R1.78 COCCCNC1CC(C1)O 3be9f61d685e31a5204e5e7ffc258f4f [1,0,0,1,0,0|2,0,0]=4 14182 B11R1.78 COCCCN[C@H]1C[C@@H](C1)O 4a63a6a3e6d4e7e845e7583d98ee2972 [1,0,0,1,0,0|2,0,0]=4 14183 B11R1.78 COCCCN[C@H]1C[C@H](C1)O 84b80b598dcc5578a3e9b1d074b841c0 [1,0,0,1,0,0|2,0,0]=4 14184 B11R1.78 COCCNCC1CC(C1)O b88a642ac7baef7eac227c0309ba871c [1,0,0,1,0,0|2,0,0]=4 14185 B11R1.78 COCCNC[C@H]1C[C@@H](C1)O 12286c5ebb53ea5a61cf3b2b6a645064 [1,0,0,1,0,0|2,0,0]=4 14186 B11R1.78 COCCNC[C@H]1C[C@H](C1)O 5cce8664ce8c10b6c90af144515ca28e [1,0,0,1,0,0|2,0,0]=4 14187 B11R1.78 CSCCCNC1CC(C1)O 18acee21477838f1bc7bcd53bd5b4e03 [1,0,0,1,0,0|2,0,0]=4 14188 B11R1.78 CSCCCN[C@H]1C[C@@H](C1)O 449b206440c154c8da28269535cc5ced [1,0,0,1,0,0|2,0,0]=4 14189 B11R1.78 CSCCCN[C@H]1C[C@H](C1)O 129aee7e6d278d14e331ca69eb3ef64d [1,0,0,1,0,0|2,0,0]=4 14190 B11R1.78 CSCCNCC1CC(C1)O ada8c68175057ecc95b5c622186dc0d6 [1,0,0,1,0,0|2,0,0]=4 14191 B11R1.78 CSCCNC[C@H]1C[C@@H](C1)O e498df9dce083493be096aa69ead37d2 [1,0,0,1,0,0|2,0,0]=4 14192 B11R1.78 CSCCNC[C@H]1C[C@H](C1)O 7b2bb50302897ff725f9fda3be2fc829 [1,0,0,1,0,0|2,0,0]=4 14193 B11R1.78 OC1CC(C1)CNCCCCl 3c26f7d757d686f607cb9d2f3d83d3b2 [1,0,0,1,0,0|2,0,0]=4 14194 B11R1.78 OC1CC(C1)CNCCCF db1aef53858109e962124a85709ccb3f [1,0,0,1,0,0|2,0,0]=4 14195 B11R1.78 OC1CC(C1)CNCCCS 142651bb2aad5a9c083f061daf1b5919 [1,0,0,1,0,0|2,0,0]=4 14196 B11R1.78 OC1CC(C1)NCCCCCl 931a1496c7522769713b8c9b799b6999 [1,0,0,1,0,0|2,0,0]=4 14197 B11R1.78 OC1CC(C1)NCCCCF 163f63bca90d817555435146b6a1db3d [1,0,0,1,0,0|2,0,0]=4 14198 B11R1.78 OC1CC(C1)NCCCCS c0f907869ffe1acdbc1d380ee8ed2cdc [1,0,0,1,0,0|2,0,0]=4 14199 B11R1.78 OC1CN(C1)CCCCCF 85df38c234a9ad05c7e47c9ff76b50f1 [1,0,0,1,0,0|2,0,0]=4 14200 B11R1.78 OCCCCCN1CC(C1)O 8f9cddd3091542e8810e970dcc25cb8d [1,0,0,1,0,0|2,0,0]=4 14201 B11R1.78 OCCCCNC1CC(C1)O b7ce95fb08acc180449af025cc35ddb1 [1,0,0,1,0,0|2,0,0]=4 14202 B11R1.78 OCCCCN[C@H]1C[C@@H](C1)O 05281facb8e5edb97225389bbabecd69 [1,0,0,1,0,0|2,0,0]=4 14203 B11R1.78 OCCCCN[C@H]1C[C@H](C1)O b1362683ca4249e8858d372dd85eee0c [1,0,0,1,0,0|2,0,0]=4 14204 B11R1.78 OCCCNCC1CC(C1)O d1123262ced16ea986b14643142bae11 [1,0,0,1,0,0|2,0,0]=4 14205 B11R1.78 OCCCNC[C@H]1C[C@@H](C1)O fd51d6a88cbba317c153f0d35112c016 [1,0,0,1,0,0|2,0,0]=4 14206 B11R1.78 OCCCNC[C@H]1C[C@H](C1)O eba930fb5d292bd8913872c52303b9c3 [1,0,0,1,0,0|2,0,0]=4 14207 B11R1.78 O[C@H]1C[C@@H](C1)CNCCCF 5858fd4a46d00bea11a8855a2cd01916 [1,0,0,1,0,0|2,0,0]=4 14208 B11R1.78 O[C@H]1C[C@@H](C1)CNCCCS 854eddb64870b39f29dc9bc536be67ad [1,0,0,1,0,0|2,0,0]=4 14209 B11R1.78 O[C@H]1C[C@@H](C1)NCCCCF c34ec792a4ef5b617509008e7d296660 [1,0,0,1,0,0|2,0,0]=4 14210 B11R1.78 O[C@H]1C[C@H](C1)CNCCCF 3758369d89364e7350948698a649cf84 [1,0,0,1,0,0|2,0,0]=4 14211 B11R1.78 O[C@H]1C[C@H](C1)CNCCCS f75717d0507a2a230c403c9e6b282f3e [1,0,0,1,0,0|2,0,0]=4 14212 B11R1.78 O[C@H]1C[C@H](C1)NCCCCF 773135769bef301fc52111293e417e75 [1,0,0,1,0,0|2,0,0]=4 14213 B11R1.86 CC(C)CN1CCCCC1C 7e6c44644fa1b65a061c9a541a5265e8 [1,0,0,1,0,0|2,0,0]=4 14214 B11R1.86 CC(C)CN1CCCC[C@@H]1C b384962572375a1d6f7eb1f96a641baa [1,0,0,1,0,0|2,0,0]=4 14215 B11R1.86 CC(C)CN1CCCC[C@H]1C f32f034b8cd489d424495a56c43084df [1,0,0,1,0,0|2,0,0]=4 14216 B11R1.86 CC(C)NC1CCCCC1C 59fffc5078675fc3d3f8a588629cd683 [1,0,0,1,0,0|2,0,0]=4 14217 B11R1.86 CC(C)N[C@@H]1CCCC[C@@H]1C b80de803d2ac32a37de443807bca7d09 [1,0,0,1,0,0|2,0,0]=4 14218 B11R1.86 CC(C)N[C@@H]1CCCC[C@H]1C be82855be400f4004c267990a9f5b9b6 [1,0,0,1,0,0|2,0,0]=4 14219 B11R1.86 CC(C)N[C@H]1CCCC[C@@H]1C 4111eb3ea0118e5acd989275b2287c72 [1,0,0,1,0,0|2,0,0]=4 14220 B11R1.86 CC(C)N[C@H]1CCCC[C@H]1C 5ddc71ba6810859085c63da636d18679 [1,0,0,1,0,0|2,0,0]=4 14221 B11R1.86 CC(C)OC1CCCCC1C b4c267bb3b9407b9284b4f055ae2de60 [1,0,0,1,0,0|2,0,0]=4 14222 B11R1.86 CC(C)O[C@@H]1CCCC[C@@H]1C f3f862e5cd7c7e64b484aab9f56b2096 [1,0,0,1,0,0|2,0,0]=4 14223 B11R1.86 CC(C)O[C@H]1CCCC[C@@H]1C 64cafc3979af74337ea251fe8ffa8fbe [1,0,0,1,0,0|2,0,0]=4 14224 B11R1.86 CC(C)O[C@H]1CCCC[C@H]1C 39bbc4065e1eb39991f25781ceb406de [1,0,0,1,0,0|2,0,0]=4 14225 B11R1.86 CC(O)CN1CCCCC1C 9d1a770d8c6ffc9de988cc511348705e [1,0,0,1,0,0|1,0,0]=3 14226 B11R1.86 CC(O)CN1CCCC[C@@H]1C 9c8cfb57d89cf66010f3efcebc7fe58c [1,0,0,1,0,0|1,0,0]=3 14227 B11R1.86 CC(O)CN1CCCC[C@H]1C 02a958dfbac6e1d310ffb64db6fb82bf [1,0,0,1,0,0|1,0,0]=3 14228 B11R1.86 CC(O)CN1CCOCC1C 37edb5191dd032ecadf328a0d027ad15 [1,0,0,1,0,0|2,0,0]=4 14229 B11R1.86 CC(O)CN1CCOC[C@@H]1C ca9ee4e4f89f951ad9aa79b89fa40453 [1,0,0,1,0,0|2,0,0]=4 14230 B11R1.86 CC(O)CN1CCOC[C@H]1C 5caf3cefeeadabb848e85b8b5675f5da [1,0,0,1,0,0|2,0,0]=4 14231 B11R1.86 CC1CCCCN1C[C@@H](C)O 1d631de616b3f66a4c20cc8d16f043a6 [1,0,0,1,0,0|1,0,0]=3 14232 B11R1.86 CC1CCCCN1C[C@H](C)O fdcf1f4aa6cf52991110da7e3f59d550 [1,0,0,1,0,0|1,0,0]=3 14233 B11R1.86 CC1COCCN1C[C@@H](C)O 690546eef2b2715c4c25af676a3fd594 [1,0,0,1,0,0|2,0,0]=4 14234 B11R1.86 CC1COCCN1C[C@H](C)O 964c4766c0615536c53883612e6ffd0d [1,0,0,1,0,0|2,0,0]=4 14235 B11R1.86 C[C@@H](O)CN1CCCC[C@@H]1C 6533e1fd1ce09c7b87ce64552cb60745 [1,0,0,1,0,0|1,0,0]=3 14236 B11R1.86 C[C@@H](O)CN1CCOC[C@@H]1C 830530656cf004440c927ba513a1153f [1,0,0,1,0,0|2,0,0]=4 14237 B11R1.86 C[C@@H]1CCCCN1C[C@@H](C)O b1f6ca06f1750494bca4672f61144d55 [1,0,0,1,0,0|1,0,0]=3 14238 B11R1.86 C[C@@H]1COCCN1C[C@@H](C)O 44b28ff8ae15682a0cbab13c29f41660 [1,0,0,1,0,0|2,0,0]=4 14239 B11R1.86 C[C@H](O)CN1CCCC[C@@H]1C c9267625a00653d10cc5b362431a7302 [1,0,0,1,0,0|1,0,0]=3 14240 B11R1.86 C[C@H](O)CN1CCCC[C@H]1C 52f856f74c0a46ea90e1bd35af995aec [1,0,0,1,0,0|1,0,0]=3 14241 B11R1.86 C[C@H](O)CN1CCOC[C@@H]1C 7c621593bf32af0f6edd6fa54fff0e53 [1,0,0,1,0,0|2,0,0]=4 14242 B11R1.86 C[C@H](O)CN1CCOC[C@H]1C 06e6531004d4205d94b8bdea999d0e88 [1,0,0,1,0,0|2,0,0]=4 14243 B11R1.90 CC(C)CCN1CCCC1C 6d7f21807177c897eebf743c338f5f78 [1,0,0,1,0,0|2,0,0]=4 14244 B11R1.90 CC(C)CCN1CCC[C@@H]1C d20b498e428f0de8f13f47699a61bc3a [1,0,0,1,0,0|2,0,0]=4 14245 B11R1.90 CC(C)CCN1CCC[C@H]1C 97c280483f2161912a4bcc726de0ee18 [1,0,0,1,0,0|2,0,0]=4 14246 B11R1.90 CC(C)COC1CCCC1C 48615804ded09223746f73b73c1b367e [1,0,0,1,0,0|2,0,0]=4 14247 B11R1.90 CC(C)CO[C@@H]1CCC[C@@H]1C aa2f547a396e8147424428845484c318 [1,0,0,1,0,0|2,0,0]=4 14248 B11R1.90 CC(C)CO[C@@H]1CCC[C@H]1C 95c8507c650a23b54663a8d0ef3f70da [1,0,0,1,0,0|2,0,0]=4 14249 B11R1.90 CC(C)CO[C@H]1CCC[C@@H]1C 01d0a29d7a72806e0d7b59347c663abb [1,0,0,1,0,0|2,0,0]=4 14250 B11R1.90 CC(C)CO[C@H]1CCC[C@H]1C 2dd511a60d77abf4d381d74807ddf79f [1,0,0,1,0,0|2,0,0]=4 14251 B11R1.90 CC(C)OCC1CCCC1C 27fdb38e13dfe0110a5ec49b89cca334 [1,0,0,1,0,0|2,0,0]=4 14252 B11R1.90 CC(O)CCN1CCCC1C 0534d9fafec12288d1bffcc4dbcba705 [1,0,0,1,0,0|1,0,0]=3 14253 B11R1.90 CC(O)CCN1CCCC1O 6fc349970a7321ac4440ec0492b9af9f [1,0,0,1,0,0|2,0,0]=4 14254 B11R1.90 CC(O)CCN1CCC[C@@H]1C 9971487b5c3d4c90ac0c7790a8fbf742 [1,0,0,1,0,0|1,0,0]=3 14255 B11R1.90 CC(O)CCN1CCC[C@H]1C d3da0fc2f580ed5f28623b0b34f807f5 [1,0,0,1,0,0|1,0,0]=3 14256 B11R1.90 CC(O)CCN1CCSC1C e2d255f362d857ef3668c2e7e3b91eef [1,0,0,1,0,0|2,0,0]=4 14257 B11R1.90 CC(O)CNC1CCCC1O 29980d7fca9bfa75ef76fafa12304b3e [1,0,0,1,0,0|2,0,0]=4 14258 B11R1.90 CC(O)CN[C@@H]1CCC[C@@H]1O 5b4fa3f2fb46e5d0f720c7848b2a10f4 [1,0,0,1,0,0|2,0,0]=4 14259 B11R1.90 CC(O)CN[C@@H]1CCC[C@H]1O b7d8dfd85eaddacca1a0011edc1fea5f [1,0,0,1,0,0|2,0,0]=4 14260 B11R1.90 CC(O)CN[C@H]1CCC[C@@H]1O 25e0ef19d0e4d87a9c0b15cbbf44f62e [1,0,0,1,0,0|2,0,0]=4 14261 B11R1.90 CC(O)CN[C@H]1CCC[C@H]1O 93a42ec70088e97c7a6722e4f4ee692c [1,0,0,1,0,0|2,0,0]=4 14262 B11R1.90 C[C@@H](O)CNC1CCCC1O 092be02da963a88016b1682a5662380e [1,0,0,1,0,0|2,0,0]=4 14263 B11R1.90 C[C@@H](O)CN[C@@H]1CCC[C@@H]1O 0abb682b71ecc6032ede1daa4e99d879 [1,0,0,1,0,0|2,0,0]=4 14264 B11R1.90 C[C@@H](O)CN[C@@H]1CCC[C@H]1O be2ae0a623ec7a995aaab08c1e776f8c [1,0,0,1,0,0|2,0,0]=4 14265 B11R1.90 C[C@@H](O)CN[C@H]1CCC[C@@H]1O b2383ecf35a3643078e9f17c64d56889 [1,0,0,1,0,0|2,0,0]=4 14266 B11R1.90 C[C@@H](O)CN[C@H]1CCC[C@H]1O 582ecbbdc2f8f5199908bbfc84ab01a9 [1,0,0,1,0,0|2,0,0]=4 14267 B11R1.90 C[C@H](O)CNC1CCCC1O 6ed3dbed74d43bacd90d7360fe7b9955 [1,0,0,1,0,0|2,0,0]=4 14268 B11R1.90 C[C@H](O)CN[C@@H]1CCC[C@@H]1O c0e877c40576df03c75762c07945160a [1,0,0,1,0,0|2,0,0]=4 14269 B11R1.90 C[C@H](O)CN[C@@H]1CCC[C@H]1O 99205c3b4053512fc45c35c30ae3726c [1,0,0,1,0,0|2,0,0]=4 14270 B11R1.90 C[C@H](O)CN[C@H]1CCC[C@@H]1O 650941c25c38dde697fa7df2bc245368 [1,0,0,1,0,0|2,0,0]=4 14271 B11R1.90 C[C@H](O)CN[C@H]1CCC[C@H]1O d260e20836b2d162c25c353f9d8360cf [1,0,0,1,0,0|2,0,0]=4 14272 B11R1.91 CC(C)CNC1CCCCC1 fbf9e8f1dab722f87d1182bd78b8cdee [1,0,0,1,0,0|2,0,0]=4 14273 B11R1.91 CC(C)COC1CCCCC1 7819b34cbd8ad7c57fa1b5b9ae584724 [1,0,0,1,0,0|2,0,0]=4 14274 B11R1.91 CC(C)NCC1CCCCC1 9daf273094f9db4efa50b8bb51dc3651 [1,0,0,1,0,0|2,0,0]=4 14275 B11R1.91 CC(C)OCC1CCCCC1 51cc2d63a8c37a12d3bab34a3922fdb2 [1,0,0,1,0,0|2,0,0]=4 14276 B11R1.91 CC(F)COC1CCCCC1 7994f2c32f011028084b3cffbdd02931 [1,0,0,1,0,0|2,0,0]=4 14277 B11R1.91 CC(O)CCN1CCCOC1 9c1b5fd1f1b8327b2fecda6c58d4e57f [1,0,0,1,0,0|2,0,0]=4 14278 B11R1.91 CC(O)CCN1CCCSC1 0a0f20c2909e70336ed0748e73c5df34 [1,0,0,1,0,0|2,0,0]=4 14279 B11R1.91 CC(O)CCN1CCOCC1 4029f9c135363e4246345a93ffba9c41 [1,0,0,1,0,0|2,0,0]=4 14280 B11R1.91 CC(O)CCN1CCSCC1 e65ed86e4940568795c8f1866216a1af [1,0,0,1,0,0|2,0,0]=4 14281 B11R1.91 CC(O)CNC1CCCCC1 cd24f4a1c32e632345ce0698292b8646 [1,0,0,1,0,0|1,0,0]=3 14282 B11R1.91 CC(O)CNC1CCCCO1 c6ce164ae9f299ae4d638a762eb56ed1 [1,0,0,1,0,0|2,0,0]=4 14283 B11R1.91 CC(O)CNC1CCCOC1 c9613e4af07df3542aa4c50524a8c405 [1,0,0,1,0,0|2,0,0]=4 14284 B11R1.91 CC(O)CNC1CCOCC1 9b4be5e811aaf766cc570eb1ac246d09 [1,0,0,1,0,0|2,0,0]=4 14285 B11R1.91 CC(O)CNC1CCSCC1 c5980aabc91ff456ebdfc92f25e7cc24 [1,0,0,1,0,0|2,0,0]=4 14286 B11R1.91 CC(O)CN[C@@H]1CCCOC1 96ca4dd8acc434b898354527cc541f83 [1,0,0,1,0,0|2,0,0]=4 14287 B11R1.91 CC(O)CN[C@H]1CCCOC1 5587ba88905bad1ddb0a47314aef52af [1,0,0,1,0,0|2,0,0]=4 14288 B11R1.91 CC(S)COC1CCCCC1 df891f233fec9585db2fa6e81d33cca4 [1,0,0,1,0,0|1,1,0]=4 14289 B11R1.91 C[C@@H](F)COC1CCCCC1 edb6f87500f078cc9680d2382285d974 [1,0,0,1,0,0|2,0,0]=4 14290 B11R1.91 C[C@@H](O)CNC1CCCCC1 91e9a88b20b24b38b0d78b488a0fe9c0 [1,0,0,1,0,0|1,0,0]=3 14291 B11R1.91 C[C@@H](O)CNC1CCCCO1 7e6111bfc3eeed3731f4b1fa663d2ff4 [1,0,0,1,0,0|2,0,0]=4 14292 B11R1.91 C[C@@H](O)CNC1CCCOC1 2690a48a2cf8bc9de48070fac3b905b9 [1,0,0,1,0,0|2,0,0]=4 14293 B11R1.91 C[C@@H](O)CNC1CCOCC1 1cc2921cfe7d258239cbbd560b260612 [1,0,0,1,0,0|2,0,0]=4 14294 B11R1.91 C[C@@H](O)CNC1CCSCC1 1af6457aa281f897ec67e432b48177be [1,0,0,1,0,0|2,0,0]=4 14295 B11R1.91 C[C@@H](O)CN[C@@H]1CCCOC1 f634b4dfbf5198c5ab457a21f443d29e [1,0,0,1,0,0|2,0,0]=4 14296 B11R1.91 C[C@@H](O)CN[C@H]1CCCOC1 46e008d1e29a611d38752b46ddcd82c9 [1,0,0,1,0,0|2,0,0]=4 14297 B11R1.91 C[C@H](F)COC1CCCCC1 2dbbff1b6360423349c10857f3204dfa [1,0,0,1,0,0|2,0,0]=4 14298 B11R1.91 C[C@H](O)CNC1CCCCC1 2b10c0e5471b4cfd1de8bc851a4f8b1e [1,0,0,1,0,0|1,0,0]=3 14299 B11R1.91 C[C@H](O)CNC1CCCCO1 f9ed8a3dfae51ca2b67627884ce0e9d2 [1,0,0,1,0,0|2,0,0]=4 14300 B11R1.91 C[C@H](O)CNC1CCCOC1 98a602ff977f39fdd647ae23f24491cd [1,0,0,1,0,0|2,0,0]=4 14301 B11R1.91 C[C@H](O)CNC1CCOCC1 0eb5d12eb4b79bab0ca2ec42ecd17bd9 [1,0,0,1,0,0|2,0,0]=4 14302 B11R1.91 C[C@H](O)CNC1CCSCC1 cf816f3f86e909da752029ca78526ed8 [1,0,0,1,0,0|2,0,0]=4 14303 B11R1.91 C[C@H](O)CN[C@@H]1CCCOC1 841efb7ff0432111ee9fc857d686911d [1,0,0,1,0,0|2,0,0]=4 14304 B11R1.91 C[C@H](O)CN[C@H]1CCCOC1 2a57df9eae18fcf6260cd36cd0706a23 [1,0,0,1,0,0|2,0,0]=4 14305 B11R1.99 CCCCCCCNC1CC1 f3eda5f5f3ce39f724aa2c899a2a9b33 [1,0,0,1,0,0|2,0,0]=4 14306 B11R1.99 CCCCCCCOC1CC1 cf4fbfbf4e38a1d8c5b44b3a3b2e5bcf [1,0,0,1,0,0|2,0,0]=4 14307 B11R1.99 CCCCCCNCC1CC1 684af512ae233f85f91baeda69d9f7e3 [1,0,0,1,0,0|2,0,0]=4 14308 B11R1.99 CCCCCCOCC1CC1 c1ddb491c84df944feccf1fa581b283b [1,0,0,1,0,0|2,0,0]=4 14309 B11R1.99 CCCCCNCCC1CC1 c4d20616f255ff4790a007a5e8bed20b [1,0,0,1,0,0|2,0,0]=4 14310 B11R1.99 CCCCCOCCC1CC1 2883dd530cdf1deba1e1e0b9e17420f1 [1,0,0,1,0,0|2,0,0]=4 14311 B11R1.99 CCCCOCCCC1CC1 d650cf0b4a53cbc1cf29dc528b7d050d [1,0,0,1,0,0|2,0,0]=4 14312 B11R1.102 CC(C)CCCNC1CC1C 16c09e3e2fecba50a31cc2d2830bd456 [1,0,0,1,0,0|2,0,0]=4 14313 B11R1.102 CC(C)CCOCC1CC1C 290a686bdca9e3f344b1900f73e82312 [1,0,0,1,0,0|2,0,0]=4 14314 B11R1.102 CC(C)CCOC[C@@H]1C[C@@H]1C d5979f6155bb279a84ccf61371468aca [1,0,0,1,0,0|2,0,0]=4 14315 B11R1.102 CC(C)CCOC[C@@H]1C[C@H]1C 3e213b1ae95fea160b776b18da43bd30 [1,0,0,1,0,0|2,0,0]=4 14316 B11R1.102 CC(C)CCOC[C@H]1C[C@@H]1C 93a2d70b2c7f8588f191770c067c0db9 [1,0,0,1,0,0|2,0,0]=4 14317 B11R1.102 CC(O)CCCNC1CC1C da46f5a577c985a8aab6993bf8d404d7 [1,0,0,1,0,0|1,0,0]=3 14318 B11R1.102 CC(O)CCCN[C@@H]1C[C@H]1F 01d75b63b81ec6728fc03bd4ceac841b [1,0,0,1,0,0|2,0,0]=4 14319 B11R1.102 CC(O)CCCN[C@H]1C[C@@H]1F 3e0e18502c6a187e4302f066e49b4f12 [1,0,0,1,0,0|2,0,0]=4 14320 B11R1.102 CC(O)CCCN[C@H]1C[C@H]1F 065319442b800ebc5b4178b5582a9097 [1,0,0,1,0,0|2,0,0]=4 14321 B11R1.110 CCCN1CCCCC(C1)O 2f2cb2c7cbe11e5b7ef88d61c562732e [1,0,0,1,0,0|1,0,0]=3 14322 B11R1.110 CCCN1CCCC[C@H](C1)O 83e8bcc0472a8fbdf816d8033ef8921a [1,0,0,1,0,0|1,0,0]=3 14323 B11R1.110 CCCN1CCOCC(C1)O 795a258bd78f33d979900fb4a7c63b6b [1,0,0,1,0,0|2,0,0]=4 14324 B11R1.110 CCCN1CCOC[C@@H](C1)O 8fecc0c6a410e26613f02414b341de08 [1,0,0,1,0,0|2,0,0]=4 14325 B11R1.110 CCCN1CCOC[C@H](C1)O 9088cb47d70e2a6a554d2fdc05e41a68 [1,0,0,1,0,0|2,0,0]=4 14326 B11R1.110 COCN1CCCCC(C1)O e0125e0954ec1a2e96977c6e411e3fa2 [1,0,0,1,0,0|2,0,0]=4 14327 B11R1.110 COCN1CCCC[C@H](C1)O 873a4b2a49a277ba7d732d2bd69d49a5 [1,0,0,1,0,0|2,0,0]=4 14328 B11R1.110 CSCN1CCCCC(C1)O ac45dbe27c89bfcbf0963d130784e47f [1,0,0,1,0,0|2,0,0]=4 14329 B11R1.110 CSCN1CCCC[C@H](C1)O 971c79fc4438f32ce92cc83ec00e2ffb [1,0,0,1,0,0|2,0,0]=4 14330 B11R1.110 OC1CCCCN(C1)CCF a2fe9ac118b4b981a83b67fbc4ecb0b7 [1,0,0,1,0,0|2,0,0]=4 14331 B11R1.110 OC1CCCCN(C1)CCS 7cfec7a6b465e76c2acb7b35fc6d70da [1,0,0,1,0,0|2,0,0]=4 14332 B11R1.110 OCCN1CCCCC(C1)O 160f06a7df0a5e69f080da3f4f34b3c8 [1,0,0,1,0,0|2,0,0]=4 14333 B11R1.110 OCCN1CCCC[C@H](C1)O 7a8e494fd53315297c8d5e83aebd7716 [1,0,0,1,0,0|2,0,0]=4 14334 B11R1.110 O[C@@H]1CCCCN(C1)CCF 2785e0163d4f9fc35d39253412781ede [1,0,0,1,0,0|2,0,0]=4 14335 B11R1.110 O[C@@H]1CCCCN(C1)CCS ce432d6df1a3b078950e24d32c78677a [1,0,0,1,0,0|2,0,0]=4 14336 B11R1.113 CC(O)CN1CCC1CCO ec6c2fb8321a9e6e4871cd0b5c00b25b [1,0,0,1,0,0|2,0,0]=4 14337 B11R1.113 COCC1CCN1CC(C)O e119eb85a8d00f64d2d1907aff45d09b [1,0,0,1,0,0|2,0,0]=4 14338 B11R1.113 COCC1CCN1C[C@@H](C)O 1e87aa1f4b2d2f441fb2c243f334aa45 [1,0,0,1,0,0|2,0,0]=4 14339 B11R1.113 COCC1CCN1C[C@H](C)O 21634a5858d984ac9d77d71d3e6c9013 [1,0,0,1,0,0|2,0,0]=4 14340 B11R1.113 COC[C@@H]1CCN1CC(C)O 2f4cbdbcd32cea1a46669cea44ec6da6 [1,0,0,1,0,0|2,0,0]=4 14341 B11R1.113 COC[C@@H]1CCN1C[C@@H](C)O 82b73e1c49bf01d1b31e20f44cae101f [1,0,0,1,0,0|2,0,0]=4 14342 B11R1.113 COC[C@@H]1CCN1C[C@H](C)O 36ce6029e64e7a657b33a02b2fd0be11 [1,0,0,1,0,0|2,0,0]=4 14343 B11R1.113 COC[C@H]1CCN1CC(C)O 78f13519f060577995bfc111920d9a67 [1,0,0,1,0,0|2,0,0]=4 14344 B11R1.113 COC[C@H]1CCN1C[C@@H](C)O 8b379b885f4ee312d7c893c20c4d2b04 [1,0,0,1,0,0|2,0,0]=4 14345 B11R1.113 COC[C@H]1CCN1C[C@H](C)O 0405baa98dca1b1f1ffba3c60f66e608 [1,0,0,1,0,0|2,0,0]=4 14346 B11R1.113 C[C@@H](O)CN1CCC1CCO 18447e32ab17ec7498810854fb2a583f [1,0,0,1,0,0|2,0,0]=4 14347 B11R1.113 C[C@H](O)CN1CCC1CCO 418ca1a78722a6f5fa141b878183a100 [1,0,0,1,0,0|2,0,0]=4 14348 B11R1.130 COC[C@@H]1C[C@@H]1NCC(C)O dacec808b8515941d13e6ba0b526db11 [1,0,0,1,0,0|2,0,0]=4 14349 B11R1.130 COC[C@@H]1C[C@@H]1NC[C@@H](C)O 31e3e2e52ce93705ab319318ea6e47b9 [1,0,0,1,0,0|2,0,0]=4 14350 B11R1.130 COC[C@@H]1C[C@@H]1NC[C@H](C)O 9a7f4bde5d786a57b4758ddac9d9d593 [1,0,0,1,0,0|2,0,0]=4 14351 B11R1.130 COC[C@H]1C[C@@H]1NCC(C)O 7879309df54a687753c60f40e32d4f51 [1,0,0,1,0,0|2,0,0]=4 14352 B11R1.130 COC[C@H]1C[C@@H]1NC[C@@H](C)O 9348acaad8ed5a46d57003886e3efbab [1,0,0,1,0,0|2,0,0]=4 14353 B11R1.130 COC[C@H]1C[C@@H]1NC[C@H](C)O b4fae4f210ece17e862d9298b1053a96 [1,0,0,1,0,0|2,0,0]=4 14354 B11R1.143 CC(C)N1CCCCCC1C 5c65f7aa5203c8fc287e05018e5e69d0 [1,0,0,1,0,0|2,0,0]=4 14355 B11R1.161 CC(C)CCN[C@@H]1CC[C@H]1C e06433d3a9e591bd5decd43b4d138a5a [1,0,0,1,0,0|2,0,0]=4 14356 B11R1.161 CC(C)CCN[C@H]1CC[C@H]1C b2e021fd813a13ad9411e76335922743 [1,0,0,1,0,0|2,0,0]=4 14357 B11R1.161 CC(O)CCNC1CCC1F b8a17e77b0990cd65061bb4a736823c3 [1,0,0,1,0,0|2,0,0]=4 14358 B11R1.161 CC(O)CCNC1CCC1O a89948ec8d5e5ff09f668fed5034b6e6 [1,0,0,1,0,0|2,0,0]=4 14359 B11R1.161 CC(O)CCNC1COC1C 2c8008997bf2f8bed34e87a76857621c [1,0,0,1,0,0|2,0,0]=4 14360 B11R1.161 CC(O)CCN[C@@H]1CC[C@@H]1O 00bf754af5b9058c99d12a0abea502a9 [1,0,0,1,0,0|2,0,0]=4 14361 B11R1.161 CC(O)CCN[C@@H]1CC[C@H]1C bda83bfb292724c512b5930ecbc94b90 [1,0,0,1,0,0|1,0,0]=3 14362 B11R1.161 CC(O)CCN[C@@H]1CC[C@H]1O 96576f93a39cf7183a02399da8f8331d [1,0,0,1,0,0|2,0,0]=4 14363 B11R1.161 CC(O)CCN[C@H]1CC[C@@H]1O a5d1d6063baf09c378a1d18603bd93ff [1,0,0,1,0,0|2,0,0]=4 14364 B11R1.161 CC(O)CCN[C@H]1CC[C@H]1C b5e11edf941a1be25bfd75536917ad92 [1,0,0,1,0,0|1,0,0]=3 14365 B11R1.161 CC(O)CCN[C@H]1CC[C@H]1O 189f4855f342c9d416acf74ae183095b [1,0,0,1,0,0|2,0,0]=4 14366 B11R1.161 CC(O)CNCC1CCN1C 1e58426d21160812d02a1089f452925f [1,0,0,1,0,0|2,0,0]=4 14367 B11R1.161 C[C@@H](O)CNCC1CCN1C b4aae04ef5554eb1297e437ad67ff3ed [1,0,0,1,0,0|2,0,0]=4 14368 B11R1.161 C[C@H](O)CNCC1CCN1C 413df757b7ccd5bec39c3cb314f09efa [1,0,0,1,0,0|2,0,0]=4 14369 B11R1.172 CC(C)CCNC1CCCC1 dfcd7e6b60b22ea15f28ca5d27824949 [1,0,0,1,0,0|2,0,0]=4 14370 B11R1.172 CC(C)CCOC1CCCC1 cc9eb0b7726c3f7f3a4dc04c99338791 [1,0,0,1,0,0|2,0,0]=4 14371 B11R1.172 CC(C)CNCC1CCCC1 b53484b3a7f0075048ea2b9afd67dee9 [1,0,0,1,0,0|2,0,0]=4 14372 B11R1.172 CC(C)COCC1CCCC1 a4568b2e8bf0af295d42d4309f6c7194 [1,0,0,1,0,0|2,0,0]=4 14373 B11R1.172 CC(C)NCCC1CCCC1 76802b69db9a853dd1a79326b431d279 [1,0,0,1,0,0|2,0,0]=4 14374 B11R1.172 CC(C)OCCC1CCCC1 cf29d28ee6383da47a2cd2b15f42c3d5 [1,0,0,1,0,0|2,0,0]=4 14375 B11R1.172 CC(F)COCC1CCCC1 dcb6fb80664e4ade78bd17c5ebf20ed5 [1,0,0,1,0,0|2,0,0]=4 14376 B11R1.172 CC(O)CCCN1CCSC1 ca1076f42f354491876da17a72bf8c80 [1,0,0,1,0,0|2,0,0]=4 14377 B11R1.172 CC(O)CCNC1CCCC1 afc76907d0b9e80cce600d96be08fffb [1,0,0,1,0,0|1,0,0]=3 14378 B11R1.172 CC(O)CCNC1CCOC1 b7cf1e185135368534717fde8c635d24 [1,0,0,1,0,0|2,0,0]=4 14379 B11R1.172 CC(O)CCNC1CCSC1 eca09cf1c8279f747ffa30618891be9b [1,0,0,1,0,0|2,0,0]=4 14380 B11R1.172 CC(O)CCN[C@@H]1CCOC1 823195bc0d7fa78517ae8d3baabf72c2 [1,0,0,1,0,0|2,0,0]=4 14381 B11R1.172 CC(O)CCN[C@H]1CCOC1 eedf8adb56198621bb4981829d176f62 [1,0,0,1,0,0|2,0,0]=4 14382 B11R1.172 CC(O)CNCC1CCCC1 93c08beebf5ce5a94ae43f93dd99f843 [1,0,0,1,0,0|1,0,0]=3 14383 B11R1.172 CC(O)CNCC1CCCO1 2f429a5a820f62234066f1327fddb7aa [1,0,0,1,0,0|2,0,0]=4 14384 B11R1.172 CC(O)CNCC1CCOC1 2936e5e80305ea8108160c3fe77576c3 [1,0,0,1,0,0|2,0,0]=4 14385 B11R1.172 CC(O)CNC[C@@H]1CCCO1 cd252f4db35c96b8fcb9fb0122bf96f5 [1,0,0,1,0,0|2,0,0]=4 14386 B11R1.172 CC(O)CNC[C@@H]1CCOC1 8f86148925cb915209f3f18860192a3e [1,0,0,1,0,0|2,0,0]=4 14387 B11R1.172 CC(O)CNC[C@H]1CCCO1 e67d50fb7ea2de51b4e28c4ec7677bf9 [1,0,0,1,0,0|2,0,0]=4 14388 B11R1.172 CC(O)CNC[C@H]1CCOC1 9a6020c746eb61bf3fc5a0e8979fa021 [1,0,0,1,0,0|2,0,0]=4 14389 B11R1.172 CC(S)COCC1CCCC1 e420e20ebb4cd17abe651606ab660b4a [1,0,0,1,0,0|1,1,0]=4 14390 B11R1.172 C[C@@H](F)COCC1CCCC1 ef04540a3052c1c3b1e04a0342b97fb5 [1,0,0,1,0,0|2,0,0]=4 14391 B11R1.172 C[C@@H](O)CCNC1CCCC1 01a08df4278ae56f9ce81ecb085cb36a [1,0,0,1,0,0|1,0,0]=3 14392 B11R1.172 C[C@@H](O)CCNC1CCOC1 14302e16d17e6b84d5724db6aa44b53a [1,0,0,1,0,0|2,0,0]=4 14393 B11R1.172 C[C@@H](O)CCN[C@@H]1CCOC1 a9edc11c70727cef3b9ae94e830312cc [1,0,0,1,0,0|2,0,0]=4 14394 B11R1.172 C[C@@H](O)CCN[C@H]1CCOC1 4aa1437b22e6249be07309099720dfe1 [1,0,0,1,0,0|2,0,0]=4 14395 B11R1.172 C[C@@H](O)CNCC1CCCC1 18cba5e5fea8d69e88ae9cd345456750 [1,0,0,1,0,0|1,0,0]=3 14396 B11R1.172 C[C@@H](O)CNCC1CCCO1 0ef386de7c28dfd30305c630e088beaa [1,0,0,1,0,0|2,0,0]=4 14397 B11R1.172 C[C@@H](O)CNCC1CCOC1 3c45b1e3eeb891e694bd3c2125ec53e0 [1,0,0,1,0,0|2,0,0]=4 14398 B11R1.172 C[C@@H](O)CNC[C@@H]1CCCO1 a03faa5897767e6da81d61348b5f99ca [1,0,0,1,0,0|2,0,0]=4 14399 B11R1.172 C[C@@H](O)CNC[C@@H]1CCOC1 064d9f6e0aad82de79b461a180123cd1 [1,0,0,1,0,0|2,0,0]=4 14400 B11R1.172 C[C@@H](O)CNC[C@H]1CCCO1 b63ee975238fc0480db8d4f9c00f9ac2 [1,0,0,1,0,0|2,0,0]=4 14401 B11R1.172 C[C@@H](O)CNC[C@H]1CCOC1 1298c95ee501691f2a17e2035faf49cd [1,0,0,1,0,0|2,0,0]=4 14402 B11R1.172 C[C@H](F)COCC1CCCC1 4676f0369cc636d85558583120f0ada7 [1,0,0,1,0,0|2,0,0]=4 14403 B11R1.172 C[C@H](O)CCNC1CCCC1 244055ba93d79d95c03bceadcf5d0c05 [1,0,0,1,0,0|1,0,0]=3 14404 B11R1.172 C[C@H](O)CCNC1CCOC1 01d237e204a900e5e978782beae58b9a [1,0,0,1,0,0|2,0,0]=4 14405 B11R1.172 C[C@H](O)CCN[C@@H]1CCOC1 afe69ee9b2d23d00a27b18ac33cfda15 [1,0,0,1,0,0|2,0,0]=4 14406 B11R1.172 C[C@H](O)CCN[C@H]1CCOC1 7c06004ad34b36630db3918c665703ee [1,0,0,1,0,0|2,0,0]=4 14407 B11R1.172 C[C@H](O)CNCC1CCCC1 09cf9ef0b76988786cefde99b3fcb501 [1,0,0,1,0,0|1,0,0]=3 14408 B11R1.172 C[C@H](O)CNCC1CCCO1 cf62be0ee91fa9c23037b510344e4095 [1,0,0,1,0,0|2,0,0]=4 14409 B11R1.172 C[C@H](O)CNCC1CCOC1 976c90454e413afa0c208be0df45630c [1,0,0,1,0,0|2,0,0]=4 14410 B11R1.172 C[C@H](O)CNC[C@@H]1CCCO1 994f643fb2ada1fcc12af26ba2d7b6cd [1,0,0,1,0,0|2,0,0]=4 14411 B11R1.172 C[C@H](O)CNC[C@@H]1CCOC1 c445df03cddb7a757010a8fe2def45cd [1,0,0,1,0,0|2,0,0]=4 14412 B11R1.172 C[C@H](O)CNC[C@H]1CCCO1 43c98fa20a2352d4f1b7613374e13b90 [1,0,0,1,0,0|2,0,0]=4 14413 B11R1.172 C[C@H](O)CNC[C@H]1CCOC1 c3d9bebd41272d5c27d5451fc3fde8e2 [1,0,0,1,0,0|2,0,0]=4 14414 B11R1.174 CC(C)CCCCN1CCC1 faa6965bc54dfa2800c74843a019017d [1,0,0,1,0,0|2,0,0]=4 14415 B11R1.174 CC(C)CCCNC1CCC1 a2c0f1bb939d6deeefbd33d2d35242d3 [1,0,0,1,0,0|2,0,0]=4 14416 B11R1.174 CC(C)CCCOC1CCC1 61729ad2309116ab4696475879e0b0d5 [1,0,0,1,0,0|2,0,0]=4 14417 B11R1.174 CC(C)CCNCC1CCC1 9323f36dcde028825ae2f824e7f2e96c [1,0,0,1,0,0|2,0,0]=4 14418 B11R1.174 CC(C)CCOCC1CCC1 c8d2fc654f6b0fd842b30803994b5deb [1,0,0,1,0,0|2,0,0]=4 14419 B11R1.174 CC(C)CNCCC1CCC1 de56775f04ab85d8d61bbf8602d5a90e [1,0,0,1,0,0|2,0,0]=4 14420 B11R1.174 CC(C)COCCC1CCC1 1fd7a1ad838b7a274c3f4fbfe0cdf94e [1,0,0,1,0,0|2,0,0]=4 14421 B11R1.174 CC(C)OCCCC1CCC1 ac65920b17e8d7ea55ac9707a1e329af [1,0,0,1,0,0|2,0,0]=4 14422 B11R1.174 CC(F)COCCC1CCC1 f074067909c48015a3448b0512793d5a [1,0,0,1,0,0|2,0,0]=4 14423 B11R1.174 CC(O)CCCCN1CCC1 8406a558f31bb03b3242ca1b31978a82 [1,0,0,1,0,0|1,0,0]=3 14424 B11R1.174 CC(O)CCCNC1CCC1 224435ed31ecafed414a0a14f16f4db2 [1,0,0,1,0,0|1,0,0]=3 14425 B11R1.174 CC(O)CCCNC1COC1 3a0fe2105019a780f72e580c9c5985ef [1,0,0,1,0,0|2,0,0]=4 14426 B11R1.174 CC(O)CCNCC1CCC1 180594aa84852a257aec8460d74bb063 [1,0,0,1,0,0|1,0,0]=3 14427 B11R1.174 CC(O)CCNCC1CCO1 0dc6f968de7216074d5d19fee0cb6784 [1,0,0,1,0,0|2,0,0]=4 14428 B11R1.174 CC(O)CCNCC1COC1 71f70df7071a13c6452cfa154d7918a9 [1,0,0,1,0,0|2,0,0]=4 14429 B11R1.174 CC(O)CCNC[C@@H]1CCO1 b7e74345f0e9ee93084c43c9fa650ffb [1,0,0,1,0,0|2,0,0]=4 14430 B11R1.174 CC(O)CCNC[C@H]1CCO1 7eacee9bed7b70504d28481ce88973ed [1,0,0,1,0,0|2,0,0]=4 14431 B11R1.174 CC(O)CNCCC1CCC1 899b7380e7204898781d4f1ea9d4dac0 [1,0,0,1,0,0|1,0,0]=3 14432 B11R1.174 CC(O)CNCCC1CCO1 b672ba9f1c291c730a936d89be7e2808 [1,0,0,1,0,0|2,0,0]=4 14433 B11R1.174 CC(O)CNCCC1COC1 3d215c95400d9050c0421e4dfbbe02dc [1,0,0,1,0,0|2,0,0]=4 14434 B11R1.174 CC(O)CNCCN1CCC1 3f1e78f6bf5365b6999e2b8769362573 [1,0,0,1,0,0|2,0,0]=4 14435 B11R1.174 CC(O)CNCC[C@@H]1CCO1 daa7e78df0e0058c15d535eb1cfaa2f9 [1,0,0,1,0,0|2,0,0]=4 14436 B11R1.174 CC(S)COCCC1CCC1 c3e42e77f6f413362dac080e57955d05 [1,0,0,1,0,0|1,1,0]=4 14437 B11R1.174 C[C@@H](F)COCCC1CCC1 a9ba082e6568c10825ace1ad23c21043 [1,0,0,1,0,0|2,0,0]=4 14438 B11R1.174 C[C@@H](O)CCCCN1CCC1 c82b2c7a02fc4e689992e1520866ba62 [1,0,0,1,0,0|1,0,0]=3 14439 B11R1.174 C[C@@H](O)CCNCC1CCC1 7e2621cc8c9335dff3489fcd83d1ce1f [1,0,0,1,0,0|1,0,0]=3 14440 B11R1.174 C[C@@H](O)CCNCC1CCO1 96fbcff352656680246c84eb9c83277c [1,0,0,1,0,0|2,0,0]=4 14441 B11R1.174 C[C@@H](O)CCNCC1COC1 a4d202f4be40856a8515cdb059521571 [1,0,0,1,0,0|2,0,0]=4 14442 B11R1.174 C[C@@H](O)CCNC[C@@H]1CCO1 958a3c9dad48afe377aeea05e06a33e0 [1,0,0,1,0,0|2,0,0]=4 14443 B11R1.174 C[C@@H](O)CCNC[C@H]1CCO1 dd36fdbd7dba1b8e9e9491006b68a7af [1,0,0,1,0,0|2,0,0]=4 14444 B11R1.174 C[C@@H](O)CNCCC1CCC1 9b5af2d454111c494f8d310aef7f9039 [1,0,0,1,0,0|1,0,0]=3 14445 B11R1.174 C[C@@H](O)CNCCC1CCO1 19a75627510d943b516c660d39314753 [1,0,0,1,0,0|2,0,0]=4 14446 B11R1.174 C[C@@H](O)CNCCC1COC1 1ab6d2692f7f63b5c0634935439dca21 [1,0,0,1,0,0|2,0,0]=4 14447 B11R1.174 C[C@@H](O)CNCCN1CCC1 6f76070975e6a7536fb9c91eee297610 [1,0,0,1,0,0|2,0,0]=4 14448 B11R1.174 C[C@@H](O)CNCC[C@@H]1CCO1 c17376eed0c3f301eecbb5d5fae390f3 [1,0,0,1,0,0|2,0,0]=4 14449 B11R1.174 C[C@H](F)COCCC1CCC1 40198b50ebd3c9c94c27dd15c84ca262 [1,0,0,1,0,0|2,0,0]=4 14450 B11R1.174 C[C@H](O)CCNCC1CCC1 605840902192f6dbb9aaae8beed5ea18 [1,0,0,1,0,0|1,0,0]=3 14451 B11R1.174 C[C@H](O)CCNCC1CCO1 4c8400ab4e44374884778261d893bc8a [1,0,0,1,0,0|2,0,0]=4 14452 B11R1.174 C[C@H](O)CCNCC1COC1 4eb3f7f2675b8159de54d8838d6f4d63 [1,0,0,1,0,0|2,0,0]=4 14453 B11R1.174 C[C@H](O)CCNC[C@@H]1CCO1 f6bc175dfd801bade802d06e342c1e5d [1,0,0,1,0,0|2,0,0]=4 14454 B11R1.174 C[C@H](O)CCNC[C@H]1CCO1 d9c99657310835785291b27338295719 [1,0,0,1,0,0|2,0,0]=4 14455 B11R1.174 C[C@H](O)CNCCC1CCC1 7944011a523f7249cac362e9d9eccc0c [1,0,0,1,0,0|1,0,0]=3 14456 B11R1.174 C[C@H](O)CNCCC1CCO1 659a45b14113d62c7e1143124181c4d7 [1,0,0,1,0,0|2,0,0]=4 14457 B11R1.174 C[C@H](O)CNCCC1COC1 a4ed220e3cb1fab7566c7cfee50db457 [1,0,0,1,0,0|2,0,0]=4 14458 B11R1.174 C[C@H](O)CNCCN1CCC1 4dda2a2ca35662d08c7aded50de7f73b [1,0,0,1,0,0|2,0,0]=4 14459 B11R1.174 C[C@H](O)CNCC[C@@H]1CCO1 de26092fd65f0808ef298f2e74fb6fd4 [1,0,0,1,0,0|2,0,0]=4 14460 B11R1.176 CC(C)CCCCNC1CC1 2423f245c7e33c3f8b167163a1e43396 [1,0,0,1,0,0|2,0,0]=4 14461 B11R1.176 CC(C)CCCCOC1CC1 25b09969ac9de57f4e6dd641cad56096 [1,0,0,1,0,0|2,0,0]=4 14462 B11R1.176 CC(C)CCCNCC1CC1 4db010450482c9b548766f85c94cc96b [1,0,0,1,0,0|2,0,0]=4 14463 B11R1.176 CC(C)CCCOCC1CC1 2547176dd9ffd6083df01359b2537c52 [1,0,0,1,0,0|2,0,0]=4 14464 B11R1.176 CC(C)CCNCCC1CC1 5479127af653c466f4d16d58d9500eab [1,0,0,1,0,0|2,0,0]=4 14465 B11R1.176 CC(C)CCOCCC1CC1 23c26eaba8fd013f53eebace016ece77 [1,0,0,1,0,0|2,0,0]=4 14466 B11R1.176 CC(C)COCCCC1CC1 8161d928d3d2d53b9b112937eac4ffba [1,0,0,1,0,0|2,0,0]=4 14467 B11R1.176 CC(O)CCCCNC1CC1 7232d250576ddf41e7e3b2b70f58bcf1 [1,0,0,1,0,0|1,0,0]=3 14468 B11R1.176 CC(O)CCCNCC1CC1 095af535a104f12bc99dd024a5f3fab5 [1,0,0,1,0,0|1,0,0]=3 14469 B11R1.176 CC(O)CCNCCC1CC1 a4a51dbb830c2ee40ec5fe97e9062fd1 [1,0,0,1,0,0|1,0,0]=3 14470 B11R1.176 CC(O)CCNCCN1CC1 f569655dfe4c6e2d1ff0e53d1559ad81 [1,0,0,1,0,0|2,0,0]=4 14471 B11R1.176 CC(O)CNCCOC1CC1 f9a17b81d93fa4576da28e5fe88c53a4 [1,0,0,1,0,0|2,0,0]=4 14472 B11R1.176 C[C@@H](O)CCCCNC1CC1 8624d841da30243b268a44d4d1d6d1ee [1,0,0,1,0,0|1,0,0]=3 14473 B11R1.176 C[C@@H](O)CCNCCC1CC1 228ef128c4627c7673cacc70bdefaff8 [1,0,0,1,0,0|1,0,0]=3 14474 B11R1.176 C[C@@H](O)CNCCOC1CC1 b219a4b2678d07289750dbdd90717301 [1,0,0,1,0,0|2,0,0]=4 14475 B11R1.176 C[C@H](O)CCNCCC1CC1 96de328720fa3323f2ae5d1d75017e03 [1,0,0,1,0,0|1,0,0]=3 14476 B11R1.176 C[C@H](O)CNCCOC1CC1 314ee6178786b78a739dc307486dfdbf [1,0,0,1,0,0|2,0,0]=4 14477 B11R1.191 CC1(CCCCC1NCF)O c3d91c72a987af29521dd7d704791e3e [1,0,0,1,0,0|2,0,0]=4 14478 B11R1.191 CC1(CCCCC1NCO)O d5f1e0bdadd1ad64d61a816af72c74b2 [1,0,0,1,0,0|2,0,0]=4 14479 B11R1.191 CCCN1CCCCC1(C)C 49ee18d54882944d6a45094509dbb589 [1,0,0,1,0,0|2,0,0]=4 14480 B11R1.191 CCNC1CCCCC1(C)C 8e174ebf059d89e4df3c3f311d802c16 [1,0,0,1,0,0|2,0,0]=4 14481 B11R1.191 CCNC1CCCCC1(C)O ae26b29892fb3bcfdbf94dd008ae79f6 [1,0,0,1,0,0|1,0,0]=3 14482 B11R1.191 CCOC1CCCCC1(C)C ffb41d0422e8151677e995843e539298 [1,0,0,1,0,0|2,0,0]=4 14483 B11R1.193 CC(O)C1CCCN1CCF 9982e8cdc8b3bf23af8c6a63b863a5d4 [1,0,0,1,0,0|2,0,0]=4 14484 B11R1.193 CC(O)C1CCCN1CCO df40770ddfe3f5736dd569ef2018866a [1,0,0,1,0,0|2,0,0]=4 14485 B11R1.193 CC(O)C1CCCN1CCS d51db83bca7bb03412e4b6b91d306e58 [1,0,0,1,0,0|2,0,0]=4 14486 B11R1.193 CC(O)[C@H]1CCCN1CCF 671e425a11945a778e9a6fd3fb7e9057 [1,0,0,1,0,0|2,0,0]=4 14487 B11R1.193 CC(O)[C@H]1CCCN1CCO 37de025a68bfdd8150259d90ee280f92 [1,0,0,1,0,0|2,0,0]=4 14488 B11R1.193 CC(O)[C@H]1CCCN1CCS b1c954d7d6265b5d8c53aad316c38935 [1,0,0,1,0,0|2,0,0]=4 14489 B11R1.193 CCCN1CCCC1C(C)C 678f1b8a2234adbac752868752c0d326 [1,0,0,1,0,0|2,0,0]=4 14490 B11R1.193 CCCN1CCCC1C(C)O 06c0ee1d47fb382c8f6fe1ae4d5e49db [1,0,0,1,0,0|1,0,0]=3 14491 B11R1.193 CCCN1CCC[C@@H]1C(C)O 928b3072563b392083179ee68c307cdc [1,0,0,1,0,0|1,0,0]=3 14492 B11R1.193 CCCN1CCC[C@H]1C(C)C 2fab88a9da93b036d7ca5fa4c7e04532 [1,0,0,1,0,0|2,0,0]=4 14493 B11R1.193 CCCN1CCC[C@H]1[C@H](C)O 7b67ac5834f2e37048360661ce78ed9d [1,0,0,1,0,0|1,0,0]=3 14494 B11R1.193 CCOC1CCCC1C(C)C a39e619ea631bec3e02dabd96add76b0 [1,0,0,1,0,0|2,0,0]=4 14495 B11R1.193 COCN1CCCC1C(C)O 263c2aa618d93beb10ddc738b646514b [1,0,0,1,0,0|2,0,0]=4 14496 B11R1.193 COCN1CCC[C@@H]1C(C)O 999ea78275f452f82e0ad8a642101807 [1,0,0,1,0,0|2,0,0]=4 14497 B11R1.193 COCN1CCC[C@H]1[C@H](C)O 3d89b7de7e1ba33496483240b28479bc [1,0,0,1,0,0|2,0,0]=4 14498 B11R1.193 CSCN1CCCC1C(C)O ec8a7d96859a526d0dbf94b781cb24f3 [1,0,0,1,0,0|2,0,0]=4 14499 B11R1.193 CSCN1CCC[C@@H]1C(C)O 7d5882e224a78ca4dec0507bbcd75920 [1,0,0,1,0,0|2,0,0]=4 14500 B11R1.193 CSCN1CCC[C@H]1[C@H](C)O 89199e837fc3599437151a7a68b4b3ab [1,0,0,1,0,0|2,0,0]=4 14501 B11R1.193 C[C@H](O)[C@@H]1CCCN1CCF ee11108af19737aa52e64c2edf488f3b [1,0,0,1,0,0|2,0,0]=4 14502 B11R1.193 C[C@H](O)[C@@H]1CCCN1CCO c700171a245f12b59c0092ab54cb85c2 [1,0,0,1,0,0|2,0,0]=4 14503 B11R1.193 C[C@H](O)[C@@H]1CCCN1CCS 73dcbdb772239ad077a001b8987b8c5f [1,0,0,1,0,0|2,0,0]=4 14504 B11R1.233 CC1(CCCC1NCCF)O 342140d19e14d7c2ad118edb2f466157 [1,0,0,1,0,0|2,0,0]=4 14505 B11R1.233 CC1(CCCC1NCCO)O cf4b82af87e65fb697497d4478ce6974 [1,0,0,1,0,0|2,0,0]=4 14506 B11R1.233 CC1(CCCC1NCCS)O 9052ade8445a62bf177e40f92491f8cc [1,0,0,1,0,0|2,0,0]=4 14507 B11R1.233 CCCCN1CCCC1(C)C 11850635168c5f7c78d33a220baf53e3 [1,0,0,1,0,0|2,0,0]=4 14508 B11R1.233 CCCNC1CCCC1(C)C f24cc4abc4e624c0304d5452c5b2e95d [1,0,0,1,0,0|2,0,0]=4 14509 B11R1.233 CCCNC1CCCC1(C)O abfaa72394c628afaf72d4d43012f817 [1,0,0,1,0,0|1,0,0]=3 14510 B11R1.233 CCCN[C@@H]1CCC[C@@]1(C)O f77f495705152282870eef75ccd6d503 [1,0,0,1,0,0|1,0,0]=3 14511 B11R1.233 CCCN[C@H]1CCC[C@]1(C)O ecb4f2c5f4fbf9c549c5b8d3e3cbda1e [1,0,0,1,0,0|1,0,0]=3 14512 B11R1.233 CCCOC1CCCC1(C)C f7e1582c95befdd40bc0abe86cdd000a [1,0,0,1,0,0|2,0,0]=4 14513 B11R1.233 CCCO[C@@H]1CCCC1(C)C 98ccee1aafaee64d71d8fdde27ba75aa [1,0,0,1,0,0|2,0,0]=4 14514 B11R1.233 CCCO[C@H]1CCCC1(C)C 6a2b38f24fa21bb59f0dc25a1f0508cc [1,0,0,1,0,0|2,0,0]=4 14515 B11R1.233 COCNC1CCCC1(C)O 8defed32aa1a340a855ef9b8ecb3c94c [1,0,0,1,0,0|2,0,0]=4 14516 B11R1.233 COCN[C@@H]1CCC[C@@]1(C)O 90b9e3afeeabe86e72f68daaf530e0f2 [1,0,0,1,0,0|2,0,0]=4 14517 B11R1.233 COCN[C@H]1CCC[C@]1(C)O bea607cb22f06f3ecca71231b3ceb85c [1,0,0,1,0,0|2,0,0]=4 14518 B11R1.233 CSCNC1CCCC1(C)O 8150ce92216df249b5a05d0af4134a18 [1,0,0,1,0,0|2,0,0]=4 14519 B11R1.233 CSCN[C@@H]1CCC[C@@]1(C)O e74cc9d07d8deb4103bc730aa812bc14 [1,0,0,1,0,0|2,0,0]=4 14520 B11R1.233 CSCN[C@H]1CCC[C@]1(C)O 21890648523317df6fd64d430d7f0b2e [1,0,0,1,0,0|2,0,0]=4 14521 B11R1.233 C[C@@]1(CCC[C@@H]1NCCF)O f969eee96f1f9143d6384444a06f1412 [1,0,0,1,0,0|2,0,0]=4 14522 B11R1.233 C[C@@]1(CCC[C@@H]1NCCO)O 8e9f4d52a2543d5d4ab0459140cf6105 [1,0,0,1,0,0|2,0,0]=4 14523 B11R1.233 C[C@@]1(CCC[C@@H]1NCCS)O 86ade3a681f7462c2a3d9699c2699e8c [1,0,0,1,0,0|2,0,0]=4 14524 B11R1.233 C[C@]1(CCC[C@H]1NCCF)O 88e172beb8f680ba334723bda7a3950f [1,0,0,1,0,0|2,0,0]=4 14525 B11R1.233 C[C@]1(CCC[C@H]1NCCO)O c84bd7243d3d10fe49024098a1ee5a4d [1,0,0,1,0,0|2,0,0]=4 14526 B11R1.233 C[C@]1(CCC[C@H]1NCCS)O 4f13a5cac73816bb1f93b1ed2c0ec4c7 [1,0,0,1,0,0|2,0,0]=4 14527 B11R1.241 CC(O)CCN[C@@H]1C[C@H]1CO dfd404a03f4bfd441abf1aa1bb4d32a0 [1,0,0,1,0,0|2,0,0]=4 14528 B11R1.241 CC(O)CCN[C@H]1C[C@@H]1CO cb23cdb767d9268639e704db9a3b3fbe [1,0,0,1,0,0|2,0,0]=4 14529 B11R1.241 CC(O)CCN[C@H]1C[C@H]1CO 5ea241cb8359822ce3c8f73f5bdd46a1 [1,0,0,1,0,0|2,0,0]=4 14530 B11R1.241 CC(O)CNCC1CC1CO e78f19c5d07bc12a5833bbe9357a3663 [1,0,0,1,0,0|2,0,0]=4 14531 B11R1.241 CO[C@H]1C[C@H]1NCCC(C)O 10c57b0a6ae3927767bdec036d922403 [1,0,0,1,0,0|2,0,0]=4 14532 B11R1.241 C[C@@H](O)CNCC1CC1CO cfa83239b863e972fb99d283c021a2ca [1,0,0,1,0,0|2,0,0]=4 14533 B11R1.241 C[C@H](O)CNCC1CC1CO fc31bc995a419c32d084dfd6ba7e4327 [1,0,0,1,0,0|2,0,0]=4 14534 B11R1.271 CC(O)CCN1CCC1CO 9b70c9874f26f7c4dffe7c3c14d2052a [1,0,0,1,0,0|2,0,0]=4 14535 B11R1.271 CC(O)CCN1CC[C@@H]1CO 5109dc30cf74638c8c3163958796b503 [1,0,0,1,0,0|2,0,0]=4 14536 B11R1.271 CC(O)CCN1CC[C@H]1CO 7899866ae50a5e0de86069f89e637505 [1,0,0,1,0,0|2,0,0]=4 14537 B11R1.271 CCC1CCN1CCC(C)C 45627f3543da9e98f9eab5482f60e24a [1,0,0,1,0,0|2,0,0]=4 14538 B11R1.271 CCC1CCN1CCC(C)O 3965e5badc1f26a1ed1c0eee323b10c8 [1,0,0,1,0,0|1,0,0]=3 14539 B11R1.271 COC1CCC1NCC(C)O 66fe5a124b05116d39b318a363140b1b [1,0,0,1,0,0|2,0,0]=4 14540 B11R1.271 COC1CCC1NC[C@@H](C)O d80d7c35d7e25d388399a5760e9cbec5 [1,0,0,1,0,0|2,0,0]=4 14541 B11R1.271 COC1CCC1NC[C@H](C)O 4a4ea23b5905ac8c7e453821a2b5488a [1,0,0,1,0,0|2,0,0]=4 14542 B11R1.271 CO[C@@H]1CC[C@@H]1NCC(C)O f219b6485c667d78037a2decfbcc406a [1,0,0,1,0,0|2,0,0]=4 14543 B11R1.271 CO[C@@H]1CC[C@@H]1NC[C@@H](C)O 19f9aee4d0c2e264fb29a754ce034aa6 [1,0,0,1,0,0|2,0,0]=4 14544 B11R1.271 CO[C@@H]1CC[C@@H]1NC[C@H](C)O 85032cc065807b97df87e41605844ba8 [1,0,0,1,0,0|2,0,0]=4 14545 B11R1.271 CO[C@@H]1CC[C@H]1NCC(C)O a5f4e300c0ac174ac70486eff1e67174 [1,0,0,1,0,0|2,0,0]=4 14546 B11R1.271 CO[C@@H]1CC[C@H]1NC[C@@H](C)O 4abe11979de846866cbd3d2ef87cc021 [1,0,0,1,0,0|2,0,0]=4 14547 B11R1.271 CO[C@@H]1CC[C@H]1NC[C@H](C)O cd05a297d8b085bb1509d468def59aff [1,0,0,1,0,0|2,0,0]=4 14548 B11R1.271 CO[C@H]1CC[C@@H]1NCC(C)O 06ae6790b52470f986ca4e5ee7a9f70a [1,0,0,1,0,0|2,0,0]=4 14549 B11R1.271 CO[C@H]1CC[C@@H]1NC[C@@H](C)O 4c2492ffb9f1abd63f1cecbe41e443cc [1,0,0,1,0,0|2,0,0]=4 14550 B11R1.271 CO[C@H]1CC[C@@H]1NC[C@H](C)O 925d0dacb99d0c5f0e5669163f7c444b [1,0,0,1,0,0|2,0,0]=4 14551 B11R1.271 CO[C@H]1CC[C@H]1NCC(C)O 9017a1a48b310ea8ca4b461ec9a9fa41 [1,0,0,1,0,0|2,0,0]=4 14552 B11R1.271 CO[C@H]1CC[C@H]1NC[C@@H](C)O 769fdf1c1881cedcc6f25fb9846abd80 [1,0,0,1,0,0|2,0,0]=4 14553 B11R1.271 CO[C@H]1CC[C@H]1NC[C@H](C)O 61439842ba431ed6ac4ed6da6de2ae0b [1,0,0,1,0,0|2,0,0]=4 14554 B11R1.335 CCCCOC1CCC1(C)C b9b86d7f93885bb14b1cbe0a8f750f52 [1,0,0,1,0,0|2,0,0]=4 14555 B11R1.706 CC(C)N1CCCCCCC1 55bfc930502299d9c5afd3aed373b259 [1,0,0,1,0,0|2,0,0]=4 14556 B11R1.742 CC(C)CN1CCCCCC1 bddcfb09854b53e7398a70fcbd7adc6c [1,0,0,1,0,0|2,0,0]=4 14557 B11R1.742 CC(C)NC1CCCCCC1 e2c3ba367683d489f8b42fe23c91b490 [1,0,0,1,0,0|2,0,0]=4 14558 B11R1.742 CC(C)OC1CCCCCC1 49cd74212008956419b032828c1aeb5a [1,0,0,1,0,0|2,0,0]=4 14559 B11R1.742 CC(O)CN1CCCCCC1 498903f6d699cdaa1a577d829993a3fc [1,0,0,1,0,0|1,0,0]=3 14560 B11R1.742 CC(O)CN1CCCOCC1 22bbd8235f4f7608c7b507880bf2f8e2 [1,0,0,1,0,0|2,0,0]=4 14561 B11R1.742 C[C@@H](O)CN1CCCCCC1 ba89f8f9782a716134051a422cfdfc47 [1,0,0,1,0,0|1,0,0]=3 14562 B11R1.742 C[C@@H](O)CN1CCCOCC1 fc57e244fe927cb3e9461597effa89a3 [1,0,0,1,0,0|2,0,0]=4 14563 B11R1.742 C[C@H](O)CN1CCCCCC1 4c725979e3b71bae8b90837911fd64ef [1,0,0,1,0,0|1,0,0]=3 14564 B11R1.742 C[C@H](O)CN1CCCOCC1 a1419cd7c9025ad1fc19464561e49607 [1,0,0,1,0,0|2,0,0]=4 14565 B11R1.898 CCCCCCN1CC1(C)C 1fb34701b9a7d2bd077c9b54f3ccbef5 [1,0,0,1,0,0|2,0,0]=4 14566 B11R1.898 CCCCCNC1CC1(C)C 3e13bc2a42c30acc08adb97c52f3f541 [1,0,0,1,0,0|2,0,0]=4 14567 B11R1.898 CCCCCN[C@@H]1CC1(C)C d2428c7a21acd9594a665e1567b2d2c5 [1,0,0,1,0,0|2,0,0]=4 14568 B11R1.898 CCCCCN[C@H]1CC1(C)C 1518a64eab625b5570e7cb1ddafcba2f [1,0,0,1,0,0|2,0,0]=4 14569 B11R1.898 CCCCCOC1CC1(C)C d3ba7240160ce1e50845c5e12196a921 [1,0,0,1,0,0|2,0,0]=4 14570 B11R1.898 CCCCNC[C@@H]1CC1(C)C adc941cee2ee997af3320aa48b3f052a [1,0,0,1,0,0|2,0,0]=4 14571 B11R1.898 CCCCNC[C@H]1CC1(C)C f0be37d02517f8135e37ca98baa55cf8 [1,0,0,1,0,0|2,0,0]=4 14572 B11R1.898 CCCCOCC1CC1(C)C 8633d552a655192c6b790389a09f5421 [1,0,0,1,0,0|2,0,0]=4 14573 B11R1.898 CCCCOC[C@@H]1CC1(C)C 532553fbca6e02b5ed7f47a62d9c873a [1,0,0,1,0,0|2,0,0]=4 14574 B11R1.898 CCCCOC[C@H]1CC1(C)C 7bc9be9cb19bcf23c5a89e9b4ba35d93 [1,0,0,1,0,0|2,0,0]=4 14575 B11R1.4 BrCCNCCC1CCCC1 30accee15326b546b15981755a8cbf1b [1,0,0,1,0,0|2,0,0]=4 14576 B11R1.4 BrCCNCCC1CCCO1 c0a083a4101a7d4c27a65fbae63ac17d [1,0,0,1,0,0|2,0,0]=4 14577 B11R1.4 CCCCCCN1CCSC1 eb0c3117f17c006a7af8d4d166dffdd7 [1,0,0,1,0,0|2,0,0]=4 14578 B11R1.4 CCCCCNC1CCCC1 704136233a5fd94e3ce2802197e418fd [1,0,0,1,0,0|1,0,0]=3 14579 B11R1.4 CCCCCNC1CCOC1 e71339dd13071583ab9b0dcdf5ff0b4b [1,0,0,1,0,0|2,0,0]=4 14580 B11R1.4 CCCCCNC1CCSC1 4fafda0a35f7587a6a1e753e48b39097 [1,0,0,1,0,0|2,0,0]=4 14581 B11R1.4 CCCCCN[C@@H]1CCOC1 37356bfd1f32684ece71747b1b291ee4 [1,0,0,1,0,0|2,0,0]=4 14582 B11R1.4 CCCCCN[C@H]1CCOC1 c3dbb85f252f94d587a9db597b2ebc09 [1,0,0,1,0,0|2,0,0]=4 14583 B11R1.4 CCCCCOC1CCCC1 ea0afe80da6af9a482238c7c0011138f [1,0,0,1,0,0|1,0,0]=3 14584 B11R1.4 CCCCCOC1CCCO1 4fcbb7f6db51b6632373c914ef3e210b [1,0,0,1,0,0|1,0,0]=3 14585 B11R1.4 CCCCCOC1CCOC1 a481691c01c064fc349d31cd7d02f028 [1,0,0,1,0,0|2,0,0]=4 14586 B11R1.4 CCCCCOC1CCSC1 beb618e344203720611c0ba6a5d8b476 [1,0,0,1,0,0|2,0,0]=4 14587 B11R1.4 CCCCCO[C@@H]1CCOC1 250c8c5128f959c88b5a701436484e72 [1,0,0,1,0,0|2,0,0]=4 14588 B11R1.4 CCCCCO[C@@H]1CCSC1 3179356a6cb04b2497eab76e2a233e4f [1,0,0,1,0,0|2,0,0]=4 14589 B11R1.4 CCCCCO[C@H]1CCOC1 d31ef9bc1e251e348a5adf1d01ef7f22 [1,0,0,1,0,0|2,0,0]=4 14590 B11R1.4 CCCCCO[C@H]1CCSC1 2ab135c42ea8f412226ce69ccba1430e [1,0,0,1,0,0|2,0,0]=4 14591 B11R1.4 CCCCNCC1CCCC1 731827e59a91924697bc94def38590cb [1,0,0,1,0,0|1,0,0]=3 14592 B11R1.4 CCCCNCC1CCCO1 5d381b028ebc3f6431ec0eb23ad96dad [1,0,0,1,0,0|1,0,0]=3 14593 B11R1.4 CCCCNCC1CCOC1 c3756bd0261cd099cdc709bdce6fa232 [1,0,0,1,0,0|2,0,0]=4 14594 B11R1.4 CCCCNC[C@@H]1CCCO1 40dda0a054e0f6d4dfaa5e4acfc3764d [1,0,0,1,0,0|1,0,0]=3 14595 B11R1.4 CCCCNC[C@@H]1CCOC1 4762caee14425a0c29233850ba87ac33 [1,0,0,1,0,0|2,0,0]=4 14596 B11R1.4 CCCCNC[C@H]1CCCO1 853017986931ae50dc82e6512a1e6233 [1,0,0,1,0,0|1,0,0]=3 14597 B11R1.4 CCCCNC[C@H]1CCOC1 0f3b777c8603da5cc88a36fa45080a8d [1,0,0,1,0,0|2,0,0]=4 14598 B11R1.4 CCCCOCC1CCCC1 5d7d52a8e3864fa84e0735eddb42e7ca [1,0,0,1,0,0|1,0,0]=3 14599 B11R1.4 CCCCOCC1CCCO1 0862079b3487ea18c32c1e28ed491ec7 [1,0,0,1,0,0|1,0,0]=3 14600 B11R1.4 CCCCOCC1CCCS1 f709349bfbc3122f056b12f6f926e50a [1,0,0,1,0,0|1,1,0]=4 14601 B11R1.4 CCCCOCC1CCOC1 a231891bdfe692c611bfd3b46c923cb9 [1,0,0,1,0,0|2,0,0]=4 14602 B11R1.4 CCCCOCN1CCCC1 62454fe8a7305250c92ef0f5fc4286b0 [1,0,0,1,0,0|2,0,0]=4 14603 B11R1.4 CCCCOC[C@@H]1CCCO1 db05d7cd3184532e54140a366489df45 [1,0,0,1,0,0|1,0,0]=3 14604 B11R1.4 CCCCOC[C@@H]1CCOC1 cf4708f2d22e9c8f8e5116d3f3763262 [1,0,0,1,0,0|2,0,0]=4 14605 B11R1.4 CCCCOC[C@H]1CCCO1 e5dcfa56095b26c5f6b49e16a96ea7d8 [1,0,0,1,0,0|1,0,0]=3 14606 B11R1.4 CCCCOC[C@H]1CCOC1 3142f21fc3f6ad095f89286d3a211209 [1,0,0,1,0,0|2,0,0]=4 14607 B11R1.4 CCCNCCC1CCCC1 d5270a9a9880d18f46e53116360a36aa [1,0,0,1,0,0|1,0,0]=3 14608 B11R1.4 CCCNCCC1CCCO1 16ccc3766cb64abb779cf31870fdd1b1 [1,0,0,1,0,0|1,0,0]=3 14609 B11R1.4 CCCNCCC1CCOC1 37e83678f55c397eb6ff0e8462199507 [1,0,0,1,0,0|2,0,0]=4 14610 B11R1.4 CCCNCCN1CCCC1 07b385095b2b11a81d5b5d3ca5f4ac0a [1,0,0,1,0,0|2,0,0]=4 14611 B11R1.4 CCCOCCC1CCCC1 787081f1fdbda17248ae4c818980f2e7 [1,0,0,1,0,0|1,0,0]=3 14612 B11R1.4 CCCOCCC1CCCO1 0bafcd2daa31466cb920a9ddb84cb9da [1,0,0,1,0,0|1,0,0]=3 14613 B11R1.4 CCCOCCC1CCOC1 1ef53bb1186d168149134661311ef251 [1,0,0,1,0,0|2,0,0]=4 14614 B11R1.4 CCCOCCN1CCCC1 b79fdf1837ad1026058dd33037798a30 [1,0,0,1,0,0|2,0,0]=4 14615 B11R1.4 CCNCCCC1CCCC1 bb38b69d7bc0534c0a37772ecaaa96d9 [1,0,0,1,0,0|1,0,0]=3 14616 B11R1.4 CCNCCCC1CCOC1 37915692199820a792dbd7b5d165da53 [1,0,0,1,0,0|2,0,0]=4 14617 B11R1.4 CCNCCCN1CCCC1 f07ef93ead196acba6313589e4768b51 [1,0,0,1,0,0|2,0,0]=4 14618 B11R1.4 CCNCCOC1CCCC1 31015dd28a95ca741ebad082f299e4a6 [1,0,0,1,0,0|2,0,0]=4 14619 B11R1.4 CCNCCSC1CCCC1 7bd7cd6f61669a88d47143e9e4e941b6 [1,0,0,1,0,0|2,0,0]=4 14620 B11R1.4 CCOCCCC1CCCC1 4c414e6d28e260b66dbefeb7947ff46e [1,0,0,1,0,0|1,0,0]=3 14621 B11R1.4 CCOCCCN1CCCC1 d5a21d419f9b60e46b8a87e36c97ca89 [1,0,0,1,0,0|2,0,0]=4 14622 B11R1.4 CCOCCNC1CCCC1 8eb348a8e3b34f9f0dbcd564bd97f0ab [1,0,0,1,0,0|2,0,0]=4 14623 B11R1.4 CCOCCOC1CCCC1 f95ff73046d9020ce92959aeee6f70dd [1,0,0,1,0,0|2,0,0]=4 14624 B11R1.4 CCOCCOC1CCCO1 b0ad09391e5328612b72dfdb37cec42d [1,0,0,1,0,0|2,0,0]=4 14625 B11R1.4 CCOCNCC1CCCC1 18ccb1802835bcdf694559b2a102409b [1,0,0,1,0,0|2,0,0]=4 14626 B11R1.4 CCOCNCC1CCCO1 79bd9dd90ba358ccba26c11bf3fee7a9 [1,0,0,1,0,0|2,0,0]=4 14627 B11R1.4 CCOCNC[C@@H]1CCCO1 4797db02add42ddd726dd979e028b26a [1,0,0,1,0,0|2,0,0]=4 14628 B11R1.4 CCOCNC[C@H]1CCCO1 d1a1cb69f076699fe55c5c2ad6c11144 [1,0,0,1,0,0|2,0,0]=4 14629 B11R1.4 CCOCOCC1CCCC1 f11de0c351dc85a7ba0f8d0d4e967aff [1,0,0,1,0,0|2,0,0]=4 14630 B11R1.4 CCOCOCC1CCCO1 1cb31ec50d09f82dae75ebae945630a6 [1,0,0,1,0,0|2,0,0]=4 14631 B11R1.4 CCOCOC[C@@H]1CCCO1 344be4f60a898a063ae103633a8489f4 [1,0,0,1,0,0|2,0,0]=4 14632 B11R1.4 CCOCOC[C@H]1CCCO1 72c1f519132345ca691996db4b9b9513 [1,0,0,1,0,0|2,0,0]=4 14633 B11R1.4 CCSCCNC1CCCC1 b17a5acbbbbe07bec66634fbfa65b135 [1,0,0,1,0,0|2,0,0]=4 14634 B11R1.4 CCSCCOC1CCCC1 ba0e6e69ed54c21abeada9c7fabeb9b8 [1,0,0,1,0,0|2,0,0]=4 14635 B11R1.4 CCSCCOC1CCCO1 4a9929986a979c7643bb1f72c35f2070 [1,0,0,1,0,0|2,0,0]=4 14636 B11R1.4 COCCCNC1CCCC1 9264939e10a2f92383bebfc542441ecc [1,0,0,1,0,0|2,0,0]=4 14637 B11R1.4 COCCCOC1CCCC1 277e9ff2e33629ac3691c3f83a4f9f29 [1,0,0,1,0,0|2,0,0]=4 14638 B11R1.4 COCCCOC1CCCO1 0ec67a812c5a891bb3b3379d52715598 [1,0,0,1,0,0|2,0,0]=4 14639 B11R1.4 COCCNCC1CCCC1 646ccd1b49b020636575e2265df157ef [1,0,0,1,0,0|2,0,0]=4 14640 B11R1.4 COCCNCC1CCCO1 f1c6a4f018db81c8de1ca2b8a4f58241 [1,0,0,1,0,0|2,0,0]=4 14641 B11R1.4 COCCNC[C@@H]1CCCO1 b955ea033c61ef3215b739aef9ddfbbf [1,0,0,1,0,0|2,0,0]=4 14642 B11R1.4 COCCNC[C@H]1CCCO1 5fef1325977611ab297316380d839ac5 [1,0,0,1,0,0|2,0,0]=4 14643 B11R1.4 COCCOCC1CCCC1 ae41cff914790c1527889061fc5b0d54 [1,0,0,1,0,0|2,0,0]=4 14644 B11R1.4 COCCOCC1CCCO1 1ce1879d94a2f0b74de16ab001c0394c [1,0,0,1,0,0|2,0,0]=4 14645 B11R1.4 COCCOC[C@@H]1CCCO1 9b724152160aee4e02d4398211b1ac54 [1,0,0,1,0,0|2,0,0]=4 14646 B11R1.4 COCCOC[C@H]1CCCO1 d73f3630462599e690ed2f7f5dc1ac78 [1,0,0,1,0,0|2,0,0]=4 14647 B11R1.4 COCNCCC1CCCC1 a21eeadc823eb042361ff27cb6d603c4 [1,0,0,1,0,0|2,0,0]=4 14648 B11R1.4 COCNCCC1CCCO1 9a0232c431ae1bcf9d059906ea761a03 [1,0,0,1,0,0|2,0,0]=4 14649 B11R1.4 COCOCCC1CCCC1 b6ffd621df0ff2b4ef40e0179ab9386a [1,0,0,1,0,0|2,0,0]=4 14650 B11R1.4 COCOCCC1CCCO1 98106163cd8c8b33957912ea6da0516f [1,0,0,1,0,0|2,0,0]=4 14651 B11R1.4 CSCCCNC1CCCC1 5f13b27cae64562a518d686148725d81 [1,0,0,1,0,0|2,0,0]=4 14652 B11R1.4 CSCCCOC1CCCC1 1a8e5007cad603a29e2e9f13bb042a9d [1,0,0,1,0,0|2,0,0]=4 14653 B11R1.4 CSCCCOC1CCCO1 685983b7138409ff49ba1f6cc03c20f4 [1,0,0,1,0,0|2,0,0]=4 14654 B11R1.4 CSCCNCC1CCCC1 d64fba2fb2d574accfc26b067a406537 [1,0,0,1,0,0|2,0,0]=4 14655 B11R1.4 CSCCNCC1CCCO1 5d4fc8976047398a47e72a8a5d24b98e [1,0,0,1,0,0|2,0,0]=4 14656 B11R1.4 CSCCNC[C@@H]1CCCO1 472826f46b6dcbd38ae02d18d8687cae [1,0,0,1,0,0|2,0,0]=4 14657 B11R1.4 CSCCNC[C@H]1CCCO1 4e5a49e4fdee6f5edbd429479a83d6ff [1,0,0,1,0,0|2,0,0]=4 14658 B11R1.4 CSCCOCC1CCCC1 29a6f4c60f43d72cc4d1ff9907b37f0b [1,0,0,1,0,0|2,0,0]=4 14659 B11R1.4 CSCCOCC1CCCO1 376bd3025414ae8fdf8ccc8da9863fdd [1,0,0,1,0,0|2,0,0]=4 14660 B11R1.4 CSCCOC[C@@H]1CCCO1 19b369ae718c5519ac5c16ffad609884 [1,0,0,1,0,0|2,0,0]=4 14661 B11R1.4 CSCCOC[C@H]1CCCO1 6347360c5092e5837d9723eb0642ac6b [1,0,0,1,0,0|2,0,0]=4 14662 B11R1.4 CSCNCCC1CCCC1 df07fd45f6dee1abf06be4bff6367fcb [1,0,0,1,0,0|2,0,0]=4 14663 B11R1.4 CSCNCCC1CCCO1 33cfe764811b18cdfe79adce2892c2b0 [1,0,0,1,0,0|2,0,0]=4 14664 B11R1.4 CSCOCCC1CCCC1 8f84deb098f375a2aa021901f794bf76 [1,0,0,1,0,0|2,0,0]=4 14665 B11R1.4 CSCOCCC1CCCO1 f234f9e56974e09368af8575207cdce0 [1,0,0,1,0,0|2,0,0]=4 14666 B11R1.4 ClCCCCNC1CCCC1 a8cef9b2c3ee0b8bc7cf9147dd8d40f9 [1,0,0,1,0,0|2,0,0]=4 14667 B11R1.4 ClCCCNCC1CCCC1 a54232385688b7a1d434a89535eecd43 [1,0,0,1,0,0|2,0,0]=4 14668 B11R1.4 ClCCCNCC1CCCO1 4e552f25ccb518e2c27aed9928a8ea28 [1,0,0,1,0,0|2,0,0]=4 14669 B11R1.4 FCCCCNC1CCCC1 9e170bf99ba8efbe55da8b7f7364188d [1,0,0,1,0,0|2,0,0]=4 14670 B11R1.4 FCCCCOC1CCCC1 8c406a6630e984b14e870de7c2077183 [1,0,0,1,0,0|2,0,0]=4 14671 B11R1.4 FCCCCOC1CCCO1 0b44e73fde881e17aaafab85f6a755f3 [1,0,0,1,0,0|2,0,0]=4 14672 B11R1.4 FCCCNCC1CCCC1 d4ac8aeba67ec7562ddedc4d7516b0fe [1,0,0,1,0,0|2,0,0]=4 14673 B11R1.4 FCCCNCC1CCCO1 31d37c2be125a6437318c1fe81bbc145 [1,0,0,1,0,0|2,0,0]=4 14674 B11R1.4 FCCCNC[C@@H]1CCCO1 58898ba9f8930c1a8bc01e6668ee7370 [1,0,0,1,0,0|2,0,0]=4 14675 B11R1.4 FCCCNC[C@H]1CCCO1 52756df4534f1dec2ae6c1cfc888d278 [1,0,0,1,0,0|2,0,0]=4 14676 B11R1.4 FCCCOCC1CCCC1 90db026f29caada687147a5f57cb9dee [1,0,0,1,0,0|2,0,0]=4 14677 B11R1.4 FCCCOCC1CCCO1 6d5299ad50c4f7a2ca1eb6c774102842 [1,0,0,1,0,0|2,0,0]=4 14678 B11R1.4 FCCCOC[C@@H]1CCCO1 444231d54a2dc4d2b3f0d3b53120761a [1,0,0,1,0,0|2,0,0]=4 14679 B11R1.4 FCCCOC[C@H]1CCCO1 58135f1e0eccc4e94209a292b16840db [1,0,0,1,0,0|2,0,0]=4 14680 B11R1.4 FCCNCCC1CCCC1 8aa50914002333ce93b2cf834e61832a [1,0,0,1,0,0|2,0,0]=4 14681 B11R1.4 FCCNCCC1CCCO1 a3d73c71bd8ff99249be076e2dba7985 [1,0,0,1,0,0|2,0,0]=4 14682 B11R1.4 FCCOCCC1CCCC1 6b25cc65bf6e1cfda2ab80ef9e752b38 [1,0,0,1,0,0|2,0,0]=4 14683 B11R1.4 FCCOCCC1CCCO1 b3337743ac442e3cb86ab0a0cbfc5962 [1,0,0,1,0,0|2,0,0]=4 14684 B11R1.4 FCNCCCC1CCCC1 2fcb402bd4e77d8499306e6017d78b30 [1,0,0,1,0,0|2,0,0]=4 14685 B11R1.4 FCOCCCC1CCCC1 bcfbca514c5feb4a60a5612863f82310 [1,0,0,1,0,0|2,0,0]=4 14686 B11R1.4 ICCNCCC1CCCC1 d57d165fba36861d7a7be2b2d7705dab [1,0,0,1,0,0|2,0,0]=4 14687 B11R1.4 ICCNCCC1CCCO1 3b588dcaf765ca6d8058558ed1175eb7 [1,0,0,1,0,0|2,0,0]=4 14688 B11R1.4 OCCCCCN1CCSC1 a64f2fb9c5b1d74713e4af053f39e886 [1,0,0,1,0,0|2,0,0]=4 14689 B11R1.4 OCCCCNC1CCCC1 10371cd3a6987b785ad3af8eb276fd84 [1,0,0,1,0,0|1,0,0]=3 14690 B11R1.4 OCCCCNC1CCOC1 a563a3cf9b13af310ee884037c6894a9 [1,0,0,1,0,0|2,0,0]=4 14691 B11R1.4 OCCCCNC1CCSC1 9b9737f3517e8757f55b4babaa1ae4ec [1,0,0,1,0,0|2,0,0]=4 14692 B11R1.4 OCCCCN[C@@H]1CCOC1 21468162cc7a8affb9a18068758df79d [1,0,0,1,0,0|2,0,0]=4 14693 B11R1.4 OCCCCN[C@H]1CCOC1 ba6bd25ec3bf2bfff71c84db53ea9a8f [1,0,0,1,0,0|2,0,0]=4 14694 B11R1.4 OCCCNCC1CCCC1 997e4a12a5ed94dc182d6e90055559b6 [1,0,0,1,0,0|1,0,0]=3 14695 B11R1.4 OCCCNCC1CCCO1 9b7bbcf71b32bf8227aa0c63ca744a8c [1,0,0,1,0,0|2,0,0]=4 14696 B11R1.4 OCCCNCC1CCOC1 bf38d17fe28ebfa3344b21f7edbb4453 [1,0,0,1,0,0|2,0,0]=4 14697 B11R1.4 OCCCNC[C@@H]1CCCO1 f574b2ada6ddbe87f78b330c3f10856c [1,0,0,1,0,0|2,0,0]=4 14698 B11R1.4 OCCCNC[C@@H]1CCOC1 3a4308b2d61417d2549bee6b0d81d0f7 [1,0,0,1,0,0|2,0,0]=4 14699 B11R1.4 OCCCNC[C@H]1CCCO1 19ba165d64649875173e26444a23725e [1,0,0,1,0,0|2,0,0]=4 14700 B11R1.4 OCCCNC[C@H]1CCOC1 342e9c45afde5773aabdf925e5bc886c [1,0,0,1,0,0|2,0,0]=4 14701 B11R1.4 OCCNCCC1CCCC1 4c282b62d98e70540ae289d799539185 [1,0,0,1,0,0|1,0,0]=3 14702 B11R1.4 OCCNCCC1CCCO1 ebbc41d2d98547f43619a37a5170a3e0 [1,0,0,1,0,0|2,0,0]=4 14703 B11R1.4 OCCNCCC1CCOC1 53347350f44242ffd140fc71556fb4d4 [1,0,0,1,0,0|2,0,0]=4 14704 B11R1.4 OCCNCCN1CCCC1 cc021fa9e69de4c18a18e182b9b5110f [1,0,0,1,0,0|2,0,0]=4 14705 B11R1.4 OCNCCCC1CCCC1 b06a04ed90cc0e692125de0652125c7f [1,0,0,1,0,0|1,0,0]=3 14706 B11R1.4 OCNCCCC1CCOC1 c91f03b58041380df292e9052c41e145 [1,0,0,1,0,0|2,0,0]=4 14707 B11R1.4 OCNCCCN1CCCC1 1630b31d9e9372313da8cefd7a885c78 [1,0,0,1,0,0|2,0,0]=4 14708 B11R1.4 OCNCCOC1CCCC1 4e7736874e8a0ccbcb758a3d34b0f32c [1,0,0,1,0,0|2,0,0]=4 14709 B11R1.4 OCNCCSC1CCCC1 8a6aca83eab267266d25e63d39a76719 [1,0,0,1,0,0|2,0,0]=4 14710 B11R1.4 SCCCCNC1CCCC1 298239f11ba9217d905333cb1ed46c9f [1,0,0,1,0,0|1,1,0]=4 14711 B11R1.4 SCCCCOC1CCCC1 5b7b863374c6c9e0ba7ae40644fa5073 [1,0,0,1,0,0|1,1,0]=4 14712 B11R1.4 SCCCNCC1CCCC1 6df23f46e7ac6490120c2e1fc291a6b7 [1,0,0,1,0,0|1,1,0]=4 14713 B11R1.4 SCCCNCC1CCCO1 e58940cefbbc45b26d9694745794c605 [1,0,0,1,0,0|2,0,0]=4 14714 B11R1.4 SCCCNC[C@@H]1CCCO1 3bf0c46d909e703587e42c273e8bd15c [1,0,0,1,0,0|2,0,0]=4 14715 B11R1.4 SCCCNC[C@H]1CCCO1 fbec23e6563db7ebded7c6f15b9f9c4a [1,0,0,1,0,0|2,0,0]=4 14716 B11R1.4 SCCCOCC1CCCC1 ae80ab892b5a8d24d91965a9b0c43c5b [1,0,0,1,0,0|1,1,0]=4 14717 B11R1.4 SCCCOCC1CCCO1 f62114df2d600bcfc8eaf17f81c08646 [1,0,0,1,0,0|2,0,0]=4 14718 B11R1.4 SCCCOC[C@@H]1CCCO1 b26a6a8df291eb7ddef5d8d2c8bddb34 [1,0,0,1,0,0|2,0,0]=4 14719 B11R1.4 SCCCOC[C@H]1CCCO1 a54cf16c8e034aa1b8202b30f8e4db90 [1,0,0,1,0,0|2,0,0]=4 14720 B11R1.4 SCCNCCC1CCCC1 9e9cd4ab62074a0bf559befe96a07904 [1,0,0,1,0,0|1,1,0]=4 14721 B11R1.4 SCCNCCC1CCCO1 c757e149cd5d735618f1d459bd85820f [1,0,0,1,0,0|2,0,0]=4 14722 B11R1.4 SCCOCCC1CCCC1 3daae7d5edba49d47a893299a24320a6 [1,0,0,1,0,0|1,1,0]=4 14723 B11R1.4 SCCOCCC1CCCO1 a35aa355bd74b038afbefb4022497197 [1,0,0,1,0,0|2,0,0]=4 14724 B11R1.5 CC1CCCCCN1CCF 4c60149b0b9ff1ad26c5d9406ceba8c9 [1,0,0,1,0,0|2,0,0]=4 14725 B11R1.5 CC1CCCCCN1CCO 057c6b87b8285708a5579f8fa31ee9f9 [1,0,0,1,0,0|1,0,0]=3 14726 B11R1.5 CC1CCCCCN1CCS 19f293bbc2a0a5b26587ad161f76dfd5 [1,0,0,1,0,0|1,1,0]=4 14727 B11R1.5 CC1CCOCCN1CCO 9e3edc5c88838dd82b88274a1b534396 [1,0,0,1,0,0|2,0,0]=4 14728 B11R1.5 CC1CCSCCN1CCO 58dffc6d64aacd2133fce4951ab0587c [1,0,0,1,0,0|2,0,0]=4 14729 B11R1.5 CC1COCCCN1CCO 5ab9d0ff869550f3ffcfb65a2683d470 [1,0,0,1,0,0|2,0,0]=4 14730 B11R1.5 CCCN1CCCCCC1C 29918e7d6c2ed7cbd3b8be71c6bc41c1 [1,0,0,1,0,0|1,0,0]=3 14731 B11R1.5 CCCN1CCCOCC1C 9066758650d47213110c3c8ade69bf24 [1,0,0,1,0,0|2,0,0]=4 14732 B11R1.5 CCCN1CCOCCC1C 65997e4e85b8afd2bfa6b21d0e681755 [1,0,0,1,0,0|2,0,0]=4 14733 B11R1.5 CCCN1CCSCCC1C d8d08f9f316904305475d3dfeaa43ce6 [1,0,0,1,0,0|2,0,0]=4 14734 B11R1.5 CCN[C@@H]1CCCCC[C@@H]1O deb26c7299ed6334e1a991f54447a9c5 [1,0,0,1,0,0|1,0,0]=3 14735 B11R1.5 CCN[C@@H]1CCCCC[C@H]1O 713169aeab8b05177be1f53d96a8599b [1,0,0,1,0,0|1,0,0]=3 14736 B11R1.5 CCN[C@H]1CCCCC[C@@H]1O 9b966678bef528ff6940b725ce3b16fe [1,0,0,1,0,0|1,0,0]=3 14737 B11R1.5 COCN1CCCCCC1C 4fb795b9e6471664971070101f1b3290 [1,0,0,1,0,0|2,0,0]=4 14738 B11R1.5 CSCN1CCCCCC1C d83541eaa17c0ab612bb7d014a466883 [1,0,0,1,0,0|2,0,0]=4 14739 B11R1.5 OCN[C@@H]1CCCCC[C@@H]1O 1baa89bf54227ebee6d797b86771f91b [1,0,0,1,0,0|2,0,0]=4 14740 B11R1.5 OCN[C@@H]1CCCCC[C@H]1O 586c460b1f2e244f5192beda10410e5c [1,0,0,1,0,0|2,0,0]=4 14741 B11R1.5 OCN[C@H]1CCCCC[C@@H]1O 005052a9017a3a25d5bbf0f153cb7c49 [1,0,0,1,0,0|2,0,0]=4 14742 B11R1.5 O[C@@H]1CCCCC[C@H]1NCF 93819f18d492bb546f58237deea30894 [1,0,0,1,0,0|2,0,0]=4 14743 B11R1.5 O[C@H]1CCCCC[C@@H]1NCF 37a1daebd7bef8d35ba81446a6f84c45 [1,0,0,1,0,0|2,0,0]=4 14744 B11R1.5 O[C@H]1CCCCC[C@H]1NCF 6f21f3afcfade25d54674c99f3b2593f [1,0,0,1,0,0|2,0,0]=4 14745 B11R1.17 CC1CCCCC1CNCF cbe7e08942f504db6ac88cc822fa0eb2 [1,0,0,1,0,0|2,0,0]=4 14746 B11R1.17 CC1CCCCC1CNCO 69775eb9e35ab19ef3c7f4c19248721e [1,0,0,1,0,0|1,0,0]=3 14747 B11R1.17 CC1CCCCC1NCCF 76b11e50787e0378c014cac27937e219 [1,0,0,1,0,0|2,0,0]=4 14748 B11R1.17 CC1CCCCC1NCCO 52c6ad311f6fad2268e1eda79c81b36a [1,0,0,1,0,0|1,0,0]=3 14749 B11R1.17 CC1CCCCC1NCCS 304aa6f0b749c17bf457e18174d7c518 [1,0,0,1,0,0|1,1,0]=4 14750 B11R1.17 CC1CCCCC1OCCF dbad73d99254e4ee3296ed6293b7e54b [1,0,0,1,0,0|2,0,0]=4 14751 B11R1.17 CC1CCCCC1OCCS 2590ec6e7649626e0ce7c7117fe9347e [1,0,0,1,0,0|1,1,0]=4 14752 B11R1.17 CC1CCCCN1CCCF 640bc7f1f987bc9986ab4a5c75f2e681 [1,0,0,1,0,0|2,0,0]=4 14753 B11R1.17 CC1CCCCN1CCCO a0173451728ed2077ecde1c84d76b55a [1,0,0,1,0,0|1,0,0]=3 14754 B11R1.17 CC1CCCCN1CCCS f4d961fab8ff02afbf77cda8cdc612a3 [1,0,0,1,0,0|1,1,0]=4 14755 B11R1.17 CC1COCCC1NCCO 44151a87603973006a7c2083a8f1b50d [1,0,0,1,0,0|2,0,0]=4 14756 B11R1.17 CC1COCCN1CCCO b8ff556ac531d88b9932f234e1b7c62f [1,0,0,1,0,0|2,0,0]=4 14757 B11R1.17 CCCCN1CCCCC1C 83c4670684a1fe719987a5a81f008b63 [1,0,0,1,0,0|1,0,0]=3 14758 B11R1.17 CCCCN1CCCC[C@@H]1C 20ce0036f3189270a4c28fd97f80fe7c [1,0,0,1,0,0|1,0,0]=3 14759 B11R1.17 CCCCN1CCCC[C@H]1C 8f99e3e23714c78cfa0be5f1bf432828 [1,0,0,1,0,0|1,0,0]=3 14760 B11R1.17 CCCCN1CCOCC1C b332b43da124227592c1c6c71aeafe02 [1,0,0,1,0,0|2,0,0]=4 14761 B11R1.17 CCCCN1CCOC[C@@H]1C 09ae043fbeeaf348dc90e21afe8c0174 [1,0,0,1,0,0|2,0,0]=4 14762 B11R1.17 CCCCN1CCOC[C@H]1C fcb2a4ea95dc5b4db30ab40ca840789f [1,0,0,1,0,0|2,0,0]=4 14763 B11R1.17 CCCNC1CCCCC1C bdb9b023308419a6bdd339eb4623faf7 [1,0,0,1,0,0|1,0,0]=3 14764 B11R1.17 CCCNC1CCCCC1F 58bf2dbb064449dd08e5c7d1ee873f6d [1,0,0,1,0,0|2,0,0]=4 14765 B11R1.17 CCCNC1CCCCC1O a7a69cea9f0e251081de7c555541f76e [1,0,0,1,0,0|1,0,0]=3 14766 B11R1.17 CCCNC1CCOCC1C 2c050665e71aa0c380b294751183834d [1,0,0,1,0,0|2,0,0]=4 14767 B11R1.17 CCCNC1CCOCC1O 9e474b02c1e69f6dcf008dd0356ae520 [1,0,0,1,0,0|2,0,0]=4 14768 B11R1.17 CCCN[C@@H]1CCCC[C@@H]1C 1317a9b9d1647bfa509f7e2a68369b53 [1,0,0,1,0,0|1,0,0]=3 14769 B11R1.17 CCCN[C@@H]1CCCC[C@H]1C fdeaf4479440c414ae221687ebf74d86 [1,0,0,1,0,0|1,0,0]=3 14770 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O 305c976006d68d744857563374a03bf7 [1,0,0,1,0,0|1,0,0]=3 14771 B11R1.17 CCCN[C@@H]1CCOC[C@@H]1C 786a63f729a89b8944f5ddef06234b89 [1,0,0,1,0,0|2,0,0]=4 14772 B11R1.17 CCCN[C@@H]1CCOC[C@@H]1O 513ac98cd82ad66b064d30a13e402622 [1,0,0,1,0,0|2,0,0]=4 14773 B11R1.17 CCCN[C@@H]1CCOC[C@H]1O 24b46da57d31cce50d135e07f1c2430a [1,0,0,1,0,0|2,0,0]=4 14774 B11R1.17 CCCN[C@@H]1COCC[C@@H]1O d848264cb0a3823322521eb24cd14e6f [1,0,0,1,0,0|2,0,0]=4 14775 B11R1.17 CCCN[C@@H]1COCC[C@H]1O 3411687d8eda56d1100ca805d52c5a8b [1,0,0,1,0,0|2,0,0]=4 14776 B11R1.17 CCCN[C@H]1CCCC[C@@H]1C a75070aed8e0fbb0e1d31ce9811b7104 [1,0,0,1,0,0|1,0,0]=3 14777 B11R1.17 CCCN[C@H]1CCCC[C@@H]1O d1feb4a032f6483fe5a8ed49ec4dc95c [1,0,0,1,0,0|1,0,0]=3 14778 B11R1.17 CCCN[C@H]1CCCC[C@H]1C 93523405ad8f6e38114baf82438de76c [1,0,0,1,0,0|1,0,0]=3 14779 B11R1.17 CCCN[C@H]1CCCC[C@H]1O daad993687adc821be8d24c275cce592 [1,0,0,1,0,0|1,0,0]=3 14780 B11R1.17 CCCN[C@H]1CCOC[C@@H]1O 34fccf3a72af5bc929c9fb9a5643c613 [1,0,0,1,0,0|2,0,0]=4 14781 B11R1.17 CCCN[C@H]1CCOC[C@H]1C 5c8a9835455078abf1738e8951b60026 [1,0,0,1,0,0|2,0,0]=4 14782 B11R1.17 CCCN[C@H]1CCOC[C@H]1O 44c86d7ee4d917069ffe3a490d209730 [1,0,0,1,0,0|2,0,0]=4 14783 B11R1.17 CCCN[C@H]1COCC[C@@H]1O 57d7489b3ceb99b407c2678fff7a51ff [1,0,0,1,0,0|2,0,0]=4 14784 B11R1.17 CCCN[C@H]1COCC[C@H]1O 5661a32f0010058508c53c98761f370e [1,0,0,1,0,0|2,0,0]=4 14785 B11R1.17 CCCOC1CCCCC1C 4d0cd2cc86879eaea764a5e506032648 [1,0,0,1,0,0|1,0,0]=3 14786 B11R1.17 CCCOC1CCCCC1F 5b119750afb6113f1e64ad8ff5224643 [1,0,0,1,0,0|2,0,0]=4 14787 B11R1.17 CCCOC1CCOCC1C a9315ae61cb200edfb68f5861da04cab [1,0,0,1,0,0|2,0,0]=4 14788 B11R1.17 CCCO[C@@H]1CCCC[C@@H]1C e7057264cfbad8629f9a4688e6a83d4f [1,0,0,1,0,0|1,0,0]=3 14789 B11R1.17 CCCO[C@@H]1CCCC[C@H]1F b046b599956a03824b30c58925a0f1ac [1,0,0,1,0,0|2,0,0]=4 14790 B11R1.17 CCCO[C@H]1CCCC[C@@H]1C 6243eb875afc5a9f4ff394ac6f43dee3 [1,0,0,1,0,0|1,0,0]=3 14791 B11R1.17 CCCO[C@H]1CCCC[C@H]1C 81c2b2c6a4f88908629c095bb85377dd [1,0,0,1,0,0|1,0,0]=3 14792 B11R1.17 CCNCC1CCCCC1C 3db2897bc02580041d74323dfcee9c77 [1,0,0,1,0,0|1,0,0]=3 14793 B11R1.17 CCNCC1CCCCC1O 6f9959cd04171fe590f2e6148374867d [1,0,0,1,0,0|1,0,0]=3 14794 B11R1.17 CCNCC1CCCCN1C 9b3b6b0ce9423edfcf46d5f6e8fcb5d8 [1,0,0,1,0,0|2,0,0]=4 14795 B11R1.17 CCNCC1CSCCC1O b11eaaf59b907a4c21682c90321b2474 [1,0,0,1,0,0|2,0,0]=4 14796 B11R1.17 CCOCC1CCCCN1C 8e8a56bfae80eacb06ce70cbd2978572 [1,0,0,1,0,0|2,0,0]=4 14797 B11R1.17 CCOCN1CCCCC1C 2a71a64337fff5a0e9115ec13f84cfda [1,0,0,1,0,0|2,0,0]=4 14798 B11R1.17 CCOCN1CCCC[C@@H]1C d200dca18d6cd57545248364d6503b5e [1,0,0,1,0,0|2,0,0]=4 14799 B11R1.17 CCOCN1CCCC[C@H]1C bd992d68022a5d86ce95cae6a61027b3 [1,0,0,1,0,0|2,0,0]=4 14800 B11R1.17 CCOC[C@@H]1CCCCN1C cff92034da3e0c43ee3ae40113b0373d [1,0,0,1,0,0|2,0,0]=4 14801 B11R1.17 CCOC[C@H]1CCCCN1C 81e8c9544a472aa4c574ca8fad79de10 [1,0,0,1,0,0|2,0,0]=4 14802 B11R1.17 CN1CCCCC1CNCO 88c5efc57ca79c91123a67a83e8a9702 [1,0,0,1,0,0|2,0,0]=4 14803 B11R1.17 COCCN1CCCCC1C 96ee899ad6e827c3482f3034cab85790 [1,0,0,1,0,0|2,0,0]=4 14804 B11R1.17 COCCN1CCCC[C@@H]1C f63ca5fd4ab428a98fdb4ca8b0d06fe8 [1,0,0,1,0,0|2,0,0]=4 14805 B11R1.17 COCCN1CCCC[C@H]1C 530fbfb27258d6c523499772d1500e82 [1,0,0,1,0,0|2,0,0]=4 14806 B11R1.17 COCNC1CCCCC1C cdc9d9bcfc9f373a10989fb50990231e [1,0,0,1,0,0|2,0,0]=4 14807 B11R1.17 COCNC1CCCCC1O 01a10d4dccebb7f44625c4cd030487e0 [1,0,0,1,0,0|2,0,0]=4 14808 B11R1.17 COCN[C@@H]1CCCC[C@@H]1C 4345b190afa2aa5b423d34c9bd8b4899 [1,0,0,1,0,0|2,0,0]=4 14809 B11R1.17 COCN[C@@H]1CCCC[C@H]1C aa996b1708358e8f16d5f8037987495a [1,0,0,1,0,0|2,0,0]=4 14810 B11R1.17 COCN[C@@H]1CCCC[C@H]1O b3223e1e9ce55d5a1bf4400437b317eb [1,0,0,1,0,0|2,0,0]=4 14811 B11R1.17 COCN[C@H]1CCCC[C@@H]1C 250df64a8c821cf75414489b14b7ec53 [1,0,0,1,0,0|2,0,0]=4 14812 B11R1.17 COCN[C@H]1CCCC[C@@H]1O 7355d3cfeeab35fb0acdbd23da0a81ef [1,0,0,1,0,0|2,0,0]=4 14813 B11R1.17 COCN[C@H]1CCCC[C@H]1C 6d401645345aba0cb48a0b91fd4803ce [1,0,0,1,0,0|2,0,0]=4 14814 B11R1.17 COCN[C@H]1CCCC[C@H]1O 383067d8c410602bed30706f0816dc01 [1,0,0,1,0,0|2,0,0]=4 14815 B11R1.17 COCOC1CCCCC1C 04612028f51e6cada192150c12627c72 [1,0,0,1,0,0|2,0,0]=4 14816 B11R1.17 COCO[C@@H]1CCCC[C@@H]1C 13b925b59bd3c505248c6e004437cf1c [1,0,0,1,0,0|2,0,0]=4 14817 B11R1.17 COCO[C@H]1CCCC[C@@H]1C c1630b0bfee2f4e9e26e6e47add49623 [1,0,0,1,0,0|2,0,0]=4 14818 B11R1.17 COCO[C@H]1CCCC[C@H]1C 40896b335cde93f2f6d498ccca277374 [1,0,0,1,0,0|2,0,0]=4 14819 B11R1.17 CSCCN1CCCCC1C f8e44a546f08f8d8d8f301c1e8c1e18c [1,0,0,1,0,0|2,0,0]=4 14820 B11R1.17 CSCCN1CCCC[C@@H]1C 92495bbb572d6b689c281a2be2deca15 [1,0,0,1,0,0|2,0,0]=4 14821 B11R1.17 CSCCN1CCCC[C@H]1C 7e814755476f8ca4bc07e1170a8dc29c [1,0,0,1,0,0|2,0,0]=4 14822 B11R1.17 CSCNC1CCCCC1C 7812ed0c98df7a82026e27e06f65aad0 [1,0,0,1,0,0|2,0,0]=4 14823 B11R1.17 CSCNC1CCCCC1O 1060a5f6ac3d20e3417fe41750f8e4b5 [1,0,0,1,0,0|2,0,0]=4 14824 B11R1.17 CSCN[C@@H]1CCCC[C@@H]1C 1474f0c9f062f92a35277585253b97ff [1,0,0,1,0,0|2,0,0]=4 14825 B11R1.17 CSCN[C@@H]1CCCC[C@H]1C f2023afb290854e39ce51534602e5486 [1,0,0,1,0,0|2,0,0]=4 14826 B11R1.17 CSCN[C@@H]1CCCC[C@H]1O 7ebf2621aa81f01fad65b29d09965dbb [1,0,0,1,0,0|2,0,0]=4 14827 B11R1.17 CSCN[C@H]1CCCC[C@@H]1C 2de3ebccd88d3be0f065a4a5363f3f9e [1,0,0,1,0,0|2,0,0]=4 14828 B11R1.17 CSCN[C@H]1CCCC[C@@H]1O 897378086b7d8fddc543348ccac3cf23 [1,0,0,1,0,0|2,0,0]=4 14829 B11R1.17 CSCN[C@H]1CCCC[C@H]1C ead33bb8654d629e5807d8033ebc9deb [1,0,0,1,0,0|2,0,0]=4 14830 B11R1.17 CSCN[C@H]1CCCC[C@H]1O 110925d0022d9cb257d56788b8705849 [1,0,0,1,0,0|2,0,0]=4 14831 B11R1.17 CSCOC1CCCCC1C 7ad203cec64717c90481576c7786bb07 [1,0,0,1,0,0|2,0,0]=4 14832 B11R1.17 CSCO[C@@H]1CCCC[C@@H]1C 1fa088698c8224331021de5c87e94d80 [1,0,0,1,0,0|2,0,0]=4 14833 B11R1.17 CSCO[C@H]1CCCC[C@@H]1C 2781b7cfa1a51dc80f8e0408b9fa3d68 [1,0,0,1,0,0|2,0,0]=4 14834 B11R1.17 CSCO[C@H]1CCCC[C@H]1C d966848fd97cf8f4c939348557cc6d17 [1,0,0,1,0,0|2,0,0]=4 14835 B11R1.17 C[C@@H]1CCCCN1CCCF 073ed6a0a7096583af71de8f5079f5de [1,0,0,1,0,0|2,0,0]=4 14836 B11R1.17 C[C@@H]1CCCCN1CCCO 6fd84a4e3b169ec43015356a9027c3bc [1,0,0,1,0,0|1,0,0]=3 14837 B11R1.17 C[C@@H]1CCCCN1CCCS 67adc912345d034bc70c853529eac623 [1,0,0,1,0,0|1,1,0]=4 14838 B11R1.17 C[C@@H]1CCCC[C@@H]1NCCBr cf0770342699da27307b1701add51807 [1,0,0,1,0,0|2,0,0]=4 14839 B11R1.17 C[C@@H]1CCCC[C@@H]1NCCF 473e01e8ef39ac1adcb370a2d6f1cc38 [1,0,0,1,0,0|2,0,0]=4 14840 B11R1.17 C[C@@H]1CCCC[C@@H]1NCCI 486f23121a31bb3a6f29af394f8af5c3 [1,0,0,1,0,0|2,0,0]=4 14841 B11R1.17 C[C@@H]1CCCC[C@@H]1NCCO 87fc70f547ddc2db47020bf411604945 [1,0,0,1,0,0|1,0,0]=3 14842 B11R1.17 C[C@@H]1CCCC[C@@H]1NCCS 68c2b89e59abc718aefb7289cb6fb9e6 [1,0,0,1,0,0|1,1,0]=4 14843 B11R1.17 C[C@@H]1CCCC[C@@H]1OCCF 2eefa151e6e59f054bbaee32ba283c98 [1,0,0,1,0,0|2,0,0]=4 14844 B11R1.17 C[C@@H]1CCCC[C@@H]1OCCS f63be3378242d696b498bcbf6b6b9ab8 [1,0,0,1,0,0|1,1,0]=4 14845 B11R1.17 C[C@@H]1CCCC[C@H]1NCCF 36a6685e56e8548859c142981e7502b2 [1,0,0,1,0,0|2,0,0]=4 14846 B11R1.17 C[C@@H]1CCCC[C@H]1NCCO b4b92dc556e26bd3055d19e7820d8afe [1,0,0,1,0,0|1,0,0]=3 14847 B11R1.17 C[C@@H]1CCCC[C@H]1NCCS f9955f168f265e5f566b85201829ba2d [1,0,0,1,0,0|1,1,0]=4 14848 B11R1.17 C[C@@H]1COCCN1CCCO 6b86fcde902fc25e3a3c23f4fc57a45f [1,0,0,1,0,0|2,0,0]=4 14849 B11R1.17 C[C@@H]1COCC[C@@H]1NCCO 87af949ce30bcb15ce6d2eecc011b0e3 [1,0,0,1,0,0|2,0,0]=4 14850 B11R1.17 C[C@H]1CCCCN1CCCF 09b625893a39e998f7543dd4a9a4cff3 [1,0,0,1,0,0|2,0,0]=4 14851 B11R1.17 C[C@H]1CCCCN1CCCO 13ed03d551929cc9996e311ec7b70ce5 [1,0,0,1,0,0|1,0,0]=3 14852 B11R1.17 C[C@H]1CCCCN1CCCS 682f211d47a9a421b3f7d3fdca0deeb8 [1,0,0,1,0,0|1,1,0]=4 14853 B11R1.17 C[C@H]1CCCC[C@@H]1NCCF 615a79844f576d7110003a3eb5f615ee [1,0,0,1,0,0|2,0,0]=4 14854 B11R1.17 C[C@H]1CCCC[C@@H]1NCCO 5b3deeb81fb04710cff51b19df9244a1 [1,0,0,1,0,0|1,0,0]=3 14855 B11R1.17 C[C@H]1CCCC[C@@H]1NCCS e0d304407efeeed37af1a15e6f8e2f24 [1,0,0,1,0,0|1,1,0]=4 14856 B11R1.17 C[C@H]1CCCC[C@@H]1OCCF 5ccb609b65c8c6d0dc7a9e72cf4f2317 [1,0,0,1,0,0|2,0,0]=4 14857 B11R1.17 C[C@H]1CCCC[C@@H]1OCCS 11d3d12f0afaac2d5b26f85f6cc2f69e [1,0,0,1,0,0|1,1,0]=4 14858 B11R1.17 C[C@H]1CCCC[C@H]1NCCF d4dbe4fdf37782c708539e20da74c891 [1,0,0,1,0,0|2,0,0]=4 14859 B11R1.17 C[C@H]1CCCC[C@H]1NCCO e07252d90a0c78830feaac80840cb6e3 [1,0,0,1,0,0|1,0,0]=3 14860 B11R1.17 C[C@H]1CCCC[C@H]1NCCS 052de88308aa1ad85311ed961875585e [1,0,0,1,0,0|1,1,0]=4 14861 B11R1.17 C[C@H]1CCCC[C@H]1OCCF 2abb0a28c254dd3dbe118b235d42bc1f [1,0,0,1,0,0|2,0,0]=4 14862 B11R1.17 C[C@H]1CCCC[C@H]1OCCS ffd9997f4f199afa9828e6a571afc26b [1,0,0,1,0,0|1,1,0]=4 14863 B11R1.17 C[C@H]1COCCN1CCCO a52169cddd275b42dd26bf305da98149 [1,0,0,1,0,0|2,0,0]=4 14864 B11R1.17 C[C@H]1COCC[C@H]1NCCO e12a419860762e98c1523a017d29eb88 [1,0,0,1,0,0|2,0,0]=4 14865 B11R1.17 OC1CCCCC1CNCF 5949696e6255e99be83c31bdccf1229e [1,0,0,1,0,0|2,0,0]=4 14866 B11R1.17 OC1CCCCC1NCCBr a96d13d910e39628289353a00b6e888d [1,0,0,1,0,0|2,0,0]=4 14867 B11R1.17 OC1CCCCC1NCCF 62c8b1d64c14162a8bb9363c92812153 [1,0,0,1,0,0|2,0,0]=4 14868 B11R1.17 OC1CCCCC1NCCI 0f1bb461daab4359ff7542da426a7d97 [1,0,0,1,0,0|2,0,0]=4 14869 B11R1.17 OC1CCCCC1NCCS 169f3af071bb56be85142fa2b7201c8d [1,0,0,1,0,0|2,0,0]=4 14870 B11R1.17 OCCNC1CCCCC1F ef5650fd3b35957482cdcc198c55f12c [1,0,0,1,0,0|2,0,0]=4 14871 B11R1.17 OCCNC1CCCCC1O 3f1b1aa3e35ebd8a05ea744278835792 [1,0,0,1,0,0|2,0,0]=4 14872 B11R1.17 OCCN[C@@H]1CCCC[C@H]1O ed7142584fad3902df45594cc6e19adb [1,0,0,1,0,0|2,0,0]=4 14873 B11R1.17 OCCN[C@H]1CCCC[C@@H]1O be7d1755321f950d933ca305484d57a2 [1,0,0,1,0,0|2,0,0]=4 14874 B11R1.17 OCCN[C@H]1CCCC[C@H]1O a82b7e424d366a07592605ff89028365 [1,0,0,1,0,0|2,0,0]=4 14875 B11R1.17 OCNCC1CCCCC1O c2cdf6d7532b39fe16c5231943578b41 [1,0,0,1,0,0|2,0,0]=4 14876 B11R1.17 O[C@@H]1CCCC[C@@H]1NCCF 20efbbe2d781dd76dbf6fbf1a925672c [1,0,0,1,0,0|2,0,0]=4 14877 B11R1.17 O[C@@H]1CCCC[C@@H]1NCCS 211d51c7c4b380ea4056cafbf369e092 [1,0,0,1,0,0|2,0,0]=4 14878 B11R1.17 O[C@@H]1CCCC[C@H]1NCCF 50157b9fb8839e31869341976d777a41 [1,0,0,1,0,0|2,0,0]=4 14879 B11R1.17 O[C@@H]1CCCC[C@H]1NCCS b53b0b7079e5b317b7f578fe48f84053 [1,0,0,1,0,0|2,0,0]=4 14880 B11R1.17 O[C@H]1CCCC[C@@H]1NCCBr 958ef1cb221c681a195620c2d3d742fc [1,0,0,1,0,0|2,0,0]=4 14881 B11R1.17 O[C@H]1CCCC[C@@H]1NCCF eff87c1356e2757d5677d5f50cffed7e [1,0,0,1,0,0|2,0,0]=4 14882 B11R1.17 O[C@H]1CCCC[C@@H]1NCCI 70d427ff6cf8200d7ad9eaa2bab4654d [1,0,0,1,0,0|2,0,0]=4 14883 B11R1.17 O[C@H]1CCCC[C@@H]1NCCS a7dd640b63261e6f58d09120c763f651 [1,0,0,1,0,0|2,0,0]=4 14884 B11R1.18 CCC1CCCN1CCCF 25a7b908b6883ba5b226a74bf788cca0 [1,0,0,1,0,0|2,0,0]=4 14885 B11R1.18 CCC1CCCN1CCCO 803ebab82fbf275fabb90b1b0ce7fcdc [1,0,0,1,0,0|1,0,0]=3 14886 B11R1.18 CCC1CCCN1CCCS 0ac25c15511ae6a933e6329ca541467a [1,0,0,1,0,0|1,1,0]=4 14887 B11R1.18 CCC1CCCN1CCOC 5f03900d40043c1f9fb6ca902674c056 [1,0,0,1,0,0|2,0,0]=4 14888 B11R1.18 CCC1CCCN1CCSC 22adc361156c9b3506f6a4a89d775e76 [1,0,0,1,0,0|2,0,0]=4 14889 B11R1.18 CCCCC1CCCN1CC 6c3b253cd7b75c3fe3c15ee12418cb92 [1,0,0,1,0,0|1,0,0]=3 14890 B11R1.18 CCCCC1CCCN1CF 5cdfbd32970a08a4b1b0fbab3273a0a3 [1,0,0,1,0,0|2,0,0]=4 14891 B11R1.18 CCCCC1CCCN1CO 1152907f1020b8b4004dacf8ec4bab60 [1,0,0,1,0,0|1,0,0]=3 14892 B11R1.18 CCCCN1CCCC1CC 78cb241f46461735c4b5f7893f213a25 [1,0,0,1,0,0|1,0,0]=3 14893 B11R1.18 CCCCN1CCCC1CO 83d221fbb3b16ae3b7a08929ebb75712 [1,0,0,1,0,0|1,0,0]=3 14894 B11R1.18 CCCCN1CCCC1OC b5515402d1dba298d756934586663141 [1,0,0,1,0,0|2,0,0]=4 14895 B11R1.18 CCCCN1CCC[C@@H]1CF ed4b5efaa82b0b2287979c8159b96702 [1,0,0,1,0,0|2,0,0]=4 14896 B11R1.18 CCCCN1CCC[C@@H]1CO 2ab854d0a1cd0494d03c2c9c60b4dd9d [1,0,0,1,0,0|1,0,0]=3 14897 B11R1.18 CCCCN1CCC[C@H]1CC 7302ac816375b5c29fea5606915b75ef [1,0,0,1,0,0|1,0,0]=3 14898 B11R1.18 CCCCN1CCC[C@H]1CF 068bf3df02e4d6d35cf8e857f3a10dc0 [1,0,0,1,0,0|2,0,0]=4 14899 B11R1.18 CCCCN1CCC[C@H]1CO 9a57a266850776285275dd1df46f1f8a [1,0,0,1,0,0|1,0,0]=3 14900 B11R1.18 CCCNC1CCCC1OC 4a4d42594c9c70c0f4af50374a59c588 [1,0,0,1,0,0|2,0,0]=4 14901 B11R1.18 CCCNC1COCC1CO b5f91df61c9c9967f1db011c031bb7c6 [1,0,0,1,0,0|2,0,0]=4 14902 B11R1.18 CCCN[C@@H]1CCC[C@H]1CC 0260a219c7a0da72fd07ddc4b096af94 [1,0,0,1,0,0|1,0,0]=3 14903 B11R1.18 CCCN[C@@H]1CCC[C@H]1OC 0282ae25478cb29cdb88d20c4493395a [1,0,0,1,0,0|2,0,0]=4 14904 B11R1.18 CCCN[C@@H]1COC[C@H]1CO d776c96b7c8916e06cbf44cf26f1f6be [1,0,0,1,0,0|2,0,0]=4 14905 B11R1.18 CCCN[C@H]1CCC[C@@H]1OC fc37b734cdfa3f5b94730d4e63a20a5e [1,0,0,1,0,0|2,0,0]=4 14906 B11R1.18 CCCN[C@H]1CCC[C@H]1CO 7f9e01219e173aa81717ebe34fce9daa [1,0,0,1,0,0|1,0,0]=3 14907 B11R1.18 CCCN[C@H]1CCC[C@H]1OC d32e2c12eb805ff51198e6332d46549e [1,0,0,1,0,0|2,0,0]=4 14908 B11R1.18 CCCN[C@H]1CSC[C@@H]1CO 0f08aabc4755175334f2025ac3cfde4e [1,0,0,1,0,0|2,0,0]=4 14909 B11R1.18 CCN1CCCC1CCOC 46a40520f50594f14badb67028c0d59d [1,0,0,1,0,0|2,0,0]=4 14910 B11R1.18 CCN1CCCC1CNCO 762a80a16412307b26b04ed667ee3258 [1,0,0,1,0,0|2,0,0]=4 14911 B11R1.18 CCN1CCC[C@@H]1CNCO 817e83fb64ac98dcea64e04b5a88b307 [1,0,0,1,0,0|2,0,0]=4 14912 B11R1.18 CCN1CCC[C@H]1CNCO 4017dd6a61954f4bff979379e54ee843 [1,0,0,1,0,0|2,0,0]=4 14913 B11R1.18 CCNCC1CCCN1CC 0ff1febe60c0bf01e2ce73ddb578bc76 [1,0,0,1,0,0|2,0,0]=4 14914 B11R1.18 CCNC[C@@H]1CCCN1CC 0ebae2c6ec60fd0bcda12e41e464e721 [1,0,0,1,0,0|2,0,0]=4 14915 B11R1.18 CCNC[C@H]1CCCN1CC e56cbe7305a797299abd6a7d6954b516 [1,0,0,1,0,0|2,0,0]=4 14916 B11R1.18 CCOCC1CCCN1CC 63eaf6371cc1d623ecd9b1f45daa79d7 [1,0,0,1,0,0|2,0,0]=4 14917 B11R1.18 CCOCC1CCCN1CO 2979feb73072f1b46b351e7db02d866a [1,0,0,1,0,0|2,0,0]=4 14918 B11R1.18 CCOCN1CCCC1CC 2e675f14b8bdcafe750642720a7f83b1 [1,0,0,1,0,0|2,0,0]=4 14919 B11R1.18 CCOCN1CCCC1CO 04555f4efc17fa26eaec7b83d6ffbf05 [1,0,0,1,0,0|2,0,0]=4 14920 B11R1.18 CCOCN1CCC[C@@H]1CO 227f596d458ca3c002f8b2bcd5a50906 [1,0,0,1,0,0|2,0,0]=4 14921 B11R1.18 CCOCN1CCC[C@H]1CC 582b386fa8a483743b5c4ace2600dbf3 [1,0,0,1,0,0|2,0,0]=4 14922 B11R1.18 CCOCN1CCC[C@H]1CO 6a2bbfc71ce8c181e76fa03ce55f5a34 [1,0,0,1,0,0|2,0,0]=4 14923 B11R1.18 CCOC[C@@H]1CCCN1CC 1a02705649771ca6d1693c2774ec93e7 [1,0,0,1,0,0|2,0,0]=4 14924 B11R1.18 CCOC[C@@H]1CCCN1CO dcf7a810c3982b1ea2652a379201edd4 [1,0,0,1,0,0|2,0,0]=4 14925 B11R1.18 CCOC[C@H]1CCCN1CC e09e9d26cf53735b74b4c7e251988bad [1,0,0,1,0,0|2,0,0]=4 14926 B11R1.18 CC[C@@H]1CCCN1CCCF 4777899e64c15d296164ac13d8b8b6ff [1,0,0,1,0,0|2,0,0]=4 14927 B11R1.18 CC[C@@H]1CCCN1CCCO 5b187df5386c82d4eca96fb746f1d513 [1,0,0,1,0,0|1,0,0]=3 14928 B11R1.18 CC[C@@H]1CCCN1CCCS ed45753523164271dc7c2f733bfcc206 [1,0,0,1,0,0|1,1,0]=4 14929 B11R1.18 CC[C@@H]1CCCN1CCOC 9bc6faf71565a7e86f8a07138c80ac44 [1,0,0,1,0,0|2,0,0]=4 14930 B11R1.18 CC[C@@H]1CCCN1CCSC e7b4bc4491a228bf9d7494d0910aca92 [1,0,0,1,0,0|2,0,0]=4 14931 B11R1.18 CC[C@@H]1CCC[C@H]1NCCF b540f5586db9732318e8c3afe108fab7 [1,0,0,1,0,0|2,0,0]=4 14932 B11R1.18 CC[C@@H]1CCC[C@H]1NCCO 41cde81dbb377171e1bff224d9430c1b [1,0,0,1,0,0|1,0,0]=3 14933 B11R1.18 CC[C@@H]1CCC[C@H]1NCCS 6f43b360dc48174781724acca897e8a3 [1,0,0,1,0,0|1,1,0]=4 14934 B11R1.18 CC[C@@H]1CCC[C@H]1NCOC bb512839be67debe40d9bc15d4c54e52 [1,0,0,1,0,0|2,0,0]=4 14935 B11R1.18 CC[C@@H]1CCC[C@H]1NCSC 82c72da68c76cb55d91190a3da96558b [1,0,0,1,0,0|2,0,0]=4 14936 B11R1.18 COC1CCCC1NCCO e7eef39e4454f565b97f8f95bc0345fb [1,0,0,1,0,0|2,0,0]=4 14937 B11R1.18 COC1CCCN1CCCO 5d512acbd487f9802e5cf5c167c5d5e9 [1,0,0,1,0,0|2,0,0]=4 14938 B11R1.18 COCCC1CCCN1CO 8fc35a41be30252d963f426c02be7bb2 [1,0,0,1,0,0|2,0,0]=4 14939 B11R1.18 COCCN1CCCC1CO d7f8a8669cb733cbeaa74a9c121c464b [1,0,0,1,0,0|2,0,0]=4 14940 B11R1.18 COCCN1CCC[C@@H]1CO a91c45185a1df7c59dd4d64b19277536 [1,0,0,1,0,0|2,0,0]=4 14941 B11R1.18 COCCN1CCC[C@H]1CO 2df5284a87488b598dfeaa2124c9e9f1 [1,0,0,1,0,0|2,0,0]=4 14942 B11R1.18 COCN[C@H]1CCC[C@H]1CO 8974a63b470386e2260c208d40bc988f [1,0,0,1,0,0|2,0,0]=4 14943 B11R1.18 CO[C@@H]1CCC[C@@H]1NCCO f39340315db1625bb54015b2d5a98333 [1,0,0,1,0,0|2,0,0]=4 14944 B11R1.18 CO[C@@H]1CCC[C@H]1NCCO d18bee00fb237a7d226d7cc9f83a94be [1,0,0,1,0,0|2,0,0]=4 14945 B11R1.18 CO[C@H]1CCC[C@@H]1NCCO 5ee274e9493aa5dd0ff692972494a16c [1,0,0,1,0,0|2,0,0]=4 14946 B11R1.18 CSCCN1CCCC1CO a68ce511de55c6bb378a8b12532fc853 [1,0,0,1,0,0|2,0,0]=4 14947 B11R1.18 CSCCN1CCC[C@@H]1CO cc138692fa9b020a24d4ea99754845dd [1,0,0,1,0,0|2,0,0]=4 14948 B11R1.18 CSCCN1CCC[C@H]1CO dc65382b6f6b63c94dce5a05a8b33841 [1,0,0,1,0,0|2,0,0]=4 14949 B11R1.18 CSCN[C@H]1CCC[C@H]1CO 1c5be29f4d9f3de2dcf145a5786f2e41 [1,0,0,1,0,0|2,0,0]=4 14950 B11R1.18 OCC1CCCN1CCCF 827b1bd6e7d0ade575e24a0b69acb85b [1,0,0,1,0,0|2,0,0]=4 14951 B11R1.18 OCC1CCCN1CCCS 7986f335e722bfc6f5d846cad0980bd0 [1,0,0,1,0,0|2,0,0]=4 14952 B11R1.18 OCCCN1CCCC1CO 0439a7dc011b26b9f65f19d759b20754 [1,0,0,1,0,0|2,0,0]=4 14953 B11R1.18 OCCCN1CCC[C@@H]1CF 2009836a05efef616044caa23373f1a9 [1,0,0,1,0,0|2,0,0]=4 14954 B11R1.18 OCCCN1CCC[C@@H]1CO f3156266c1a9cc30c73a318cf336afa3 [1,0,0,1,0,0|2,0,0]=4 14955 B11R1.18 OCCCN1CCC[C@H]1CF 625840f6494e921c41c14cb2742ef04a [1,0,0,1,0,0|2,0,0]=4 14956 B11R1.18 OCCCN1CCC[C@H]1CO 40ae0f4e3389c38ace747d5c8ea09944 [1,0,0,1,0,0|2,0,0]=4 14957 B11R1.18 OCCN[C@H]1CCC[C@H]1CO cd4249355223dc9bd82973f2b1c6e2f8 [1,0,0,1,0,0|2,0,0]=4 14958 B11R1.18 OC[C@@H]1CCCN1CCCF 65b6ab8a773fb6fa9e2af11d51815df6 [1,0,0,1,0,0|2,0,0]=4 14959 B11R1.18 OC[C@@H]1CCCN1CCCS 32ebb530b94776b99e5df08f64816f80 [1,0,0,1,0,0|2,0,0]=4 14960 B11R1.18 OC[C@@H]1CCC[C@@H]1NCCF ad332586c7ad6e26477308862dd6054b [1,0,0,1,0,0|2,0,0]=4 14961 B11R1.18 OC[C@@H]1CCC[C@@H]1NCCS b54ccce5ad248e07d605f712ad9aef7e [1,0,0,1,0,0|2,0,0]=4 14962 B11R1.18 OC[C@H]1CCCN1CCCF b175862144faa9a51f5dcf0644ea0937 [1,0,0,1,0,0|2,0,0]=4 14963 B11R1.18 OC[C@H]1CCCN1CCCS 8cebd9ae876f5411d84fae91af9ee2e6 [1,0,0,1,0,0|2,0,0]=4 14964 B11R1.28 BrCCNCC1CCCCC1 24933cf29df25ceb43a974451b0e6e6c [1,0,0,1,0,0|2,0,0]=4 14965 B11R1.28 BrCCNCC1CCCCO1 9e5564589df03bba40836a6d2f4e2bd2 [1,0,0,1,0,0|2,0,0]=4 14966 B11R1.28 CCCCCN1CCCOC1 79f9dd929b5ac021a5a0f57a392f6c1b [1,0,0,1,0,0|2,0,0]=4 14967 B11R1.28 CCCCCN1CCCSC1 c4d03306acc5a58e915560b33411cb8e [1,0,0,1,0,0|2,0,0]=4 14968 B11R1.28 CCCCCN1CCOCC1 a720ae151cb2f85d45ba6a38cacf446b [1,0,0,1,0,0|2,0,0]=4 14969 B11R1.28 CCCCCN1CCSCC1 18feed15648bed4e1008e5f9e8ce122f [1,0,0,1,0,0|2,0,0]=4 14970 B11R1.28 CCCCNC1CCCCC1 081506d55ac6f6089148e671a66a8336 [1,0,0,1,0,0|1,0,0]=3 14971 B11R1.28 CCCCNC1CCCCO1 3bd035030ae808d12bab4c5cba6dcb1f [1,0,0,1,0,0|1,0,0]=3 14972 B11R1.28 CCCCNC1CCCOC1 b4de02ce2074c2109061868e26fac7b6 [1,0,0,1,0,0|2,0,0]=4 14973 B11R1.28 CCCCNC1CCOCC1 25be351f4cc2d9f9dd697e062f604dde [1,0,0,1,0,0|2,0,0]=4 14974 B11R1.28 CCCCNC1CCSCC1 0e951c0daaea7be4d4d95e10c0a52583 [1,0,0,1,0,0|2,0,0]=4 14975 B11R1.28 CCCCN[C@@H]1CCCOC1 83cc5a166182fbc7792295bf5344d9b0 [1,0,0,1,0,0|2,0,0]=4 14976 B11R1.28 CCCCN[C@H]1CCCOC1 540d94e71ee3c1b178e7733fa3780384 [1,0,0,1,0,0|2,0,0]=4 14977 B11R1.28 CCCCOC1CCCCC1 f5bd8d5f1c876320c48af2302e4c3043 [1,0,0,1,0,0|1,0,0]=3 14978 B11R1.28 CCCCOC1CCCCO1 876a79fef12cc68fcbedfbd209aaa824 [1,0,0,1,0,0|1,0,0]=3 14979 B11R1.28 CCCCOC1CCCOC1 b965f0a69b783a538a209e81db495746 [1,0,0,1,0,0|2,0,0]=4 14980 B11R1.28 CCCCOC1CCCSC1 d2154f649ac030f2f81aff751bce0e92 [1,0,0,1,0,0|2,0,0]=4 14981 B11R1.28 CCCCOC1CCOCC1 2c5700fee9a0f081ce7c3e2b031ac7d4 [1,0,0,1,0,0|2,0,0]=4 14982 B11R1.28 CCCCOC1CCSCC1 33d373d9ee529d2dbbc9a9e28861aac1 [1,0,0,1,0,0|2,0,0]=4 14983 B11R1.28 CCCCO[C@@H]1CCCOC1 76b964cddf72514bedf80202ed3e7a06 [1,0,0,1,0,0|2,0,0]=4 14984 B11R1.28 CCCCO[C@H]1CCCOC1 9f7a3bf7e5b7e495c6b0685f6ef9d2d9 [1,0,0,1,0,0|2,0,0]=4 14985 B11R1.28 CCCNCC1CCCCC1 d57d75a8c5a99c98c9e00aaf0dac4e8e [1,0,0,1,0,0|1,0,0]=3 14986 B11R1.28 CCCNCC1CCCCO1 fe32d4ffbdc5749c38e47cf869213fa5 [1,0,0,1,0,0|1,0,0]=3 14987 B11R1.28 CCCNCC1CCCOC1 67d90b054c31d898f4946882df762eb2 [1,0,0,1,0,0|2,0,0]=4 14988 B11R1.28 CCCNCC1CCOCC1 923272e434247a2e6ddd74e94ac9c385 [1,0,0,1,0,0|2,0,0]=4 14989 B11R1.28 CCCNCC1CCSCC1 4a04a7f7c93098e0e4d7270a1d3f7caa [1,0,0,1,0,0|2,0,0]=4 14990 B11R1.28 CCCNCC1COCCO1 ed3557b82f8e084d504cdedb116e42d8 [1,0,0,1,0,0|2,0,0]=4 14991 B11R1.28 CCCNC[C@@H]1CCCOC1 d9e4e27e5401c0756a055952e9b2275d [1,0,0,1,0,0|2,0,0]=4 14992 B11R1.28 CCCNC[C@H]1CCCOC1 96507b1af994998589d4527a37dcf9f0 [1,0,0,1,0,0|2,0,0]=4 14993 B11R1.28 CCCNC[C@H]1COCCO1 76f9b05e4c1d6229a6a7e19c907faf38 [1,0,0,1,0,0|2,0,0]=4 14994 B11R1.28 CCCOCC1CCCCC1 a40e97204a11eb00ef961e0329142e58 [1,0,0,1,0,0|1,0,0]=3 14995 B11R1.28 CCCOCC1CCCCO1 90f98ba9e9eadc1d9df337afb14e5eef [1,0,0,1,0,0|1,0,0]=3 14996 B11R1.28 CCCOCC1CCCOC1 bc76e5d72680f980fe3e82eb083b157e [1,0,0,1,0,0|2,0,0]=4 14997 B11R1.28 CCCOCC1CCOCC1 3229f1aa26cacbd34eaf1ba6443a14eb [1,0,0,1,0,0|2,0,0]=4 14998 B11R1.28 CCCOCC1CCSCC1 d6dbd4199228a9dc0915dbaecf7046d9 [1,0,0,1,0,0|2,0,0]=4 14999 B11R1.28 CCCOCC1COCCO1 d373cb86d24bc03b4f5de11ba9c8dd0b [1,0,0,1,0,0|2,0,0]=4 15000 B11R1.28 CCCOC[C@@H]1CCCCO1 20a5d3e0feb8c992886908978ec6f96d [1,0,0,1,0,0|1,0,0]=3 15001 B11R1.28 CCCOC[C@@H]1CCCOC1 24a0567a60a59f6a00220b24c33e7478 [1,0,0,1,0,0|2,0,0]=4 15002 B11R1.28 CCCOC[C@@H]1COCCO1 399dd8b05ea70e6a33ab405f8465f1ec [1,0,0,1,0,0|2,0,0]=4 15003 B11R1.28 CCCOC[C@H]1CCCCO1 6cb49fd295b71bf392a373607d504cfc [1,0,0,1,0,0|1,0,0]=3 15004 B11R1.28 CCCOC[C@H]1CCCOC1 85e9a301351c961de50f44cf9c85bb85 [1,0,0,1,0,0|2,0,0]=4 15005 B11R1.28 CCCOC[C@H]1COCCO1 61da58f2af21a43cf6549adc8199e648 [1,0,0,1,0,0|2,0,0]=4 15006 B11R1.28 CCNCCC1CCCCC1 2e867833c56674d23036d88c814c9550 [1,0,0,1,0,0|1,0,0]=3 15007 B11R1.28 CCNCCC1CCCCO1 0514cc2009abea27205eb2d4527ea2a3 [1,0,0,1,0,0|1,0,0]=3 15008 B11R1.28 CCNCCC1CCCOC1 97eeccda4adb42457b18a5a9b4a8e19b [1,0,0,1,0,0|2,0,0]=4 15009 B11R1.28 CCNCCC1CCOCC1 3ecda4850b06fd9ef45d681b61acee92 [1,0,0,1,0,0|2,0,0]=4 15010 B11R1.28 CCNCCC1CCSCC1 5f49c19144487c6829e2937530c700d3 [1,0,0,1,0,0|2,0,0]=4 15011 B11R1.28 CCNCCC1COCCO1 43d21b9749475a28ebf4e260baab8d3d [1,0,0,1,0,0|2,0,0]=4 15012 B11R1.28 CCNCCN1CCCCC1 965f48ba0b732fa74a0c7768fe79cfc2 [1,0,0,1,0,0|2,0,0]=4 15013 B11R1.28 CCOCCC1CCCCC1 41db2982246c499a6c04bf31353c607f [1,0,0,1,0,0|1,0,0]=3 15014 B11R1.28 CCOCCC1CCCCO1 0eb2e7b6ffe2601ad6e04d63bcdae13d [1,0,0,1,0,0|1,0,0]=3 15015 B11R1.28 CCOCCC1CCOCC1 1d8792aa07e80f216ca0378a44550a62 [1,0,0,1,0,0|2,0,0]=4 15016 B11R1.28 CCOCCC1CCSCC1 2e442cb80bdc2d978aed94b4b74ee4b0 [1,0,0,1,0,0|2,0,0]=4 15017 B11R1.28 CCOCCC1COCCO1 a0f15d9fb996534b4cdb5208ddc95c47 [1,0,0,1,0,0|2,0,0]=4 15018 B11R1.28 CCOCCN1CCCCC1 8eda9c4e0637b98680d02f19e5d66e30 [1,0,0,1,0,0|2,0,0]=4 15019 B11R1.28 CCOCC[C@@H]1COCCO1 af7c6d7fe58ce08ff7c192e8f2109968 [1,0,0,1,0,0|2,0,0]=4 15020 B11R1.28 CCOCC[C@H]1COCCO1 2c3e5d7679458cacfefb08b815331ec5 [1,0,0,1,0,0|2,0,0]=4 15021 B11R1.28 CCOCOC1CCCCC1 bce8c02398227889de43c612ff29ff76 [1,0,0,1,0,0|2,0,0]=4 15022 B11R1.28 CCOCOC1CCCCO1 0f4524c2e8e813e351421dedcc9df42d [1,0,0,1,0,0|2,0,0]=4 15023 B11R1.28 COCCNC1CCCCC1 8a077bd22d51dc37daa212ddc9966b72 [1,0,0,1,0,0|2,0,0]=4 15024 B11R1.28 COCCNC1CCCCO1 bea2b628b27bcf9aab0e592d94fe689c [1,0,0,1,0,0|2,0,0]=4 15025 B11R1.28 COCCOC1CCCCC1 89747c8b73267e9a27e120d58cc56307 [1,0,0,1,0,0|2,0,0]=4 15026 B11R1.28 COCCOC1CCCCO1 aae3bc5c1d62193f2f13eec11013a254 [1,0,0,1,0,0|2,0,0]=4 15027 B11R1.28 COCNCC1CCCCC1 84ad299e5cff9e57ef4201283978b6ba [1,0,0,1,0,0|2,0,0]=4 15028 B11R1.28 COCNCC1CCCCO1 75f74c7e00120e01dfafa6c3099cba08 [1,0,0,1,0,0|2,0,0]=4 15029 B11R1.28 COCOCC1CCCCC1 a2256e490d9ce6f557bed254cd5f15ef [1,0,0,1,0,0|2,0,0]=4 15030 B11R1.28 COCOCC1CCCCO1 abdc3aff433495bd3417250fa96b3f5e [1,0,0,1,0,0|2,0,0]=4 15031 B11R1.28 COCOC[C@@H]1CCCCO1 4c389b580c190708168cdbed880fb514 [1,0,0,1,0,0|2,0,0]=4 15032 B11R1.28 COCOC[C@H]1CCCCO1 29174a6964b3c17a5ab2af6015adccec [1,0,0,1,0,0|2,0,0]=4 15033 B11R1.28 CSCCNC1CCCCC1 7e4b2f9029968206af1e4d6932879c83 [1,0,0,1,0,0|2,0,0]=4 15034 B11R1.28 CSCCNC1CCCCO1 e6e1a4c4d0deb561ada7425be0343af2 [1,0,0,1,0,0|2,0,0]=4 15035 B11R1.28 CSCCOC1CCCCC1 22ac0590a2acde06c0b7b58e1c97187f [1,0,0,1,0,0|2,0,0]=4 15036 B11R1.28 CSCCOC1CCCCO1 149c50f1501a789f8c6e7e67569096d1 [1,0,0,1,0,0|2,0,0]=4 15037 B11R1.28 CSCNCC1CCCCC1 7a0112d9d7f0843f2a8e95c448ef7b4b [1,0,0,1,0,0|2,0,0]=4 15038 B11R1.28 CSCNCC1CCCCO1 692feb7ee414c11e2a64f4f94fb38471 [1,0,0,1,0,0|2,0,0]=4 15039 B11R1.28 CSCOCC1CCCCC1 c0e507d9b0b8d0f33654353ab733b4e9 [1,0,0,1,0,0|2,0,0]=4 15040 B11R1.28 CSCOCC1CCCCO1 8e01f9bfd7b853754075c877cc79b9e4 [1,0,0,1,0,0|2,0,0]=4 15041 B11R1.28 CSCOC[C@@H]1CCCCO1 30effe68ec12a71101c3df4d991df6ae [1,0,0,1,0,0|2,0,0]=4 15042 B11R1.28 CSCOC[C@H]1CCCCO1 a3c6230f487104272597aca9b9b68532 [1,0,0,1,0,0|2,0,0]=4 15043 B11R1.28 ClCCCNC1CCCCC1 4a562ae49183dcc672681afa504fe99c [1,0,0,1,0,0|2,0,0]=4 15044 B11R1.28 ClCCCNC1CCCCO1 42fda894494d5481d0e86e19e281c06b [1,0,0,1,0,0|2,0,0]=4 15045 B11R1.28 FCCCOC1CCCCC1 da6d8f04453b061b9af4cd595a01691d [1,0,0,1,0,0|2,0,0]=4 15046 B11R1.28 FCCCOC1CCCCO1 008cb57abe4f539402bb74e74c3949af [1,0,0,1,0,0|2,0,0]=4 15047 B11R1.28 FCCNCC1CCCCC1 5427d4d3480a7bcf4fc771fab34204f7 [1,0,0,1,0,0|2,0,0]=4 15048 B11R1.28 FCCNCC1CCCCO1 8a0b45a6ec02c577180a0e976ef9a2a3 [1,0,0,1,0,0|2,0,0]=4 15049 B11R1.28 FCCOCC1CCCCC1 72eea73dfa6eadd6da2ce328c0a192c0 [1,0,0,1,0,0|2,0,0]=4 15050 B11R1.28 FCCOCC1CCCCO1 12c3d7e4501cabab4113070366eb5398 [1,0,0,1,0,0|2,0,0]=4 15051 B11R1.28 FCCOC[C@@H]1CCCCO1 9b448c6463fff37a51b6fc8419c662ab [1,0,0,1,0,0|2,0,0]=4 15052 B11R1.28 FCCOC[C@H]1CCCCO1 3472adcec135aff3b4a29d5aa3cf27bc [1,0,0,1,0,0|2,0,0]=4 15053 B11R1.28 FCNCCC1CCCCC1 5bdf27448e2514e957a1dd6b1e39977e [1,0,0,1,0,0|2,0,0]=4 15054 B11R1.28 FCNCCC1CCCCO1 6266a434236976df09ce0cddacdb85f2 [1,0,0,1,0,0|2,0,0]=4 15055 B11R1.28 FCOCCC1CCCCC1 47d5c12944f0e4db7a16d1e5b9471e6e [1,0,0,1,0,0|2,0,0]=4 15056 B11R1.28 FCOCCC1CCCCO1 ddd1b9bd831f5b4fd11b7c0ee52267ac [1,0,0,1,0,0|2,0,0]=4 15057 B11R1.28 ICCNCC1CCCCC1 5c536d95b0515c5d732fd425d1673036 [1,0,0,1,0,0|2,0,0]=4 15058 B11R1.28 ICCNCC1CCCCO1 efa608e09b31198b922d44a083c5a3e1 [1,0,0,1,0,0|2,0,0]=4 15059 B11R1.28 OCCCCN1CCCOC1 f0484e3c52a4a1e2d4e9dfaba391719c [1,0,0,1,0,0|2,0,0]=4 15060 B11R1.28 OCCCCN1CCCSC1 6117e7b6d3e8c3911ab3f3265bb9bd78 [1,0,0,1,0,0|2,0,0]=4 15061 B11R1.28 OCCCCN1CCOCC1 14a76811f2f3d90f7f5007e432f4f8dd [1,0,0,1,0,0|2,0,0]=4 15062 B11R1.28 OCCCCN1CCSCC1 303c85218b40a9e08cda2f9e895846e9 [1,0,0,1,0,0|2,0,0]=4 15063 B11R1.28 OCCCNC1CCCCC1 11a7a7781105afae04cf0eaaf16b5aa1 [1,0,0,1,0,0|1,0,0]=3 15064 B11R1.28 OCCCNC1CCCCO1 4762660d5ae75f80da5d9ce6c70081cf [1,0,0,1,0,0|2,0,0]=4 15065 B11R1.28 OCCCNC1CCCOC1 b1f7bc488d32b93040e6bd0a89609a77 [1,0,0,1,0,0|2,0,0]=4 15066 B11R1.28 OCCCNC1CCOCC1 8a6c1391b01d3cf9df09265c7f8c2415 [1,0,0,1,0,0|2,0,0]=4 15067 B11R1.28 OCCCNC1CCSCC1 f5caedaa47061e8c3f24ff0b707ecd72 [1,0,0,1,0,0|2,0,0]=4 15068 B11R1.28 OCCCN[C@@H]1CCCOC1 707326e9227cb0d0c4397bec6dba8007 [1,0,0,1,0,0|2,0,0]=4 15069 B11R1.28 OCCCN[C@H]1CCCOC1 3adaa45a7d05186aa6105f96c1a230eb [1,0,0,1,0,0|2,0,0]=4 15070 B11R1.28 OCCNCC1CCCCC1 e116e6fe6cf50ae26cbc6aa1c79b1b6b [1,0,0,1,0,0|1,0,0]=3 15071 B11R1.28 OCCNCC1CCCCO1 39c6bfe66df72ec97acad7889c1eb1d0 [1,0,0,1,0,0|2,0,0]=4 15072 B11R1.28 OCCNCC1CCCOC1 fb2b9f4e981ba78ddb463fffb4cb7159 [1,0,0,1,0,0|2,0,0]=4 15073 B11R1.28 OCCNCC1CCOCC1 afe79867da476a714b31515bc679fb81 [1,0,0,1,0,0|2,0,0]=4 15074 B11R1.28 OCCNCC1CCSCC1 88312dc63681f282ef64dade49b16d4d [1,0,0,1,0,0|2,0,0]=4 15075 B11R1.28 OCCNC[C@@H]1CCCOC1 24c46c65bf804fb63b6a8c4fab11fc2a [1,0,0,1,0,0|2,0,0]=4 15076 B11R1.28 OCCNC[C@H]1CCCOC1 938221bafde0efe302d62a04559bc024 [1,0,0,1,0,0|2,0,0]=4 15077 B11R1.28 OCNCCC1CCCCC1 5efc6e566b59ea85b5b691a2ceb88c55 [1,0,0,1,0,0|1,0,0]=3 15078 B11R1.28 OCNCCC1CCCCO1 2f862ebddde7e04bf751de49873bbb87 [1,0,0,1,0,0|2,0,0]=4 15079 B11R1.28 OCNCCC1CCCOC1 158fed6a57c4a46847cd3009200dc6c3 [1,0,0,1,0,0|2,0,0]=4 15080 B11R1.28 OCNCCC1CCOCC1 79f3f7e59929806d9714500e860e6963 [1,0,0,1,0,0|2,0,0]=4 15081 B11R1.28 OCNCCC1CCSCC1 3c1c0d1cb16132a52d5c1c2162fee760 [1,0,0,1,0,0|2,0,0]=4 15082 B11R1.28 OCNCCN1CCCCC1 5e5ae65c4abb32c7764f203f3ec93ad2 [1,0,0,1,0,0|2,0,0]=4 15083 B11R1.28 SCCCOC1CCCCC1 da2c6989cda21de68fbeb93b91e0ede6 [1,0,0,1,0,0|1,1,0]=4 15084 B11R1.28 SCCCOC1CCCCO1 c9b93223355c1e89e9d5baebd311e1f8 [1,0,0,1,0,0|2,0,0]=4 15085 B11R1.28 SCCNCC1CCCCC1 c091d9eb02ff0501e904ed06adb366a3 [1,0,0,1,0,0|1,1,0]=4 15086 B11R1.28 SCCNCC1CCCCO1 0b8d80fee57c076ceedea484dbd628b6 [1,0,0,1,0,0|2,0,0]=4 15087 B11R1.28 SCCOCC1CCCCC1 b675c36dd959cef4731af5e4a01c12fe [1,0,0,1,0,0|1,1,0]=4 15088 B11R1.28 SCCOCC1CCCCO1 86aa807ab484b9f23e5f277d7f7abbcb [1,0,0,1,0,0|2,0,0]=4 15089 B11R1.28 SCCOC[C@@H]1CCCCO1 3663e7beeaf311a325d64bf56f1e650f [1,0,0,1,0,0|2,0,0]=4 15090 B11R1.28 SCCOC[C@H]1CCCCO1 d6b15e9d088711ec46e2651cdf37fc89 [1,0,0,1,0,0|2,0,0]=4 15091 B11R1.41 CCC1CCCCC1OCF 1cd08105dd638695cc6af1465a6af2c4 [1,0,0,1,0,0|2,0,0]=4 15092 B11R1.41 CCC1CCCCN1CCF 4d39270bcb63aea79c2b0ec2e0a8a338 [1,0,0,1,0,0|2,0,0]=4 15093 B11R1.41 CCC1CCCCN1CCO 0401c5f429c790b76a4d5dfa63345bf3 [1,0,0,1,0,0|1,0,0]=3 15094 B11R1.41 CCC1CCCCN1CCS 3efaebcd49209a267fc05e11c1d329e8 [1,0,0,1,0,0|1,1,0]=4 15095 B11R1.41 CCC1CCCCN1COC c830fe20ea9bdbe509ff6e6030a6a99d [1,0,0,1,0,0|2,0,0]=4 15096 B11R1.41 CCC1CCCCN1CSC 3cc41bde65462484156be3a933dd6265 [1,0,0,1,0,0|2,0,0]=4 15097 B11R1.41 CCC1COCCC1NCO acdfd98bc489df6f183759ec4320cf0a [1,0,0,1,0,0|2,0,0]=4 15098 B11R1.41 CCC1COCCN1CCO 1df80e36b7411083461282314e6372f4 [1,0,0,1,0,0|2,0,0]=4 15099 B11R1.41 CCCC1COCCN1CC 177a112a975bb40fa5605e74479a2fab [1,0,0,1,0,0|2,0,0]=4 15100 B11R1.41 CCCC1COCCN1CO 29798c431447159d66934e48fab9692d [1,0,0,1,0,0|2,0,0]=4 15101 B11R1.41 CCCN1CCCCC1CC f2435757f1fd18c21601dd2b31d08991 [1,0,0,1,0,0|1,0,0]=3 15102 B11R1.41 CCCN1CCCCC1CO cbdcf5ac41b8638f32db05ab0071fc53 [1,0,0,1,0,0|1,0,0]=3 15103 B11R1.41 CCCN1CCCC[C@@H]1CC a1da9c4facc05a83af6dbc4dddc1c007 [1,0,0,1,0,0|1,0,0]=3 15104 B11R1.41 CCCN1CCCC[C@@H]1CO 81bf1346884b73c414b8ca8dd7de270a [1,0,0,1,0,0|1,0,0]=3 15105 B11R1.41 CCCN1CCCC[C@H]1CC 211bfe4f63afdabf8e93ac5b64213f46 [1,0,0,1,0,0|1,0,0]=3 15106 B11R1.41 CCCN1CCCC[C@H]1CO 634940ce88b6dfc96c3ac67ec2e69e71 [1,0,0,1,0,0|1,0,0]=3 15107 B11R1.41 CCCN1CCOCC1CC 976c9f74976ccbb85c65835b77253721 [1,0,0,1,0,0|2,0,0]=4 15108 B11R1.41 CCCN1CCOCC1CO 6dc2f960e2f53c9f2d72d6ad879bd0df [1,0,0,1,0,0|2,0,0]=4 15109 B11R1.41 CCCN1CCOC[C@@H]1CC 51af9da65d34ccb85f92a8e8e609687b [1,0,0,1,0,0|2,0,0]=4 15110 B11R1.41 CCCN1CCOC[C@@H]1CO 30a3a481eb4906f1d484ee5728ab755a [1,0,0,1,0,0|2,0,0]=4 15111 B11R1.41 CCCN1CCOC[C@H]1CC 742ea737b16f28dca9357fd1b74dd02e [1,0,0,1,0,0|2,0,0]=4 15112 B11R1.41 CCCN1CCOC[C@H]1CO c0a7f8966a0a279e927dedf6e9f6eb3f [1,0,0,1,0,0|2,0,0]=4 15113 B11R1.41 CCN1CCCCC1CCCl 6249b2f2be46d1cb832663b2c9acde5a [1,0,0,1,0,0|2,0,0]=4 15114 B11R1.41 CCN1CCCCC1CCO b9f5cf9d4760ab3b20f8fc4f4bd6c46c [1,0,0,1,0,0|1,0,0]=3 15115 B11R1.41 CCN1CCCCC1COC 973d2a499a91fa439c051ca01a6d422e [1,0,0,1,0,0|2,0,0]=4 15116 B11R1.41 CCN1CCCC[C@@H]1CCO 40c75c3fe5c226eb0c040626ccf3ce44 [1,0,0,1,0,0|1,0,0]=3 15117 B11R1.41 CCN1CCCC[C@H]1CCO 8281549c53ce644ed205bf54245ed833 [1,0,0,1,0,0|1,0,0]=3 15118 B11R1.41 CCNC1CCCCC1OC 399eacd217d9e2b01936b1db37753c6f [1,0,0,1,0,0|2,0,0]=4 15119 B11R1.41 CCNC1CCOCC1CC a0788cf5023e9650f9f81209af942bae [1,0,0,1,0,0|2,0,0]=4 15120 B11R1.41 CCNC1CCOCC1CO 1d0cc59bb6964267330b6ae30ff8127a [1,0,0,1,0,0|2,0,0]=4 15121 B11R1.41 CCN[C@@H]1CCCC[C@@H]1CO 428345999db4a73120dd9126a2d5dc20 [1,0,0,1,0,0|1,0,0]=3 15122 B11R1.41 CCN[C@@H]1CCCC[C@H]1CO 220b704f10481bbeec7d5a9df2e4beb3 [1,0,0,1,0,0|1,0,0]=3 15123 B11R1.41 CCN[C@@H]1CCOC[C@@H]1CO 0a2c99441cbdb636fa3fd2b6f098d6ad [1,0,0,1,0,0|2,0,0]=4 15124 B11R1.41 CCN[C@H]1CCCC[C@@H]1OC 5616abdabadf3f4916ce17e41db4c8af [1,0,0,1,0,0|2,0,0]=4 15125 B11R1.41 CCN[C@H]1CCCC[C@H]1CO 2aa408ffb74a00ab65ee745d9718ff38 [1,0,0,1,0,0|1,0,0]=3 15126 B11R1.41 CCOC1CCCCC1CC 810042b55fdd81b47fd5fb695851c34e [1,0,0,1,0,0|1,0,0]=3 15127 B11R1.41 CCOC1CCCCC1OC b532451a5bdbf718fe078517509cf76d [1,0,0,1,0,0|2,0,0]=4 15128 B11R1.41 CCO[C@@H]1CCCC[C@H]1SC 2993473c789d05460b7803f356cbcc00 [1,0,0,1,0,0|2,0,0]=4 15129 B11R1.41 CC[C@@H]1CCCCN1CCF fb86463cd95f58884af69ac60bd1231b [1,0,0,1,0,0|2,0,0]=4 15130 B11R1.41 CC[C@@H]1CCCCN1CCO 31c74c02e02d1431ecaa933f030f1164 [1,0,0,1,0,0|1,0,0]=3 15131 B11R1.41 CC[C@@H]1CCCCN1CCS 2c417a3d758fff453b54dd0128a3cafc [1,0,0,1,0,0|1,1,0]=4 15132 B11R1.41 CC[C@@H]1CCCCN1COC 7ddbc4f926a6b73ff2a6d516efef45f3 [1,0,0,1,0,0|2,0,0]=4 15133 B11R1.41 CC[C@@H]1CCCCN1CSC ac4459213f2066e71d994ea429cbfaea [1,0,0,1,0,0|2,0,0]=4 15134 B11R1.41 CC[C@@H]1COCCN1CCO 812e89620767426003e3e091e92d21f7 [1,0,0,1,0,0|2,0,0]=4 15135 B11R1.41 CC[C@H]1CCCCN1CCF 94d1be321aa7ab88a74249a2dce41f9d [1,0,0,1,0,0|2,0,0]=4 15136 B11R1.41 CC[C@H]1CCCCN1CCO 4087292e87a1b50826328ff916748508 [1,0,0,1,0,0|1,0,0]=3 15137 B11R1.41 CC[C@H]1CCCCN1CCS 43db613ac849735db72f158230c17e69 [1,0,0,1,0,0|1,1,0]=4 15138 B11R1.41 CC[C@H]1CCCCN1COC 9f247d4e5f4aa41942bca5b0938560db [1,0,0,1,0,0|2,0,0]=4 15139 B11R1.41 CC[C@H]1CCCCN1CSC 2936729c15c3de3873feeebefcab4d9a [1,0,0,1,0,0|2,0,0]=4 15140 B11R1.41 CC[C@H]1COCCN1CCO 4af2b42b961eba399c0ca74443dd7b79 [1,0,0,1,0,0|2,0,0]=4 15141 B11R1.41 COC1CCCCC1NCO 39c2ec1814672e97624f63cda7264e5a [1,0,0,1,0,0|2,0,0]=4 15142 B11R1.41 COCC1CCCCN1CO 0e5f163e03ff4bc2694988574041429a [1,0,0,1,0,0|2,0,0]=4 15143 B11R1.41 COCN1CCCCC1CO f8163689cb72a0593839ac560246a899 [1,0,0,1,0,0|2,0,0]=4 15144 B11R1.41 COCN1CCCC[C@@H]1CO e97ed5c4884d509f5c1b5afe0ea72bbc [1,0,0,1,0,0|2,0,0]=4 15145 B11R1.41 COCN1CCCC[C@H]1CO d25c9b2365ec5c5b8aa4bc2fab4a97fd [1,0,0,1,0,0|2,0,0]=4 15146 B11R1.41 CO[C@H]1CCCC[C@@H]1NCO f3747a3b58ec8a8552a2292d45208515 [1,0,0,1,0,0|2,0,0]=4 15147 B11R1.41 CSCN1CCCCC1CO 294a4fda453a501d9d3cbb0b5a5dab4e [1,0,0,1,0,0|2,0,0]=4 15148 B11R1.41 CSCN1CCCC[C@@H]1CO 4724cee81561fe79a4a7bd3ebcebdc56 [1,0,0,1,0,0|2,0,0]=4 15149 B11R1.41 CSCN1CCCC[C@H]1CO 4e23d4b5c15c3561ff8d2fc3ae27b331 [1,0,0,1,0,0|2,0,0]=4 15150 B11R1.41 OCC1CCCCN1CCF 619df512f5d41aa92bba3bd40e3d82e3 [1,0,0,1,0,0|2,0,0]=4 15151 B11R1.41 OCC1CCCCN1CCS d5b2a3c0734ff4de7585cafb516033ac [1,0,0,1,0,0|2,0,0]=4 15152 B11R1.41 OCCC1CCCCN1CF c81866b88f5ce62016dfa4e7bfa851c3 [1,0,0,1,0,0|2,0,0]=4 15153 B11R1.41 OCCC1CCCCN1CO 2f9edd733481a2150d5a135430557cd5 [1,0,0,1,0,0|2,0,0]=4 15154 B11R1.41 OCCN1CCCCC1CO f629753f385815aeb5136d85eb1831e5 [1,0,0,1,0,0|2,0,0]=4 15155 B11R1.41 OCCN1CCCC[C@@H]1CO 891efb3f9c78a401616e0a6186d144bd [1,0,0,1,0,0|2,0,0]=4 15156 B11R1.41 OCCN1CCCC[C@H]1CO 9ec77ea142e365939e90dbf34899b16e [1,0,0,1,0,0|2,0,0]=4 15157 B11R1.41 OCC[C@@H]1CCCCN1CF 3cec1d0d31ba96ce6ce8b368a601bfb8 [1,0,0,1,0,0|2,0,0]=4 15158 B11R1.41 OCC[C@@H]1CCCCN1CO 95978ea09d57e2629e9b29a87ff96e33 [1,0,0,1,0,0|2,0,0]=4 15159 B11R1.41 OCC[C@H]1CCCCN1CF 4befe8b0e1512fc40df1af397656ba00 [1,0,0,1,0,0|2,0,0]=4 15160 B11R1.41 OCC[C@H]1CCCCN1CO 531e7e5d43ad993f2cc626b44e0a03df [1,0,0,1,0,0|2,0,0]=4 15161 B11R1.41 OCN1CCCCC1CCCl 461f06055ee6fbd2ac4e1c73273da108 [1,0,0,1,0,0|2,0,0]=4 15162 B11R1.41 OCN[C@@H]1CCCC[C@@H]1CO 801f90cabe5c8f613435d159d4378b2e [1,0,0,1,0,0|2,0,0]=4 15163 B11R1.41 OCN[C@@H]1CCCC[C@H]1CO a89b3f0c7c50cff5c5f434de20145b86 [1,0,0,1,0,0|2,0,0]=4 15164 B11R1.41 OCN[C@H]1CCCC[C@H]1CO fc9b11efe264c94de043adc2c00969e2 [1,0,0,1,0,0|2,0,0]=4 15165 B11R1.41 OC[C@@H]1CCCCN1CCF 5743429b8350784efe3cf9683a266f9a [1,0,0,1,0,0|2,0,0]=4 15166 B11R1.41 OC[C@@H]1CCCCN1CCS ede745bcc697b05162026f65ea55e491 [1,0,0,1,0,0|2,0,0]=4 15167 B11R1.41 OC[C@@H]1CCCC[C@@H]1NCF b8ef802ee3b9883f5640f4678cdfcb98 [1,0,0,1,0,0|2,0,0]=4 15168 B11R1.41 OC[C@@H]1CCCC[C@H]1NCF 1b20dc5f3d8f9c5c35b859776d7dca41 [1,0,0,1,0,0|2,0,0]=4 15169 B11R1.41 OC[C@H]1CCCCN1CCF aae6def993e99414ba4be4f01aac785f [1,0,0,1,0,0|2,0,0]=4 15170 B11R1.41 OC[C@H]1CCCCN1CCS b1ff5dc3fcdf69223bda121763380932 [1,0,0,1,0,0|2,0,0]=4 15171 B11R1.41 OC[C@H]1CCCC[C@H]1NCF 6a031a5ffa482074e7ba3f4caf376254 [1,0,0,1,0,0|2,0,0]=4 15172 B11R1.47 CCCCCCCN1CCC1 fee8360b73c5a8bdd416a5139d6968a3 [1,0,0,1,0,0|1,0,0]=3 15173 B11R1.47 CCCCCCNC1CCC1 b26a0715d69af89d10892938e8d52ecd [1,0,0,1,0,0|1,0,0]=3 15174 B11R1.47 CCCCCCNC1COC1 de5284ee25bebeb6888cac6223c5cf7d [1,0,0,1,0,0|2,0,0]=4 15175 B11R1.47 CCCCCCOC1CCC1 95c82acfdeac63f9cd311721ad86c980 [1,0,0,1,0,0|1,0,0]=3 15176 B11R1.47 CCCCCCOC1COC1 60bbff0f992a3812da6a4cbcabc1c476 [1,0,0,1,0,0|2,0,0]=4 15177 B11R1.47 CCCCCCOC1CSC1 bc91b288c62723d0c7bff3ccd0cac76c [1,0,0,1,0,0|2,0,0]=4 15178 B11R1.47 CCCCCNCC1CCC1 0b0aceafbf0f7749033fee0175ae828f [1,0,0,1,0,0|1,0,0]=3 15179 B11R1.47 CCCCCNCC1CCO1 747d73e477ba3b14fd230fc000ba1d9d [1,0,0,1,0,0|1,0,0]=3 15180 B11R1.47 CCCCCNCC1COC1 ff0194e51700fb47a9e1884795e071a6 [1,0,0,1,0,0|2,0,0]=4 15181 B11R1.47 CCCCCNC[C@@H]1CCO1 392043285bd95ae0ff440cf219d169df [1,0,0,1,0,0|1,0,0]=3 15182 B11R1.47 CCCCCNC[C@H]1CCO1 41699c21d22797562e5382c98c16cc28 [1,0,0,1,0,0|1,0,0]=3 15183 B11R1.47 CCCCCOCC1CCC1 e59b5b77882d05dc4f715a35f54df6e5 [1,0,0,1,0,0|1,0,0]=3 15184 B11R1.47 CCCCCOCC1CCO1 2e0bdffc82cf36dcae98e3535b3870ad [1,0,0,1,0,0|1,0,0]=3 15185 B11R1.47 CCCCCOCC1COC1 60cd30e719ca1a02d1fbe74aaacdf955 [1,0,0,1,0,0|2,0,0]=4 15186 B11R1.47 CCCCCOCC1CSC1 7339a636cef8b13b32e2417db7a9d4d8 [1,0,0,1,0,0|2,0,0]=4 15187 B11R1.47 CCCCCOC[C@@H]1CCO1 b570869864ddf9b5b97f907b686a338e [1,0,0,1,0,0|1,0,0]=3 15188 B11R1.47 CCCCCOC[C@H]1CCO1 90d4e592e9f8fd134e8b79d08ad995c8 [1,0,0,1,0,0|1,0,0]=3 15189 B11R1.47 CCCCNCCC1CCC1 62baad0f5bbb1adf6b0756fff3d23cce [1,0,0,1,0,0|1,0,0]=3 15190 B11R1.47 CCCCNCCC1CCO1 67f965a722148d216740f7201bb6dc41 [1,0,0,1,0,0|1,0,0]=3 15191 B11R1.47 CCCCNCCC1COC1 81c408222809e106b9b65cf45d9c3b38 [1,0,0,1,0,0|2,0,0]=4 15192 B11R1.47 CCCCNCCN1CCC1 ac5931dc83f36daad2f85464478d2229 [1,0,0,1,0,0|2,0,0]=4 15193 B11R1.47 CCCCNCC[C@@H]1CCO1 aa789319497701350747a24114258a67 [1,0,0,1,0,0|1,0,0]=3 15194 B11R1.47 CCCCOCCC1CCC1 85001243f0c33622d1a508ce0f3b262b [1,0,0,1,0,0|1,0,0]=3 15195 B11R1.47 CCCCOCCC1CCO1 0d19e3cf6ded3e448b9a2892fc698aa6 [1,0,0,1,0,0|1,0,0]=3 15196 B11R1.47 CCCCOCCC1COC1 4b18519d3570401cdf2ca76a643cd309 [1,0,0,1,0,0|2,0,0]=4 15197 B11R1.47 CCCCOCCN1CCC1 f1c15eb353ed30636cba0c3a432a7f4f [1,0,0,1,0,0|2,0,0]=4 15198 B11R1.47 CCCCOCC[C@@H]1CCO1 4c92bef55ca26b5a622f3bbe7b5f493e [1,0,0,1,0,0|1,0,0]=3 15199 B11R1.47 CCCCOCC[C@H]1CCO1 34694f9909c56c54c4a207264ca54746 [1,0,0,1,0,0|1,0,0]=3 15200 B11R1.47 CCCCOCNC1CCC1 87d70ee20d77964052b02012a4b8cfe3 [1,0,0,1,0,0|2,0,0]=4 15201 B11R1.47 CCCCOCOC1CCC1 0177bc7749ef86679020b748ccea1f87 [1,0,0,1,0,0|2,0,0]=4 15202 B11R1.47 CCCNCCCN1CCC1 e88915d2490e8d036cb9a8032ed59702 [1,0,0,1,0,0|2,0,0]=4 15203 B11R1.47 CCCNCCOC1CCC1 2f66b2f850045980b3b5a33aa2f764c0 [1,0,0,1,0,0|2,0,0]=4 15204 B11R1.47 CCCOCCCC1CCC1 7382dbd4db11d05da7dc17df968bd9ea [1,0,0,1,0,0|1,0,0]=3 15205 B11R1.47 CCCOCCCC1COC1 bbeba4498e374cd9a321301321b7566d [1,0,0,1,0,0|2,0,0]=4 15206 B11R1.47 CCCOCCCN1CCC1 9f57c190e9c0b0b6ec8f6a4c83c5776d [1,0,0,1,0,0|2,0,0]=4 15207 B11R1.47 CCCOCCNC1CCC1 a6240bc8f0135d0f9e5c649e77fc2401 [1,0,0,1,0,0|2,0,0]=4 15208 B11R1.47 CCCOCCOC1CCC1 bbceec19bb20ee49155cb185e848c1f0 [1,0,0,1,0,0|2,0,0]=4 15209 B11R1.47 CCCSCCOC1CCC1 c24996cc7e5cc87b9214c3c3bc405aa3 [1,0,0,1,0,0|2,0,0]=4 15210 B11R1.47 CCOCCCNC1CCC1 2fc662fe875c5603ad6de6652140fffe [1,0,0,1,0,0|2,0,0]=4 15211 B11R1.47 CCOCCCOC1CCC1 4a3a3961f24c64087a70d3f026edb6e0 [1,0,0,1,0,0|2,0,0]=4 15212 B11R1.47 CCOCCNCC1CCC1 b3ef8269e340f473c34d9e4c4c7da7a1 [1,0,0,1,0,0|2,0,0]=4 15213 B11R1.47 CCOCCNCC1CCO1 88ded670f1faf8e162cb35c7ca204a84 [1,0,0,1,0,0|2,0,0]=4 15214 B11R1.47 CCOCCNC[C@@H]1CCO1 c9d493e166a96565d3d1920d1c5c454d [1,0,0,1,0,0|2,0,0]=4 15215 B11R1.47 CCOCCNC[C@H]1CCO1 5a9a633daab428e7ed90e008cda78d7f [1,0,0,1,0,0|2,0,0]=4 15216 B11R1.47 CCOCCOCC1CCC1 00f4f58ecdd54453715c952b6b03ffe3 [1,0,0,1,0,0|2,0,0]=4 15217 B11R1.47 CCOCCOCC1CCO1 1f9ba8de74a20a0f49b7aa944843d7cb [1,0,0,1,0,0|2,0,0]=4 15218 B11R1.47 CCOCCOC[C@@H]1CCO1 84122b5ccf6118019ecf92fd0f6422ec [1,0,0,1,0,0|2,0,0]=4 15219 B11R1.47 CCOCCOC[C@H]1CCO1 804832e0004edcb841e82355be321fb6 [1,0,0,1,0,0|2,0,0]=4 15220 B11R1.47 CCOCNCCC1CCC1 5c5f070afc4c5a6491edc848c458e3d9 [1,0,0,1,0,0|2,0,0]=4 15221 B11R1.47 CCOCNCCC1CCO1 336983d99ab723fd786e8263497cab7c [1,0,0,1,0,0|2,0,0]=4 15222 B11R1.47 CCOCNCC[C@@H]1CCO1 ec0f916001f37bc8652e8ecef0413035 [1,0,0,1,0,0|2,0,0]=4 15223 B11R1.47 CCOCOCCC1CCC1 2bbf466354495be4ad331541724eb363 [1,0,0,1,0,0|2,0,0]=4 15224 B11R1.47 CCOCOCCC1CCO1 762302154fad78b7a9b13926d1a51d81 [1,0,0,1,0,0|2,0,0]=4 15225 B11R1.47 CCOCOCC[C@@H]1CCO1 f73d1ccd1fea82c85066f3553ac4fb7d [1,0,0,1,0,0|2,0,0]=4 15226 B11R1.47 CCOCOCC[C@H]1CCO1 e58b564b778d737cb152246ca063dd4a [1,0,0,1,0,0|2,0,0]=4 15227 B11R1.47 CCSCCCNC1CCC1 8adc4d1ddda0268ef1358b2dd0dc4b05 [1,0,0,1,0,0|2,0,0]=4 15228 B11R1.47 CCSCCCOC1CCC1 6d804e3049445675130f580c06d2a588 [1,0,0,1,0,0|2,0,0]=4 15229 B11R1.47 CCSCCNCC1CCC1 26f20cef6acce494b9a42f03a02295de [1,0,0,1,0,0|2,0,0]=4 15230 B11R1.47 CCSCCNCC1CCO1 6cec1a531c4005b2d161b6c9cea9e998 [1,0,0,1,0,0|2,0,0]=4 15231 B11R1.47 CCSCCNC[C@@H]1CCO1 0e35a431639220501d80bbbbf4715c3f [1,0,0,1,0,0|2,0,0]=4 15232 B11R1.47 CCSCCNC[C@H]1CCO1 5c9a234aee57fef18266f47840d5c0bf [1,0,0,1,0,0|2,0,0]=4 15233 B11R1.47 CCSCCOCC1CCC1 c8b734cc1df4d3531b441b76d3562049 [1,0,0,1,0,0|2,0,0]=4 15234 B11R1.47 CCSCCOCC1CCO1 a4a58a20357be58a86129d9a0b685c52 [1,0,0,1,0,0|2,0,0]=4 15235 B11R1.47 CCSCCOC[C@@H]1CCO1 ddd731a698131cde61243c807c0e89db [1,0,0,1,0,0|2,0,0]=4 15236 B11R1.47 CCSCCOC[C@H]1CCO1 e258732e57266b2dfc8138eba0f34f22 [1,0,0,1,0,0|2,0,0]=4 15237 B11R1.47 COCCCCCN1CCC1 ed0cd89bbf0cdd618925437fc011e0dc [1,0,0,1,0,0|2,0,0]=4 15238 B11R1.47 COCCCCNC1CCC1 4e05ff11e7f688bd3b33a03f122af9b8 [1,0,0,1,0,0|2,0,0]=4 15239 B11R1.47 COCCCCOC1CCC1 acdbb527a24242f45f8e86ce08f2e7fd [1,0,0,1,0,0|2,0,0]=4 15240 B11R1.47 COCCCNCC1CCC1 2db6dffa35226681adedc07ee9beed20 [1,0,0,1,0,0|2,0,0]=4 15241 B11R1.47 COCCCNCC1CCO1 72c4f9cda2f8fcddbcbb2ac3c52a41db [1,0,0,1,0,0|2,0,0]=4 15242 B11R1.47 COCCCNC[C@@H]1CCO1 1e3e752a16b1b7e282c1ac4ea9ca8eb8 [1,0,0,1,0,0|2,0,0]=4 15243 B11R1.47 COCCCNC[C@H]1CCO1 5fb5bfbff68834b9324f66f4900c7890 [1,0,0,1,0,0|2,0,0]=4 15244 B11R1.47 COCCCOCC1CCC1 731c83e4b7303647f59f837e4d56e579 [1,0,0,1,0,0|2,0,0]=4 15245 B11R1.47 COCCCOCC1CCO1 24ea21fbd76a7559fbffe6e3b866a2fb [1,0,0,1,0,0|2,0,0]=4 15246 B11R1.47 COCCCOC[C@@H]1CCO1 878feaf4abd2183a71f0360ed1acff2d [1,0,0,1,0,0|2,0,0]=4 15247 B11R1.47 COCCCOC[C@H]1CCO1 095c138e57e0d674d95c474fe6ec28f9 [1,0,0,1,0,0|2,0,0]=4 15248 B11R1.47 COCCNCCC1CCC1 9b3625e5a1318b4c46803094c808a05d [1,0,0,1,0,0|2,0,0]=4 15249 B11R1.47 COCCNCCC1CCO1 d2bbc9d84bf46d2356b35f220966f812 [1,0,0,1,0,0|2,0,0]=4 15250 B11R1.47 COCCNCC[C@@H]1CCO1 bdf7e90e719865474bee7070c5c0339e [1,0,0,1,0,0|2,0,0]=4 15251 B11R1.47 COCCOCCC1CCC1 259902e0a76cb00382140cdad248936c [1,0,0,1,0,0|2,0,0]=4 15252 B11R1.47 COCCOCCC1CCO1 85261d3d4a6e0b0706128fc8f0b56f12 [1,0,0,1,0,0|2,0,0]=4 15253 B11R1.47 COCCOCC[C@@H]1CCO1 fc866bc6bb1a9b398cb9a5224c9549f9 [1,0,0,1,0,0|2,0,0]=4 15254 B11R1.47 COCCOCC[C@H]1CCO1 887411cd2c0b32286a565c51863c67a1 [1,0,0,1,0,0|2,0,0]=4 15255 B11R1.47 COCOCCCC1CCC1 06c3e3417415790c6b2b2a278df114e0 [1,0,0,1,0,0|2,0,0]=4 15256 B11R1.47 CSCCCCNC1CCC1 f288d77f722115c4d469e9c5f617930f [1,0,0,1,0,0|2,0,0]=4 15257 B11R1.47 CSCCCCOC1CCC1 9bb03d725a9976e0f72a9e402a362ea3 [1,0,0,1,0,0|2,0,0]=4 15258 B11R1.47 CSCCCNCC1CCC1 2d74cde2bfdd0c9dc90049c62c6fc188 [1,0,0,1,0,0|2,0,0]=4 15259 B11R1.47 CSCCCNCC1CCO1 a95cae17809f0bd63fcf4ab9122752a5 [1,0,0,1,0,0|2,0,0]=4 15260 B11R1.47 CSCCCNC[C@@H]1CCO1 99f947784ce65392c352da97435d5f4a [1,0,0,1,0,0|2,0,0]=4 15261 B11R1.47 CSCCCNC[C@H]1CCO1 9780be6e7d65a0c676b1481670ce702f [1,0,0,1,0,0|2,0,0]=4 15262 B11R1.47 CSCCCOCC1CCC1 eab37231c3c7dfd30af250d72f4a711f [1,0,0,1,0,0|2,0,0]=4 15263 B11R1.47 CSCCCOCC1CCO1 a4484f89f28df5300654193adcfbcdf4 [1,0,0,1,0,0|2,0,0]=4 15264 B11R1.47 CSCCCOC[C@@H]1CCO1 86c26355a40964358e104d895d3e0047 [1,0,0,1,0,0|2,0,0]=4 15265 B11R1.47 CSCCCOC[C@H]1CCO1 5962838b7b0336bb3ee22ad09d443ed3 [1,0,0,1,0,0|2,0,0]=4 15266 B11R1.47 CSCCNCCC1CCC1 61d0ae70232c289c5caf69c54e84ac40 [1,0,0,1,0,0|2,0,0]=4 15267 B11R1.47 CSCCNCCC1CCO1 84369b517f9878b77f109ee478d17d90 [1,0,0,1,0,0|2,0,0]=4 15268 B11R1.47 CSCCNCC[C@@H]1CCO1 572ee558fb10a251a7fe95c94c389def [1,0,0,1,0,0|2,0,0]=4 15269 B11R1.47 CSCCOCCC1CCC1 d5f73a036d025960525e04a28eaa5162 [1,0,0,1,0,0|2,0,0]=4 15270 B11R1.47 CSCCOCCC1CCO1 235297a827c4280fb8052dcd248dc772 [1,0,0,1,0,0|2,0,0]=4 15271 B11R1.47 CSCCOCC[C@@H]1CCO1 a6cd7ec1a3b18ba943936e359a3400d7 [1,0,0,1,0,0|2,0,0]=4 15272 B11R1.47 CSCCOCC[C@H]1CCO1 5407906e74d3a7eb679b7e3c4cc80798 [1,0,0,1,0,0|2,0,0]=4 15273 B11R1.47 CSCOCCCC1CCC1 0c38c5e96b33ac46065a0f01a4023c54 [1,0,0,1,0,0|2,0,0]=4 15274 B11R1.47 ClCCCCCNC1CCC1 881eee23bc700089a21343b8b89106cb [1,0,0,1,0,0|2,0,0]=4 15275 B11R1.47 ClCCCCNCC1CCC1 6fe6c25c791f4134c9de1a35e9a810c1 [1,0,0,1,0,0|2,0,0]=4 15276 B11R1.47 ClCCCCNCC1CCO1 18c5cd7f7d8e26c060364fbca52606d0 [1,0,0,1,0,0|2,0,0]=4 15277 B11R1.47 ClCCCCNC[C@@H]1CCO1 ca2f88024066f4f03ea9bf119f978b11 [1,0,0,1,0,0|2,0,0]=4 15278 B11R1.47 ClCCCCNC[C@H]1CCO1 9fa16701fec8827d9c640b3fbbed7948 [1,0,0,1,0,0|2,0,0]=4 15279 B11R1.47 ClCCCNCCC1CCC1 81382a07983cf6a9361cf8374a110197 [1,0,0,1,0,0|2,0,0]=4 15280 B11R1.47 ClCCCNCCC1CCO1 446482e521709eddde9712931fc381da [1,0,0,1,0,0|2,0,0]=4 15281 B11R1.47 FCCCCCCN1CCC1 d49ede994a206404f87c492a62b9c47e [1,0,0,1,0,0|2,0,0]=4 15282 B11R1.47 FCCCCCNC1CCC1 c06c0c3679d63bb2deb3e6854edbe4b6 [1,0,0,1,0,0|2,0,0]=4 15283 B11R1.47 FCCCCCOC1CCC1 50adb4e9da9360c13438ed391503c4c3 [1,0,0,1,0,0|2,0,0]=4 15284 B11R1.47 FCCCCNCC1CCC1 678cafb8f76db13d6de57a604f727239 [1,0,0,1,0,0|2,0,0]=4 15285 B11R1.47 FCCCCNCC1CCO1 d0896dc000e95cf4487bb0f1c9357e76 [1,0,0,1,0,0|2,0,0]=4 15286 B11R1.47 FCCCCNC[C@@H]1CCO1 29379b7b6e4c3e9a354d536ea84a72c9 [1,0,0,1,0,0|2,0,0]=4 15287 B11R1.47 FCCCCNC[C@H]1CCO1 c4a12ec1b6d602168a1fb6bc33e2ca66 [1,0,0,1,0,0|2,0,0]=4 15288 B11R1.47 FCCCCOCC1CCC1 c5a7c8f9cef8caa8b101ca3abf20bdb6 [1,0,0,1,0,0|2,0,0]=4 15289 B11R1.47 FCCCCOCC1CCO1 c6c556fbef805c9b73ed5954a43d1780 [1,0,0,1,0,0|2,0,0]=4 15290 B11R1.47 FCCCCOC[C@@H]1CCO1 779a7b6f1942140616489372feaa497a [1,0,0,1,0,0|2,0,0]=4 15291 B11R1.47 FCCCCOC[C@H]1CCO1 65266d9328b255b06259bf09e2a67796 [1,0,0,1,0,0|2,0,0]=4 15292 B11R1.47 FCCCNCCC1CCC1 68ef0a49841b6ab27ae11efc089222ca [1,0,0,1,0,0|2,0,0]=4 15293 B11R1.47 FCCCNCCC1CCO1 0fca9ef3c5132aa8bf057f9445c23bdc [1,0,0,1,0,0|2,0,0]=4 15294 B11R1.47 FCCCNCC[C@@H]1CCO1 78e8dcc4795ac7af89379a499a484925 [1,0,0,1,0,0|2,0,0]=4 15295 B11R1.47 FCCCOCCC1CCC1 f96741d2de6dae7a6b70f1a268231477 [1,0,0,1,0,0|2,0,0]=4 15296 B11R1.47 FCCCOCCC1CCO1 50afa9598a9be8d9c7a2f17d5bd3a7ab [1,0,0,1,0,0|2,0,0]=4 15297 B11R1.47 FCCCOCC[C@@H]1CCO1 7fdf70a6f885a7d317e6f25b6911b6f1 [1,0,0,1,0,0|2,0,0]=4 15298 B11R1.47 FCCCOCC[C@H]1CCO1 c510932f495b08191728d0d1a386a123 [1,0,0,1,0,0|2,0,0]=4 15299 B11R1.47 FCCOCCCC1CCC1 873c1a799575801062d2799d21a7bdce [1,0,0,1,0,0|2,0,0]=4 15300 B11R1.47 OCCCCCCN1CCC1 dfe981e98bf6d51c7c123615845307d8 [1,0,0,1,0,0|1,0,0]=3 15301 B11R1.47 OCCCCCNC1CCC1 29510c75b03d87ee75f1b9d5bd17ea59 [1,0,0,1,0,0|1,0,0]=3 15302 B11R1.47 OCCCCCNC1COC1 36909d29e024c4c4b91f8b44037d0b98 [1,0,0,1,0,0|2,0,0]=4 15303 B11R1.47 OCCCCNCC1CCC1 b7e9410c195c187fafce32b9457cc986 [1,0,0,1,0,0|1,0,0]=3 15304 B11R1.47 OCCCCNCC1CCO1 9863376923210494c358b9d5af7f53a7 [1,0,0,1,0,0|2,0,0]=4 15305 B11R1.47 OCCCCNCC1COC1 e3fdf9bce98185932e80f158abcfef8b [1,0,0,1,0,0|2,0,0]=4 15306 B11R1.47 OCCCCNC[C@@H]1CCO1 93c37a7e0e0862a7554310dfe602580d [1,0,0,1,0,0|2,0,0]=4 15307 B11R1.47 OCCCCNC[C@H]1CCO1 4f6d3d9fd6fabe1ae74aba7b14ce133f [1,0,0,1,0,0|2,0,0]=4 15308 B11R1.47 OCCCNCCC1CCC1 85e191147830ea37186697a32920468c [1,0,0,1,0,0|1,0,0]=3 15309 B11R1.47 OCCCNCCC1CCO1 3678f1d68dab4840488915e4c9209d8e [1,0,0,1,0,0|2,0,0]=4 15310 B11R1.47 OCCCNCCC1COC1 9e923e36d0a324570e943f0e392fcd41 [1,0,0,1,0,0|2,0,0]=4 15311 B11R1.47 OCCCNCCN1CCC1 d5d6c03f840a524a99fceecfe701873b [1,0,0,1,0,0|2,0,0]=4 15312 B11R1.47 OCCCNCC[C@@H]1CCO1 caa979ba94dba4a31f3de36a1644674c [1,0,0,1,0,0|2,0,0]=4 15313 B11R1.47 OCCNCCCN1CCC1 f36f458796aabc9e6031230963bf558c [1,0,0,1,0,0|2,0,0]=4 15314 B11R1.47 OCCNCCOC1CCC1 8cdef3abce4892bbf61b33f04d6904ed [1,0,0,1,0,0|2,0,0]=4 15315 B11R1.47 OCCOCCNC1CCC1 1e754f1a6dc3368cbefedea14d6ee0f7 [1,0,0,1,0,0|2,0,0]=4 15316 B11R1.47 OCCSCCNC1CCC1 698297a621ad18efca0241de4e572749 [1,0,0,1,0,0|2,0,0]=4 15317 B11R1.47 SCCCCNCC1CCC1 81231495de3be593161b69415dd2ab64 [1,0,0,1,0,0|1,1,0]=4 15318 B11R1.47 SCCCCNCC1CCO1 e98688b52f48bb259b522e0a994c80e3 [1,0,0,1,0,0|2,0,0]=4 15319 B11R1.47 SCCCCNC[C@@H]1CCO1 1ed6dfa18aa969d89d4855e3917c5a24 [1,0,0,1,0,0|2,0,0]=4 15320 B11R1.47 SCCCCNC[C@H]1CCO1 9bb3a148ed9a035b411369c46538a137 [1,0,0,1,0,0|2,0,0]=4 15321 B11R1.47 SCCCCOCC1CCC1 7d0ebf7b7b5ae5a15708b69b2b7e36b3 [1,0,0,1,0,0|1,1,0]=4 15322 B11R1.47 SCCCCOCC1CCO1 c0ad552b30fd23ca97e61e490adf15d4 [1,0,0,1,0,0|2,0,0]=4 15323 B11R1.47 SCCCCOC[C@@H]1CCO1 0b80e92de6c1890a4e4b77c1c46fab29 [1,0,0,1,0,0|2,0,0]=4 15324 B11R1.47 SCCCCOC[C@H]1CCO1 26ab6dc1936e1d44df916535f7f554aa [1,0,0,1,0,0|2,0,0]=4 15325 B11R1.47 SCCCNCCC1CCC1 0419a04cee6de66bfa831dde7bae9073 [1,0,0,1,0,0|1,1,0]=4 15326 B11R1.47 SCCCNCCC1CCO1 09323ef652abfc749f722ae0246b70a9 [1,0,0,1,0,0|2,0,0]=4 15327 B11R1.47 SCCCNCC[C@@H]1CCO1 b5c5d4f84e5ded340ba60d7f7a4930ac [1,0,0,1,0,0|2,0,0]=4 15328 B11R1.47 SCCCOCCC1CCC1 c570e993003db0640620f3e32883c571 [1,0,0,1,0,0|1,1,0]=4 15329 B11R1.47 SCCCOCCC1CCO1 ccccbe9abc5feb404af28f27346ab232 [1,0,0,1,0,0|2,0,0]=4 15330 B11R1.47 SCCCOCC[C@@H]1CCO1 fa6de68d1000e31908274d11a3ba4457 [1,0,0,1,0,0|2,0,0]=4 15331 B11R1.47 SCCCOCC[C@H]1CCO1 5d00ace7649477eee1a0a53f1eddd5f3 [1,0,0,1,0,0|2,0,0]=4 15332 B11R1.47 SCCOCCCC1CCC1 73a6ffea2d3808f5a2343b8f73c7d3e3 [1,0,0,1,0,0|1,1,0]=4 15333 B11R1.51 CCN1CCCCCC1CO 5b9c33c66c2a14262594aac64dae96e9 [1,0,0,1,0,0|1,0,0]=3 15334 B11R1.51 CCN1CCCOCC1CO d0681843a30da34b7a05df408ca409ab [1,0,0,1,0,0|2,0,0]=4 15335 B11R1.51 CCN1CCCOC[C@@H]1CO 5d7455ea6719a2d493891fbce4090b7a [1,0,0,1,0,0|2,0,0]=4 15336 B11R1.51 CCN1CCCOC[C@H]1CO 7946cfd128232d469dd123ac8b253f5c [1,0,0,1,0,0|2,0,0]=4 15337 B11R1.51 OCC1CCCCCN1CF da953f13f19f6ccb9fd6935937234b9a [1,0,0,1,0,0|2,0,0]=4 15338 B11R1.51 OCC1CCCCCN1CO e6edcd321a0314c5c9405ac25a95c290 [1,0,0,1,0,0|2,0,0]=4 15339 B11R1.52 CCCCN[C@H]1C[C@@H]1COC d8d5b194ead0cd8e605aab838a35f5b3 [1,0,0,1,0,0|2,0,0]=4 15340 B11R1.52 CCCCN[C@H]1C[C@H]1COC 13a164926f5eb70b0a96cc602c5ddbc9 [1,0,0,1,0,0|2,0,0]=4 15341 B11R1.52 COC[C@@H]1C[C@@H]1NCCCO 94a772d4d6ee2929ff028d70237f17de [1,0,0,1,0,0|2,0,0]=4 15342 B11R1.52 COC[C@H]1C[C@@H]1NCCCO 307d460ae7f9a6b6ee99325bc653737d [1,0,0,1,0,0|2,0,0]=4 15343 B11R1.109 CCCC1SCCN1CCC 2556b8f198fd867c85558f018016e2f9 [1,0,0,1,0,0|2,0,0]=4 15344 B11R1.109 CCCC1SCCN1CCO 794873e09cefd6c3df3e8e9e6cc7d75e [1,0,0,1,0,0|2,0,0]=4 15345 B11R1.109 CCCN1CCCC1CCO 0546c8bf6c6bab9276b0a60be9bf47e2 [1,0,0,1,0,0|1,0,0]=3 15346 B11R1.109 CCCN1CCCC1COC a895f441cf1248553bd9579c23e2d0ae [1,0,0,1,0,0|2,0,0]=4 15347 B11R1.109 CCCN1CCCC1CSC d598f652c0ba1cbc8e65842f936cf7c0 [1,0,0,1,0,0|2,0,0]=4 15348 B11R1.109 CCCN1CCC[C@@H]1CCO 4278d4edf676540698dba79e59f9ddee [1,0,0,1,0,0|1,0,0]=3 15349 B11R1.109 CCCN1CCC[C@@H]1COC 206fa0bb7ef6367d6fa0e0d9bbf9ed9d [1,0,0,1,0,0|2,0,0]=4 15350 B11R1.109 CCCN1CCC[C@H]1COC 05ef159412577459cf5ea4565251ccaf [1,0,0,1,0,0|2,0,0]=4 15351 B11R1.109 CCN[C@@H]1CCC[C@@H]1COC 7ffe2fa0f1e1248d1ca68384378fd5ab [1,0,0,1,0,0|2,0,0]=4 15352 B11R1.109 CCN[C@H]1CCC[C@H]1COC 28e30f55064a095a4d83e91efb76ac2e [1,0,0,1,0,0|2,0,0]=4 15353 B11R1.109 COCC1CCCN1CCO f09db4a748f18e2b34f38c5e57851454 [1,0,0,1,0,0|2,0,0]=4 15354 B11R1.109 COCN1CCCC1CCO e9a5cf7f28eff49ac6c09d8736dea690 [1,0,0,1,0,0|2,0,0]=4 15355 B11R1.109 COCN1CCC[C@@H]1CCO 11b5df4f5a5a9ab78934a5067f07efad [1,0,0,1,0,0|2,0,0]=4 15356 B11R1.109 COC[C@@H]1CCCN1CCO ccef4a2380392c4267d53cecf34656b0 [1,0,0,1,0,0|2,0,0]=4 15357 B11R1.109 COC[C@@H]1CCC[C@@H]1NCO 1d37345dc9ef9e844608dd7a200d5955 [1,0,0,1,0,0|2,0,0]=4 15358 B11R1.109 COC[C@H]1CCCN1CCO d40c2071be4791b828de3b66b9e5a773 [1,0,0,1,0,0|2,0,0]=4 15359 B11R1.109 COC[C@H]1CCC[C@H]1NCO ffb941df1af1be5a10674826ed773194 [1,0,0,1,0,0|2,0,0]=4 15360 B11R1.109 CSCC1CCCN1CCO 0b22e37c83b46617a799a57327eb17a8 [1,0,0,1,0,0|2,0,0]=4 15361 B11R1.109 CSCN1CCCC1CCO 9d3b2bce056d908c199a2e5a2697f8e9 [1,0,0,1,0,0|2,0,0]=4 15362 B11R1.109 CSCN1CCC[C@@H]1CCO c6df428a246b840d75eac6ec41427e71 [1,0,0,1,0,0|2,0,0]=4 15363 B11R1.109 OCCC1CCCN1CCF 4858472dc406e4dbceadb66ff05e885f [1,0,0,1,0,0|2,0,0]=4 15364 B11R1.109 OCCC1CCCN1CCO 914a374adb35faf413efb8ac7fbf48d9 [1,0,0,1,0,0|2,0,0]=4 15365 B11R1.109 OCCC1CCCN1CCS dce862cdbc983bce410cf8dd56d5613b [1,0,0,1,0,0|2,0,0]=4 15366 B11R1.109 OCC[C@H]1CCCN1CCF 805e15465d7ea3b44110763d307de4f6 [1,0,0,1,0,0|2,0,0]=4 15367 B11R1.109 OCC[C@H]1CCCN1CCO 35d3cde331e26ad6093dde00900ca870 [1,0,0,1,0,0|2,0,0]=4 15368 B11R1.109 OCC[C@H]1CCCN1CCS 4fdf0446b97710b04328dfac689cfa8f [1,0,0,1,0,0|2,0,0]=4 15369 B11R1.117 CCCN1CCCCCCC1 328dcd98ace70168763c8b5439e5b7fa [1,0,0,1,0,0|1,0,0]=3 15370 B11R1.117 CCNC1CCCCCCC1 50d835a0fc710efafe0ab4df29e9a1e9 [1,0,0,1,0,0|1,0,0]=3 15371 B11R1.117 CCOC1CCCCCCC1 8de234ac4018711f0809089a1dbd7f4d [1,0,0,1,0,0|1,0,0]=3 15372 B11R1.117 COCN1CCCCCCC1 c8c298b463fa5cff4681e3337e74f538 [1,0,0,1,0,0|2,0,0]=4 15373 B11R1.117 CSCN1CCCCCCC1 3eaa6f671e78ef71f082444ae5ae077c [1,0,0,1,0,0|2,0,0]=4 15374 B11R1.117 FCCN1CCCCCCC1 3b0ce379f59c6594558643d5b15ca0aa [1,0,0,1,0,0|2,0,0]=4 15375 B11R1.117 FCNC1CCCCCCC1 7400798fb063a3f04c818515ca61aa4d [1,0,0,1,0,0|2,0,0]=4 15376 B11R1.117 FCOC1CCCCCCC1 a2ade3c88ec76dedf0ca21d312063bec [1,0,0,1,0,0|2,0,0]=4 15377 B11R1.117 OCCN1CCCCCCC1 8113da9194205273e686fb6bd2d23931 [1,0,0,1,0,0|1,0,0]=3 15378 B11R1.117 OCNC1CCCCCCC1 b3518fc0dbe59b5227ec4eb3c1d3682c [1,0,0,1,0,0|1,0,0]=3 15379 B11R1.117 SCCN1CCCCCCC1 819d5dd84d40fb687e4eba9ae1b91cc4 [1,0,0,1,0,0|1,1,0]=4 15380 B11R1.180 CC1CCCC1COCCF 8a0a4036012d661424e3aa77b5e234f0 [1,0,0,1,0,0|2,0,0]=4 15381 B11R1.180 CC1CCCC1COCCS e1e383c523cda14acba7c9c9a715d131 [1,0,0,1,0,0|1,1,0]=4 15382 B11R1.180 CC1CCCC1OCCCF 0d0aab9550e0bb0e859a8ac92f18cf22 [1,0,0,1,0,0|2,0,0]=4 15383 B11R1.180 CC1CCCC1OCCCS fb4a0e162598fabd8f8529c4572dc813 [1,0,0,1,0,0|1,1,0]=4 15384 B11R1.180 CC1CCCN1CCCCF 8f258d13e64349f4c96db3fe0672d34a [1,0,0,1,0,0|2,0,0]=4 15385 B11R1.180 CC1CCCN1CCCCO a673de70102c9ce1017d52deb044963b [1,0,0,1,0,0|1,0,0]=3 15386 B11R1.180 CC1COCC1CNCCO ac396fa99e7cacfc228a9516f729a0e6 [1,0,0,1,0,0|2,0,0]=4 15387 B11R1.180 CC1SCCN1CCCCO 14a0e3abeb7d96e72cf675d178421fee [1,0,0,1,0,0|2,0,0]=4 15388 B11R1.180 CCCCCN1CCCC1C 07fc8cec62763b016fc411bb35abd56c [1,0,0,1,0,0|1,0,0]=3 15389 B11R1.180 CCCCCN1CCCC1O c398c8293942e8b6d8331839eac42dcd [1,0,0,1,0,0|1,0,0]=3 15390 B11R1.180 CCCCCN1CCC[C@@H]1C db1500b86215c83121a9d926faa49684 [1,0,0,1,0,0|1,0,0]=3 15391 B11R1.180 CCCCCN1CCC[C@H]1C 1fbacd4c0d5aee021f8867b6cfe55a36 [1,0,0,1,0,0|1,0,0]=3 15392 B11R1.180 CCCCCN1CCSC1C 5792ddf5488322652750728329f008de [1,0,0,1,0,0|2,0,0]=4 15393 B11R1.180 CCCCNC1CCCC1O 246f31f8097c61c8292d23ee442adf29 [1,0,0,1,0,0|1,0,0]=3 15394 B11R1.180 CCCCNC1COCC1O 7285d01f7bdb53a2098a9a5ef9a550fe [1,0,0,1,0,0|2,0,0]=4 15395 B11R1.180 CCCCN[C@@H]1CCC[C@@H]1O 8e8e24cd1c7e98f8ca1808e722a25c2b [1,0,0,1,0,0|1,0,0]=3 15396 B11R1.180 CCCCN[C@@H]1CCC[C@H]1O 702179409785dfcf937fe4220b12fea6 [1,0,0,1,0,0|1,0,0]=3 15397 B11R1.180 CCCCN[C@@H]1COC[C@@H]1O 3be9161d363b6b88ecf77ff955fe3328 [1,0,0,1,0,0|2,0,0]=4 15398 B11R1.180 CCCCN[C@@H]1COC[C@H]1O 42f48d4aaf92a54c37fda1198c14c0f7 [1,0,0,1,0,0|2,0,0]=4 15399 B11R1.180 CCCCN[C@H]1CCC[C@@H]1O 6d73b740216fb5fde874206510ff282a [1,0,0,1,0,0|1,0,0]=3 15400 B11R1.180 CCCCN[C@H]1CCC[C@H]1O 2945bb9484d0a3e284def0f3103a9fff [1,0,0,1,0,0|1,0,0]=3 15401 B11R1.180 CCCCN[C@H]1COC[C@@H]1O 970641a556d916f0b91c0c3237227d79 [1,0,0,1,0,0|2,0,0]=4 15402 B11R1.180 CCCCN[C@H]1COC[C@H]1O f8349fe28eb51d387d1b178fe8d76308 [1,0,0,1,0,0|2,0,0]=4 15403 B11R1.180 CCCCOC1CCCC1C bbf695826b5d2224780e8ace71866a13 [1,0,0,1,0,0|1,0,0]=3 15404 B11R1.180 CCCCOC1COCC1C a4da6e6274e3518c98c48ca6af9757dc [1,0,0,1,0,0|2,0,0]=4 15405 B11R1.180 CCCCO[C@@H]1CCC[C@@H]1C d890bbf3094eab75ec9e53a337ab9861 [1,0,0,1,0,0|1,0,0]=3 15406 B11R1.180 CCCCO[C@@H]1CCC[C@H]1C bedcbc9e69231ec35eec054d3fd826e7 [1,0,0,1,0,0|1,0,0]=3 15407 B11R1.180 CCCCO[C@@H]1CCC[C@H]1F 0449d712f0f96169cbd7493bb569bb28 [1,0,0,1,0,0|2,0,0]=4 15408 B11R1.180 CCCCO[C@@H]1COC[C@@H]1C a258545cd922242c7aa1f5623d78c3ab [1,0,0,1,0,0|2,0,0]=4 15409 B11R1.180 CCCCO[C@H]1CCC[C@@H]1C 601ed2d4bdd4b49048d672a0c4e56ec7 [1,0,0,1,0,0|1,0,0]=3 15410 B11R1.180 CCCCO[C@H]1CCC[C@H]1C 01268c10d1c93b43c7fb3e48946ca6b2 [1,0,0,1,0,0|1,0,0]=3 15411 B11R1.180 CCCCO[C@H]1COC[C@@H]1C 870e7d7c0c446e65beadb490a3cf1382 [1,0,0,1,0,0|2,0,0]=4 15412 B11R1.180 CCCCO[C@H]1COC[C@H]1C e2b410c3a3ad87058b54b5815a17229c [1,0,0,1,0,0|2,0,0]=4 15413 B11R1.180 CCCNCC1CCCC1O 92cff7131ea3a21e6f1efd4706322900 [1,0,0,1,0,0|1,0,0]=3 15414 B11R1.180 CCCNCC1CCCN1C 9be14da124e482d531a6135cc5787428 [1,0,0,1,0,0|2,0,0]=4 15415 B11R1.180 CCCNCC1COCC1C 3bd82b590f8d4ffaf62489734fb544b3 [1,0,0,1,0,0|2,0,0]=4 15416 B11R1.180 CCCNC[C@@H]1CCCN1C 1d7cd111be46e158a3d779693610a34f [1,0,0,1,0,0|2,0,0]=4 15417 B11R1.180 CCCNC[C@@H]1COC[C@@H]1O 51e3cef623247f1ddd1e7870932f223b [1,0,0,1,0,0|2,0,0]=4 15418 B11R1.180 CCCNC[C@H]1CCCN1C 32fc14a009b93787be7d7dc405d038ae [1,0,0,1,0,0|2,0,0]=4 15419 B11R1.180 CCCOCC1CCCC1C 118ed8d287625874ba26030881e3da78 [1,0,0,1,0,0|1,0,0]=3 15420 B11R1.180 CCCOCC1CCCN1C bf8e443012ae9dc1d87b802b881d0e7f [1,0,0,1,0,0|2,0,0]=4 15421 B11R1.180 CCCOCC1COCC1C 553e5451c849fbb57a33ed086734d820 [1,0,0,1,0,0|2,0,0]=4 15422 B11R1.180 CCCOCC1OCCC1C 57feccde124dd0fb0c06be2cf8c20256 [1,0,0,1,0,0|2,0,0]=4 15423 B11R1.180 CCCOC[C@@H]1CCCN1C 4eaaca3fec96583d7f11678f9d67e935 [1,0,0,1,0,0|2,0,0]=4 15424 B11R1.180 CCCOC[C@@H]1CCC[C@H]1F eaf7c020b285e2fbc01d608fed6ac578 [1,0,0,1,0,0|2,0,0]=4 15425 B11R1.180 CCCOC[C@@H]1CCO[C@@H]1C 6bc16d6e28a51845c97a69d0e0cc4eae [1,0,0,1,0,0|2,0,0]=4 15426 B11R1.180 CCCOC[C@H]1CCCN1C 3b4dfbc6f049122810edfeee80233f50 [1,0,0,1,0,0|2,0,0]=4 15427 B11R1.180 CCNCCC1CCCN1C 8dd87623ed8ce203aec3094aca5d8d00 [1,0,0,1,0,0|2,0,0]=4 15428 B11R1.180 CCNCC[C@@H]1CCCN1C c400f1373ed29c6a36e401acf31cf6f7 [1,0,0,1,0,0|2,0,0]=4 15429 B11R1.180 CCNCC[C@H]1CCCN1C 4f78b80ca36916acb38782523b9d13d9 [1,0,0,1,0,0|2,0,0]=4 15430 B11R1.180 CCOCCC1CCCN1C 2ce48a83ef6a23ca1f01db7eef6b80ad [1,0,0,1,0,0|2,0,0]=4 15431 B11R1.180 CCOCCN1CCCC1C 760d865391a339b0ded70d288518fa24 [1,0,0,1,0,0|2,0,0]=4 15432 B11R1.180 CCOCCN1CCCC1O 92f7f3bdbdb1b8528921b6f1e481006c [1,0,0,1,0,0|2,0,0]=4 15433 B11R1.180 CCOCCN1CCC[C@@H]1C 2f118b7b1a1ef0f4e0a9ae1f47599506 [1,0,0,1,0,0|2,0,0]=4 15434 B11R1.180 CCOCCN1CCC[C@H]1C 23d44924f918a7dd2af2633224aa0054 [1,0,0,1,0,0|2,0,0]=4 15435 B11R1.180 CCOCC[C@@H]1CCCN1C 9c9a3b3a307be5c9f7e73141f3a945ac [1,0,0,1,0,0|2,0,0]=4 15436 B11R1.180 CCOCC[C@H]1CCCN1C 34b7fadfc7a279e2ef84b7a8ef3f0a76 [1,0,0,1,0,0|2,0,0]=4 15437 B11R1.180 CCOCNC1CCCC1O 705cc34b9b98a13ea1ec8acb3f1589c7 [1,0,0,1,0,0|2,0,0]=4 15438 B11R1.180 CCOCN[C@@H]1CCC[C@@H]1O 8d81df3ef210ec3b35c31a545c8d6a72 [1,0,0,1,0,0|2,0,0]=4 15439 B11R1.180 CCOCN[C@@H]1CCC[C@H]1O f4928477b5d2335cfa930c78ea6d72b5 [1,0,0,1,0,0|2,0,0]=4 15440 B11R1.180 CCOCN[C@H]1CCC[C@@H]1O ce58c76563da892dc3641548138dc555 [1,0,0,1,0,0|2,0,0]=4 15441 B11R1.180 CCOCN[C@H]1CCC[C@H]1O e9c21ff612f822037990ccbf0c1bb67e [1,0,0,1,0,0|2,0,0]=4 15442 B11R1.180 CCOCOC1CCCC1C 82532d0186bc57a1bf449bf270222dfd [1,0,0,1,0,0|2,0,0]=4 15443 B11R1.180 CCOCO[C@@H]1CCC[C@@H]1C 7a847edba406956de20e06db3a6f06e5 [1,0,0,1,0,0|2,0,0]=4 15444 B11R1.180 CCOCO[C@@H]1CCC[C@H]1C 2c5205e79dd884c53692d579f45bd07c [1,0,0,1,0,0|2,0,0]=4 15445 B11R1.180 CCOCO[C@H]1CCC[C@@H]1C bed5b73420a076d49a5ae32e4bcedaf3 [1,0,0,1,0,0|2,0,0]=4 15446 B11R1.180 CCOCO[C@H]1CCC[C@H]1C f5dde802a553d1e934e0723ae5d95477 [1,0,0,1,0,0|2,0,0]=4 15447 B11R1.180 CCSCCN1CCCC1C c544a5623a4df285ff525512c883f004 [1,0,0,1,0,0|2,0,0]=4 15448 B11R1.180 CCSCCN1CCCC1O fe9b87538d9b65140960457585a2766f [1,0,0,1,0,0|2,0,0]=4 15449 B11R1.180 CCSCCN1CCC[C@@H]1C 2934eff3fd01c080b05ca78657294b86 [1,0,0,1,0,0|2,0,0]=4 15450 B11R1.180 CCSCCN1CCC[C@H]1C 704f35b7c135f9f06782547df893bf93 [1,0,0,1,0,0|2,0,0]=4 15451 B11R1.180 CN1CCCC1CCNCO d2a6824222e5326694bca846ec25ac24 [1,0,0,1,0,0|2,0,0]=4 15452 B11R1.180 CN1CCCC1CNCCO 08f83faa0041a7e8bf669fc12fa4dc03 [1,0,0,1,0,0|2,0,0]=4 15453 B11R1.180 CN1CCC[C@@H]1CCNCO 6811b6f644ef963721db8b18a4afc0bd [1,0,0,1,0,0|2,0,0]=4 15454 B11R1.180 CN1CCC[C@@H]1CNCCO 49fa4376c7979bcd23d2b8f6b3d102d2 [1,0,0,1,0,0|2,0,0]=4 15455 B11R1.180 CN1CCC[C@H]1CCNCO 515316e64c3097f61d0f42ea75b40978 [1,0,0,1,0,0|2,0,0]=4 15456 B11R1.180 CN1CCC[C@H]1CNCCO 5a5d7a14f406a1f05263af9bc2374efc [1,0,0,1,0,0|2,0,0]=4 15457 B11R1.180 COCCCN1CCCC1C cd85f7e80148e4eb10aadddbc975e350 [1,0,0,1,0,0|2,0,0]=4 15458 B11R1.180 COCCCN1CCCC1O 957952848228a7974cfeb6c0b7ad4c6e [1,0,0,1,0,0|2,0,0]=4 15459 B11R1.180 COCCCN1CCC[C@@H]1C b91a533f815c2919a2747d1dd4c8e596 [1,0,0,1,0,0|2,0,0]=4 15460 B11R1.180 COCCCN1CCC[C@H]1C 7e99e49a1681835d074cc073a2270faa [1,0,0,1,0,0|2,0,0]=4 15461 B11R1.180 COCCNC1CCCC1O e3689a5b580baa2fdabbf76bab5909e0 [1,0,0,1,0,0|2,0,0]=4 15462 B11R1.180 COCCN[C@@H]1CCC[C@@H]1O b6ff942dfd610a7cc1abea11ba78dff7 [1,0,0,1,0,0|2,0,0]=4 15463 B11R1.180 COCCN[C@@H]1CCC[C@H]1O 3f20d031584c03941562f506c959bdb3 [1,0,0,1,0,0|2,0,0]=4 15464 B11R1.180 COCCN[C@H]1CCC[C@@H]1O db9fc93a1cc46386941acba5d60b1cf1 [1,0,0,1,0,0|2,0,0]=4 15465 B11R1.180 COCCN[C@H]1CCC[C@H]1O 358077aff0cf20a93ff795f58653fff9 [1,0,0,1,0,0|2,0,0]=4 15466 B11R1.180 COCCOC1CCCC1C badefe44dc991bae0b65a92afd897017 [1,0,0,1,0,0|2,0,0]=4 15467 B11R1.180 COCCO[C@@H]1CCC[C@@H]1C d06276027fdcf78aa031bf15e75646ba [1,0,0,1,0,0|2,0,0]=4 15468 B11R1.180 COCCO[C@@H]1CCC[C@H]1C 8000046286af97c43a1fbc4f6fa0eefc [1,0,0,1,0,0|2,0,0]=4 15469 B11R1.180 COCCO[C@H]1CCC[C@@H]1C b5f2ded7acdbefc4707f16c231509201 [1,0,0,1,0,0|2,0,0]=4 15470 B11R1.180 COCCO[C@H]1CCC[C@H]1C 0b3fcbd4a376690cfd7893ebdde78bfe [1,0,0,1,0,0|2,0,0]=4 15471 B11R1.180 COCNCC1CCCC1O 9ab3b905b3eb1758fb14b11df0091c3c [1,0,0,1,0,0|2,0,0]=4 15472 B11R1.180 COCOCC1CCCC1C 2065198ebdc7732de499e333955aad3c [1,0,0,1,0,0|2,0,0]=4 15473 B11R1.180 CSCCCN1CCCC1C f4b57a5bd0fee4b8447fbcc9fd65b241 [1,0,0,1,0,0|2,0,0]=4 15474 B11R1.180 CSCCCN1CCCC1O 64bbbe7f1c23333d2af0b76e7561d34e [1,0,0,1,0,0|2,0,0]=4 15475 B11R1.180 CSCCCN1CCC[C@@H]1C 043111dc4fa2cca76b6855845f0abea8 [1,0,0,1,0,0|2,0,0]=4 15476 B11R1.180 CSCCCN1CCC[C@H]1C 20cf3324474c14b86e88c03a13f9228f [1,0,0,1,0,0|2,0,0]=4 15477 B11R1.180 CSCCNC1CCCC1O 54863a1dc9a32cf4d250a82fdffd08a8 [1,0,0,1,0,0|2,0,0]=4 15478 B11R1.180 CSCCN[C@@H]1CCC[C@@H]1O 50172978d5b3a9cee42ace94a21dc71e [1,0,0,1,0,0|2,0,0]=4 15479 B11R1.180 CSCCN[C@@H]1CCC[C@H]1O 1ed3fbc42f7771d9959e14fceb58d8af [1,0,0,1,0,0|2,0,0]=4 15480 B11R1.180 CSCCN[C@H]1CCC[C@@H]1O 4e3140a110663612ba4b4ad95e1d3eb9 [1,0,0,1,0,0|2,0,0]=4 15481 B11R1.180 CSCCN[C@H]1CCC[C@H]1O d81591c9c18517ccaddb839673316dd9 [1,0,0,1,0,0|2,0,0]=4 15482 B11R1.180 CSCCOC1CCCC1C 5543426e67f1f47bf87e90b546c84064 [1,0,0,1,0,0|2,0,0]=4 15483 B11R1.180 CSCCO[C@@H]1CCC[C@@H]1C de9e01f6d0bb41df7dc0f33cc3f6f8ad [1,0,0,1,0,0|2,0,0]=4 15484 B11R1.180 CSCCO[C@@H]1CCC[C@H]1C 1ee9332d854079447ca5c5e94bd9e6ad [1,0,0,1,0,0|2,0,0]=4 15485 B11R1.180 CSCCO[C@H]1CCC[C@@H]1C bbce509244253823c034577a02fadbc0 [1,0,0,1,0,0|2,0,0]=4 15486 B11R1.180 CSCCO[C@H]1CCC[C@H]1C aaaa1a3cd09090953a6c7bb2c326d2e4 [1,0,0,1,0,0|2,0,0]=4 15487 B11R1.180 CSCNCC1CCCC1O 88c13cb787206f7db91031365d7952ba [1,0,0,1,0,0|2,0,0]=4 15488 B11R1.180 CSCOCC1CCCC1C a12fb8fc49b7d331c6764e7154a18bf1 [1,0,0,1,0,0|2,0,0]=4 15489 B11R1.180 C[C@@H]1CCCN1CCCCF 409fd98b492d5074401fc716d44e19ae [1,0,0,1,0,0|2,0,0]=4 15490 B11R1.180 C[C@@H]1CCCN1CCCCO 52b2ae2b2f26360d62d1d124caf59cc6 [1,0,0,1,0,0|1,0,0]=3 15491 B11R1.180 C[C@@H]1CCC[C@@H]1OCCCF c7c0f76c996b63ba8795a91187f91c49 [1,0,0,1,0,0|2,0,0]=4 15492 B11R1.180 C[C@@H]1CCC[C@@H]1OCCCS f3fae79eda0a0707841901b375e81400 [1,0,0,1,0,0|1,1,0]=4 15493 B11R1.180 C[C@@H]1CCC[C@H]1OCCCF f63f46e5f62a39b3bf4b3a18e64a0e73 [1,0,0,1,0,0|2,0,0]=4 15494 B11R1.180 C[C@@H]1CCC[C@H]1OCCCS 744d40eea89ff9f205ebca6bae489c48 [1,0,0,1,0,0|1,1,0]=4 15495 B11R1.180 C[C@H]1CCCN1CCCCF beb048df1e8364d23716cf220574c2e7 [1,0,0,1,0,0|2,0,0]=4 15496 B11R1.180 C[C@H]1CCCN1CCCCO dec6a5199f71a07249a314463f71af58 [1,0,0,1,0,0|1,0,0]=3 15497 B11R1.180 C[C@H]1CCC[C@@H]1OCCCF 5d3722e7a068e0f70cf8f9281d762a77 [1,0,0,1,0,0|2,0,0]=4 15498 B11R1.180 C[C@H]1CCC[C@@H]1OCCCS 0643587dc8bec99d499884a0ec25fa9b [1,0,0,1,0,0|1,1,0]=4 15499 B11R1.180 C[C@H]1CCC[C@H]1OCCCF bedf10ab5c85b3eef44a43bf9153a181 [1,0,0,1,0,0|2,0,0]=4 15500 B11R1.180 C[C@H]1CCC[C@H]1OCCCS 00db28a956bc61647959696368fa0749 [1,0,0,1,0,0|1,1,0]=4 15501 B11R1.180 OC1CCCC1CNCCF d400743a5f5c9382428bb88ca381667b [1,0,0,1,0,0|2,0,0]=4 15502 B11R1.180 OC1CCCC1CNCCS 280e59d1b45952d3890f11c414d3caac [1,0,0,1,0,0|2,0,0]=4 15503 B11R1.180 OC1CCCC1NCCCCl 18e0dfa005e20a7794d37188320e60fa [1,0,0,1,0,0|2,0,0]=4 15504 B11R1.180 OC1CCCC1NCCCF d52eb209bdd8640e6735e0022131053c [1,0,0,1,0,0|2,0,0]=4 15505 B11R1.180 OC1CCCC1NCCCS ad5ad91bb8a1e477be3240fb65b15c57 [1,0,0,1,0,0|2,0,0]=4 15506 B11R1.180 OC1CCCN1CCCCF 2901c9635aad53a10ff2307c8c446994 [1,0,0,1,0,0|2,0,0]=4 15507 B11R1.180 OCCCCN1CCCC1O b66dc1eda917a4ce6d9edf8bad2b7f04 [1,0,0,1,0,0|2,0,0]=4 15508 B11R1.180 OCCCNC1CCCC1O 8a3dd0956c2a3350634eb03d9a5f83a3 [1,0,0,1,0,0|2,0,0]=4 15509 B11R1.180 OCCCN[C@@H]1CCC[C@@H]1O 6ec83be7912e80a6f332a2408ba85f3f [1,0,0,1,0,0|2,0,0]=4 15510 B11R1.180 OCCCN[C@@H]1CCC[C@H]1O 93070f5dd84082dc934e41926f52d278 [1,0,0,1,0,0|2,0,0]=4 15511 B11R1.180 OCCCN[C@H]1CCC[C@@H]1O 6f2193d4fbbd69d5a1672538370cd6dd [1,0,0,1,0,0|2,0,0]=4 15512 B11R1.180 OCCCN[C@H]1CCC[C@H]1O bcc6cdc902450ea66e5f517233207ef1 [1,0,0,1,0,0|2,0,0]=4 15513 B11R1.180 OCCNCC1CCCC1O 0e4bf9962add0552ede3a15df100d736 [1,0,0,1,0,0|2,0,0]=4 15514 B11R1.180 O[C@@H]1CCC[C@@H]1NCCCF 0566334efc972f4605dbd5cf456bd85c [1,0,0,1,0,0|2,0,0]=4 15515 B11R1.180 O[C@@H]1CCC[C@@H]1NCCCS 00c2ddbae242ed335bf835b6f98cca35 [1,0,0,1,0,0|2,0,0]=4 15516 B11R1.180 O[C@@H]1CCC[C@H]1NCCCCl c99f07634d03f6a9a62f3b57ca710903 [1,0,0,1,0,0|2,0,0]=4 15517 B11R1.180 O[C@@H]1CCC[C@H]1NCCCF 7d035eed9d029a50a5d9ca2905e25955 [1,0,0,1,0,0|2,0,0]=4 15518 B11R1.180 O[C@@H]1CCC[C@H]1NCCCS 4b469205667fd6e6ad5bd41366126633 [1,0,0,1,0,0|2,0,0]=4 15519 B11R1.180 O[C@H]1CCC[C@@H]1NCCCCl 4b7094728466c9027fb1629622957be6 [1,0,0,1,0,0|2,0,0]=4 15520 B11R1.180 O[C@H]1CCC[C@@H]1NCCCF 370bb80e64df8b4b9a38b81e52e2ef88 [1,0,0,1,0,0|2,0,0]=4 15521 B11R1.180 O[C@H]1CCC[C@@H]1NCCCS 54f03ddde825d1912b25a4bb5547c233 [1,0,0,1,0,0|2,0,0]=4 15522 B11R1.180 O[C@H]1CCC[C@H]1NCCCF 9d38eee4b52c5d8151f6fa6246dd365b [1,0,0,1,0,0|2,0,0]=4 15523 B11R1.180 O[C@H]1CCC[C@H]1NCCCS 3b7870cf7ccc2025ab0934b47937b7c7 [1,0,0,1,0,0|2,0,0]=4 15524 B11R1.181 CCC1CCN1CCCCF 4e2c724c021dbac46f773b44403d0bab [1,0,0,1,0,0|2,0,0]=4 15525 B11R1.181 CCC1CCN1CCCCO 6dcefaab7839eafb56d4489f1ad59479 [1,0,0,1,0,0|1,0,0]=3 15526 B11R1.181 CCC1CCN1CCCOC 46269441a6c4f7b08a2e7e0af8a8589b [1,0,0,1,0,0|2,0,0]=4 15527 B11R1.181 CCC1CCN1CCCSC 7360975a0bcf9cc17fb97b6505d6ca76 [1,0,0,1,0,0|2,0,0]=4 15528 B11R1.181 CCCCCN1CCC1CC d87c5a1952c60e2a0dc9773d9714a4e0 [1,0,0,1,0,0|1,0,0]=3 15529 B11R1.181 CCCCCN1CCC1CO 6df1327feaf83954da6b9a067cabb546 [1,0,0,1,0,0|1,0,0]=3 15530 B11R1.181 CCCCCN1CC[C@@H]1CO ea98adfd739b3f69e4fd108b2760c455 [1,0,0,1,0,0|1,0,0]=3 15531 B11R1.181 CCCCCN1CC[C@H]1CO 762996ba67c76ae98634a15c6d26763b [1,0,0,1,0,0|1,0,0]=3 15532 B11R1.181 CCCCNC1CCC1OC 6dd31c065a28468fcce35b5e7bfa21f4 [1,0,0,1,0,0|2,0,0]=4 15533 B11R1.181 CCCCN[C@@H]1CC[C@@H]1OC fea0702715db67b15cf6921d6b2b52ad [1,0,0,1,0,0|2,0,0]=4 15534 B11R1.181 CCCCN[C@@H]1CC[C@H]1OC 9dd153bb410ea57c19a91ae73dea2e33 [1,0,0,1,0,0|2,0,0]=4 15535 B11R1.181 CCCCN[C@H]1CC[C@@H]1OC d32ffa27bccaa77e5e280a400aac6371 [1,0,0,1,0,0|2,0,0]=4 15536 B11R1.181 CCCCN[C@H]1CC[C@H]1OC ec311279d24da909fb79a29807b1b885 [1,0,0,1,0,0|2,0,0]=4 15537 B11R1.181 CCCOCC1CCC1OC 72fa20f1c9722a919d48ee92d51e59bd [1,0,0,1,0,0|2,0,0]=4 15538 B11R1.181 CCCOC[C@@H]1CC[C@H]1OC 510ab44498952463dd6a2987759beafc [1,0,0,1,0,0|2,0,0]=4 15539 B11R1.181 CCCOC[C@H]1CC[C@H]1OC 3dfba8b44a94e76109f506a548ded20f [1,0,0,1,0,0|2,0,0]=4 15540 B11R1.181 CCOCCN1CCC1CC 905d8055dd619186f482aabd7a6bf1c9 [1,0,0,1,0,0|2,0,0]=4 15541 B11R1.181 CCOCCN1CCC1CO aff21467892f481418f7af6157163063 [1,0,0,1,0,0|2,0,0]=4 15542 B11R1.181 CCOCCN1CC[C@@H]1CO e89fc01bb266118820e69a78d0e9ba81 [1,0,0,1,0,0|2,0,0]=4 15543 B11R1.181 CCOCCN1CC[C@H]1CO 1dce2ed3765b7a9eb16f9579e88ca9ce [1,0,0,1,0,0|2,0,0]=4 15544 B11R1.181 CCSCCN1CCC1CC 08fca5fd4ac185ab96f1212290b39dcc [1,0,0,1,0,0|2,0,0]=4 15545 B11R1.181 CCSCCN1CCC1CO 54ae70e88c8beacf4b605a641ae2f771 [1,0,0,1,0,0|2,0,0]=4 15546 B11R1.181 CCSCCN1CC[C@@H]1CO e9955121b2491b2de801e46491864ad1 [1,0,0,1,0,0|2,0,0]=4 15547 B11R1.181 CCSCCN1CC[C@H]1CO 7261c4b45f6fdee88a5b316c3e9c56da [1,0,0,1,0,0|2,0,0]=4 15548 B11R1.181 COC1CCC1NCCCO b345c861eda2ef7fc1d6c16af2c38bed [1,0,0,1,0,0|2,0,0]=4 15549 B11R1.181 COCCCN1CCC1CO 65a7d8e408b06643ad6c461f044c3566 [1,0,0,1,0,0|2,0,0]=4 15550 B11R1.181 COCCCN1CC[C@@H]1CO 9b340f1907cd68f46fbdce99f6d2932b [1,0,0,1,0,0|2,0,0]=4 15551 B11R1.181 COCCCN1CC[C@H]1CO 5aa67e064640ff045d1f6232a525f2f2 [1,0,0,1,0,0|2,0,0]=4 15552 B11R1.181 CO[C@@H]1CC[C@@H]1NCCCO 266adfd0bc08dbcf7e54c932b48635b2 [1,0,0,1,0,0|2,0,0]=4 15553 B11R1.181 CO[C@@H]1CC[C@H]1NCCCO d1eb85ae6340e68bfb320ece4eb054ad [1,0,0,1,0,0|2,0,0]=4 15554 B11R1.181 CO[C@H]1CC[C@@H]1NCCCO 34e0ccbbb01399e43a54b5d30cec5a65 [1,0,0,1,0,0|2,0,0]=4 15555 B11R1.181 CO[C@H]1CC[C@H]1NCCCO c74fa114de4299f7d428f618273e9d1a [1,0,0,1,0,0|2,0,0]=4 15556 B11R1.181 CSCCCN1CCC1CO 2ddbe57a428de1745fb0ae6ffc404577 [1,0,0,1,0,0|2,0,0]=4 15557 B11R1.181 CSCCCN1CC[C@@H]1CO af8e99db2d0954bf741eeabbe1071bf8 [1,0,0,1,0,0|2,0,0]=4 15558 B11R1.181 CSCCCN1CC[C@H]1CO 9a85296fe7f60058cf896ae5c18dac16 [1,0,0,1,0,0|2,0,0]=4 15559 B11R1.181 OCC1CCN1CCCCF 0a07c738fd9fe3a3890c40b2a2240c79 [1,0,0,1,0,0|2,0,0]=4 15560 B11R1.181 OCCCCN1CCC1CO 97cdd2bae2f68b3b41abae5a2399cbe7 [1,0,0,1,0,0|2,0,0]=4 15561 B11R1.181 OCCCCN1CC[C@@H]1CO 386401a992931ec0545f8db5387160d7 [1,0,0,1,0,0|2,0,0]=4 15562 B11R1.181 OCCCCN1CC[C@H]1CO b5c607c2e49f89874699a7427b6edbff [1,0,0,1,0,0|2,0,0]=4 15563 B11R1.181 OC[C@@H]1CCN1CCCCF 6b1654def6b05c5b92c1d21b155c5abe [1,0,0,1,0,0|2,0,0]=4 15564 B11R1.181 OC[C@H]1CCN1CCCCF 70f6399e0ea6f7e05db4e2829390c6ff [1,0,0,1,0,0|2,0,0]=4 15565 B11R1.190 CC1OCC1NCCCCO 4b8bce5f107b2ee705a2586fda914f46 [1,0,0,1,0,0|2,0,0]=4 15566 B11R1.190 CCCCCNC1CCC1F a146047d38c3bdd9090085a413871235 [1,0,0,1,0,0|2,0,0]=4 15567 B11R1.190 CCCCCNC1CCC1O 410aa34364c82b055bc5985073043c05 [1,0,0,1,0,0|1,0,0]=3 15568 B11R1.190 CCCCCNC1COC1C 3aacd0a2a062c954e2541a06a482d870 [1,0,0,1,0,0|2,0,0]=4 15569 B11R1.190 CCCCCN[C@@H]1CC[C@@H]1O 3bfddf88d98d6ab4994d6784c3fd6517 [1,0,0,1,0,0|1,0,0]=3 15570 B11R1.190 CCCCCN[C@@H]1CC[C@H]1C 002f44fb3ffabbe6605e6c3f7dd381bf [1,0,0,1,0,0|1,0,0]=3 15571 B11R1.190 CCCCCN[C@@H]1CC[C@H]1O 34c028bce85047ac0c4cc16404f41087 [1,0,0,1,0,0|1,0,0]=3 15572 B11R1.190 CCCCCN[C@H]1CC[C@@H]1O 5ea4d0eba39dbdbad00d06d8e47d31a3 [1,0,0,1,0,0|1,0,0]=3 15573 B11R1.190 CCCCCN[C@H]1CC[C@H]1C 5a06436e33acd44359303f29494f2b5b [1,0,0,1,0,0|1,0,0]=3 15574 B11R1.190 CCCCCN[C@H]1CC[C@H]1O cba60cfc8498948982fdaefc9b5ecaf9 [1,0,0,1,0,0|1,0,0]=3 15575 B11R1.190 CCCCCOC1COC1C a62b7a902b7662df8ccd5c7e3e430cf6 [1,0,0,1,0,0|2,0,0]=4 15576 B11R1.190 CCCCNCC1CCN1C 59187fb9acd1a125bedab51e19941618 [1,0,0,1,0,0|2,0,0]=4 15577 B11R1.190 CCCCOCC1CCC1F 242777143ecb2cd46f7a74061f6d0e4f [1,0,0,1,0,0|2,0,0]=4 15578 B11R1.190 CCCCOCC1CCN1C 7921ea40754a8b7abe3e2e4c83e7b4e2 [1,0,0,1,0,0|2,0,0]=4 15579 B11R1.190 CCCCOC[C@@H]1CCN1C 58a093bd1a5865018cd62b7c89d1854a [1,0,0,1,0,0|2,0,0]=4 15580 B11R1.190 CCCCOC[C@H]1CCN1C f9b70a340c96b2720df6380bfaf0b4cf [1,0,0,1,0,0|2,0,0]=4 15581 B11R1.190 CCOCCNC1CCC1O 888f67b278d647ce0f6b2e80d72a24a3 [1,0,0,1,0,0|2,0,0]=4 15582 B11R1.190 CCOCCN[C@@H]1CC[C@@H]1O ab59ccc276db747148ad6466116c9387 [1,0,0,1,0,0|2,0,0]=4 15583 B11R1.190 CCOCCN[C@@H]1CC[C@H]1C ad194e9ee9d537eff7e698e30ef07ee9 [1,0,0,1,0,0|2,0,0]=4 15584 B11R1.190 CCOCCN[C@@H]1CC[C@H]1O 19885a1aa16bd97729c264da10a808d3 [1,0,0,1,0,0|2,0,0]=4 15585 B11R1.190 CCOCCN[C@H]1CC[C@@H]1O b5e8bc658eab308a0f31ce6a466fd6d7 [1,0,0,1,0,0|2,0,0]=4 15586 B11R1.190 CCOCCN[C@H]1CC[C@H]1C 36ccc8c9cea2fed5b7601483e25fe26f [1,0,0,1,0,0|2,0,0]=4 15587 B11R1.190 CCOCCN[C@H]1CC[C@H]1O db6ad1f5f8bcb2f042fe484cbae3475a [1,0,0,1,0,0|2,0,0]=4 15588 B11R1.190 CCSCCNC1CCC1O b5da4f89bfb7e96826030cf572c5bd00 [1,0,0,1,0,0|2,0,0]=4 15589 B11R1.190 CCSCCN[C@@H]1CC[C@@H]1O 03b7ee50a2e77e424906524293032c23 [1,0,0,1,0,0|2,0,0]=4 15590 B11R1.190 CCSCCN[C@@H]1CC[C@H]1C bcf639639fb1c5088cfd22484bb8e8a0 [1,0,0,1,0,0|2,0,0]=4 15591 B11R1.190 CCSCCN[C@@H]1CC[C@H]1O 353b8ca7e3c3afc4992556d718aea45c [1,0,0,1,0,0|2,0,0]=4 15592 B11R1.190 CCSCCN[C@H]1CC[C@@H]1O 956be0e55a58973d1ca526dee0b9e479 [1,0,0,1,0,0|2,0,0]=4 15593 B11R1.190 CCSCCN[C@H]1CC[C@H]1C 2c9bbae2dd8fa39064c087574f90d30f [1,0,0,1,0,0|2,0,0]=4 15594 B11R1.190 CCSCCN[C@H]1CC[C@H]1O b42475c93ce402c6b078d5af8a989387 [1,0,0,1,0,0|2,0,0]=4 15595 B11R1.190 CN1CCC1CNCCCO a018078d54f2080aec1d0e0a895c42b5 [1,0,0,1,0,0|2,0,0]=4 15596 B11R1.190 COCCCNC1CCC1O 095285c26f97e7ac8f4f8db049b9c789 [1,0,0,1,0,0|2,0,0]=4 15597 B11R1.190 COCCCN[C@@H]1CC[C@@H]1O 67e2f9284a43922bd9364245d5928348 [1,0,0,1,0,0|2,0,0]=4 15598 B11R1.190 COCCCN[C@@H]1CC[C@H]1C 826b3e57120693f986adb89e6cc0991f [1,0,0,1,0,0|2,0,0]=4 15599 B11R1.190 COCCCN[C@@H]1CC[C@H]1O 046177c2a5259ec713a6ea103c25597a [1,0,0,1,0,0|2,0,0]=4 15600 B11R1.190 COCCCN[C@H]1CC[C@@H]1O e599502f914828e9108f42cc892f3954 [1,0,0,1,0,0|2,0,0]=4 15601 B11R1.190 COCCCN[C@H]1CC[C@H]1C 3f223401a883ce99a1cd2fe9e324b427 [1,0,0,1,0,0|2,0,0]=4 15602 B11R1.190 COCCCN[C@H]1CC[C@H]1O 69cd296efbf0928bd2fb588d6020e25a [1,0,0,1,0,0|2,0,0]=4 15603 B11R1.190 CSCCCNC1CCC1O 8f720d7f95e9aca2ab3d0aa7bd56e81a [1,0,0,1,0,0|2,0,0]=4 15604 B11R1.190 CSCCCN[C@@H]1CC[C@@H]1O 125233f6d67f5f81560b5921410b28e2 [1,0,0,1,0,0|2,0,0]=4 15605 B11R1.190 CSCCCN[C@@H]1CC[C@H]1C 9b2ce1325def3cd8b0c20af467c148b0 [1,0,0,1,0,0|2,0,0]=4 15606 B11R1.190 CSCCCN[C@@H]1CC[C@H]1O d4ca26b298458188ab75a890f7fdde03 [1,0,0,1,0,0|2,0,0]=4 15607 B11R1.190 CSCCCN[C@H]1CC[C@@H]1O 5de2b3ad49523d1e7bd903a022b47c8e [1,0,0,1,0,0|2,0,0]=4 15608 B11R1.190 CSCCCN[C@H]1CC[C@H]1C 97fb8ea0d29def8c1641dd83258af688 [1,0,0,1,0,0|2,0,0]=4 15609 B11R1.190 CSCCCN[C@H]1CC[C@H]1O 3e70414eb2fc9a5ddcdf319a511a1fb5 [1,0,0,1,0,0|2,0,0]=4 15610 B11R1.190 C[C@@H]1CC[C@@H]1NCCCCF 16dce8f512c64f41f6ee76e79a1bff6c [1,0,0,1,0,0|2,0,0]=4 15611 B11R1.190 C[C@@H]1CC[C@@H]1NCCCCO c2c4c81afcf85f006543b04a37b79bd9 [1,0,0,1,0,0|1,0,0]=3 15612 B11R1.190 C[C@@H]1CC[C@H]1NCCCCF be98bc6df968f8eeca5535b6e1a13330 [1,0,0,1,0,0|2,0,0]=4 15613 B11R1.190 C[C@@H]1CC[C@H]1NCCCCO a770862bc7b5c32bf6b9dd31ff6f528b [1,0,0,1,0,0|1,0,0]=3 15614 B11R1.190 OC1CCC1NCCCCF ba7aa6a0f9264dcace9d393dc2797e4a [1,0,0,1,0,0|2,0,0]=4 15615 B11R1.190 OCCCCNC1CCC1F a5d9ff4e2b2a6e8378487e4f9270109c [1,0,0,1,0,0|2,0,0]=4 15616 B11R1.190 OCCCCNC1CCC1O 64d8235aab4476b9671dcf52ed1c172e [1,0,0,1,0,0|2,0,0]=4 15617 B11R1.190 OCCCCN[C@@H]1CC[C@@H]1O 13bd1e0e209b16e3063ec805208c38fc [1,0,0,1,0,0|2,0,0]=4 15618 B11R1.190 OCCCCN[C@@H]1CC[C@H]1O 7a4ba4aa9658c1afa13780657f096367 [1,0,0,1,0,0|2,0,0]=4 15619 B11R1.190 OCCCCN[C@H]1CC[C@@H]1O 208811e5675a1eaca802f97b83fdb19e [1,0,0,1,0,0|2,0,0]=4 15620 B11R1.190 OCCCCN[C@H]1CC[C@H]1O dffa24fcfbc283facf1b084e166da9c0 [1,0,0,1,0,0|2,0,0]=4 15621 B11R1.190 O[C@@H]1CC[C@@H]1NCCCCF aa099edae22aac90041fa6b9f6c9ae47 [1,0,0,1,0,0|2,0,0]=4 15622 B11R1.190 O[C@@H]1CC[C@H]1NCCCCF aae6d18bed42683e53ab59fc742658ca [1,0,0,1,0,0|2,0,0]=4 15623 B11R1.190 O[C@H]1CC[C@@H]1NCCCCF 79083ad6aec069000995b4afc25dbb7d [1,0,0,1,0,0|2,0,0]=4 15624 B11R1.190 O[C@H]1CC[C@H]1NCCCCF f89379a99d7024ad1c63ae39a9ea7579 [1,0,0,1,0,0|2,0,0]=4 15625 B11R1.203 BrCCNC1CCCCCC1 ae90443e89339ced20423fff423e45af [1,0,0,1,0,0|2,0,0]=4 15626 B11R1.203 CCCCN1CCCCCC1 efa7754fb7e0af662a839d9bbcf60db4 [1,0,0,1,0,0|1,0,0]=3 15627 B11R1.203 CCCCN1CCCOCC1 19d0fd66efe6b0b2db8f039245a02376 [1,0,0,1,0,0|2,0,0]=4 15628 B11R1.203 CCCNC1CCCCCC1 be3afd6091ac207b6cf40b281273c757 [1,0,0,1,0,0|1,0,0]=3 15629 B11R1.203 CCCNC1CCCOCC1 d7a04daa48d12eea8d4a8374a1ad7adc [1,0,0,1,0,0|2,0,0]=4 15630 B11R1.203 CCCOC1CCCCCC1 a0d3b974b653d57eb78c12eb297baa1e [1,0,0,1,0,0|1,0,0]=3 15631 B11R1.203 CCCOC1CCCOCC1 e6ba70a1eee68a270651209b5c88918d [1,0,0,1,0,0|2,0,0]=4 15632 B11R1.203 CCNCC1CCCCCC1 1aa480dec958b76c9e0d1e012a7b0c7e [1,0,0,1,0,0|1,0,0]=3 15633 B11R1.203 CCOCC1CCCCCC1 01b51887c2e87b16f92024e3ab52aa12 [1,0,0,1,0,0|1,0,0]=3 15634 B11R1.203 CCOCN1CCCCCC1 77048636f84233a3974266d958aff3ff [1,0,0,1,0,0|2,0,0]=4 15635 B11R1.203 COCCN1CCCCCC1 3dad7161692272ba66df5a2a0151998c [1,0,0,1,0,0|2,0,0]=4 15636 B11R1.203 COCNC1CCCCCC1 b53fc949bfa9200dcabd9c186f6cee1b [1,0,0,1,0,0|2,0,0]=4 15637 B11R1.203 COCOC1CCCCCC1 c669f7add16d44cc1d0541c9bd6617f7 [1,0,0,1,0,0|2,0,0]=4 15638 B11R1.203 CSCCN1CCCCCC1 5085844863e997aca09c0ca620bf2431 [1,0,0,1,0,0|2,0,0]=4 15639 B11R1.203 CSCNC1CCCCCC1 335e9ecfeb1a192cc410ee1640570a5e [1,0,0,1,0,0|2,0,0]=4 15640 B11R1.203 CSCOC1CCCCCC1 90eec6a2a8287bbaa85dcf4e8ba247e3 [1,0,0,1,0,0|2,0,0]=4 15641 B11R1.203 FCCCN1CCCCCC1 286aa5f65f2356d25aa5f8717fd29819 [1,0,0,1,0,0|2,0,0]=4 15642 B11R1.203 FCCNC1CCCCCC1 0ec892e340700017c8b0f151d96ecf76 [1,0,0,1,0,0|2,0,0]=4 15643 B11R1.203 FCCOC1CCCCCC1 7a234923a4de254fa31b1ac546f7c56f [1,0,0,1,0,0|2,0,0]=4 15644 B11R1.203 FCNCC1CCCCCC1 6b0a864b08319c0eb2cd929ab72f5c9a [1,0,0,1,0,0|2,0,0]=4 15645 B11R1.203 FCOCC1CCCCCC1 180d24b69547b24cf74154898667164f [1,0,0,1,0,0|2,0,0]=4 15646 B11R1.203 ICCNC1CCCCCC1 cedf21d151d665c616dac62990c7c7df [1,0,0,1,0,0|2,0,0]=4 15647 B11R1.203 OCCCN1CCCCCC1 7f2d557aa733fe77dff5c07ecf424d3d [1,0,0,1,0,0|1,0,0]=3 15648 B11R1.203 OCCCN1CCCOCC1 2e324c5015d8d8250de47215d420842d [1,0,0,1,0,0|2,0,0]=4 15649 B11R1.203 OCCNC1CCCCCC1 c34d7831eecf639a92fdf0e477751492 [1,0,0,1,0,0|1,0,0]=3 15650 B11R1.203 OCCNC1CCCOCC1 997af834a76af838373d4159ab17cadd [1,0,0,1,0,0|2,0,0]=4 15651 B11R1.203 OCNCC1CCCCCC1 e9833a8d1bf4aa3da84560a76f5e3a41 [1,0,0,1,0,0|1,0,0]=3 15652 B11R1.203 SCCCN1CCCCCC1 796211e099c2c8dd18076af50beb69b0 [1,0,0,1,0,0|1,1,0]=4 15653 B11R1.203 SCCNC1CCCCCC1 8f2f93f10cc68a000bb25c717544bf7f [1,0,0,1,0,0|1,1,0]=4 15654 B11R1.203 SCCOC1CCCCCC1 75478865fa94ff788ac8d34e86861fcf [1,0,0,1,0,0|1,1,0]=4 15655 B11R1.229 CCCCCN[C@@H]1C[C@@H]1OC 63674d81d87e11799b63402fb3c65a52 [1,0,0,1,0,0|2,0,0]=4 15656 B11R1.229 CCCCCN[C@@H]1C[C@H]1CO 8b78761299fc677978c31200332d44e4 [1,0,0,1,0,0|1,0,0]=3 15657 B11R1.229 CCCCCN[C@H]1C[C@@H]1CO ad2e5841e2feda90ba186db0742959c3 [1,0,0,1,0,0|1,0,0]=3 15658 B11R1.229 CCCCCN[C@H]1C[C@H]1CO 966bfeaedb6c59f4f814c88b606b70dc [1,0,0,1,0,0|1,0,0]=3 15659 B11R1.229 CCCCNCC1CC1CO a1a4d242388b6021686f25289a5a519b [1,0,0,1,0,0|1,0,0]=3 15660 B11R1.229 CCOCCN[C@@H]1C[C@H]1CO 64307326afacf77979435ebbd020c2ca [1,0,0,1,0,0|2,0,0]=4 15661 B11R1.229 CCOCCN[C@H]1C[C@@H]1CO bd718bd0a9c60c147807433a10a33235 [1,0,0,1,0,0|2,0,0]=4 15662 B11R1.229 CCOCCN[C@H]1C[C@H]1CO fb4ef4e8c9274daa48d4bd21873d70b5 [1,0,0,1,0,0|2,0,0]=4 15663 B11R1.229 CCOCNCC1CC1CO 4e3b9eada9f88b283c828970fd26998f [1,0,0,1,0,0|2,0,0]=4 15664 B11R1.229 CCSCCN[C@@H]1C[C@H]1CO 442fdb2e374c7eb0c8bd11e777e1e9ad [1,0,0,1,0,0|2,0,0]=4 15665 B11R1.229 CCSCCN[C@H]1C[C@@H]1CO e9c76b848ad70288b5b4653392a94478 [1,0,0,1,0,0|2,0,0]=4 15666 B11R1.229 CCSCCN[C@H]1C[C@H]1CO 55d12d2e31b6082405a56c9760421688 [1,0,0,1,0,0|2,0,0]=4 15667 B11R1.229 COCCCN[C@@H]1C[C@H]1CO 4818fc99858130dd82e203c082ff61fa [1,0,0,1,0,0|2,0,0]=4 15668 B11R1.229 COCCCN[C@H]1C[C@@H]1CO dbe58b21837097209afbc3e268e583b0 [1,0,0,1,0,0|2,0,0]=4 15669 B11R1.229 COCCCN[C@H]1C[C@H]1CO f669c87f240893d60a64084e82849f6c [1,0,0,1,0,0|2,0,0]=4 15670 B11R1.229 COCCNCC1CC1CO e4ad88a7d844954b3550bb21d86e68a8 [1,0,0,1,0,0|2,0,0]=4 15671 B11R1.229 CO[C@H]1C[C@H]1NCCCCO 80b6380a79b616c78bd9a45f94a008f8 [1,0,0,1,0,0|2,0,0]=4 15672 B11R1.229 CSCCCN[C@@H]1C[C@H]1CO 155d82c9174823e01afbf65f57dfac9e [1,0,0,1,0,0|2,0,0]=4 15673 B11R1.229 CSCCCN[C@H]1C[C@@H]1CO 8f5886cd5c86100984a284f3ec671cdd [1,0,0,1,0,0|2,0,0]=4 15674 B11R1.229 CSCCCN[C@H]1C[C@H]1CO 15ef1900ed84603944fae3e39bc78659 [1,0,0,1,0,0|2,0,0]=4 15675 B11R1.229 CSCCNCC1CC1CO 85ca0428ab087bfa1d647d7cb8829db5 [1,0,0,1,0,0|2,0,0]=4 15676 B11R1.229 OCC1CC1CNCCCF c707450a1b8b9a19a7101d3816b029b1 [1,0,0,1,0,0|2,0,0]=4 15677 B11R1.229 OCC1CC1CNCCCS 860b7b76373886ea43eb9dcb9e60e87e [1,0,0,1,0,0|2,0,0]=4 15678 B11R1.229 OCCCCN[C@@H]1C[C@H]1CO 82aecec8f1e5c92991a31cc98a3cdcdb [1,0,0,1,0,0|2,0,0]=4 15679 B11R1.229 OCCCCN[C@H]1C[C@@H]1CO 8cd870158238a85a7e152fb28022d422 [1,0,0,1,0,0|2,0,0]=4 15680 B11R1.229 OCCCCN[C@H]1C[C@H]1CO 485d69b49e06646fbb165f6f852c8f43 [1,0,0,1,0,0|2,0,0]=4 15681 B11R1.229 OCCCNCC1CC1CO 625183df8d96001a6b9256d283d9fc00 [1,0,0,1,0,0|2,0,0]=4 15682 B11R1.229 OC[C@@H]1C[C@@H]1NCCCCF 878154fc407b359fae2ab9b4de7fa21d [1,0,0,1,0,0|2,0,0]=4 15683 B11R1.229 OC[C@@H]1C[C@H]1NCCCCF d056fc1fd2600f20c532ba5e6a3a5e01 [1,0,0,1,0,0|2,0,0]=4 15684 B11R1.229 OC[C@H]1C[C@@H]1NCCCCF cd05d48819831ab790afd8dc570d83f6 [1,0,0,1,0,0|2,0,0]=4 15685 B11R1.232 CCCCN1CCC1CCO cf9681096b6146bae176348e6db94d0e [1,0,0,1,0,0|1,0,0]=3 15686 B11R1.232 CCCCN1CCC1COC f8113ba5b9860b2308ca20cdeb064fd9 [1,0,0,1,0,0|2,0,0]=4 15687 B11R1.232 CCCCN1CC[C@@H]1COC ef56a20b5f3427cdb33f97a35fc8482e [1,0,0,1,0,0|2,0,0]=4 15688 B11R1.232 CCCCN1CC[C@H]1COC 8e610828e0c6117889dc3e7da9a6db3a [1,0,0,1,0,0|2,0,0]=4 15689 B11R1.232 CCOCN1CCC1CCO 3183dc10af0495891db972029c74f643 [1,0,0,1,0,0|2,0,0]=4 15690 B11R1.232 COCC1CCN1CCCO 27c786ae462c78957e953f3db3df2e0e [1,0,0,1,0,0|2,0,0]=4 15691 B11R1.232 COCCN1CCC1CCO 5d1cc46a80c71547c5db13caf43a7556 [1,0,0,1,0,0|2,0,0]=4 15692 B11R1.232 COC[C@@H]1CCN1CCCO eecc6d018fa5ad50e8b96412c110711d [1,0,0,1,0,0|2,0,0]=4 15693 B11R1.232 COC[C@H]1CCN1CCCO 47008a6c9d2f1fcc8652eaae22b234ea [1,0,0,1,0,0|2,0,0]=4 15694 B11R1.232 CSCCN1CCC1CCO 988fdc18eec652be49854dc9f9a484a5 [1,0,0,1,0,0|2,0,0]=4 15695 B11R1.232 OCCC1CCN1CCCF 5b06945efe7d39a1c707c8ffadabf1e7 [1,0,0,1,0,0|2,0,0]=4 15696 B11R1.232 OCCC1CCN1CCCS 318f3c89da5970551e6abe00d5a647c8 [1,0,0,1,0,0|2,0,0]=4 15697 B11R1.232 OCCCN1CCC1CCO bffd62dc55e8861ab618ddac7b58ac9c [1,0,0,1,0,0|2,0,0]=4 15698 B11R1.248 CCN1CCCCCCCC1 74e8e77a0fa5757a1cb015979f1ae5bd [1,0,0,1,0,0|1,0,0]=3 15699 B11R1.248 FCN1CCCCCCCC1 d12c1c9053a2b8e6a830250dbbb63442 [1,0,0,1,0,0|2,0,0]=4 15700 B11R1.248 OCN1CCCCCCCC1 34093a305ba2dc113fc49a0d96d53af5 [1,0,0,1,0,0|1,0,0]=3 15701 B13R1.27 C#CCCCCCN1CCC(C1)O 4e368af5440a4bf96ef75a848a78a6e1 [0,1,0,1,0,0|0,0,2]=4 15702 B13R1.27 C#CCCCCCN1CC[C@@H](C1)O 9bf1b6f79fab978192af5181e46a8fde [0,1,0,1,0,0|0,0,2]=4 15703 B13R1.27 C#CCCCCCN1CC[C@H](C1)O 04672348a167327f1018f1359b75510d [0,1,0,1,0,0|0,0,2]=4 15704 B13R1.27 C#CCCCCNC1CCC(C1)O 6145b3baccdcb0383298edae63292985 [0,1,0,1,0,0|0,0,2]=4 15705 B13R1.27 C#CCCCCN[C@@H]1CC[C@@H](C1)O 7c268f9fad089b792d1d1aba89ccbd72 [0,1,0,1,0,0|0,0,2]=4 15706 B13R1.27 C#CCCCCN[C@@H]1CC[C@H](C1)O 1a210bab3237beb451c6156d19e51472 [0,1,0,1,0,0|0,0,2]=4 15707 B13R1.27 C#CCCCCN[C@H]1CC[C@@H](C1)O d107ccc2f6853675bb73f488b6fa0e6e [0,1,0,1,0,0|0,0,2]=4 15708 B13R1.27 C#CCCCCN[C@H]1CC[C@H](C1)O c967eacbd466f35000d1c891a67f6254 [0,1,0,1,0,0|0,0,2]=4 15709 B13R1.27 C#CCCCNCC1CCC(C1)O 4bf35b2a760c76699ce33100ed4b24a3 [0,1,0,1,0,0|0,0,2]=4 15710 B13R1.27 C#CCCCOCC1CCC(O1)C abeebe915f01f99b1ad3cfab26732cb7 [0,1,0,1,0,0|0,0,2]=4 15711 B13R1.27 C#CCCCOC[C@@H]1CC[C@@H](O1)C e437c090a6a726ea9fcbcff23e9c3939 [0,1,0,1,0,0|0,0,2]=4 15712 B13R1.27 C/C=C\CCCNC1CCC(C1)O 4207c9e6287b92bc9a66b95770999b8b [0,1,0,1,0,0|0,0,2]=4 15713 B13R1.27 C/C=C\CCCN[C@@H]1CC[C@@H](C1)O ba900e5ed68078063b081a2d5ad7899b [0,1,0,1,0,0|0,0,2]=4 15714 B13R1.27 C/C=C\CCCN[C@@H]1CC[C@H](C1)O d778874bfb3c806eb6eb666adb07084e [0,1,0,1,0,0|0,0,2]=4 15715 B13R1.27 C/C=C\CCCN[C@H]1CC[C@@H](C1)O 8380fc9ceee1e378ea3fc882aacddaa3 [0,1,0,1,0,0|0,0,2]=4 15716 B13R1.27 C/C=C\CCCN[C@H]1CC[C@H](C1)O 4a720edc21960b450b2b74ac50c25ad3 [0,1,0,1,0,0|0,0,2]=4 15717 B13R1.27 C=CCCCCCN1CCC(C1)O fb548003e4b30b464ca1a2bca9fd04cd [0,1,0,1,0,0|0,0,2]=4 15718 B13R1.27 C=CCCCCCN1CC[C@@H](C1)O d7a0744b4047b578de7b7472d77de97b [0,1,0,1,0,0|0,0,2]=4 15719 B13R1.27 C=CCCCCCN1CC[C@H](C1)O 2ba073d18a474518a1ba81e5769ff843 [0,1,0,1,0,0|0,0,2]=4 15720 B13R1.27 C=CCCCCNC1CCC(C1)O f9aa317497419a9d3143ee0a340cd92d [0,1,0,1,0,0|0,0,2]=4 15721 B13R1.27 C=CCCCCN[C@@H]1CC[C@@H](C1)O 3d4c5bcb8691210ac845ba212e1357be [0,1,0,1,0,0|0,0,2]=4 15722 B13R1.27 C=CCCCCN[C@@H]1CC[C@H](C1)O 71d50b1cd46e4a235ed2e8f2764489a5 [0,1,0,1,0,0|0,0,2]=4 15723 B13R1.27 C=CCCCCN[C@H]1CC[C@@H](C1)O 1db777169ac9002e21d7231b50c28e6a [0,1,0,1,0,0|0,0,2]=4 15724 B13R1.27 C=CCCCCN[C@H]1CC[C@H](C1)O c1c9dca8f3da166bccd4e2322d398321 [0,1,0,1,0,0|0,0,2]=4 15725 B13R1.27 C=CCCCNCC1CCC(C1)O 6005fd553c8877712e90545bb5a7d1b0 [0,1,0,1,0,0|0,0,2]=4 15726 B13R1.27 C=CCCCOCC1CCC(O1)C 9be0d18322b6d2519531ba2b930643b5 [0,1,0,1,0,0|0,0,2]=4 15727 B13R1.27 C=CCCCOC[C@@H]1CC[C@@H](O1)C 3752053927c09d6af86a2acfe1e6936c [0,1,0,1,0,0|0,0,2]=4 15728 B13R1.27 CC#CCCCNC1CCC(C1)O 07d2c9fc3ae845d012e7e89b2ba1836f [0,1,0,1,0,0|0,0,2]=4 15729 B13R1.27 CC#CCCCN[C@@H]1CC[C@@H](C1)O d395275076bd86482d68f842025e0182 [0,1,0,1,0,0|0,0,2]=4 15730 B13R1.27 CC#CCCCN[C@@H]1CC[C@H](C1)O 26793a4354745a8a1d35c2cd13f457d9 [0,1,0,1,0,0|0,0,2]=4 15731 B13R1.27 CC#CCCCN[C@H]1CC[C@@H](C1)O 018a5a70fc4f6e2ff7c9138fa8a75a00 [0,1,0,1,0,0|0,0,2]=4 15732 B13R1.27 CC#CCCCN[C@H]1CC[C@H](C1)O aaf39f7700d3f0df56f8c3a8fca3f07b [0,1,0,1,0,0|0,0,2]=4 15733 B13R1.27 CC/C=C/CNCC1CCC(C1)O c243cfe1928807fee2f067ebd745a945 [0,1,0,1,0,0|0,0,2]=4 15734 B13R1.27 CC/C=C/COCC1CCC(O1)C 8e377fd7f38f351fee283416d1ca493e [0,1,0,1,0,0|0,0,2]=4 15735 B13R1.27 CC/C=C/COC[C@@H]1CC[C@@H](O1)C 61ba98d563f5414cfb918bbdab356be4 [0,1,0,1,0,0|0,0,2]=4 15736 B13R1.27 CC/C=C\CCNC1CCC(C1)O 589f1a8148f119efb7069b8ba0ae5b72 [0,1,0,1,0,0|0,0,2]=4 15737 B13R1.27 CC/C=C\CCN[C@@H]1CC[C@@H](C1)O 055271f89d48d0ed8d98b621100d77f3 [0,1,0,1,0,0|0,0,2]=4 15738 B13R1.27 CC/C=C\CCN[C@@H]1CC[C@H](C1)O fc57783316c84daa6cc864632bf3ee5b [0,1,0,1,0,0|0,0,2]=4 15739 B13R1.27 CC/C=C\CCN[C@H]1CC[C@@H](C1)O 6142c69716cbac7263760be48763a51e [0,1,0,1,0,0|0,0,2]=4 15740 B13R1.27 CC/C=C\CCN[C@H]1CC[C@H](C1)O fd3c38b79160b79ea788d5a9b1a6ef2c [0,1,0,1,0,0|0,0,2]=4 15741 B13R1.27 CC1CC(CO1)NCCCCCCl 7cdbd72d53ac9d37b3ff6592f9436712 [0,1,0,1,0,0|2,0,0]=4 15742 B13R1.27 CC1CC(CO1)NCCCCCO 630433def19e09781d5ea24025ddc24a [0,1,0,1,0,0|2,0,0]=4 15743 B13R1.27 CC1CC(CO1)OCCCCCF f2a9df424848199038b8327170258b78 [0,1,0,1,0,0|2,0,0]=4 15744 B13R1.27 CC1CCC(C1)CCCOCCF 5b6dfd34a96ad62fc5800598365587da [0,1,0,1,0,0|2,0,0]=4 15745 B13R1.27 CC1CCC(C1)CCCOCCS a7f84d9ae62bf08b34d7f49377a71dde [0,1,0,1,0,0|2,0,0]=4 15746 B13R1.27 CC1CCC(C1)COCCCCF 89b671cd4d4cdeefaabd4cba079f82ba [0,1,0,1,0,0|2,0,0]=4 15747 B13R1.27 CC1CCC(C1)NCCCCCF 1dfa73d697f24043ec5d70fbbf6a0cda [0,1,0,1,0,0|2,0,0]=4 15748 B13R1.27 CC1CCC(C1)NCCCCCO 611bebc79be33e4bd1c0088da9e4d6ac [0,1,0,1,0,0|2,0,0]=4 15749 B13R1.27 CC1CCC(C1)OCCCCCF fa55363aefb23523e363bb7893d1f9b7 [0,1,0,1,0,0|2,0,0]=4 15750 B13R1.27 CC1CCC(O1)COCCCC#N 56189bbb9c9d84cb63c29e173fb231f2 [0,1,0,1,0,0|1,0,1]=4 15751 B13R1.27 CC1CCC(O1)COCCCC=O 786cbe2c5780f54eed28417ae3ad107c [0,1,0,1,0,0|1,0,1]=4 15752 B13R1.27 CC1CCC(O1)COCCCCF a726329c1d0b0310b2e3e479bf952d51 [0,1,0,1,0,0|1,0,0]=3 15753 B13R1.27 CC1CCN(C1)CCCCCCF e69b1c50d381be3ddf06e1b427347a94 [0,1,0,1,0,0|2,0,0]=4 15754 B13R1.27 CC1CCN(C1)CCCCCCO b8ad62c75cfd667a0ec85f1a98f60b8e [0,1,0,1,0,0|2,0,0]=4 15755 B13R1.27 CCC#CCNCC1CCC(C1)O 4d0ed537611d79971e7d4cacf90ad1b1 [0,1,0,1,0,0|0,0,2]=4 15756 B13R1.27 CCC/C=C/CNC1CCC(C1)O 69e6f15fbcdfc66f8e4dc690541ce108 [0,1,0,1,0,0|0,0,2]=4 15757 B13R1.27 CCC/C=C/CN[C@@H]1CC[C@@H](C1)O 0fa756fd1e8000506015082d176b7037 [0,1,0,1,0,0|0,0,2]=4 15758 B13R1.27 CCC/C=C/CN[C@@H]1CC[C@H](C1)O 010154bc0c9be805488ecd877835907d [0,1,0,1,0,0|0,0,2]=4 15759 B13R1.27 CCC/C=C/CN[C@H]1CC[C@@H](C1)O 78e020133ed08e879e4e656d93286da4 [0,1,0,1,0,0|0,0,2]=4 15760 B13R1.27 CCC/C=C/CN[C@H]1CC[C@H](C1)O 486bedce8f7245a71d2ba9cb6bdbbecf [0,1,0,1,0,0|0,0,2]=4 15761 B13R1.27 CCC/C=C\CNC1CCC(C1)O 495c990a112a078a956a0d78c72770ba [0,1,0,1,0,0|0,0,2]=4 15762 B13R1.27 CCC/C=C\CN[C@@H]1CC[C@@H](C1)O 226761d4acff6b23c190590adbdfb7e8 [0,1,0,1,0,0|0,0,2]=4 15763 B13R1.27 CCC/C=C\CN[C@@H]1CC[C@H](C1)O 6cb06c4ebe1c1b38670c005ac061d366 [0,1,0,1,0,0|0,0,2]=4 15764 B13R1.27 CCC/C=C\CN[C@H]1CC[C@@H](C1)O bd163b7692248d8894111a00eb2c49c7 [0,1,0,1,0,0|0,0,2]=4 15765 B13R1.27 CCC/C=C\CN[C@H]1CC[C@H](C1)O fbcd5e66411c3f731ba5b18816944e82 [0,1,0,1,0,0|0,0,2]=4 15766 B13R1.27 CCCC/C=C/CN1CCC(C1)O a5fa00524bdceba08267e5179620b9d6 [0,1,0,1,0,0|0,0,2]=4 15767 B13R1.27 CCCC/C=C/CN1CC[C@@H](C1)O 4c730ae46f4324ec333be66fab854a6d [0,1,0,1,0,0|0,0,2]=4 15768 B13R1.27 CCCC/C=C/CN1CC[C@H](C1)O f5fea333caf41d2480793c66ed521afe [0,1,0,1,0,0|0,0,2]=4 15769 B13R1.27 CCCC/C=C\CN1CCC(C1)O dacaee18d77a4b95fcf8be85250ac6fe [0,1,0,1,0,0|0,0,2]=4 15770 B13R1.27 CCCC/C=C\CN1CC[C@@H](C1)O 6737a213508e4cbde6938aa1e11ae84f [0,1,0,1,0,0|0,0,2]=4 15771 B13R1.27 CCCC/C=C\CN1CC[C@H](C1)O 756d28fb5625da91cb58a1fe7cd34143 [0,1,0,1,0,0|0,0,2]=4 15772 B13R1.27 CCCCCCCN1CCC(C1)C 1ceb4ae08bc20334a3bdc2361b1701e8 [0,1,0,1,0,0|1,0,0]=3 15773 B13R1.27 CCCCCCCN1CCC(C1)F 9345f22acc91af46b873832c6b107a55 [0,1,0,1,0,0|1,0,0]=3 15774 B13R1.27 CCCCCCCN1CCC(C1)O 69d0c584e2a2c842036624324286a492 [0,1,0,1,0,0|0,0,0]=2 15775 B13R1.27 CCCCCCCN1CCN(C1)C b550f0adf5607861e62fe877f55a7723 [0,1,0,1,0,0|2,0,0]=4 15776 B13R1.27 CCCCCCCN1CC[C@@H](C1)F 83bfca7f16900b58cfa48305494b4c75 [0,1,0,1,0,0|1,0,0]=3 15777 B13R1.27 CCCCCCCN1CC[C@@H](C1)O 241db1d093ced7c549e2f8a92189af56 [0,1,0,1,0,0|0,0,0]=2 15778 B13R1.27 CCCCCCCN1CC[C@H](C1)F 0be76dcdcd0cc378863661cd10ad8c39 [0,1,0,1,0,0|1,0,0]=3 15779 B13R1.27 CCCCCCCN1CC[C@H](C1)O e6ff74374df58f199ea4b36a71ca459a [0,1,0,1,0,0|0,0,0]=2 15780 B13R1.27 CCCCCCNC1CCC(C1)C 507e7f6f878eb0467016c82c355acff5 [0,1,0,1,0,0|1,0,0]=3 15781 B13R1.27 CCCCCCNC1CCC(C1)O 5fcc573d7b5ee850f312b76ab5c7f11b [0,1,0,1,0,0|0,0,0]=2 15782 B13R1.27 CCCCCCNC1CCN(C1)C db39cadcde03c19245b7ef984cac73d9 [0,1,0,1,0,0|2,0,0]=4 15783 B13R1.27 CCCCCCNC1COC(C1)C 1bc4855babd947cd84138a81d6070156 [0,1,0,1,0,0|1,0,0]=3 15784 B13R1.27 CCCCCCN[C@@H]1C=C[C@@H](C1)O 3f12222e69d639844cc42339c7a19fd1 [0,1,0,1,0,0|0,0,2]=4 15785 B13R1.27 CCCCCCN[C@@H]1CCN(C1)C 4bc9b46b0ba424344a82b15aafe17edd [0,1,0,1,0,0|2,0,0]=4 15786 B13R1.27 CCCCCCN[C@@H]1CC[C@@H](C1)O a8b75706e75cfc3124fdd2dae32ca618 [0,1,0,1,0,0|0,0,0]=2 15787 B13R1.27 CCCCCCN[C@@H]1CC[C@H](C1)O 91c1095878a98bf9d87474180a2119a5 [0,1,0,1,0,0|0,0,0]=2 15788 B13R1.27 CCCCCCN[C@H]1C=C[C@H](C1)O 535f062982461970d571aa55e3bc62c8 [0,1,0,1,0,0|0,0,2]=4 15789 B13R1.27 CCCCCCN[C@H]1CCN(C1)C a032b9871161113f99e4afca9f46bad6 [0,1,0,1,0,0|2,0,0]=4 15790 B13R1.27 CCCCCCN[C@H]1CC[C@@H](C1)O fc8cc71d50480e76b1e910b2c24791e5 [0,1,0,1,0,0|0,0,0]=2 15791 B13R1.27 CCCCCCN[C@H]1CC[C@H](C1)O e3e2ba535f6442748f0bd5841408e20f [0,1,0,1,0,0|0,0,0]=2 15792 B13R1.27 CCCCCCOC1CCC(=O)C1 973ed80f1e658044f6fdd0fe18ff4167 [0,1,0,1,0,0|0,0,2]=4 15793 B13R1.27 CCCCCCOC1CCC(C1)C 71691345e3b799815a5bbcb42326ca41 [0,1,0,1,0,0|1,0,0]=3 15794 B13R1.27 CCCCCCOC1CCC(C1)F fe263f4ef86d1e2885f2d076a6a90dfa [0,1,0,1,0,0|1,0,0]=3 15795 B13R1.27 CCCCCCOC1CCN(C1)C 1be71a9e47f9d0f77fe008f2fcb438bd [0,1,0,1,0,0|2,0,0]=4 15796 B13R1.27 CCCCCCOC1COC(C1)C 908c75206ed342d2f8c2a2483fb41a72 [0,1,0,1,0,0|1,0,0]=3 15797 B13R1.27 CCCCCCO[C@@H]1CCN(C1)C 6e66b30b31ccb59de6747422106af07e [0,1,0,1,0,0|2,0,0]=4 15798 B13R1.27 CCCCCCO[C@H]1CCN(C1)C 5f9e65f415728d5d6e5b25ba2a989237 [0,1,0,1,0,0|2,0,0]=4 15799 B13R1.27 CCCCCNCC1CCC(=O)O1 1bd93f68b1f9743b2bf4002027fa6a5a [0,1,0,1,0,0|1,0,1]=4 15800 B13R1.27 CCCCCNCC1CCC(C1)O 21bf6b555ea5cbef025b1f844438644b [0,1,0,1,0,0|0,0,0]=2 15801 B13R1.27 CCCCCNCC1CCN(C1)C 409c61b181010e3d88ace72f98b5b59e [0,1,0,1,0,0|2,0,0]=4 15802 B13R1.27 CCCCCNC[C@@H]1CCN(C1)C 86d29f8bad4ffa098e462e0e28c7e269 [0,1,0,1,0,0|2,0,0]=4 15803 B13R1.27 CCCCCNC[C@H]1CCN(C1)C 019861a468c0433d1358e6cb624ebfc0 [0,1,0,1,0,0|2,0,0]=4 15804 B13R1.27 CCCCCOCC1CCC(=O)C1 4104c71e5529edd10a3f62acc1d201bf [0,1,0,1,0,0|0,0,2]=4 15805 B13R1.27 CCCCCOCC1CCC(=O)O1 0b603596968b44265afd9159ebdba1d2 [0,1,0,1,0,0|1,0,1]=4 15806 B13R1.27 CCCCCOCC1CCC(C1)C 13193d2c469d90376fb4d9eeacae6276 [0,1,0,1,0,0|1,0,0]=3 15807 B13R1.27 CCCCCOCC1CCC(C1)F 7e478f52b41041a8d7c3fb32e4410258 [0,1,0,1,0,0|1,0,0]=3 15808 B13R1.27 CCCCCOCC1CCC(O1)C f09d38d0dd6f9caec5df2dff6982fbbe [0,1,0,1,0,0|0,0,0]=2 15809 B13R1.27 CCCCCOCC1CCN(C1)C 00fa40615223309e3dbd9dd0898b8a62 [0,1,0,1,0,0|2,0,0]=4 15810 B13R1.27 CCCCCOC[C@@H]1CCC(=O)C1 1a50c974985fb0289e104403a6c638db [0,1,0,1,0,0|0,0,2]=4 15811 B13R1.27 CCCCCOC[C@@H]1CCC(=O)O1 05884102ded19f27327e7933b0d928a4 [0,1,0,1,0,0|1,0,1]=4 15812 B13R1.27 CCCCCOC[C@@H]1CCN(C1)C ca996f17d061f1c4dd8700381acf73ea [0,1,0,1,0,0|2,0,0]=4 15813 B13R1.27 CCCCCOC[C@@H]1CC[C@@H](O1)C fc15f0af8f55550dd653feb5532ac8df [0,1,0,1,0,0|0,0,0]=2 15814 B13R1.27 CCCCCOC[C@@H]1CC[C@H](C1)F 5bd66edff46fff770246bc933fc288f1 [0,1,0,1,0,0|1,0,0]=3 15815 B13R1.27 CCCCCOC[C@H]1CCC(=O)O1 965c62a7dad55bd34d69655b2db58a96 [0,1,0,1,0,0|1,0,1]=4 15816 B13R1.27 CCCCCOC[C@H]1CCN(C1)C f7b71fd1d2c4d2e0663ddb7d466918d2 [0,1,0,1,0,0|2,0,0]=4 15817 B13R1.27 CCCCCOC[C@H]1CC[C@H](C1)F 3acdd486745bb5d9625d82b1584305ce [0,1,0,1,0,0|1,0,0]=3 15818 B13R1.27 CCCCNCCC1CCN(C1)C 8ee7917c5bdb97d548fd1bc859e69f04 [0,1,0,1,0,0|2,0,0]=4 15819 B13R1.27 CCCCNCCN1CCC(C1)F 913396ee1e0c8c9cb1f67debdd8e9dac [0,1,0,1,0,0|2,0,0]=4 15820 B13R1.27 CCCCNCCN1CCC(C1)O c8c990152d89048338782df30497db98 [0,1,0,1,0,0|1,0,0]=3 15821 B13R1.27 CCCCNCCN1CC[C@@H](C1)F 81f03de38005ba187dfd1475db76921e [0,1,0,1,0,0|2,0,0]=4 15822 B13R1.27 CCCCNCCN1CC[C@@H](C1)O a941c8f26d826ec6e96fc768f46e1b0e [0,1,0,1,0,0|1,0,0]=3 15823 B13R1.27 CCCCNCCN1CC[C@H](C1)F a73710153efc2d5bd749f80542e2723b [0,1,0,1,0,0|2,0,0]=4 15824 B13R1.27 CCCCOCCC1CCN(C1)C 64ada1803777bd8a575cd50819cc6936 [0,1,0,1,0,0|2,0,0]=4 15825 B13R1.27 CCCCOCCN1CCC(C1)C f5e4d285b8a7380f4d2911d56c128640 [0,1,0,1,0,0|2,0,0]=4 15826 B13R1.27 CCCCOCCN1CCC(C1)F 90cf80789ffb9ad309046b6e53188ac1 [0,1,0,1,0,0|2,0,0]=4 15827 B13R1.27 CCCCOCCN1CCC(C1)O 08e771e1828725ffd8ddc0af05a85208 [0,1,0,1,0,0|1,0,0]=3 15828 B13R1.27 CCCCOCCN1CC[C@@H](C1)F fae599c4d14530d2be40368ff8846e3f [0,1,0,1,0,0|2,0,0]=4 15829 B13R1.27 CCCCOCCN1CC[C@@H](C1)O 31df35b6352d67c0689d8293a51eebc8 [0,1,0,1,0,0|1,0,0]=3 15830 B13R1.27 CCCCOCCN1CC[C@H](C1)F 132a94144a4a61d845f5fbe8ba4fabec [0,1,0,1,0,0|2,0,0]=4 15831 B13R1.27 CCCCOCCN1CC[C@H](C1)O cec09e432979b13ea00c7abcaddecebb [0,1,0,1,0,0|1,0,0]=3 15832 B13R1.27 CCCCOCNC1CCC(C1)C 25799bf4d319a168bb7f437327cebe76 [0,1,0,1,0,0|2,0,0]=4 15833 B13R1.27 CCCCOCNC1CCC(C1)O 3069d8315a241609f3f8896342d88998 [0,1,0,1,0,0|1,0,0]=3 15834 B13R1.27 CCCCOCN[C@@H]1CC[C@@H](C1)O 31d297e6c3b00539740966eb2dc973a4 [0,1,0,1,0,0|1,0,0]=3 15835 B13R1.27 CCCCOCN[C@@H]1CC[C@H](C1)O 818faba65383bfe7a5c18b833a795395 [0,1,0,1,0,0|1,0,0]=3 15836 B13R1.27 CCCCOCN[C@H]1CC[C@@H](C1)O 59528cbc02d1db549b506d02b7fb6fd6 [0,1,0,1,0,0|1,0,0]=3 15837 B13R1.27 CCCCOCN[C@H]1CC[C@H](C1)O d1ea4eba3cb3c3f086dd629e4d7a910e [0,1,0,1,0,0|1,0,0]=3 15838 B13R1.27 CCCCOCOC1CCC(C1)C 53d1ae6112066dac9c60b7487193c4a6 [0,1,0,1,0,0|2,0,0]=4 15839 B13R1.27 CCCCOCOC1CCC(C1)F a3466652e19a899dea69bbc6209ad7cd [0,1,0,1,0,0|2,0,0]=4 15840 B13R1.27 CCCCOCOC1COC(C1)C c6aa6365769bd06838e5bf62873b314d [0,1,0,1,0,0|2,0,0]=4 15841 B13R1.27 CCCNCCCN1CC[C@@H](C1)F 4cdfad6a302a9ee547391dd347036503 [0,1,0,1,0,0|2,0,0]=4 15842 B13R1.27 CCCNCCCN1CC[C@H](C1)F ff4644d51319a0f0fae17b7ac69b2076 [0,1,0,1,0,0|2,0,0]=4 15843 B13R1.27 CCCOCCCC1CCC(C1)C 7e656d8b9d9ff022856e4f7b9f403e99 [0,1,0,1,0,0|1,0,0]=3 15844 B13R1.27 CCCOCCCN1CCC(C1)C d399fc7db4075b16fff6905e84546fbf [0,1,0,1,0,0|2,0,0]=4 15845 B13R1.27 CCCOCCCN1CCC(C1)F d1da1312136f5a6e66cd3026db1d28ca [0,1,0,1,0,0|2,0,0]=4 15846 B13R1.27 CCCOCCCN1CCC(C1)O 86c3cf5c9ab6e847a626997b73aec773 [0,1,0,1,0,0|1,0,0]=3 15847 B13R1.27 CCCOCCCN1CC[C@@H](C1)F ad375b4f1a88e7c15cc74631644cbed3 [0,1,0,1,0,0|2,0,0]=4 15848 B13R1.27 CCCOCCCN1CC[C@@H](C1)O 378a752e595541235c0da1f20ff8ba0a [0,1,0,1,0,0|1,0,0]=3 15849 B13R1.27 CCCOCCCN1CC[C@H](C1)F f4529cc8da7ef49cb2f73444e8266ca3 [0,1,0,1,0,0|2,0,0]=4 15850 B13R1.27 CCCOCCCN1CC[C@H](C1)O c3662127d84162a7c5db500a50d0b4ec [0,1,0,1,0,0|1,0,0]=3 15851 B13R1.27 CCCOCCNC1CCC(C1)C 45b7fb7f77257a42fc57269382786bbe [0,1,0,1,0,0|2,0,0]=4 15852 B13R1.27 CCCOCCNC1CCC(C1)O 324a5436c36ce5b72643b83c934b8d50 [0,1,0,1,0,0|1,0,0]=3 15853 B13R1.27 CCCOCCNC1COC(C1)C e464cc0dd30ac1188bbcf1fa06c5ed12 [0,1,0,1,0,0|2,0,0]=4 15854 B13R1.27 CCCOCCN[C@@H]1CC[C@@H](C1)O e29f69f4d5d8557fa10f77d6a5b05267 [0,1,0,1,0,0|1,0,0]=3 15855 B13R1.27 CCCOCCN[C@@H]1CC[C@H](C1)O d84d0c0f600a75d17b641437512aed9d [0,1,0,1,0,0|1,0,0]=3 15856 B13R1.27 CCCOCCN[C@H]1CC[C@@H](C1)O ce6fec2c97d0772d02a783ded22b6c2c [0,1,0,1,0,0|1,0,0]=3 15857 B13R1.27 CCCOCCN[C@H]1CC[C@H](C1)O 1e09c66e94cf9edf3f855737153c4e58 [0,1,0,1,0,0|1,0,0]=3 15858 B13R1.27 CCCOCCOC1CCC(C1)C 5150900a07a684998835ac241cd505ad [0,1,0,1,0,0|2,0,0]=4 15859 B13R1.27 CCCOCCOC1CCC(C1)F d89853869da104380f1521a9c137816a [0,1,0,1,0,0|2,0,0]=4 15860 B13R1.27 CCCOCCOC1COC(C1)C 711803f500092963259b208597a3568c [0,1,0,1,0,0|2,0,0]=4 15861 B13R1.27 CCCSCCOC1COC(C1)C 0a47fdae2b08a86dd904934a671069ab [0,1,0,1,0,0|2,0,0]=4 15862 B13R1.27 CCOCCCNC1CCC(C1)C 094185af23a516bfa23806fd8af49e45 [0,1,0,1,0,0|2,0,0]=4 15863 B13R1.27 CCOCCCNC1CCC(C1)O 4f8a69fb1cdb7ad756263561410d6bf9 [0,1,0,1,0,0|1,0,0]=3 15864 B13R1.27 CCOCCCNC1COC(C1)C 4b114ebb3301f6ddbb6f9f5b8ea7af46 [0,1,0,1,0,0|2,0,0]=4 15865 B13R1.27 CCOCCCN[C@@H]1CC[C@@H](C1)O 5d233b149b92157a0a0ba71361e73fd8 [0,1,0,1,0,0|1,0,0]=3 15866 B13R1.27 CCOCCCN[C@@H]1CC[C@H](C1)O e4d058ece9f04a1c703dbe145d158667 [0,1,0,1,0,0|1,0,0]=3 15867 B13R1.27 CCOCCCN[C@H]1CC[C@@H](C1)O 5c6d76b366747e71450be518be684f4c [0,1,0,1,0,0|1,0,0]=3 15868 B13R1.27 CCOCCCN[C@H]1CC[C@H](C1)O 1b83856b2f1557a88ec8a1bc3d0742b4 [0,1,0,1,0,0|1,0,0]=3 15869 B13R1.27 CCOCCCOC1CCC(C1)C 3ae5ce3b6214d304625ac5f8bfff3cb1 [0,1,0,1,0,0|2,0,0]=4 15870 B13R1.27 CCOCCCOC1CCC(C1)F 024940cb4630c692c21532cb176fae29 [0,1,0,1,0,0|2,0,0]=4 15871 B13R1.27 CCOCCCOC1COC(C1)C 6f8b453dcb69bec3a6b96041a12f4418 [0,1,0,1,0,0|2,0,0]=4 15872 B13R1.27 CCOCCNCC1CCC(C1)O bc6b69b897ac053b862bdfe516c81d30 [0,1,0,1,0,0|1,0,0]=3 15873 B13R1.27 CCOCCOCC1CCC(C1)C 8d837f96ab8f6f1147aa32b7cd4a420c [0,1,0,1,0,0|2,0,0]=4 15874 B13R1.27 CCOCCOCC1CCC(C1)F 9680ef9e3a35678e37fab5e60f9e7dcc [0,1,0,1,0,0|2,0,0]=4 15875 B13R1.27 CCOCCOCC1CCC(O1)C 4572a83726aae191fe7a93a44eab04b5 [0,1,0,1,0,0|1,0,0]=3 15876 B13R1.27 CCOCCOC[C@@H]1CC[C@@H](O1)C d0c9682df1cc98f3012b97f45f764886 [0,1,0,1,0,0|1,0,0]=3 15877 B13R1.27 CCOCCOC[C@@H]1CC[C@H](C1)F c8e1f344789bae7ad2d4d9f25d55202b [0,1,0,1,0,0|2,0,0]=4 15878 B13R1.27 CCOCCOC[C@H]1CC[C@H](C1)F 6662f8b8f52977d6ec162ff496b1c1a6 [0,1,0,1,0,0|2,0,0]=4 15879 B13R1.27 CCOCNCCN1CCC(C1)O eeaa749a8a0fd282dc8a109e976cb78c [0,1,0,1,0,0|2,0,0]=4 15880 B13R1.27 CCOCNCCN1CC[C@@H](C1)O 445dcf33b77764ffd51c34656c54ec8e [0,1,0,1,0,0|2,0,0]=4 15881 B13R1.27 CCSCCCNC1CCC(C1)C f7ecdc2dea5d9b023493c5a40a1c38aa [0,1,0,1,0,0|2,0,0]=4 15882 B13R1.27 CCSCCCNC1CCC(C1)O d526e23c732ebb6d57f49b87082ebab0 [0,1,0,1,0,0|1,0,0]=3 15883 B13R1.27 CCSCCCN[C@@H]1CC[C@@H](C1)O 37292777518eca8b734c77f41cfde184 [0,1,0,1,0,0|1,0,0]=3 15884 B13R1.27 CCSCCCN[C@@H]1CC[C@H](C1)O 644bbfa16b27f96ed06c6a96529260fc [0,1,0,1,0,0|1,0,0]=3 15885 B13R1.27 CCSCCCN[C@H]1CC[C@@H](C1)O d65e436553989daf7f3d690a520e1b25 [0,1,0,1,0,0|1,0,0]=3 15886 B13R1.27 CCSCCCN[C@H]1CC[C@H](C1)O 06fd0302e7891a9f9e447a9c1a71826a [0,1,0,1,0,0|1,0,0]=3 15887 B13R1.27 CCSCCCOC1CCC(C1)C 929bf63de8d701b8ae70613f172ad9e4 [0,1,0,1,0,0|2,0,0]=4 15888 B13R1.27 CCSCCCOC1CCC(C1)F 889c380440cd3151739268cf348acc99 [0,1,0,1,0,0|2,0,0]=4 15889 B13R1.27 CCSCCCOC1COC(C1)C 5a04f2f5df3d702cffbeebfe759d727c [0,1,0,1,0,0|2,0,0]=4 15890 B13R1.27 CCSCCNCC1CCC(C1)O 1e001a8b7911befd90b6ffdfeb1ce3fa [0,1,0,1,0,0|1,0,0]=3 15891 B13R1.27 CCSCCOCC1CCC(C1)C 495d4ccd54128cbd1bb76cd40c2fc374 [0,1,0,1,0,0|2,0,0]=4 15892 B13R1.27 CCSCCOCC1CCC(C1)F ea42da319425730454218f0351c6c3a7 [0,1,0,1,0,0|2,0,0]=4 15893 B13R1.27 CCSCCOCC1CCC(O1)C c9b4e77c7e20ee771ebd2e96b4919b2c [0,1,0,1,0,0|1,0,0]=3 15894 B13R1.27 CCSCCOC[C@@H]1CC[C@@H](O1)C a94ffccc09b2add2e7bfcc7697060a80 [0,1,0,1,0,0|1,0,0]=3 15895 B13R1.27 CCSCCOC[C@@H]1CC[C@H](C1)F 8f3682b768d2f03349865f0c4c6751be [0,1,0,1,0,0|2,0,0]=4 15896 B13R1.27 CCSCCOC[C@H]1CC[C@H](C1)F 7624f4cdfc0aa3c74f80cff05f42834d [0,1,0,1,0,0|2,0,0]=4 15897 B13R1.27 COCCCCCN1CCC(C1)C a67863fc8fe6e9130abf5a328b454611 [0,1,0,1,0,0|2,0,0]=4 15898 B13R1.27 COCCCCCN1CCC(C1)F 4041cc13a093f6b79993b66c25dfe80f [0,1,0,1,0,0|2,0,0]=4 15899 B13R1.27 COCCCCCN1CCC(C1)O 02c5b49ca1a4acba748c59d01ff46822 [0,1,0,1,0,0|1,0,0]=3 15900 B13R1.27 COCCCCCN1CC[C@@H](C1)F 64a41f0755ba23c7c7194f348c2514c4 [0,1,0,1,0,0|2,0,0]=4 15901 B13R1.27 COCCCCCN1CC[C@@H](C1)O eb1f8fc7c6629f47f79d7c777326a471 [0,1,0,1,0,0|1,0,0]=3 15902 B13R1.27 COCCCCCN1CC[C@H](C1)F 48ec74c3eb82ab2b625e6b99b268a469 [0,1,0,1,0,0|2,0,0]=4 15903 B13R1.27 COCCCCCN1CC[C@H](C1)O 90a0c41a6bb2f8916c466f8b04dc60dc [0,1,0,1,0,0|1,0,0]=3 15904 B13R1.27 COCCCCNC1CCC(C1)C a66fd4ac946395273fdd741ac19be65a [0,1,0,1,0,0|2,0,0]=4 15905 B13R1.27 COCCCCNC1CCC(C1)O a804a20b985297bdd95df5144b7db632 [0,1,0,1,0,0|1,0,0]=3 15906 B13R1.27 COCCCCNC1COC(C1)C 0640a516b064331d7c616943d15f0588 [0,1,0,1,0,0|2,0,0]=4 15907 B13R1.27 COCCCCN[C@@H]1CC[C@@H](C1)O 0175df9eb9758d3b63a08ecacef5c543 [0,1,0,1,0,0|1,0,0]=3 15908 B13R1.27 COCCCCN[C@@H]1CC[C@H](C1)O 6825a4c22c8ada6372c2d4162eda27ee [0,1,0,1,0,0|1,0,0]=3 15909 B13R1.27 COCCCCN[C@H]1CC[C@@H](C1)O c63dba2f3d4a545dcaf551cdb48cfcb7 [0,1,0,1,0,0|1,0,0]=3 15910 B13R1.27 COCCCCN[C@H]1CC[C@H](C1)O 13211760aad325e3d8d9faeefcc7b7db [0,1,0,1,0,0|1,0,0]=3 15911 B13R1.27 COCCCCOC1CCC(C1)C a3e0dd2397dd29f8996508057aaa339d [0,1,0,1,0,0|2,0,0]=4 15912 B13R1.27 COCCCCOC1CCC(C1)F c9f02d166dd4395d02d999ef7d9b4976 [0,1,0,1,0,0|2,0,0]=4 15913 B13R1.27 COCCCCOC1COC(C1)C b9abebe2912c7f7afe38e7980f51bc6b [0,1,0,1,0,0|2,0,0]=4 15914 B13R1.27 COCCCNCC1CCC(C1)O 5baa4cfbdbb1d6b510850a1208b7486c [0,1,0,1,0,0|1,0,0]=3 15915 B13R1.27 COCCCOCC1CCC(C1)C a2b6b48c79df97299ae16bcb88d26213 [0,1,0,1,0,0|2,0,0]=4 15916 B13R1.27 COCCCOCC1CCC(C1)F d9e782768f063ae7ac8b38c5dec1a4d5 [0,1,0,1,0,0|2,0,0]=4 15917 B13R1.27 COCCCOCC1CCC(O1)C 571aab8ed8123c5a2af8478c2a124b2f [0,1,0,1,0,0|1,0,0]=3 15918 B13R1.27 COCCCOC[C@@H]1CC[C@@H](O1)C 3733e988c6544a505fa2b1164ac2cdea [0,1,0,1,0,0|1,0,0]=3 15919 B13R1.27 COCCCOC[C@@H]1CC[C@H](C1)F 616fe91126fc2c1b1556484c874af8c8 [0,1,0,1,0,0|2,0,0]=4 15920 B13R1.27 COCCCOC[C@H]1CC[C@H](C1)F 319dd56254c16301fce620bcf0dc705c [0,1,0,1,0,0|2,0,0]=4 15921 B13R1.27 COCCNCCN1CCC(C1)O 0d00bed1649393df65e664682301448b [0,1,0,1,0,0|2,0,0]=4 15922 B13R1.27 COCCNCCN1CC[C@@H](C1)O 812349db8584cb87384431a07310f380 [0,1,0,1,0,0|2,0,0]=4 15923 B13R1.27 COCCOCCN1CCC(C1)O 4dc94590659b95496df8c93bef7e50e9 [0,1,0,1,0,0|2,0,0]=4 15924 B13R1.27 COCCOCCN1CC[C@@H](C1)O 04849e2dfbce7f8fa3e938a271cfb213 [0,1,0,1,0,0|2,0,0]=4 15925 B13R1.27 COCCOCCN1CC[C@H](C1)O 5988a386aabdae1fca7fb405a5fdea2a [0,1,0,1,0,0|2,0,0]=4 15926 B13R1.27 COCCOCNC1CCC(C1)O ec604dd4f03832edfebe24f0f5e4ab26 [0,1,0,1,0,0|2,0,0]=4 15927 B13R1.27 COCCOCN[C@@H]1CC[C@@H](C1)O cf5497316835a76c05cd9f7af28dd883 [0,1,0,1,0,0|2,0,0]=4 15928 B13R1.27 COCCOCN[C@@H]1CC[C@H](C1)O d0bbaff7f91f5d3908582a6071b53bd4 [0,1,0,1,0,0|2,0,0]=4 15929 B13R1.27 COCCOCN[C@H]1CC[C@@H](C1)O e445a16b4841569b88dbf64310121322 [0,1,0,1,0,0|2,0,0]=4 15930 B13R1.27 COCCOCN[C@H]1CC[C@H](C1)O 238175790a777f564b9ebd6fc1c3cea1 [0,1,0,1,0,0|2,0,0]=4 15931 B13R1.27 COCOCCCC1CCC(C1)C 5e557c7186ae2e8352d5d398cf36f946 [0,1,0,1,0,0|2,0,0]=4 15932 B13R1.27 COCOCCNC1CCC(C1)O 409b5c41b3bd16f70286a89db4aa64bf [0,1,0,1,0,0|2,0,0]=4 15933 B13R1.27 COCOCCN[C@@H]1CC[C@@H](C1)O 1f9642277a995ecd0b6db594670ec06d [0,1,0,1,0,0|2,0,0]=4 15934 B13R1.27 COCOCCN[C@@H]1CC[C@H](C1)O c534befa87cc9fa5aa14c49241cc55af [0,1,0,1,0,0|2,0,0]=4 15935 B13R1.27 COCOCCN[C@H]1CC[C@@H](C1)O 8927f327fd1741aa50605b3937b65764 [0,1,0,1,0,0|2,0,0]=4 15936 B13R1.27 COCOCCN[C@H]1CC[C@H](C1)O 9ad1f04e8e7616f5ae686dde4d90df24 [0,1,0,1,0,0|2,0,0]=4 15937 B13R1.27 CSCCCCNC1COC(C1)C 6d44a0fec532c6cc4de39662090f8dc4 [0,1,0,1,0,0|2,0,0]=4 15938 B13R1.27 CSCCCCOC1COC(C1)C 10c0b69797f472c335806e7a53b580ab [0,1,0,1,0,0|2,0,0]=4 15939 B13R1.27 CSCCCNCC1CCC(C1)O 2be147d66c1c5a4682ac6c8b2d88e7f8 [0,1,0,1,0,0|1,0,0]=3 15940 B13R1.27 CSCCCOCC1CCC(C1)C e92d0e5c22eb8f23274cbf3a0ad478a4 [0,1,0,1,0,0|2,0,0]=4 15941 B13R1.27 CSCCCOCC1CCC(C1)F ec295e47df7a8cfcde3d14599dc27f95 [0,1,0,1,0,0|2,0,0]=4 15942 B13R1.27 CSCCCOCC1CCC(O1)C 6b0f765007746279a46d82eb44067a19 [0,1,0,1,0,0|1,0,0]=3 15943 B13R1.27 CSCCCOC[C@@H]1CC[C@@H](O1)C 36110365faca798b0cc0d885ede6e202 [0,1,0,1,0,0|1,0,0]=3 15944 B13R1.27 CSCCCOC[C@@H]1CC[C@H](C1)F b90465119d82b5d1c03084db27059586 [0,1,0,1,0,0|2,0,0]=4 15945 B13R1.27 CSCCCOC[C@H]1CC[C@H](C1)F b8bbb46df6ca0f53545a63cdd0486764 [0,1,0,1,0,0|2,0,0]=4 15946 B13R1.27 CSCCNCCN1CCC(C1)O 90f76d692c1cef54ba4d77e20f147fb1 [0,1,0,1,0,0|2,0,0]=4 15947 B13R1.27 CSCCNCCN1CC[C@@H](C1)O 90e849e366c57c87a2640f5f2ac398cc [0,1,0,1,0,0|2,0,0]=4 15948 B13R1.27 CSCOCCCC1CCC(C1)C 88a2e3eed1dc2fde9f749d2019aa1ac6 [0,1,0,1,0,0|2,0,0]=4 15949 B13R1.27 C[C@H]1CC[C@H](O1)COCCCC#N 00c8c88c2e9db87a3d0c05c34555222f [0,1,0,1,0,0|1,0,1]=4 15950 B13R1.27 C[C@H]1CC[C@H](O1)COCCCC=O 6c8b2a418311121e82ef82f246f1b0ab [0,1,0,1,0,0|1,0,1]=4 15951 B13R1.27 C[C@H]1CC[C@H](O1)COCCCCF c0a0256c2eec358e3ab0e42faf8a1437 [0,1,0,1,0,0|1,0,0]=3 15952 B13R1.27 FCCCCCCN1CCC(C1)F 04eb91bf3734a63600c79c27d6adad98 [0,1,0,1,0,0|2,0,0]=4 15953 B13R1.27 FCCCCCCN1CC[C@@H](C1)F 1406abff3641f73943d28df5b54e7c57 [0,1,0,1,0,0|2,0,0]=4 15954 B13R1.27 FCCCCCCN1CC[C@H](C1)F 6f38e2af4eb9a8a282a6eefc06aaef66 [0,1,0,1,0,0|2,0,0]=4 15955 B13R1.27 FCCCCCOC1CCC(C1)F cffba8d3342e8a07b5d9a785d9ea7f31 [0,1,0,1,0,0|2,0,0]=4 15956 B13R1.27 FCCCCOCC1CCC(C1)F 230b829ef04426ee450add6b05b960ca [0,1,0,1,0,0|2,0,0]=4 15957 B13R1.27 FCCCCOC[C@@H]1CC[C@H](C1)F c17154580bc0e22a3bc2bfdd83002a12 [0,1,0,1,0,0|2,0,0]=4 15958 B13R1.27 FCCCCOC[C@H]1CC[C@H](C1)F b063aa5b4f5ae38587f4fc2b2e18d516 [0,1,0,1,0,0|2,0,0]=4 15959 B13R1.27 N#CCCCCCN1CCC(C1)O c560df7c8b393630f1794847b9944dc8 [0,1,0,1,0,0|1,0,1]=4 15960 B13R1.27 N#CCCCCCN1CC[C@@H](C1)O e1eaaeb3adbc2c03d9f260701d4ac611 [0,1,0,1,0,0|1,0,1]=4 15961 B13R1.27 N#CCCCCCN1CC[C@H](C1)O 8e9ebb58a8358fc51f47d2985a90adbc [0,1,0,1,0,0|1,0,1]=4 15962 B13R1.27 N#CCCCCNC1CCC(C1)O 59cab031fb4bc7e71929a5593644b3ad [0,1,0,1,0,0|1,0,1]=4 15963 B13R1.27 N#CCCCCN[C@@H]1CC[C@@H](C1)O 75dcaddb56e5523af697ca120ee3275b [0,1,0,1,0,0|1,0,1]=4 15964 B13R1.27 N#CCCCCN[C@@H]1CC[C@H](C1)O c0b1df3e71540972675ddc9eaf4e91d2 [0,1,0,1,0,0|1,0,1]=4 15965 B13R1.27 N#CCCCCN[C@H]1CC[C@@H](C1)O 9ceb650d7dc7651722f5677a06335962 [0,1,0,1,0,0|1,0,1]=4 15966 B13R1.27 N#CCCCCN[C@H]1CC[C@H](C1)O b727fa90f7c8a8b12ca80289ae3d4fbc [0,1,0,1,0,0|1,0,1]=4 15967 B13R1.27 N#CCCCNCC1CCC(C1)O 6648a134b79398110a17ab41726cc4e8 [0,1,0,1,0,0|1,0,1]=4 15968 B13R1.27 NOCCCCNC1CCC(C1)O a78eba7c3867608c21db867a123a8e37 [0,1,0,1,0,0|2,0,0]=4 15969 B13R1.27 NOCCCCN[C@@H]1CC[C@@H](C1)O 82afae81ac97fe7e23a64575b634a63d [0,1,0,1,0,0|2,0,0]=4 15970 B13R1.27 NOCCCCN[C@@H]1CC[C@H](C1)O 6ec046809b209e080cba97ec09800b75 [0,1,0,1,0,0|2,0,0]=4 15971 B13R1.27 NOCCCCN[C@H]1CC[C@@H](C1)O 59f8c55321190bb94df9ea77d453009e [0,1,0,1,0,0|2,0,0]=4 15972 B13R1.27 NOCCCCN[C@H]1CC[C@H](C1)O c88da1a4878d0bf5b2ab6d3141339df0 [0,1,0,1,0,0|2,0,0]=4 15973 B13R1.27 O=CCCCCCN1CCC(C1)O 1729c7690c51e03d447458a11f0122f7 [0,1,0,1,0,0|1,0,1]=4 15974 B13R1.27 O=CCCCCCN1CC[C@@H](C1)O 56f7a56980f30754824a92e7d4025b33 [0,1,0,1,0,0|1,0,1]=4 15975 B13R1.27 O=CCCCCCN1CC[C@H](C1)O d3f3c33d1c99b983e9dff710289c22c8 [0,1,0,1,0,0|1,0,1]=4 15976 B13R1.27 O=CCCCCNC1CCC(C1)O 6aceae2f5201f1ba158c7e5dd166d373 [0,1,0,1,0,0|1,0,1]=4 15977 B13R1.27 O=CCCCCN[C@@H]1CC[C@@H](C1)O 85dc21bded9419bc58f9c5b3b61b7711 [0,1,0,1,0,0|1,0,1]=4 15978 B13R1.27 O=CCCCCN[C@@H]1CC[C@H](C1)O de8eb579de10309994758d5e7e9190c1 [0,1,0,1,0,0|1,0,1]=4 15979 B13R1.27 O=CCCCCN[C@H]1CC[C@@H](C1)O 124f2c977dc1e0b7db084f2cf5b95335 [0,1,0,1,0,0|1,0,1]=4 15980 B13R1.27 O=CCCCCN[C@H]1CC[C@H](C1)O 096fd62922bb6023c0f56f6c021d1eb8 [0,1,0,1,0,0|1,0,1]=4 15981 B13R1.27 O=CCCCNCC1CCC(C1)O ac9128110c722f01c23b16ec86c12eb0 [0,1,0,1,0,0|1,0,1]=4 15982 B13R1.27 OC1CCC(C1)CNCCCCF 4877ddd7188bf50429b727ef5df22432 [0,1,0,1,0,0|1,0,0]=3 15983 B13R1.27 OC1CCC(C1)NCCCCCF 5c31a412bddf9563881075c2f91c8e8a [0,1,0,1,0,0|1,0,0]=3 15984 B13R1.27 OC1CCN(C1)CCCCCCF 10bf9193bb7354c1aee8343e570ff98b [0,1,0,1,0,0|1,0,0]=3 15985 B13R1.27 OC1CCN(C1)CCNCCCF 358cc200c95718d3d94a4c65c97d7007 [0,1,0,1,0,0|2,0,0]=4 15986 B13R1.27 OC1CCN(C1)CCNCCCS 1538049a8c44692516a7fe21776ca346 [0,1,0,1,0,0|2,0,0]=4 15987 B13R1.27 OCCCCCCN1CCC(C1)F 347e35d5c74c330298479dbf07f25586 [0,1,0,1,0,0|2,0,0]=4 15988 B13R1.27 OCCCCCCN1CCC(C1)O a1fd4195a46cbb0c8918bea2ed21ce5c [0,1,0,1,0,0|1,0,0]=3 15989 B13R1.27 OCCCCCCN1CC[C@@H](C1)F ab4871b9a924396fc84450b7cbc08f75 [0,1,0,1,0,0|2,0,0]=4 15990 B13R1.27 OCCCCCCN1CC[C@@H](C1)O e38f930ea9656436b7b33caa7432d5c2 [0,1,0,1,0,0|1,0,0]=3 15991 B13R1.27 OCCCCCCN1CC[C@H](C1)F bf9514217382fcd60a94b18d46f15977 [0,1,0,1,0,0|2,0,0]=4 15992 B13R1.27 OCCCCCCN1CC[C@H](C1)O b4637326f807f690944c90bfb8c342f5 [0,1,0,1,0,0|1,0,0]=3 15993 B13R1.27 OCCCCCNC1CCC(C1)O e1720cb69ae5cad95c6b707f25aa99be [0,1,0,1,0,0|1,0,0]=3 15994 B13R1.27 OCCCCCN[C@@H]1CC[C@@H](C1)O 24a7ee0fd875c28f5f8c55a23ed1c14f [0,1,0,1,0,0|1,0,0]=3 15995 B13R1.27 OCCCCCN[C@@H]1CC[C@H](C1)O 165fd3fe9db17ca966cd27cde62dfae9 [0,1,0,1,0,0|1,0,0]=3 15996 B13R1.27 OCCCCCN[C@H]1CC[C@@H](C1)O c748cf15bc053e34725f5fe1326fa874 [0,1,0,1,0,0|1,0,0]=3 15997 B13R1.27 OCCCCCN[C@H]1CC[C@H](C1)O 930a5d9c5c99fbf1557b17becc592cc8 [0,1,0,1,0,0|1,0,0]=3 15998 B13R1.27 OCCCCNCC1CCC(C1)O 79e551e31378d5a54fa72b7a4affb8ab [0,1,0,1,0,0|1,0,0]=3 15999 B13R1.27 OCCCNCCN1CCC(C1)O 997eb7d617a07f03b486941886ad52fc [0,1,0,1,0,0|2,0,0]=4 16000 B13R1.27 OCCCNCCN1CC[C@@H](C1)O c8aaa534eb3440c9a9da21299d9aa41f [0,1,0,1,0,0|2,0,0]=4 16001 B13R1.27 OCCOCCNC1CCC(C1)O c8a0b6e82d00eb5b154afa10174dba6e [0,1,0,1,0,0|2,0,0]=4 16002 B13R1.27 OCCOCCN[C@@H]1CC[C@@H](C1)O f970ac961e57f21b38adec0f548ed66a [0,1,0,1,0,0|2,0,0]=4 16003 B13R1.27 OCCOCCN[C@@H]1CC[C@H](C1)O ae1234f963145442080356d38952cfc2 [0,1,0,1,0,0|2,0,0]=4 16004 B13R1.27 OCCOCCN[C@H]1CC[C@@H](C1)O 3ddcd9a69ff10a761787fb4b1671561f [0,1,0,1,0,0|2,0,0]=4 16005 B13R1.27 OCCOCCN[C@H]1CC[C@H](C1)O ca13606848f5e27ed6828454bd23379b [0,1,0,1,0,0|2,0,0]=4 16006 B13R1.27 O[C@@H]1CCN(C1)CCCCCCF 82afbbf0b922db8d30e5f28b82ed868d [0,1,0,1,0,0|1,0,0]=3 16007 B13R1.27 O[C@@H]1CC[C@@H](C1)NCCCCCF 1d85f34ed6b51a8c6f1012ca12471c85 [0,1,0,1,0,0|1,0,0]=3 16008 B13R1.27 O[C@@H]1CC[C@H](C1)NCCCCCF 4ce8a7fb2a0d1ae9d22afd6a5f13f205 [0,1,0,1,0,0|1,0,0]=3 16009 B13R1.27 O[C@H]1CCN(C1)CCCCCCF b6efa88ca5fae347e689b2d298ac3ec3 [0,1,0,1,0,0|1,0,0]=3 16010 B13R1.27 O[C@H]1CCN(C1)CCNCCCF 12fb7793ae1d6e11c69667f40854d1df [0,1,0,1,0,0|2,0,0]=4 16011 B13R1.27 O[C@H]1CCN(C1)CCNCCCS e9316f5067972c9b334841bcab8ead7e [0,1,0,1,0,0|2,0,0]=4 16012 B13R1.27 O[C@H]1CC[C@@H](C1)NCCCCCF d06f7b17cbc70aae4ebef7bc89efca83 [0,1,0,1,0,0|1,0,0]=3 16013 B13R1.27 O[C@H]1CC[C@H](C1)NCCCCCF 196c1c3290043063f48f8ef639ee0020 [0,1,0,1,0,0|1,0,0]=3 16014 B13R1.55 CCCCCN1CC(CC(C1)C)C 4cf4cac4d59b5eef1446ac0446f0fa9f [0,1,0,1,0,0|2,0,0]=4 16015 B13R1.55 CCCCCN1CC(CC(C1)O)O 3f21b2d10ecaab7505f5274322d8f63d [0,1,0,1,0,0|1,0,0]=3 16016 B13R1.55 CCCCCN1C[C@@H](C[C@@H](C1)C)C 44a65387b692e21428d0c6f47ac53365 [0,1,0,1,0,0|2,0,0]=4 16017 B13R1.55 CCCCCN1C[C@@H](C[C@@H](C1)O)O bfa32965017e41cc4e121acf365ecf5b [0,1,0,1,0,0|1,0,0]=3 16018 B13R1.55 CCCCCN1C[C@@H](C[C@H](C1)O)O c74fbc1052348cd424ef5758c0a3c4fb [0,1,0,1,0,0|1,0,0]=3 16019 B13R1.55 CCCCCN1C[C@H](C[C@@H](C1)O)O 812cdd46e6ca98617e9236705a4d4085 [0,1,0,1,0,0|1,0,0]=3 16020 B13R1.55 CCCCOC1CC(CC(C1)C)C edb318f8c5178fe61e245a56e8366192 [0,1,0,1,0,0|2,0,0]=4 16021 B13R1.55 CCCCO[C@@H]1C[C@@H](C[C@@H](C1)C)C c28c7d6b3725118e04b3aec602d9cb2b [0,1,0,1,0,0|2,0,0]=4 16022 B13R1.55 CCCOCC1CC(CC(C1)C)C 93cedd378b579499beb972f87507c91f [0,1,0,1,0,0|2,0,0]=4 16023 B13R1.55 CCOCCN1CC(CC(C1)O)O 9257212e08239d61124e6afbdfd41a10 [0,1,0,1,0,0|2,0,0]=4 16024 B13R1.55 CCOCCN1C[C@@H](C[C@@H](C1)O)O b37e8a96fcd9ec017d0d37e41112a750 [0,1,0,1,0,0|2,0,0]=4 16025 B13R1.55 CCOCCN1C[C@@H](C[C@H](C1)O)O 9370b0f5bac6f7d29b06df869fdbe8e6 [0,1,0,1,0,0|2,0,0]=4 16026 B13R1.55 CCOCCN1C[C@H](C[C@@H](C1)O)O 07611c4ee305b22f0c2199973214d086 [0,1,0,1,0,0|2,0,0]=4 16027 B13R1.55 CCSCCN1CC(CC(C1)O)O c7e83240a2d237751489cf6bb115dab0 [0,1,0,1,0,0|2,0,0]=4 16028 B13R1.55 CCSCCN1C[C@@H](C[C@@H](C1)O)O 63df39ea6ce119dbfdafab438f5e4b25 [0,1,0,1,0,0|2,0,0]=4 16029 B13R1.55 CCSCCN1C[C@@H](C[C@H](C1)O)O 3ced0426f2d2cf3bf6846c0a5f94184d [0,1,0,1,0,0|2,0,0]=4 16030 B13R1.55 CCSCCN1C[C@H](C[C@@H](C1)O)O 209311b3951bfec1401ad4c3b040f69e [0,1,0,1,0,0|2,0,0]=4 16031 B13R1.55 COCCCN1CC(CC(C1)O)O 1dec86fe9fa1bab50466f028e7806994 [0,1,0,1,0,0|2,0,0]=4 16032 B13R1.55 COCCCN1C[C@@H](C[C@@H](C1)O)O 280a74dc7358498530fbab05c9c09222 [0,1,0,1,0,0|2,0,0]=4 16033 B13R1.55 COCCCN1C[C@@H](C[C@H](C1)O)O 69e866fa54c095faa0df76bb90a313b1 [0,1,0,1,0,0|2,0,0]=4 16034 B13R1.55 COCCCN1C[C@H](C[C@@H](C1)O)O af315c43f417023beb198701ebea65e4 [0,1,0,1,0,0|2,0,0]=4 16035 B13R1.55 CSCCCN1CC(CC(C1)O)O 95f34a33fe82661d97aa5d9810afd79f [0,1,0,1,0,0|2,0,0]=4 16036 B13R1.55 CSCCCN1C[C@@H](C[C@@H](C1)O)O 3c959439482399e2defeb6fd4990c9a6 [0,1,0,1,0,0|2,0,0]=4 16037 B13R1.55 CSCCCN1C[C@@H](C[C@H](C1)O)O b317b4455071b92843f928e13d883425 [0,1,0,1,0,0|2,0,0]=4 16038 B13R1.55 CSCCCN1C[C@H](C[C@@H](C1)O)O 0f56ab59078f23509788d9db2d00113d [0,1,0,1,0,0|2,0,0]=4 16039 B13R1.55 OC1CC(CN(C1)CCCCF)O 8ef002c0866fae02e953a5098307ad6c [0,1,0,1,0,0|2,0,0]=4 16040 B13R1.55 OCCCCN1CC(CC(C1)O)O 0101d7a6ad61699841dd090b15d2c6d3 [0,1,0,1,0,0|2,0,0]=4 16041 B13R1.55 OCCCCN1C[C@@H](C[C@@H](C1)O)O 04d0fb919c1b8efb480c019b1b37ef29 [0,1,0,1,0,0|2,0,0]=4 16042 B13R1.55 OCCCCN1C[C@@H](C[C@H](C1)O)O 3dfcfcc655f44264ea71f5a1e233ef64 [0,1,0,1,0,0|2,0,0]=4 16043 B13R1.55 OCCCCN1C[C@H](C[C@@H](C1)O)O aa1d71f47d2659ef6d5aae409b75d091 [0,1,0,1,0,0|2,0,0]=4 16044 B13R1.55 O[C@@H]1C[C@@H](CN(C1)CCCCF)O 206d1361ecbe582ffc72d239c43ea687 [0,1,0,1,0,0|2,0,0]=4 16045 B13R1.55 O[C@@H]1C[C@H](CN(C1)CCCCF)O a90840663a7d544f5f5e71e1fb2ff3fe [0,1,0,1,0,0|2,0,0]=4 16046 B13R1.55 O[C@H]1C[C@@H](CN(C1)CCCCF)O ee586b68f4af46a16fecf0ca713deab0 [0,1,0,1,0,0|2,0,0]=4 16047 B13R1.76 CCCCN1CCC(CC1(C)C)O 47021da5809d8d58282410fda465ebf0 [0,1,0,1,0,0|2,0,0]=4 16048 B13R1.190 CCCCCCN1C[C@@H](C[C@@H]1C)F d2f5af65c25a7e10dd2608c19a93557f [0,1,0,1,0,0|2,0,0]=4 16049 B13R1.190 CCCCCCN1C[C@@H](C[C@@H]1C)O 3733f85dd47076d781d6d8a284a7404c [0,1,0,1,0,0|1,0,0]=3 16050 B13R1.190 CCCCCCN1C[C@@H](C[C@H]1C)F b85a969988c00ac684d5f8c8c7475390 [0,1,0,1,0,0|2,0,0]=4 16051 B13R1.190 CCCCCCN1C[C@@H](C[C@H]1C)O 70367fcbf78f22f123b8eed6c32c7b14 [0,1,0,1,0,0|1,0,0]=3 16052 B13R1.190 CCCCCCN1C[C@H](C[C@@H]1C)F 3ba33c48b3eadfd0ab602f0e47262aa1 [0,1,0,1,0,0|2,0,0]=4 16053 B13R1.190 CCCCCCN1C[C@H](C[C@@H]1C)O 8c81a298dd35ecbdd6032293d894e7af [0,1,0,1,0,0|1,0,0]=3 16054 B13R1.190 CCCCCCN1C[C@H](C[C@H]1C)F d03c370feb6870e33bb758a9739337f5 [0,1,0,1,0,0|2,0,0]=4 16055 B13R1.190 CCCCCCN1C[C@H](C[C@H]1C)O 672b88ea94ab876df0eafbb1d45323e5 [0,1,0,1,0,0|1,0,0]=3 16056 B13R1.190 CCCCOCN1C[C@@H](C[C@@H]1C)O fbf0998778568f361c811e28754a176f [0,1,0,1,0,0|2,0,0]=4 16057 B13R1.190 CCCCOCN1C[C@@H](C[C@H]1C)O 992b320e8ec6de685cb6671312c5e12d [0,1,0,1,0,0|2,0,0]=4 16058 B13R1.190 CCCCOCN1C[C@H](C[C@@H]1C)O 4d9da757c6ec55d2f2ede666c012368c [0,1,0,1,0,0|2,0,0]=4 16059 B13R1.190 CCCCOCN1C[C@H](C[C@H]1C)O 40151e2af5f95d5604c76ba742f95947 [0,1,0,1,0,0|2,0,0]=4 16060 B13R1.190 CCCOCCN1C[C@@H](C[C@@H]1C)O cc27432e13b1397fdf8b3619122d119b [0,1,0,1,0,0|2,0,0]=4 16061 B13R1.190 CCCOCCN1C[C@@H](C[C@H]1C)O 3987dde1fad7bb60387f2e3dc4406172 [0,1,0,1,0,0|2,0,0]=4 16062 B13R1.190 CCCOCCN1C[C@H](C[C@@H]1C)O 8e8f46fdf96f13a57116e9ab478056bc [0,1,0,1,0,0|2,0,0]=4 16063 B13R1.190 CCCOCCN1C[C@H](C[C@H]1C)O 9de712dbd770c6404723acbe80faa996 [0,1,0,1,0,0|2,0,0]=4 16064 B13R1.190 CCOCCCN1C[C@@H](C[C@@H]1C)O 621c4c0f299b33c466410044b6a2df59 [0,1,0,1,0,0|2,0,0]=4 16065 B13R1.190 CCOCCCN1C[C@@H](C[C@H]1C)O bcc5cdfd59a3ca91a11940e453d837ee [0,1,0,1,0,0|2,0,0]=4 16066 B13R1.190 CCOCCCN1C[C@H](C[C@@H]1C)O 192833bb72b76cae3b018fd7c3542e6a [0,1,0,1,0,0|2,0,0]=4 16067 B13R1.190 CCOCCCN1C[C@H](C[C@H]1C)O ba4d05aaa47968ffed22ba5aabe604fa [0,1,0,1,0,0|2,0,0]=4 16068 B13R1.190 CCSCCCN1C[C@@H](C[C@@H]1C)O 11f5d7d76baab236c6bbfc0d86a20d4b [0,1,0,1,0,0|2,0,0]=4 16069 B13R1.190 CCSCCCN1C[C@@H](C[C@H]1C)O d8b2d061e63a25b4d67b2b99f51569a8 [0,1,0,1,0,0|2,0,0]=4 16070 B13R1.190 CCSCCCN1C[C@H](C[C@@H]1C)O 31f6ad83b6a946cf687019b58632afa7 [0,1,0,1,0,0|2,0,0]=4 16071 B13R1.190 CCSCCCN1C[C@H](C[C@H]1C)O 3c8f3483f516865c78fc621dac7d5266 [0,1,0,1,0,0|2,0,0]=4 16072 B13R1.190 COCCCCN1C[C@@H](C[C@@H]1C)O 219b9262b1033a70200ca9ef61e31def [0,1,0,1,0,0|2,0,0]=4 16073 B13R1.190 COCCCCN1C[C@@H](C[C@H]1C)O 930196e854afd9bef25f21a532146126 [0,1,0,1,0,0|2,0,0]=4 16074 B13R1.190 COCCCCN1C[C@H](C[C@@H]1C)O f70d1de65ea47fb0bdaea788e89aa436 [0,1,0,1,0,0|2,0,0]=4 16075 B13R1.190 COCCCCN1C[C@H](C[C@H]1C)O 00cb8afdefd3ea015b2491408e9c3fb1 [0,1,0,1,0,0|2,0,0]=4 16076 B13R1.190 C[C@@H]1C[C@@H](CN1CCCCCF)O 0c75df555f1124f45495b874a7e9a77d [0,1,0,1,0,0|2,0,0]=4 16077 B13R1.190 C[C@@H]1C[C@@H](CN1CCCCCO)O 4f2821ecb8faaac3f99e3782e32e63ca [0,1,0,1,0,0|2,0,0]=4 16078 B13R1.190 C[C@@H]1C[C@H](CN1CCCCCF)O 966ce757f194a72563f644afbd369e2f [0,1,0,1,0,0|2,0,0]=4 16079 B13R1.190 C[C@@H]1C[C@H](CN1CCCCCO)O 2dd083e0185282f756d8902c4773dc5a [0,1,0,1,0,0|2,0,0]=4 16080 B13R1.190 C[C@H]1C[C@@H](CN1CCCCCF)O 63950393d890e9f687a23ca919a14296 [0,1,0,1,0,0|2,0,0]=4 16081 B13R1.190 C[C@H]1C[C@@H](CN1CCCCCO)O 23b8e0b022d3d06168f146a7b8f31c08 [0,1,0,1,0,0|2,0,0]=4 16082 B13R1.190 C[C@H]1C[C@H](CN1CCCCCF)O 844b76bee250e49fb7598efb793592a5 [0,1,0,1,0,0|2,0,0]=4 16083 B13R1.190 C[C@H]1C[C@H](CN1CCCCCO)O a386dc7cbcf2e6caddeb4da6056e1ebe [0,1,0,1,0,0|2,0,0]=4 16084 B13R1.201 CC(C)CC(C)N1CCCCC1C ea6a5db85eb67c175ffaa0f3e33ce8e1 [0,1,0,1,0,0|2,0,0]=4 16085 B13R1.201 CC(C)CC(C)N1CCCC[C@@H]1C 84b422525114d41af3537535039404a6 [0,1,0,1,0,0|2,0,0]=4 16086 B13R1.201 CC(C)CC(C)N1CCCC[C@H]1C 0472446df3ee5a7ea446cd549d4e344d [0,1,0,1,0,0|2,0,0]=4 16087 B13R1.201 CC(C)CN(C)[C@H]1CCCC[C@H]1C dc36c6ddbee515e82bca797dae5889db [0,1,0,1,0,0|2,0,0]=4 16088 B13R1.201 CC(O)CC(=O)N1CCCCC1C e429ad2c493cd131347302c94b5609b5 [0,1,0,1,0,0|1,0,1]=4 16089 B13R1.201 CC(O)CC(=O)N1CCCC[C@@H]1C 9d1f1044abab06f5bd5b4ffd15a8d114 [0,1,0,1,0,0|1,0,1]=4 16090 B13R1.201 CC(O)CC(=O)N1CCCC[C@H]1C 4f31988c874ee90aaebfd2ea71bb8937 [0,1,0,1,0,0|1,0,1]=4 16091 B13R1.201 CC(O)CN(C)C1CCCCC1F 82d044757f2ef74dfc816d08b0abc47a [0,1,0,1,0,0|2,0,0]=4 16092 B13R1.201 CC(O)CN(C)C1CCCCC1O c09755333269e2b024850d65d5b9d5af [0,1,0,1,0,0|2,0,0]=4 16093 B13R1.201 CC(O)CN(C)[C@@H]1CCCC[C@H]1O cab05c023630277fe2233d995c476b63 [0,1,0,1,0,0|2,0,0]=4 16094 B13R1.201 CC(O)CN(C)[C@H]1CCCC[C@@H]1O 206da78441df38056285dd01048e5c7e [0,1,0,1,0,0|2,0,0]=4 16095 B13R1.201 CC(O)CN(C)[C@H]1CCCC[C@H]1C 925725de4b2fba00330a85c127821c97 [0,1,0,1,0,0|1,0,0]=3 16096 B13R1.201 CC(O)CN(C)[C@H]1CCCC[C@H]1O 1759cdbc766aee1afcae48954ee70147 [0,1,0,1,0,0|2,0,0]=4 16097 B13R1.201 CC1CCCCN1C(=O)C[C@@H](C)O 535c00199b2a08e3de659ab34d694b43 [0,1,0,1,0,0|1,0,1]=4 16098 B13R1.201 CC1CCCCN1C(=O)C[C@H](C)O a461732f73ead4c2c1ae8ecc036dc38a [0,1,0,1,0,0|1,0,1]=4 16099 B13R1.201 C[C@@H](O)CC(=O)N1CCCC[C@@H]1C ed0e0dcae5ffad8a6f9e4a5ae88f02fc [0,1,0,1,0,0|1,0,1]=4 16100 B13R1.201 C[C@@H](O)CN(C)[C@@H]1CCCC[C@H]1O 6ea4834746434c55153a7409a88b3ce1 [0,1,0,1,0,0|2,0,0]=4 16101 B13R1.201 C[C@@H](O)CN(C)[C@H]1CCCC[C@@H]1O 8804c70850b4af07591a7ac800afcfaa [0,1,0,1,0,0|2,0,0]=4 16102 B13R1.201 C[C@@H](O)CN(C)[C@H]1CCCC[C@H]1O e60eecbfe195f65c25b1f3eb25cfac87 [0,1,0,1,0,0|2,0,0]=4 16103 B13R1.201 C[C@@H]1CCCCN1C(=O)C[C@@H](C)O 781c6e290b90f6ad98691c32a4f5a7dc [0,1,0,1,0,0|1,0,1]=4 16104 B13R1.201 C[C@H](O)CC(=O)N1CCCC[C@@H]1C 929b929fadc98571c5057a48131ff7bd [0,1,0,1,0,0|1,0,1]=4 16105 B13R1.201 C[C@H](O)CC(=O)N1CCCC[C@H]1C f160878db849ed0a943754f4fad07d2a [0,1,0,1,0,0|1,0,1]=4 16106 B13R1.201 C[C@H](O)CN(C)C1CCCCC1F 5b093d2c833d20bef668f2ca48a01e91 [0,1,0,1,0,0|2,0,0]=4 16107 B13R1.201 C[C@H](O)CN(C)C1CCCCC1O ab75fb97795d7654f9d042ce5048fefb [0,1,0,1,0,0|2,0,0]=4 16108 B13R1.201 C[C@H](O)CN(C)[C@@H]1CCCC[C@H]1O edc3aca5f5c433fc763f5bc429022e1b [0,1,0,1,0,0|2,0,0]=4 16109 B13R1.201 C[C@H](O)CN(C)[C@H]1CCCC[C@@H]1O b38a7b817b1c143cc761d6601e67417e [0,1,0,1,0,0|2,0,0]=4 16110 B13R1.201 C[C@H](O)CN(C)[C@H]1CCCC[C@H]1C 727e31fb5f52ec4b61afa5bcf27cbc6d [0,1,0,1,0,0|1,0,0]=3 16111 B13R1.201 C[C@H](O)CN(C)[C@H]1CCCC[C@H]1O 359acce0b72bd26d28fbd1f36a805cd8 [0,1,0,1,0,0|2,0,0]=4 16112 B13R1.282 CC(C)CC(C)OC1CCCC1C 435573a97cafd34e14f9a57a626a3e55 [0,1,0,1,0,0|2,0,0]=4 16113 B13R1.282 CC(C)CC(C)O[C@@H]1CCC[C@@H]1C 75e624942cbad9a4cc5401195a7a7c64 [0,1,0,1,0,0|2,0,0]=4 16114 B13R1.282 CC(C)CC(C)O[C@@H]1CCC[C@H]1C 212c4d2909217b4ac231537cc7ac3439 [0,1,0,1,0,0|2,0,0]=4 16115 B13R1.282 CC(C)CC(C)O[C@H]1CCC[C@@H]1C adc8b88102929291ff3468cc61995a24 [0,1,0,1,0,0|2,0,0]=4 16116 B13R1.282 CC(C)CC(C)O[C@H]1CCC[C@H]1C 61f5db0085fcfba7090b1e718fbcfde0 [0,1,0,1,0,0|2,0,0]=4 16117 B13R1.282 CC(O)CC(C)NC1CCCC1O 73e0425735b2f5dd36f04a1f21a9426a [0,1,0,1,0,0|2,0,0]=4 16118 B13R1.282 CC(O)CC(C)N[C@@H]1CCC[C@H]1O 90ac7d612ee8f636e8fd28ca016c23dd [0,1,0,1,0,0|2,0,0]=4 16119 B13R1.282 CC(O)CC(C)N[C@H]1CCC[C@@H]1O 989b8a047b214b6ebced30d6cceec019 [0,1,0,1,0,0|2,0,0]=4 16120 B13R1.282 CC(O)CN(C)CC1CCCN1C a1f3de05fd61a13abb0f338d8ec53699 [0,1,0,1,0,0|2,0,0]=4 16121 B13R1.282 CC(O)CN(C)CC1COCC1C 2462a6912243da2b195512789240fb96 [0,1,0,1,0,0|2,0,0]=4 16122 B13R1.282 CC(O)CN(C)C[C@@H]1CCCN1C c168574c579dea8a9289eebc321af969 [0,1,0,1,0,0|2,0,0]=4 16123 B13R1.282 CC(O)CN(C)C[C@H]1CCCN1C b178488a187b40dc4decdfc2c78f7ea6 [0,1,0,1,0,0|2,0,0]=4 16124 B13R1.282 CC1COCC1CN(C)C[C@H](C)O 9cf28a636fc36b34456d10303a02268b [0,1,0,1,0,0|2,0,0]=4 16125 B13R1.282 C[C@@H](O)CN(C)CC1CCCN1C 4d0058cd934f34a1f88783bec1ffd2a2 [0,1,0,1,0,0|2,0,0]=4 16126 B13R1.282 C[C@@H](O)CN(C)C[C@@H]1CCCN1C 0942c13d6234de8d313718a90c83b7ed [0,1,0,1,0,0|2,0,0]=4 16127 B13R1.282 C[C@@H](O)CN(C)C[C@H]1CCCN1C 0c16ce2c8a1056e732172fc4697c3c2b [0,1,0,1,0,0|2,0,0]=4 16128 B13R1.282 C[C@H](O)CN(C)CC1CCCN1C a9a062f1660968181c1e1eb423081741 [0,1,0,1,0,0|2,0,0]=4 16129 B13R1.282 C[C@H](O)CN(C)C[C@@H]1CCCN1C 4afc41c484e94debe665f546a8fe822a [0,1,0,1,0,0|2,0,0]=4 16130 B13R1.282 C[C@H](O)CN(C)C[C@H]1CCCN1C 44d935167c34438acc51147db34a62db [0,1,0,1,0,0|2,0,0]=4 16131 B13R1.348 CC(C)CC(C)NC1CCCCC1 cf767924c1774c97e78113e4257b1b49 [0,1,0,1,0,0|2,0,0]=4 16132 B13R1.348 CC(C)CC(C)OC1CCCCC1 9d10e6915422a5cb3187f093779c11f5 [0,1,0,1,0,0|2,0,0]=4 16133 B13R1.348 CC(C)CN(C)CC1CCCCC1 20c5ad5521c1b6639181349a86a533e6 [0,1,0,1,0,0|2,0,0]=4 16134 B13R1.348 CC(C)C[C@@H](C)OC1CCCCC1 a9d2c1a680e2981f86dd9b76f998d3ef [0,1,0,1,0,0|2,0,0]=4 16135 B13R1.348 CC(C)C[C@H](C)OC1CCCCC1 ae2ee6146311e4c3da7302c64718de04 [0,1,0,1,0,0|2,0,0]=4 16136 B13R1.348 CC(C)NC(C)CC1CCCCC1 024e7d766520fcbb03d908cd531db110 [0,1,0,1,0,0|2,0,0]=4 16137 B13R1.348 CC(O)CC(C)NC1CCCCC1 b3b1203d8884232c4d2d88a999d74eb7 [0,1,0,1,0,0|1,0,0]=3 16138 B13R1.348 CC(O)CC(C)NC1CCCCO1 a3c659327f656b4a8db11c2282d683a0 [0,1,0,1,0,0|2,0,0]=4 16139 B13R1.348 CC(O)CC(C)NC1CCCOC1 d32a0d3a6ed7c8e72debaa3a32808b85 [0,1,0,1,0,0|2,0,0]=4 16140 B13R1.348 CC(O)CC(C)NC1CCOCC1 5d61487cf488f51c5f79f4bf4ee57d72 [0,1,0,1,0,0|2,0,0]=4 16141 B13R1.348 CC(O)CC(C)NC1CCSCC1 db2fe4d29884ca273e9b5e8e9a869b5f [0,1,0,1,0,0|2,0,0]=4 16142 B13R1.348 CC(O)CN(C)CC1CCCCC1 2fd34f22411b078e9689f1a19c51c94f [0,1,0,1,0,0|1,0,0]=3 16143 B13R1.348 CC(O)CN(C)CC1CCCCO1 cd3037c0c92fed86600535b4ab1d7dfc [0,1,0,1,0,0|2,0,0]=4 16144 B13R1.348 CC(O)CN(C)CC1CCCOC1 9d5cc603727b04ccbaf7963f1601d50d [0,1,0,1,0,0|2,0,0]=4 16145 B13R1.348 CC(O)CN(C)CC1CCOCC1 c84d73d9b97a8f97de03484ed178162d [0,1,0,1,0,0|2,0,0]=4 16146 B13R1.348 CC(O)CN(C)CC1CCSCC1 47d9f543f3f049282f07ec8a7158f61c [0,1,0,1,0,0|2,0,0]=4 16147 B13R1.348 C[C@@H](O)CN(C)CC1CCCCC1 1bbc9f7dbb36b4241a02c11b2caee199 [0,1,0,1,0,0|1,0,0]=3 16148 B13R1.348 C[C@@H](O)CN(C)CC1CCCCO1 ea66d506cbcfc880ace7db7506f192a2 [0,1,0,1,0,0|2,0,0]=4 16149 B13R1.348 C[C@@H](O)CN(C)CC1CCCOC1 9ad76119b0e2ccac2bb114a4875c5f5d [0,1,0,1,0,0|2,0,0]=4 16150 B13R1.348 C[C@@H](O)CN(C)CC1CCOCC1 a4044ddc5b2a949d233377b9e85de56f [0,1,0,1,0,0|2,0,0]=4 16151 B13R1.348 C[C@@H](O)CN(C)CC1CCSCC1 a9a50fd86603aa6d14e2d6c59527b623 [0,1,0,1,0,0|2,0,0]=4 16152 B13R1.348 C[C@H](O)CN(C)CC1CCCCC1 21569b17a67d9b1a5c3e230f579ce768 [0,1,0,1,0,0|1,0,0]=3 16153 B13R1.348 C[C@H](O)CN(C)CC1CCCCO1 da85352648ee012f7db5afe85955d8b6 [0,1,0,1,0,0|2,0,0]=4 16154 B13R1.348 C[C@H](O)CN(C)CC1CCCOC1 4d21dd72df848ce309967ef7f566b154 [0,1,0,1,0,0|2,0,0]=4 16155 B13R1.348 C[C@H](O)CN(C)CC1CCOCC1 b4ac4f48ea9900827419988a094269e5 [0,1,0,1,0,0|2,0,0]=4 16156 B13R1.348 C[C@H](O)CN(C)CC1CCSCC1 40badfbf3d6a69c784017c9970221d5c [0,1,0,1,0,0|2,0,0]=4 16157 B13R1.373 CC(O)CN1CCCC(C1)CCO 03754c08c9473fd6193b43f821da0d09 [0,1,0,1,0,0|2,0,0]=4 16158 B13R1.373 CCOC1CCCN(C1)CC(C)O 89c7d686b0c282806ff2bab9f788d99f [0,1,0,1,0,0|2,0,0]=4 16159 B13R1.373 CCOC1CCCN(C1)C[C@@H](C)O 32e6fce9a3e2714c5043b4124cf93b60 [0,1,0,1,0,0|2,0,0]=4 16160 B13R1.373 CCOC1CCCN(C1)C[C@H](C)O 8a9e3c09f926bc28e1f2aece9d341b0a [0,1,0,1,0,0|2,0,0]=4 16161 B13R1.373 COCC1CCCN(C1)CC(C)O c6543e59dda7960c28ef18400931b92f [0,1,0,1,0,0|2,0,0]=4 16162 B13R1.373 COCC1CCCN(C1)C[C@@H](C)O 60f0616a673a8bb8a4840cbb4a7dd8cd [0,1,0,1,0,0|2,0,0]=4 16163 B13R1.373 COCC1CCCN(C1)C[C@H](C)O af8b4223bb344c4f51f6126d1f26cc7d [0,1,0,1,0,0|2,0,0]=4 16164 B13R1.373 COC[C@@H]1CCCN(C1)CC(C)O 2ddeeb7ea5a3b4fa022facd851988cee [0,1,0,1,0,0|2,0,0]=4 16165 B13R1.373 COC[C@@H]1CCCN(C1)C[C@@H](C)O 3a6706119c9d632dd33f1e44d81e6288 [0,1,0,1,0,0|2,0,0]=4 16166 B13R1.373 COC[C@@H]1CCCN(C1)C[C@H](C)O 61ed4c48fc94b99ba1d34f27da436034 [0,1,0,1,0,0|2,0,0]=4 16167 B13R1.373 C[C@@H](O)CN1CCCC(C1)CCO 65591fd631a66db74cabbbf4f3c04e42 [0,1,0,1,0,0|2,0,0]=4 16168 B13R1.373 C[C@H](O)CN1CCCC(C1)CCO a5d01691a9970f55ff297ef6319df9bc [0,1,0,1,0,0|2,0,0]=4 16169 B13R1.498 CCCCN1CCC(C1)CC(C)C 2bad7333407a54c556edeff0b079e26c [0,1,0,1,0,0|2,0,0]=4 16170 B13R1.498 CCCOC1CCN(C1)CC(C)O 16e51f8a302044000ba937e408e4bd20 [0,1,0,1,0,0|2,0,0]=4 16171 B13R1.498 CCCOC1CCN(C1)C[C@@H](C)O 63393e481608d0b85cff01fc25ffceac [0,1,0,1,0,0|2,0,0]=4 16172 B13R1.498 CCCOC1CCN(C1)C[C@H](C)O 421c5d486c3268ceb3755ac78e0cc62f [0,1,0,1,0,0|2,0,0]=4 16173 B13R1.498 CCCO[C@@H]1CCN(C1)CC(C)O 7cb67afe237ca250c09da6655fdb2d53 [0,1,0,1,0,0|2,0,0]=4 16174 B13R1.498 CCCO[C@@H]1CCN(C1)C[C@@H](C)O db265480cdb8aa59e81d194446469f6d [0,1,0,1,0,0|2,0,0]=4 16175 B13R1.498 CCCO[C@@H]1CCN(C1)C[C@H](C)O 9faa07c2ffab87eed9c2c185f1237d47 [0,1,0,1,0,0|2,0,0]=4 16176 B13R1.498 CCCO[C@H]1CCN(C1)CC(C)O 414915b075274eb4df1e92f2d47bddd2 [0,1,0,1,0,0|2,0,0]=4 16177 B13R1.498 CCCO[C@H]1CCN(C1)C[C@@H](C)O 34e7fd54f847c30eacf1ca28e6cd1115 [0,1,0,1,0,0|2,0,0]=4 16178 B13R1.498 CCCO[C@H]1CCN(C1)C[C@H](C)O ec25ccb05d80601b8d2c0e07dd506a30 [0,1,0,1,0,0|2,0,0]=4 16179 B13R1.498 CCOCC1CCN(C1)CC(C)O d3809a70feffd45586d820cfb4aad56b [0,1,0,1,0,0|2,0,0]=4 16180 B13R1.498 CCOCC1CCN(C1)C[C@@H](C)O 55d19eff735ebb315a4e329e26e1abdb [0,1,0,1,0,0|2,0,0]=4 16181 B13R1.498 CCOCC1CCN(C1)C[C@H](C)O 82b1ff2a0a69eda6f14533d9a6235b84 [0,1,0,1,0,0|2,0,0]=4 16182 B13R1.593 CC(C)CC(C)COC1CCCC1 e9eff6062270f1ac5343f8274670c170 [0,1,0,1,0,0|2,0,0]=4 16183 B13R1.593 CC(C)CC(C)NCC1CCCC1 368cc7ca507f26d212c77e5b22afaa8f [0,1,0,1,0,0|2,0,0]=4 16184 B13R1.593 CC(C)CC(C)OCC1CCCC1 1905089805132a98b0bbb74f0be34fc8 [0,1,0,1,0,0|2,0,0]=4 16185 B13R1.593 CC(C)CC(O)CNC1CCCC1 ab1898b598c7099206d878e11caf053e [0,1,0,1,0,0|2,0,0]=4 16186 B13R1.593 CC(C)CN(C)CCC1CCCC1 da4cbd14f2b4c8e536e908553392ab22 [0,1,0,1,0,0|2,0,0]=4 16187 B13R1.593 CC(C)C[C@@H](C)OCC1CCCC1 fdbde2a76de79ac3f8cd894989a3e652 [0,1,0,1,0,0|2,0,0]=4 16188 B13R1.593 CC(C)C[C@H](C)OCC1CCCC1 febf97bf1fc662c36d8bf92d1fef29f4 [0,1,0,1,0,0|2,0,0]=4 16189 B13R1.593 CC(O)CC(=O)NCC1CCCC1 40ed582e889013c425a5173c749b5d82 [0,1,0,1,0,0|1,0,1]=4 16190 B13R1.593 CC(O)CC(C)NCC1CCCC1 5dc1f32b5d26d9459d170fc64a9bc592 [0,1,0,1,0,0|1,0,0]=3 16191 B13R1.593 CC(O)CC(C)NCC1CCCO1 4490ec8632dd050c3b43487f21a1a8af [0,1,0,1,0,0|2,0,0]=4 16192 B13R1.593 CC(O)CC(C)NCC1CCOC1 2ed34dd898d7c2030339d06b7dbca5ee [0,1,0,1,0,0|2,0,0]=4 16193 B13R1.593 CC(O)CN(C)CCC1CCCC1 1a279c8798c749ea60ca22db481304d3 [0,1,0,1,0,0|1,0,0]=3 16194 B13R1.593 CC(O)CN(C)CCC1CCCO1 fcfcad55261115b521bb4292268b4448 [0,1,0,1,0,0|2,0,0]=4 16195 B13R1.593 CC(O)CN(C)CCC1CCOC1 553d6f6120c6122627deb96c5796b626 [0,1,0,1,0,0|2,0,0]=4 16196 B13R1.593 CC(O)CN(C)CCN1CCCC1 fbb771b0451c83f917ba53eab5ea73d1 [0,1,0,1,0,0|2,0,0]=4 16197 B13R1.593 C[C@@H](O)CC(=O)NCC1CCCC1 7b3d2414706c7c0f991a348e60875c7d [0,1,0,1,0,0|1,0,1]=4 16198 B13R1.593 C[C@@H](O)CN(C)CCN1CCCC1 4c3846eb7b66a182f271ce5f193454e9 [0,1,0,1,0,0|2,0,0]=4 16199 B13R1.593 C[C@H](O)CC(=O)NCC1CCCC1 15d6d22a425e25d3e0f9e55c5f375621 [0,1,0,1,0,0|1,0,1]=4 16200 B13R1.593 C[C@H](O)CN(C)CCC1CCCC1 dbc717e4fccc46bc5d681b2cb564cd4d [0,1,0,1,0,0|1,0,0]=3 16201 B13R1.593 C[C@H](O)CN(C)CCC1CCCO1 67d5983017bbb4894606ad0366cf828a [0,1,0,1,0,0|2,0,0]=4 16202 B13R1.593 C[C@H](O)CN(C)CCC1CCOC1 9d0f5366fbb28cd35d7ffdd1e507e990 [0,1,0,1,0,0|2,0,0]=4 16203 B13R1.593 C[C@H](O)CN(C)CCN1CCCC1 8be460c16aa890381c80b86b3c48055a [0,1,0,1,0,0|2,0,0]=4 16204 B13R1.1107 C=C(C)CN1CCCCCCCC1 ae34f16eadd7f89af1ebd3c682c8657e [0,1,0,1,0,0|1,0,1]=4 16205 B13R1.1107 CC(C)CN1CCCCCCCC1 7aff59a37ceb3e8fb292292d5f7280df [0,1,0,1,0,0|1,0,0]=3 16206 B13R1.1107 CC(O)CN1CCCCCCCC1 d5fedefb41998d6d9c5220580b1e1886 [0,1,0,1,0,0|0,0,0]=2 16207 B13R1.1107 CN(C)CN1CCCCCCCC1 4a4029a345f61192d9860176c240a9fc [0,1,0,1,0,0|2,0,0]=4 16208 B13R1.1107 C[C@@H](O)CN1CCCCCCCC1 6261692d5dbc18490cbc4f9baddcf49f [0,1,0,1,0,0|0,0,0]=2 16209 B13R1.1107 C[C@H](O)CN1CCCCCCCC1 36737c72c61605e8f5ab7f0b76e1bf18 [0,1,0,1,0,0|0,0,0]=2 16210 B13R1.1107 FC(F)CN1CCCCCCCC1 32040dda28c6740420b8bba8763d042f [0,1,0,1,0,0|2,0,0]=4 16211 B13R1.1107 O=C(O)CN1CCCCCCCC1 cbd36c39a59cfe364940e8f8d70f7c10 [0,1,0,1,0,0|1,0,1]=4 16212 B13R1.1154 CCCCOC1CN(C1)CC(C)O c37dd10d5465b2a12dc4f14b79002ebc [0,1,0,1,0,0|2,0,0]=4 16213 B13R1.1154 CCCCOC1CN(C1)C[C@@H](C)O 5643f2490246f0fcab2e96effaa7af28 [0,1,0,1,0,0|2,0,0]=4 16214 B13R1.1154 CCCCOC1CN(C1)C[C@H](C)O 62dd0e346cb8c73b3bb047d6f21eedbb [0,1,0,1,0,0|2,0,0]=4 16215 B13R1.2027 CC(C)CC(C)CCOC1CCC1 455a28d3dd0ef315109a1c038c5e6148 [0,1,0,1,0,0|2,0,0]=4 16216 B13R1.2027 CC(C)CC(C)COCC1CCC1 8bc4b33610879b2f08f57f15cdefe69d [0,1,0,1,0,0|2,0,0]=4 16217 B13R1.2027 CC(C)CC(C)NCCC1CCC1 d4eaac923c413619bb5d5a33fb9e1301 [0,1,0,1,0,0|2,0,0]=4 16218 B13R1.2027 CC(C)CC(C)OCCC1CCC1 7a488056263f42182f8b777d5294740a [0,1,0,1,0,0|2,0,0]=4 16219 B13R1.2027 CC(C)CC(O)CNCC1CCC1 a3aa7b3018a2c0fc3863391bce84a5c8 [0,1,0,1,0,0|2,0,0]=4 16220 B13R1.2027 CC(C)C[C@@H](C)OCCC1CCC1 c0c164e11dc2fb1ca26a1665d0b607d6 [0,1,0,1,0,0|2,0,0]=4 16221 B13R1.2027 CC(C)C[C@H](C)OCCC1CCC1 8313e99caf93b5eff20bc3e0fe925adb [0,1,0,1,0,0|2,0,0]=4 16222 B13R1.2027 CC(O)CC(=O)NCCC1CCC1 adc35335c4ae525e66872bf3b03419bc [0,1,0,1,0,0|1,0,1]=4 16223 B13R1.2027 CC(O)CC(C)NCCC1CCC1 c80ef1512cd87dec578f3aab756dfe25 [0,1,0,1,0,0|1,0,0]=3 16224 B13R1.2027 CC(O)CC(C)NCCC1CCO1 1dbb0975f03d8d2bfc57c80729d6936a [0,1,0,1,0,0|2,0,0]=4 16225 B13R1.2027 CC(O)CC(C)NCCC1COC1 132c97f587d1d395c97dbad8c5c8d10c [0,1,0,1,0,0|2,0,0]=4 16226 B13R1.2027 CC(O)CN(C)CCOC1CCC1 cb2575c26c349f9032684d4430fd34ea [0,1,0,1,0,0|2,0,0]=4 16227 B13R1.2027 C[C@@H](O)CC(=O)NCCC1CCC1 adb4e95bd39b0203093a3f7809561246 [0,1,0,1,0,0|1,0,1]=4 16228 B13R1.2027 C[C@H](O)CC(=O)NCCC1CCC1 bee419595e40d69ed491ce2ac8656d3f [0,1,0,1,0,0|1,0,1]=4 16229 B13R1.2027 C[C@H](O)CN(C)CCOC1CCC1 63ce227e01608cd79ca3a2b1a7c7124d [0,1,0,1,0,0|2,0,0]=4 16230 B13R1.2028 CC(C)CC(C)CCCOC1CC1 7bb35f56e49cfc4e35938ec65fcdf4d7 [0,1,0,1,0,0|2,0,0]=4 16231 B13R1.2028 CC(C)CC(C)CCOCC1CC1 100c49bce794e2c428610ce59659c877 [0,1,0,1,0,0|2,0,0]=4 16232 B13R1.2028 CC(C)CC(C)COCCC1CC1 e5b749108cd1948847ce67386a8c419e [0,1,0,1,0,0|2,0,0]=4 16233 B13R1.2028 CC(C)CC(C)OCCCC1CC1 681c87950fec0503e0072aaff39f5352 [0,1,0,1,0,0|2,0,0]=4 16234 B13R1.2028 CC(C)CC(O)CNCCC1CC1 f5e78a7a22a7a356c81f7d1f4db45f42 [0,1,0,1,0,0|2,0,0]=4 16235 B13R1.2028 CC(O)CC(C)NCCOC1CC1 0d42aee7a51e4ae673460246bfbd2d63 [0,1,0,1,0,0|2,0,0]=4 16236 B13R1.2433 CCCCCCN[C@@H]1C[C@@H]1C(=O)O 3eb3af4d5dadaf5c317fdf90f20cab6a [0,1,0,1,0,0|1,0,1]=4 16237 B13R1.2433 CCCCCCN[C@H]1C[C@@H]1C(=O)O 9549dc6a40d8ff8d17b0ff26f6446456 [0,1,0,1,0,0|1,0,1]=4 16238 B13R1.2433 CCCCCCN[C@H]1C[C@H]1C(=O)O d31a9b424e9bb9339bb61342076b58b4 [0,1,0,1,0,0|1,0,1]=4 16239 B13R1.2433 CCCCCCO[C@@H]1C[C@@H]1C(=O)O 92a5ce71c43cc089a1896a7210a0551c [0,1,0,1,0,0|1,0,1]=4 16240 B13R1.2433 CCCCCCO[C@H]1C[C@@H]1C(=O)O 8f176b5ea38b3e12c25f50b87653aa5f [0,1,0,1,0,0|1,0,1]=4 16241 B13R1.2433 CCCCCCO[C@H]1C[C@H]1C(=O)O 44ed97762d956099dd05cafc6350983e [0,1,0,1,0,0|1,0,1]=4 16242 B13R1.2433 CCCCCNCC1CC1C(=O)O bc2bce834246f8c73407a3c734d0de8d [0,1,0,1,0,0|1,0,1]=4 16243 B13R1.2433 CCCCCNC[C@@H]1C[C@H]1C(=O)O fbb8e679ebb26e1ae2d432955c331595 [0,1,0,1,0,0|1,0,1]=4 16244 B13R1.2433 CCCCCOCC1CC1C(=O)O abecabf4ac22cc07c3b3889a8b4b00e4 [0,1,0,1,0,0|1,0,1]=4 16245 B13R1.2433 CCCCCOC[C@@H]1C[C@H]1C(=O)O 8b205a62c0d1d6ec32ee81d0ae062b4c [0,1,0,1,0,0|1,0,1]=4 16246 B13R1.2433 CCCCCOC[C@H]1C[C@@H]1C(=O)O c486800046bf6e3294d2b7532fd0dcb5 [0,1,0,1,0,0|1,0,1]=4 16247 B13R1.2433 CCCCCOC[C@H]1C[C@H]1C(=O)O 58470869c5c6d63b72f0eb2e342e411e [0,1,0,1,0,0|1,0,1]=4 16248 B13R1.2438 CC1(CC(C1)NCCCCCF)O acbc6a39e0063647139993cec6f900dd [0,1,0,1,0,0|2,0,0]=4 16249 B13R1.2438 CC1(CC(C1)NCCCCCO)O 6753c8aa25134fa3ec18aa10a6f5ce00 [0,1,0,1,0,0|2,0,0]=4 16250 B13R1.2438 CC1(CC(O1)CNCCCCF)C 97bfc331c6ef835b32a1ca990e5cecc8 [0,1,0,1,0,0|2,0,0]=4 16251 B13R1.2438 CC1(CC(O1)CNCCCCO)C 1f94c6b2223be65570a694df2f5f97a8 [0,1,0,1,0,0|2,0,0]=4 16252 B13R1.2438 CC1(CC(O1)COCCCCF)C cf10a90f08d16a58dffd7e1c1100bedb [0,1,0,1,0,0|2,0,0]=4 16253 B13R1.2438 CC1(CN(C1)CCCCCCF)O 0b988caffd038733d949f4af37145869 [0,1,0,1,0,0|2,0,0]=4 16254 B13R1.2438 CC1(CN(C1)CCCCCCO)O 578973a47c86c8b51f179bfa0312dbc9 [0,1,0,1,0,0|2,0,0]=4 16255 B13R1.2438 CCCCCCCN1CC(C1)(C)C d5d89c16f4799059591827df7c8615f9 [0,1,0,1,0,0|2,0,0]=4 16256 B13R1.2438 CCCCCCCN1CC(C1)(C)O eda15aab47de2ea3a0540f7c3553111c [0,1,0,1,0,0|1,0,0]=3 16257 B13R1.2438 CCCCCCCN1CC(C1)(F)F 4c15b3cb1ed0a85f06c4ae637f9abc1f [0,1,0,1,0,0|2,0,0]=4 16258 B13R1.2438 CCCCCCNC1CC(C1)(C)C aa66cc4060648f5e6811a1c3f06bf812 [0,1,0,1,0,0|2,0,0]=4 16259 B13R1.2438 CCCCCCNC1CC(C1)(C)O a398f7b6afcfd56b6b627246ebb4d35f [0,1,0,1,0,0|1,0,0]=3 16260 B13R1.2438 CCCCCCNC1CC(C1)(F)F ee93f3db105ec5ee6aef30d4babd08cb [0,1,0,1,0,0|2,0,0]=4 16261 B13R1.2438 CCCCCCN[C@H]1C[C@@](C1)(C)O a8e57e6fed2ff198695ebc708d22c2a8 [0,1,0,1,0,0|1,0,0]=3 16262 B13R1.2438 CCCCCCOC1CC(C1)(C)C 1dd412d8ff16ad0f7fd41ebf27a36d62 [0,1,0,1,0,0|2,0,0]=4 16263 B13R1.2438 CCCCCCOC1CC(C1)(F)F 9ee38a568280b788bbbfb8927e6bc2f9 [0,1,0,1,0,0|2,0,0]=4 16264 B13R1.2438 CCCCCNCC1CC(C1)(C)C 58bf71d2ea47d3f01c37717b855fcedb [0,1,0,1,0,0|2,0,0]=4 16265 B13R1.2438 CCCCCNCC1CC(C1)(F)F 32b57b7a99f272a9232a56f7eac11bca [0,1,0,1,0,0|2,0,0]=4 16266 B13R1.2438 CCCCCNCC1CC(O1)(C)C 46c6c2fc1d8efddbf9711b9b227b7ac0 [0,1,0,1,0,0|1,0,0]=3 16267 B13R1.2438 CCCCCNC[C@H]1C[C@@](C1)(C)O af4fbcd041f25e6597d3b13298342ee0 [0,1,0,1,0,0|1,0,0]=3 16268 B13R1.2438 CCCCCNC[C@H]1C[C@](C1)(C)O 224eb02e895103db958d271777fe8c3d [0,1,0,1,0,0|1,0,0]=3 16269 B13R1.2438 CCCCCOCC1CC(C1)(C)C a245786abf49823c9a5b6827c24c799c [0,1,0,1,0,0|2,0,0]=4 16270 B13R1.2438 CCCCCOCC1CC(C1)(F)F 482289dbfbf11e56ead70299b17ceab7 [0,1,0,1,0,0|2,0,0]=4 16271 B13R1.2438 CCCCCOCC1CC(O1)(C)C 7964b728891f071c2aaa801b9649554e [0,1,0,1,0,0|1,0,0]=3 16272 B13R1.2438 CCCCOCCC1CC(C1)(F)F 88a742506dc303f90f2272978c9901cf [0,1,0,1,0,0|2,0,0]=4 16273 B13R1.2438 CCCCOCCN1CC(C1)(C)O dc2e221bb92cf03781e2fe4a78b971c5 [0,1,0,1,0,0|2,0,0]=4 16274 B13R1.2438 CCCCOCNC1CC(C1)(C)O 79be58831921097b6aaab707960235fb [0,1,0,1,0,0|2,0,0]=4 16275 B13R1.2438 CCCCOCN[C@H]1C[C@@](C1)(C)O 3383ad6a2dacd23bccd36ac451706d3a [0,1,0,1,0,0|2,0,0]=4 16276 B13R1.2438 CCCOCCCN1CC(C1)(C)O dbab6dbbe4e11636cfd09c660a2d2442 [0,1,0,1,0,0|2,0,0]=4 16277 B13R1.2438 CCCOCCNC1CC(C1)(C)O ae5f1c9b273a394694f231c828d9b8ab [0,1,0,1,0,0|2,0,0]=4 16278 B13R1.2438 CCCOCCN[C@H]1C[C@@](C1)(C)O 0b0c3b81a79d993d1afeeae3b19a155d [0,1,0,1,0,0|2,0,0]=4 16279 B13R1.2438 CCOCCCNC1CC(C1)(C)O 79b1f88dc7cb5e281c27c6bbd456ad6b [0,1,0,1,0,0|2,0,0]=4 16280 B13R1.2438 CCOCCCN[C@H]1C[C@@](C1)(C)O ccd203dd98a64d44a984125411fd9487 [0,1,0,1,0,0|2,0,0]=4 16281 B13R1.2438 CCOCCNCC1CC(O1)(C)C b350a0446b0aca178a2f60e04cf78ace [0,1,0,1,0,0|2,0,0]=4 16282 B13R1.2438 CCOCCNC[C@H]1C[C@@](C1)(C)O 940f7e305b05a1cf4ebbb820b3cee883 [0,1,0,1,0,0|2,0,0]=4 16283 B13R1.2438 CCOCCNC[C@H]1C[C@](C1)(C)O 987fd14305f026588eddaf599bdeff83 [0,1,0,1,0,0|2,0,0]=4 16284 B13R1.2438 CCOCCOCC1CC(O1)(C)C 5cb91024a6edb0da078b93ee2b23b5fb [0,1,0,1,0,0|2,0,0]=4 16285 B13R1.2438 CCSCCCNC1CC(C1)(C)O e83b1a600b8e961af2b58bca5234cb7c [0,1,0,1,0,0|2,0,0]=4 16286 B13R1.2438 CCSCCCN[C@H]1C[C@@](C1)(C)O 50589422b3760c52bf4edbd210b7cca4 [0,1,0,1,0,0|2,0,0]=4 16287 B13R1.2438 CCSCCNCC1CC(O1)(C)C 192bafa946cdb939efa1086012c8ebba [0,1,0,1,0,0|2,0,0]=4 16288 B13R1.2438 CCSCCNC[C@H]1C[C@@](C1)(C)O 3bbf25fba89bc92d0ddd7ad8ed5887d6 [0,1,0,1,0,0|2,0,0]=4 16289 B13R1.2438 CCSCCNC[C@H]1C[C@](C1)(C)O 8af801ab469a195628f92fe6507215cc [0,1,0,1,0,0|2,0,0]=4 16290 B13R1.2438 CCSCCOCC1CC(O1)(C)C 2edc1b73f707da890d96a148f757d472 [0,1,0,1,0,0|2,0,0]=4 16291 B13R1.2438 COCCCCCN1CC(C1)(C)O f95beef6bd2208538cd2b9f710dee93c [0,1,0,1,0,0|2,0,0]=4 16292 B13R1.2438 COCCCCNC1CC(C1)(C)O cb2386748de20ebc655826c42b57ac61 [0,1,0,1,0,0|2,0,0]=4 16293 B13R1.2438 COCCCCN[C@H]1C[C@@](C1)(C)O af790d255c649129f71b08eef9ae8217 [0,1,0,1,0,0|2,0,0]=4 16294 B13R1.2438 COCCCNCC1CC(O1)(C)C 454f7b3f6b9bf32572107cdbe1b71bc0 [0,1,0,1,0,0|2,0,0]=4 16295 B13R1.2438 COCCCNC[C@H]1C[C@@](C1)(C)O 63b21593ff244761194f83c8790ff1a6 [0,1,0,1,0,0|2,0,0]=4 16296 B13R1.2438 COCCCNC[C@H]1C[C@](C1)(C)O d4c89d520fc4d3a0737efa7d21e8c049 [0,1,0,1,0,0|2,0,0]=4 16297 B13R1.2438 COCCCOCC1CC(O1)(C)C 861e59cdd32424ce94eb299f262d2e70 [0,1,0,1,0,0|2,0,0]=4 16298 B13R1.2438 CSCCCNCC1CC(O1)(C)C 4e55003dbd1ecb34a9e8c05ac12b6bca [0,1,0,1,0,0|2,0,0]=4 16299 B13R1.2438 CSCCCNC[C@H]1C[C@@](C1)(C)O 9f649251d6b7f1c92e6491c2a9c78e29 [0,1,0,1,0,0|2,0,0]=4 16300 B13R1.2438 CSCCCNC[C@H]1C[C@](C1)(C)O 071296db93c7acdd023ab90df0528afc [0,1,0,1,0,0|2,0,0]=4 16301 B13R1.2438 CSCCCOCC1CC(O1)(C)C 688905e411c6c25cd666dbf84457818f [0,1,0,1,0,0|2,0,0]=4 16302 B13R1.2438 C[C@@]1(C[C@@H](C1)CNCCCCF)O b8b3875c690e32ce1b22d80b7f905f6d [0,1,0,1,0,0|2,0,0]=4 16303 B13R1.2438 C[C@@]1(C[C@@H](C1)CNCCCCO)O d1c298049ee5cf2c05d82ec5c3030743 [0,1,0,1,0,0|2,0,0]=4 16304 B13R1.2438 C[C@@]1(C[C@H](C1)CNCCCCF)O 7003955bf82e9433412244fe7dc06d41 [0,1,0,1,0,0|2,0,0]=4 16305 B13R1.2438 C[C@@]1(C[C@H](C1)CNCCCCO)O cdfdf3d849b421d5e35397039f9bdcc5 [0,1,0,1,0,0|2,0,0]=4 16306 B13R1.2438 C[C@@]1(C[C@H](C1)NCCCCCF)O bac376783633050847a8304fce6a0480 [0,1,0,1,0,0|2,0,0]=4 16307 B13R1.2438 C[C@@]1(C[C@H](C1)NCCCCCO)O e7c267cd0c5ab25acc4e15cf086ff740 [0,1,0,1,0,0|2,0,0]=4 16308 B13R1.2800 CCC1CCCN1C(=O)CC(C)O 4405b306286b61f6abd0a94e0e5bf32e [0,1,0,1,0,0|1,0,1]=4 16309 B13R1.2800 CCC1CCCN1C(=O)C[C@@H](C)O aa3c0094c405d508e64b53fb5f643c4a [0,1,0,1,0,0|1,0,1]=4 16310 B13R1.2800 CCC1CCCN1C(=O)C[C@H](C)O ee6491e5a98965cc3ee87ef2c2474e4b [0,1,0,1,0,0|1,0,1]=4 16311 B13R1.2800 CCC1CCCN1C(C)CC(C)C 60780dfbd57e5bb63d2234f5d25ad226 [0,1,0,1,0,0|2,0,0]=4 16312 B13R1.2800 CC[C@@H]1CCCN1C(=O)CC(C)O 9a5132788d8f2879aee3df8e0a1c3d97 [0,1,0,1,0,0|1,0,1]=4 16313 B13R1.2800 CC[C@@H]1CCCN1C(=O)C[C@@H](C)O 8569ee8746bc63cb91ed0f64b9533a8e [0,1,0,1,0,0|1,0,1]=4 16314 B13R1.2800 CC[C@@H]1CCCN1C(=O)C[C@H](C)O f5d6e03234aa3fa6e39a606d03f5ee3e [0,1,0,1,0,0|1,0,1]=4 16315 B13R1.2800 CC[C@@H]1CCCN1C(C)CC(C)C 410c16e1bab72e0d0a406fe95c8db4bb [0,1,0,1,0,0|2,0,0]=4 16316 B13R1.3574 CCCCCCCC(C)OC1CC1 016842b01f77534ce4256ede1207e687 [0,1,0,1,0,0|2,0,0]=4 16317 B13R1.3574 CCCCCCCN(C)CC1CC1 3191851e67a6b59e368ca6097e0a646e [0,1,0,1,0,0|2,0,0]=4 16318 B13R1.3574 CCCCCCC[C@H](C)NC1CC1 affd708b59034aca96a6a313daa3b73b [0,1,0,1,0,0|2,0,0]=4 16319 B13R1.3574 CCCCCCOC(C)CC1CC1 700a5146a49658cde6a379af9c8140b0 [0,1,0,1,0,0|2,0,0]=4 16320 B13R1.5437 CCCCCCN[C@@]1(C[C@H](C1)O)C 51f6a0fb0092ffa730526c167f2a2b5a [0,1,0,1,0,0|1,0,0]=3 16321 B13R1.5437 CCCCCNCC1(CC(C1)O)O e18141ea307bd0b2e493a3c92846d23e [0,1,0,1,0,0|1,0,0]=3 16322 B13R1.5437 CCCCOCN[C@@]1(C[C@H](C1)O)C b62b4e9f967efe121f9d770ec73dd2d8 [0,1,0,1,0,0|2,0,0]=4 16323 B13R1.5437 CCCOCCN[C@@]1(C[C@H](C1)O)C de86104b34f97e7659187df03cc96047 [0,1,0,1,0,0|2,0,0]=4 16324 B13R1.5437 CCOCCCN[C@@]1(C[C@H](C1)O)C 60dedaf7b826db95e74f3934a5d39967 [0,1,0,1,0,0|2,0,0]=4 16325 B13R1.5437 CCOCCNCC1(CC(C1)O)O 9610afc4882928cdfbf6c66eee4d26d5 [0,1,0,1,0,0|2,0,0]=4 16326 B13R1.5437 CCSCCCN[C@@]1(C[C@H](C1)O)C 902186c0dbf36a82f85f1a7f5f8dd357 [0,1,0,1,0,0|2,0,0]=4 16327 B13R1.5437 CCSCCNCC1(CC(C1)O)O d20aa5f35213eda62f8565f2f7189400 [0,1,0,1,0,0|2,0,0]=4 16328 B13R1.5437 COCCCCN[C@@]1(C[C@H](C1)O)C 005b4047ea4d4f88a60bf44aee1e3ec4 [0,1,0,1,0,0|2,0,0]=4 16329 B13R1.5437 COCCCNCC1(CC(C1)O)O da6821a7a045422436cb4787abdffc15 [0,1,0,1,0,0|2,0,0]=4 16330 B13R1.5437 CSCCCNCC1(CC(C1)O)O b840c0d1a26ea955407902bf8e7e5b20 [0,1,0,1,0,0|2,0,0]=4 16331 B13R1.5437 C[C@@]1(C[C@@H](C1)O)NCCCCCF 60591fbec378603e3fdae28d5d9acf9e [0,1,0,1,0,0|2,0,0]=4 16332 B13R1.5437 C[C@@]1(C[C@@H](C1)O)NCCCCCO ee6a181fb94266d731d9d18cde245a2a [0,1,0,1,0,0|2,0,0]=4 16333 B13R1.5437 OC1CC(C1)(O)CNCCCCF f0bb4360b757ebac8b23dd1ecef08966 [0,1,0,1,0,0|2,0,0]=4 16334 B13R1.5437 OCCCCNCC1(CC(C1)O)O 27de84a2e994809bf8db1af1bf764ef8 [0,1,0,1,0,0|2,0,0]=4 16335 B13R1.6567 CCCCCN1CC(CC1(C)C)C 11f02a44c51f5d0a0e1f9967778a8f6d [0,1,0,1,0,0|2,0,0]=4 16336 B13R1.6567 CCCCCN1CC(CC1(C)C)O f21a782be5c09281d65ceb8375737242 [0,1,0,1,0,0|2,0,0]=4 16337 B13R1.6567 CCCCCN1C[C@H](CC1(C)C)O d8875f1314aeae3893fb2d4b6dea9327 [0,1,0,1,0,0|2,0,0]=4 16338 B13R1.7456 CC(C)CC(C)N1CCCCCC1 f8488b2b4c9be00f8eebca741b966e68 [0,1,0,1,0,0|2,0,0]=4 16339 B13R1.7456 CC(C)CN(C)C1CCCCCC1 c67bc4b416d7ff347996a676e7e380ec [0,1,0,1,0,0|2,0,0]=4 16340 B13R1.7456 CC(O)CC(=O)N1CCCCCC1 c2486f9b821b8a326589232c2086eeb5 [0,1,0,1,0,0|1,0,1]=4 16341 B13R1.7456 CC(O)CN(C)C1CCCCCC1 fab407399ab97476bf73708b4b85005e [0,1,0,1,0,0|1,0,0]=3 16342 B13R1.7456 CC(O)CN(C)C1CCCOCC1 9af1d992275040fb428dd8e7d096eada [0,1,0,1,0,0|2,0,0]=4 16343 B13R1.7456 C[C@@H](O)CC(=O)N1CCCCCC1 b55433298a6ec56d6746702e9a55defe [0,1,0,1,0,0|1,0,1]=4 16344 B13R1.7456 C[C@@H](O)CN(C)C1CCCCCC1 55a45d0bfac6bf783331d555f46f0989 [0,1,0,1,0,0|1,0,0]=3 16345 B13R1.7456 C[C@H](O)CC(=O)N1CCCCCC1 d515ef1c2413e8bc7ed8f40618cb3f9e [0,1,0,1,0,0|1,0,1]=4 16346 B13R1.7456 C[C@H](O)CN(C)C1CCCCCC1 bdd19be5083d6cd2203f794494a57eb4 [0,1,0,1,0,0|1,0,0]=3 16347 B13R1.7456 C[C@H](O)CN(C)C1CCCOCC1 113d291082f0123f9af6937b396f63e8 [0,1,0,1,0,0|2,0,0]=4 16348 B13R1.18 CC(CCCO)N1CCCC(C1)O b689bec1bfe1aebca433bb10422f7d44 [0,1,0,1,0,0|2,0,0]=4 16349 B13R1.18 CC(CCCO)N1CCC[C@@H](C1)O f8b0188d87472bb12c7f9cf0d1a684b9 [0,1,0,1,0,0|2,0,0]=4 16350 B13R1.18 CC(CCCO)N1CCC[C@H](C1)O 47063135843fdd1dfa2421ca643b8025 [0,1,0,1,0,0|2,0,0]=4 16351 B13R1.18 CCCCC(=O)N1CCCC(C1)O 8e171b5b571c4c609b67651cf2736064 [0,1,0,1,0,0|1,0,1]=4 16352 B13R1.18 CCCCC(=O)N1CCC[C@@H](C1)O f3ad8a7304960ec32e5bba7c3e1d7f8d [0,1,0,1,0,0|1,0,1]=4 16353 B13R1.18 CCCCC(=O)N1CCC[C@H](C1)O c0ffaa52f4af3404464bef8d366f1f74 [0,1,0,1,0,0|1,0,1]=4 16354 B13R1.18 CCCCC(C)N1CCCC(C1)C c7440dcbf9f0e43ee69970ee2152f93e [0,1,0,1,0,0|2,0,0]=4 16355 B13R1.18 CCCCC(C)N1CCCC(C1)F d0ea1a15e7a9bd3cbbbad6ae052ffc80 [0,1,0,1,0,0|2,0,0]=4 16356 B13R1.18 CCCCC(C)N1CCCC(C1)O ad161f6284d990cc4b63f0506ce86611 [0,1,0,1,0,0|1,0,0]=3 16357 B13R1.18 CCCCC(C)N1CCC[C@@H](C1)C 7155fe31854c05514efd2249a3e47547 [0,1,0,1,0,0|2,0,0]=4 16358 B13R1.18 CCCCC(C)N1CCC[C@@H](C1)F 87791411b2f634e70ba87dfe464547c4 [0,1,0,1,0,0|2,0,0]=4 16359 B13R1.18 CCCCC(C)N1CCC[C@@H](C1)O 24e3c0e74336a16c87d58ce38f02f5dc [0,1,0,1,0,0|1,0,0]=3 16360 B13R1.18 CCCCC(C)N1CCC[C@H](C1)C d2bba3a4817a65a0bdf47ad330190afd [0,1,0,1,0,0|2,0,0]=4 16361 B13R1.18 CCCCC(C)N1CCC[C@H](C1)F 1a03c23474561f6f6d256fd75dabd4ae [0,1,0,1,0,0|2,0,0]=4 16362 B13R1.18 CCCCC(C)N1CCC[C@H](C1)O c95b212bd717b102bf3fa732ac633dd0 [0,1,0,1,0,0|1,0,0]=3 16363 B13R1.18 CCCCN(C)C1CCCC(C1)O eefe3c61f6e9b565dbdd4524df6696e2 [0,1,0,1,0,0|1,0,0]=3 16364 B13R1.18 CCCCN(C)[C@@H]1CCC[C@H](C1)O 248d6e32d5ac646efdf3b71164b2611d [0,1,0,1,0,0|1,0,0]=3 16365 B13R1.18 CCCCN(C)[C@H]1CCC[C@@H](C1)O 5230d93d1b40e9b20b6e9132e308935a [0,1,0,1,0,0|1,0,0]=3 16366 B13R1.18 CCOCN(C)C1CCCC(C1)O cab01ded171c4e5e52e4a61c69ddce87 [0,1,0,1,0,0|2,0,0]=4 16367 B13R1.18 CCOCN(C)[C@@H]1CCC[C@H](C1)O 94f06051cd7ccdbc192c251228961bcd [0,1,0,1,0,0|2,0,0]=4 16368 B13R1.18 CCOCN(C)[C@H]1CCC[C@@H](C1)O 87091e8657631d6a7c7760bcabff861a [0,1,0,1,0,0|2,0,0]=4 16369 B13R1.18 CN(CCCF)C1CCCC(C1)O c3eddd2679e05351e62a6c5163162252 [0,1,0,1,0,0|2,0,0]=4 16370 B13R1.18 CN(CCCF)[C@@H]1CCC[C@H](C1)O d1f35e406db71486fa9aa66bfb8f817d [0,1,0,1,0,0|2,0,0]=4 16371 B13R1.18 CN(CCCF)[C@H]1CCC[C@@H](C1)O dfa9de19f2d05c49b7a91f2cf0e4fba0 [0,1,0,1,0,0|2,0,0]=4 16372 B13R1.18 CN(CCCO)C1CCCC(C1)O 8208d1bd445fcf1645680e706292878f [0,1,0,1,0,0|2,0,0]=4 16373 B13R1.18 CN(CCCO)[C@@H]1CCC[C@H](C1)O 7f21b32667a63edd02a1d366d74d98cd [0,1,0,1,0,0|2,0,0]=4 16374 B13R1.18 CN(CCCO)[C@H]1CCC[C@@H](C1)O 7e867043562ef79cc16d990ddcb9b44b [0,1,0,1,0,0|2,0,0]=4 16375 B13R1.18 CN(CCCS)C1CCCC(C1)O 1b3a074d12338601e02ae5da141e6fb2 [0,1,0,1,0,0|2,0,0]=4 16376 B13R1.18 CN(CCCS)[C@@H]1CCC[C@H](C1)O 9b97c0c84959fc600ef326b0a3b4e327 [0,1,0,1,0,0|2,0,0]=4 16377 B13R1.18 CN(CCCS)[C@H]1CCC[C@@H](C1)O e648bdf1c119edb36a07168e890dfb8f [0,1,0,1,0,0|2,0,0]=4 16378 B13R1.18 COCCN(C)C1CCCC(C1)O 178b4a75c4de58f55f43f3f8b5bb3683 [0,1,0,1,0,0|2,0,0]=4 16379 B13R1.18 COCCN(C)[C@@H]1CCC[C@H](C1)O 7a8ceb6932867df93a9e7c21fa703ca9 [0,1,0,1,0,0|2,0,0]=4 16380 B13R1.18 COCCN(C)[C@H]1CCC[C@@H](C1)O af9c8459af84656dfc27ea529e59702d [0,1,0,1,0,0|2,0,0]=4 16381 B13R1.18 CSCCN(C)C1CCCC(C1)O ef4248a52dc0cbcf7375802336d06dcf [0,1,0,1,0,0|2,0,0]=4 16382 B13R1.18 CSCCN(C)[C@@H]1CCC[C@H](C1)O 82c6d29a1b56db010e008b56e8deddfd [0,1,0,1,0,0|2,0,0]=4 16383 B13R1.18 CSCCN(C)[C@H]1CCC[C@@H](C1)O 5103515c58a8be57d6cc58ac709a6bb6 [0,1,0,1,0,0|2,0,0]=4 16384 B13R1.43 CC(CCCO)NC1CCC(C1)O 9f57cafc0f0fc5dc39c850702504676a [0,1,0,1,0,0|2,0,0]=4 16385 B13R1.43 CC(CCCO)N[C@@H]1CC[C@@H](C1)O 6a767f2d0957208b6f5d1df5125a4262 [0,1,0,1,0,0|2,0,0]=4 16386 B13R1.43 CC(CCCO)N[C@@H]1CC[C@H](C1)O 7d91630581b9c4a05c85738729fc5c14 [0,1,0,1,0,0|2,0,0]=4 16387 B13R1.43 CC(CCCO)N[C@H]1CC[C@@H](C1)O 219c2165a61e8cb52e4aeb0dddb97611 [0,1,0,1,0,0|2,0,0]=4 16388 B13R1.43 CC(CCCO)N[C@H]1CC[C@H](C1)O af3fb11f10e348a0c13598805d7a7fc0 [0,1,0,1,0,0|2,0,0]=4 16389 B13R1.43 CCCCC(=O)NC1CCC(C1)O 0c4fb647550cbf4baa609714a0cdfa7e [0,1,0,1,0,0|1,0,1]=4 16390 B13R1.43 CCCCC(=O)N[C@@H]1CC[C@@H](C1)O 51e166a7454766dfc722bc96e001b6b4 [0,1,0,1,0,0|1,0,1]=4 16391 B13R1.43 CCCCC(=O)N[C@@H]1CC[C@H](C1)O 3ce2863c1c2e6d1e3023fcfa8657f6b2 [0,1,0,1,0,0|1,0,1]=4 16392 B13R1.43 CCCCC(=O)N[C@H]1CC[C@@H](C1)O f03d6f56ebf89671cd4492d89a2cd77e [0,1,0,1,0,0|1,0,1]=4 16393 B13R1.43 CCCCC(=O)N[C@H]1CC[C@H](C1)O f94e3c0af63879530fb674830c0f92c3 [0,1,0,1,0,0|1,0,1]=4 16394 B13R1.43 CCCCC(C)NC1CCC(C1)C 41b9a31e6d8109dc0ae45c50169fb44b [0,1,0,1,0,0|2,0,0]=4 16395 B13R1.43 CCCCC(C)NC1CCC(C1)O 7246bc86c8c400067bdbac9766561c58 [0,1,0,1,0,0|1,0,0]=3 16396 B13R1.43 CCCCC(C)N[C@@H]1CC[C@@H](C1)O ee8b189f21975447ce920f7c5849532e [0,1,0,1,0,0|1,0,0]=3 16397 B13R1.43 CCCCC(C)N[C@@H]1CC[C@H](C1)O 9a4ae62e4ce688b7428618e9b1e15324 [0,1,0,1,0,0|1,0,0]=3 16398 B13R1.43 CCCCC(C)N[C@H]1CC[C@@H](C1)O 2214e8e06f0100a33652ec39994bd461 [0,1,0,1,0,0|1,0,0]=3 16399 B13R1.43 CCCCC(C)N[C@H]1CC[C@H](C1)O 99879240fbb1848092214af69d06b2de [0,1,0,1,0,0|1,0,0]=3 16400 B13R1.43 CCCCC(C)OC1CCC(C1)C 2db84137726f2c44ab8ba2df9c64b105 [0,1,0,1,0,0|2,0,0]=4 16401 B13R1.43 CCCCC(C)OC1CCC(C1)F d9a7356cf76e7dc580c8ca5845a2e2f1 [0,1,0,1,0,0|2,0,0]=4 16402 B13R1.43 CCCNC(=O)C[C@@H]1CC[C@@H](C1)O 0dbe08ef5d2e51641e3599125e374bd5 [0,1,0,1,0,0|1,0,1]=4 16403 B13R1.43 CCCNC(=O)C[C@@H]1CC[C@H](C1)O bac43972b336d1dc45a06f8c09fecd30 [0,1,0,1,0,0|1,0,1]=4 16404 B13R1.128 C=C(C)CCCNC1CCC(C1)O 1fee59c024fb4ecfb837f511c01be3d8 [0,1,0,1,0,0|1,0,1]=4 16405 B13R1.128 C=C(C)CCCN[C@@H]1CC[C@@H](C1)O de8860574594bb5890bd16dcb870fcbc [0,1,0,1,0,0|1,0,1]=4 16406 B13R1.128 C=C(C)CCCN[C@@H]1CC[C@H](C1)O 5c3a39f6045bc7d481a8cd7884a6f73d [0,1,0,1,0,0|1,0,1]=4 16407 B13R1.128 C=C(C)CCCN[C@H]1CC[C@@H](C1)O e46cb0dfab1c0c7cda3c07467ff5f44e [0,1,0,1,0,0|1,0,1]=4 16408 B13R1.128 C=C(C)CCCN[C@H]1CC[C@H](C1)O e89f1dcba13ee92049032f8afe304269 [0,1,0,1,0,0|1,0,1]=4 16409 B13R1.128 C=C(C)CCNCC1CCC(C1)O 2317957683c355ed23ec142120d0b422 [0,1,0,1,0,0|1,0,1]=4 16410 B13R1.128 C=C(C)CCOCC1CCC(O1)C a28d4926c303acbf409c0af20071fb90 [0,1,0,1,0,0|1,0,1]=4 16411 B13R1.128 C=C(C)CCOC[C@@H]1CC[C@@H](O1)C 9241f78ecef3038387b9c0526420d87a [0,1,0,1,0,0|1,0,1]=4 16412 B13R1.128 CC(=O)CCCCN1CCC(C1)O f8b0ed7a724bf07cf886d1e6e3f13601 [0,1,0,1,0,0|1,0,1]=4 16413 B13R1.128 CC(=O)CCCCN1CC[C@@H](C1)O 18d8b2ab772e9258144321c3890f63db [0,1,0,1,0,0|1,0,1]=4 16414 B13R1.128 CC(=O)CCCCN1CC[C@H](C1)O 8d4ba51c53ac3ba13843143e05fa96f0 [0,1,0,1,0,0|1,0,1]=4 16415 B13R1.128 CC(=O)CCCNC1CCC(C1)O 09810a5b02e0fa8aa8c3898e1dae171a [0,1,0,1,0,0|1,0,1]=4 16416 B13R1.128 CC(=O)CCCN[C@@H]1CC[C@@H](C1)O 222810f5a2728fbc219fc5b6b27a27bf [0,1,0,1,0,0|1,0,1]=4 16417 B13R1.128 CC(=O)CCCN[C@@H]1CC[C@H](C1)O d96917046be560254eb4cbf3f5e6f16c [0,1,0,1,0,0|1,0,1]=4 16418 B13R1.128 CC(=O)CCCN[C@H]1CC[C@@H](C1)O ad3f0dae02286b3b60afb53b9feb3f80 [0,1,0,1,0,0|1,0,1]=4 16419 B13R1.128 CC(=O)CCCN[C@H]1CC[C@H](C1)O 9a62cd715030217db1f49f049c7ba925 [0,1,0,1,0,0|1,0,1]=4 16420 B13R1.128 CC(=O)CCNCC1CCC(C1)O 1d7851b0504b22e7a854e9912d95ca5a [0,1,0,1,0,0|1,0,1]=4 16421 B13R1.128 CC(=O)CCOCC1CCC(O1)C 09b09f85a33cc8a1cf9b7bac844b8864 [0,1,0,1,0,0|1,0,1]=4 16422 B13R1.128 CC(=O)CCOC[C@@H]1CC[C@@H](O1)C 0391018a5007cd65823714f76b96e2fd [0,1,0,1,0,0|1,0,1]=4 16423 B13R1.128 CC(C)CCCCN1CCC(C1)C 5bbac7002b347bb2f01bd6d7700f1fab [0,1,0,1,0,0|2,0,0]=4 16424 B13R1.128 CC(C)CCCCN1CCC(C1)F 2c7949694e480f2c2f2c0da68be1450d [0,1,0,1,0,0|2,0,0]=4 16425 B13R1.128 CC(C)CCCCN1CCC(C1)O 478181e6841cce87ca8cf554b2c81880 [0,1,0,1,0,0|1,0,0]=3 16426 B13R1.128 CC(C)CCCCN1CC[C@@H](C1)F 6b1aa038986965a0c8453437eecc099c [0,1,0,1,0,0|2,0,0]=4 16427 B13R1.128 CC(C)CCCCN1CC[C@@H](C1)O 5995cd371b8ba64616db0270ce996680 [0,1,0,1,0,0|1,0,0]=3 16428 B13R1.128 CC(C)CCCCN1CC[C@H](C1)F 7b5c37a8353ccf6cee529edab0dea5f1 [0,1,0,1,0,0|2,0,0]=4 16429 B13R1.128 CC(C)CCCCN1CC[C@H](C1)O c63ab6a51ffee71c9c84eb4bcdcea1a0 [0,1,0,1,0,0|1,0,0]=3 16430 B13R1.128 CC(C)CCCNC1CCC(C1)C 925640c5dbf55807db1645bc456c5227 [0,1,0,1,0,0|2,0,0]=4 16431 B13R1.128 CC(C)CCCNC1CCC(C1)O 51d9f7fdc71f8647d4ed3e29c43d196d [0,1,0,1,0,0|1,0,0]=3 16432 B13R1.128 CC(C)CCCN[C@@H]1CC[C@@H](C1)O 584495b9e18e0661b4b23b7fb57fd231 [0,1,0,1,0,0|1,0,0]=3 16433 B13R1.128 CC(C)CCCN[C@@H]1CC[C@H](C1)O b560be4032c6667ee5c5c6692910e6c4 [0,1,0,1,0,0|1,0,0]=3 16434 B13R1.128 CC(C)CCCN[C@H]1CC[C@@H](C1)O c13b58c07e03062bfe7ed311f683c7fd [0,1,0,1,0,0|1,0,0]=3 16435 B13R1.128 CC(C)CCCN[C@H]1CC[C@H](C1)O 4a1b39ae9f1e460bd8033e4c8b0c2dbc [0,1,0,1,0,0|1,0,0]=3 16436 B13R1.128 CC(C)CCCOC1CCC(C1)C 9a64772c1e5e17ca8d1d89f34342734e [0,1,0,1,0,0|2,0,0]=4 16437 B13R1.128 CC(C)CCCOC1CCC(C1)F 1c200806c1275102256280bb2a47b142 [0,1,0,1,0,0|2,0,0]=4 16438 B13R1.128 CC(C)CCNCC1CCC(C1)O 2586e445c445736f50a5f4ab05d55c7d [0,1,0,1,0,0|1,0,0]=3 16439 B13R1.128 CC(C)CCOCC1CCC(C1)C d27949161dc0093384e4f20b7b3aa7d6 [0,1,0,1,0,0|2,0,0]=4 16440 B13R1.128 CC(C)CCOCC1CCC(C1)F 2b439a553eb7194a330d76cf499568dc [0,1,0,1,0,0|2,0,0]=4 16441 B13R1.128 CC(C)CCOCC1CCC(O1)C 25d0b509c2e0bd4d7487f55dc0e9b25d [0,1,0,1,0,0|1,0,0]=3 16442 B13R1.128 CC(C)CCOC[C@@H]1CC[C@@H](O1)C fc16ab09f329a359946d53114e68b33a [0,1,0,1,0,0|1,0,0]=3 16443 B13R1.128 CC(C)CCOC[C@@H]1CC[C@H](C1)F 9bd4fe94cc5247a70176f75c49934eaa [0,1,0,1,0,0|2,0,0]=4 16444 B13R1.128 CC(C)CCOC[C@H]1CC[C@H](C1)F 5631bb9cf765aae787bf2abfe23255a7 [0,1,0,1,0,0|2,0,0]=4 16445 B13R1.128 CC(C)CNCCN1CCC(C1)O d4d7b102361dbb1b75abc8fb98a5b812 [0,1,0,1,0,0|2,0,0]=4 16446 B13R1.128 CC(C)CNCCN1CC[C@@H](C1)O fc1f3acfe070483dcfc5dbbbd38d69bf [0,1,0,1,0,0|2,0,0]=4 16447 B13R1.128 CC(C)COCCN1CCC(C1)O bfc588c01b3504ae1d0217060f521cd2 [0,1,0,1,0,0|2,0,0]=4 16448 B13R1.128 CC(C)COCCN1CC[C@@H](C1)O 94a2538ac02340187e7eac23da7698f8 [0,1,0,1,0,0|2,0,0]=4 16449 B13R1.128 CC(C)COCCN1CC[C@H](C1)O ed1291b230f816412e66c73ce1a97410 [0,1,0,1,0,0|2,0,0]=4 16450 B13R1.128 CC(C)OCCNC1CCC(C1)O f6e8319c5485130cb90d52672c03dfb7 [0,1,0,1,0,0|2,0,0]=4 16451 B13R1.128 CC(C)OCCN[C@@H]1CC[C@@H](C1)O 3f3aa69eda43c123a9e3b8c99e9c6841 [0,1,0,1,0,0|2,0,0]=4 16452 B13R1.128 CC(C)OCCN[C@@H]1CC[C@H](C1)O 534bbf448340089a135697b73ca53688 [0,1,0,1,0,0|2,0,0]=4 16453 B13R1.128 CC(C)OCCN[C@H]1CC[C@@H](C1)O 63f7e87256a4f69232bf07356dfed09c [0,1,0,1,0,0|2,0,0]=4 16454 B13R1.128 CC(C)OCCN[C@H]1CC[C@H](C1)O 43bc3c00062edbd3db1d9a50b150e728 [0,1,0,1,0,0|2,0,0]=4 16455 B13R1.128 CC(C)OCNCC1CCC(C1)O d68a5ba2f19efade7e64cf573470e1a1 [0,1,0,1,0,0|2,0,0]=4 16456 B13R1.128 CC(C)OCOCC1CCC(O1)C c943751ad4d6690c0c3c370c836c5371 [0,1,0,1,0,0|2,0,0]=4 16457 B13R1.128 CC(C)OCOC[C@@H]1CC[C@@H](O1)C b534f95964914a2c45dc50a7f147f50e [0,1,0,1,0,0|2,0,0]=4 16458 B13R1.128 CC(C)SCCNC1CCC(C1)O 913096a266493205240104105d4dbdf8 [0,1,0,1,0,0|2,0,0]=4 16459 B13R1.128 CC(C)SCCN[C@@H]1CC[C@@H](C1)O d2bd1b653fb5174d330ad2986d1cf57d [0,1,0,1,0,0|2,0,0]=4 16460 B13R1.128 CC(C)SCCN[C@@H]1CC[C@H](C1)O ba9a8f354d63c76ac946e455319f39fd [0,1,0,1,0,0|2,0,0]=4 16461 B13R1.128 CC(C)SCCN[C@H]1CC[C@@H](C1)O 479d687833b0eaddaba6e4602a7646ab [0,1,0,1,0,0|2,0,0]=4 16462 B13R1.128 CC(C)SCCN[C@H]1CC[C@H](C1)O 704bef4883d21605a2cff4d94afaf8f9 [0,1,0,1,0,0|2,0,0]=4 16463 B13R1.128 CC(O)CCCCN1CCC(C1)C 3977ac74cef7b3036cf35581cd4011e5 [0,1,0,1,0,0|1,0,0]=3 16464 B13R1.128 CC(O)CCCCN1CCC(C1)F 59ad22977bacc5cace2d787a81cd1358 [0,1,0,1,0,0|1,0,0]=3 16465 B13R1.128 CC(O)CCCCN1CCC(C1)O 3b257561015f51210590a637047fa43d [0,1,0,1,0,0|1,0,0]=3 16466 B13R1.128 CC(O)CCCCN1CCN(C1)C 56664e5591729a2da9186cfeaa8f4584 [0,1,0,1,0,0|2,0,0]=4 16467 B13R1.128 CC(O)CCCCN1CC[C@@H](C1)F 0c686663e4e91bda1d675565da95d129 [0,1,0,1,0,0|1,0,0]=3 16468 B13R1.128 CC(O)CCCCN1CC[C@@H](C1)O dc31f81746fabbbf68142dad6f1f359a [0,1,0,1,0,0|1,0,0]=3 16469 B13R1.128 CC(O)CCCCN1CC[C@H](C1)F 5dbd91904254a2c6a92b792393fcc5c2 [0,1,0,1,0,0|1,0,0]=3 16470 B13R1.128 CC(O)CCCCN1CC[C@H](C1)O 05bc6ec0ddfc7a812179e637f26664d5 [0,1,0,1,0,0|1,0,0]=3 16471 B13R1.128 CC(O)CCCNC1CCC(C1)C d3515048077ce88f0289c0aa9bf64a93 [0,1,0,1,0,0|1,0,0]=3 16472 B13R1.128 CC(O)CCCNC1CCC(C1)O 6dc0dcf96272600321757062d0bde6a6 [0,1,0,1,0,0|1,0,0]=3 16473 B13R1.128 CC(O)CCCNC1CCN(C1)C 7dad1ee5618f1976fef413a9a582150e [0,1,0,1,0,0|2,0,0]=4 16474 B13R1.128 CC(O)CCCN[C@@H]1CCN(C1)C 7e2aebaa91af0f6e624d8abdedddcc53 [0,1,0,1,0,0|2,0,0]=4 16475 B13R1.128 CC(O)CCCN[C@@H]1CC[C@@H](C1)O c7bfa180b402abb8fce79f22c30ec302 [0,1,0,1,0,0|1,0,0]=3 16476 B13R1.128 CC(O)CCCN[C@@H]1CC[C@H](C1)O efb677e2f59c0bd8931414c8cd8a9d50 [0,1,0,1,0,0|1,0,0]=3 16477 B13R1.128 CC(O)CCCN[C@H]1CCN(C1)C 230a016cb8c0efe83b4f558df4a2fedf [0,1,0,1,0,0|2,0,0]=4 16478 B13R1.128 CC(O)CCCN[C@H]1CC[C@@H](C1)O c38f7bb2c7d778e8985d32e9571350eb [0,1,0,1,0,0|1,0,0]=3 16479 B13R1.128 CC(O)CCCN[C@H]1CC[C@H](C1)O 200c4fc2d0084905af0496d4c4476298 [0,1,0,1,0,0|1,0,0]=3 16480 B13R1.128 CC(O)CCNCC1CCC(C1)O 130be7c15cb2a74a114dc60a9aecad5e [0,1,0,1,0,0|1,0,0]=3 16481 B13R1.128 CC(O)CCNCC1CCN(C1)C 080aa3e090bd318fc615853a421129dd [0,1,0,1,0,0|2,0,0]=4 16482 B13R1.128 CC(O)CCNC[C@@H]1CCN(C1)C df0f74a89bc32f636f96769e3f4da88d [0,1,0,1,0,0|2,0,0]=4 16483 B13R1.128 CC(O)CCNC[C@H]1CCN(C1)C 7fee26bbe0b633aa39c1bae792e911d8 [0,1,0,1,0,0|2,0,0]=4 16484 B13R1.128 CC(O)CNCCC1CCN(C1)C c280395859afbaed68643f19979be837 [0,1,0,1,0,0|2,0,0]=4 16485 B13R1.128 CC(O)CNCCN1CCC(C1)F d0af7260525c8033f3abd2ef884f3832 [0,1,0,1,0,0|2,0,0]=4 16486 B13R1.128 CC(O)CNCCN1CCC(C1)O 687d7655183844165ee46888193650e6 [0,1,0,1,0,0|2,0,0]=4 16487 B13R1.128 CC(O)CNCCN1CC[C@@H](C1)F c58379d4bfbac456fc210b45889b205f [0,1,0,1,0,0|2,0,0]=4 16488 B13R1.128 CC(O)CNCCN1CC[C@@H](C1)O b48b10e55f873bff139486c22e16c8c5 [0,1,0,1,0,0|2,0,0]=4 16489 B13R1.128 CC(O)CNCCN1CC[C@H](C1)F db69dfef4d9d8b64d2ea340572b016b9 [0,1,0,1,0,0|2,0,0]=4 16490 B13R1.128 CC1CCC(C1)CCCOC(C)C e16fb1f857df8421deb1500eb11794f9 [0,1,0,1,0,0|2,0,0]=4 16491 B13R1.128 CC1CCC(O1)COCCN(C)C d8d1f2b763b18349fddeaf0a0894ad6f [0,1,0,1,0,0|2,0,0]=4 16492 B13R1.128 CC1CCC(O1)COCCS(=O)C 88e51c833331028b613920eb60433b99 [0,1,0,1,0,0|2,0,0]=4 16493 B13R1.128 CC1CCN(C1)CCCC[C@@H](C)O 011321c9cd6b3be5c1a5ef78a6242613 [0,1,0,1,0,0|1,0,0]=3 16494 B13R1.128 CN(C)CCCCN1CCC(C1)O 7fde0f6a1ff0a624afd61125305ed153 [0,1,0,1,0,0|2,0,0]=4 16495 B13R1.128 CN(C)CCCCN1CC[C@@H](C1)O 6b5d13d0917cc8685e50bef111ce7bb5 [0,1,0,1,0,0|2,0,0]=4 16496 B13R1.128 CN(C)CCCCN1CC[C@H](C1)O d9f4745d77a57ce1f6c3103a4c94f355 [0,1,0,1,0,0|2,0,0]=4 16497 B13R1.128 CN(C)CCCNC1CCC(C1)O 6b54294343c1e9f409dbfdf9089d8cd4 [0,1,0,1,0,0|2,0,0]=4 16498 B13R1.128 CN(C)CCCN[C@@H]1CC[C@@H](C1)O 003c85be7c626c8b03b1df5eb29751aa [0,1,0,1,0,0|2,0,0]=4 16499 B13R1.128 CN(C)CCCN[C@@H]1CC[C@H](C1)O 3357ffc75d4240b1e360b9cb227cc41f [0,1,0,1,0,0|2,0,0]=4 16500 B13R1.128 CN(C)CCCN[C@H]1CC[C@@H](C1)O 60376a44f0802d1b2186abf7008467ca [0,1,0,1,0,0|2,0,0]=4 16501 B13R1.128 CN(C)CCCN[C@H]1CC[C@H](C1)O 2081395bc3377d14ac892c49688d6e54 [0,1,0,1,0,0|2,0,0]=4 16502 B13R1.128 CN(C)CCNCC1CCC(C1)O 73fa491d3cd0a0fbb628c4f713520c9b [0,1,0,1,0,0|2,0,0]=4 16503 B13R1.128 CS(=O)CCNCC1CCC(C1)O 2b07c0b58a09b274cd7870cfbad0e737 [0,1,0,1,0,0|2,0,0]=4 16504 B13R1.128 C[C@@H](O)CCCCN1CCC(C1)F d1c16af95f3c914313e8d675943a0eb8 [0,1,0,1,0,0|1,0,0]=3 16505 B13R1.128 C[C@@H](O)CCCCN1CCC(C1)O 3689c3010838b303a09746a72b98f732 [0,1,0,1,0,0|1,0,0]=3 16506 B13R1.128 C[C@@H](O)CCCCN1CCN(C1)C 03c28efbbabba8cc176b556e02f39c3f [0,1,0,1,0,0|2,0,0]=4 16507 B13R1.128 C[C@@H](O)CCCCN1CC[C@@H](C1)F 634585e0b60357d0a3a11796a1cfe300 [0,1,0,1,0,0|1,0,0]=3 16508 B13R1.128 C[C@@H](O)CCCCN1CC[C@@H](C1)O 7594cde52ab82b9c856cc1aac5fe0b73 [0,1,0,1,0,0|1,0,0]=3 16509 B13R1.128 C[C@@H](O)CCCCN1CC[C@H](C1)F 16e7bab955c218615a506545f35d8636 [0,1,0,1,0,0|1,0,0]=3 16510 B13R1.128 C[C@@H](O)CCCCN1CC[C@H](C1)O c7d5a34fba182b02c8e8623835519845 [0,1,0,1,0,0|1,0,0]=3 16511 B13R1.128 C[C@@H](O)CCNCC1CCN(C1)C 5061ff76d5d2827ad47602d31423b180 [0,1,0,1,0,0|2,0,0]=4 16512 B13R1.128 C[C@@H](O)CNCCC1CCN(C1)C 3d2aa85762eb2ae0fcabd7fc024e5f5f [0,1,0,1,0,0|2,0,0]=4 16513 B13R1.128 C[C@@H](O)CNCCN1CCC(C1)F 5de9be6c7f64073dc57d815aca24d0fc [0,1,0,1,0,0|2,0,0]=4 16514 B13R1.128 C[C@@H](O)CNCCN1CCC(C1)O 15eaf17f759d1b55ded92bf610c92d92 [0,1,0,1,0,0|2,0,0]=4 16515 B13R1.128 C[C@@H](O)CNCCN1CC[C@@H](C1)F 7bc6381d493003119d7aab80fffdd8d4 [0,1,0,1,0,0|2,0,0]=4 16516 B13R1.128 C[C@@H](O)CNCCN1CC[C@@H](C1)O fe51efbade3b382412ad6fbcc56aa865 [0,1,0,1,0,0|2,0,0]=4 16517 B13R1.128 C[C@@H](O)CNCCN1CC[C@H](C1)F 13737b7133896c7e02ae4de03de19e2e [0,1,0,1,0,0|2,0,0]=4 16518 B13R1.128 C[C@H](O)CCNCC1CCN(C1)C 02cf256f62836d69e3cf6aa37ee24b95 [0,1,0,1,0,0|2,0,0]=4 16519 B13R1.128 C[C@H](O)CNCCC1CCN(C1)C ee46abdb25a9deb451f817b28be7ea79 [0,1,0,1,0,0|2,0,0]=4 16520 B13R1.128 C[C@H](O)CNCCN1CCC(C1)F 7283039807bdddb58dbb8620c02960fb [0,1,0,1,0,0|2,0,0]=4 16521 B13R1.128 C[C@H](O)CNCCN1CCC(C1)O 92bd85c41dccedace8dcfa165acc7b14 [0,1,0,1,0,0|2,0,0]=4 16522 B13R1.128 C[C@H](O)CNCCN1CC[C@@H](C1)F efab65e9db57ac9875ecfd4ac75d87c6 [0,1,0,1,0,0|2,0,0]=4 16523 B13R1.128 C[C@H](O)CNCCN1CC[C@@H](C1)O db15e966ec429d03ff99e01e26db89a9 [0,1,0,1,0,0|2,0,0]=4 16524 B13R1.128 C[C@H](O)CNCCN1CC[C@H](C1)F 1163ea46dd56f96d08738f07765df762 [0,1,0,1,0,0|2,0,0]=4 16525 B13R1.128 C[C@H]1CC[C@H](O1)COCCN(C)C caf6ed373e6f8cca85fdc4bfa3ad00e0 [0,1,0,1,0,0|2,0,0]=4 16526 B13R1.128 C[C@H]1CC[C@H](O1)COCCS(=O)C b808c14d57202c903937869c6076c610 [0,1,0,1,0,0|2,0,0]=4 16527 B13R1.158 C=C(C)CCCN1CCCCC1C e8483dcfd8dc41e3d9d5670e9f256bb3 [0,1,0,1,0,0|1,0,1]=4 16528 B13R1.158 C=C(C)CCCN1CCCC[C@@H]1C 3ad8cb1294127efa71440080e699802d [0,1,0,1,0,0|1,0,1]=4 16529 B13R1.158 C=C(C)CCCN1CCCC[C@H]1C d7fddc22c253e45202a260c271e44f21 [0,1,0,1,0,0|1,0,1]=4 16530 B13R1.158 C=C(C)CCNC1CCCCC1C 7e19ae8ff9a22d8c0be16d909f318db8 [0,1,0,1,0,0|1,0,1]=4 16531 B13R1.158 C=C(C)CCN[C@@H]1CCCC[C@@H]1C 6aec5d22a96b1a552dd3a33b8b1b1fb3 [0,1,0,1,0,0|1,0,1]=4 16532 B13R1.158 C=C(C)CCN[C@@H]1CCCC[C@H]1C 88a3c9a715b11d15389e370f0a495a74 [0,1,0,1,0,0|1,0,1]=4 16533 B13R1.158 C=C(C)CCN[C@H]1CCCC[C@@H]1C d4e0697e07ec1c16fdedc12b8743ff2a [0,1,0,1,0,0|1,0,1]=4 16534 B13R1.158 C=C(C)CCN[C@H]1CCCC[C@H]1C f3cc1c5b39381f9e6db20eb7fdab04ef [0,1,0,1,0,0|1,0,1]=4 16535 B13R1.158 C=C(C)CCOC1CCCCC1C 2995074e76fc9d0c5ea376e68866e73a [0,1,0,1,0,0|1,0,1]=4 16536 B13R1.158 C=C(C)CCO[C@@H]1CCCC[C@@H]1C 61abdae5f73c174083da209dd37201fe [0,1,0,1,0,0|1,0,1]=4 16537 B13R1.158 C=C(C)CCO[C@H]1CCCC[C@@H]1C e989bf224f77c47d564d0b27f068afd0 [0,1,0,1,0,0|1,0,1]=4 16538 B13R1.158 C=C(C)CCO[C@H]1CCCC[C@H]1C cd7754b746b67241dc86f4b7a4d22037 [0,1,0,1,0,0|1,0,1]=4 16539 B13R1.158 C=C(C)CNCC1CCCCC1C 9a3c068ae26f859e4ebb94a0ef42ed25 [0,1,0,1,0,0|1,0,1]=4 16540 B13R1.158 CC(=O)CCCN1CCCCC1C 711a97d929113e2d66b2875ef68e165d [0,1,0,1,0,0|0,0,2]=4 16541 B13R1.158 CC(=O)CCCN1CCCC[C@@H]1C e546653370548a7c18e3542de9844786 [0,1,0,1,0,0|0,0,2]=4 16542 B13R1.158 CC(=O)CCCN1CCCC[C@H]1C 6aaaa8057ecadea5a84d70e5a5244125 [0,1,0,1,0,0|0,0,2]=4 16543 B13R1.158 CC(=O)CCNC1CCCCC1C b2723fc0b0829c5a36d1570482da6131 [0,1,0,1,0,0|0,0,2]=4 16544 B13R1.158 CC(=O)CCN[C@@H]1CCCC[C@@H]1C c43fca1dbd109663eafde031b28e5f06 [0,1,0,1,0,0|0,0,2]=4 16545 B13R1.158 CC(=O)CCN[C@@H]1CCCC[C@H]1C 18f82bab45758b09ea361d28749d4270 [0,1,0,1,0,0|0,0,2]=4 16546 B13R1.158 CC(=O)CCN[C@H]1CCCC[C@@H]1C 829040a3398e8cf09a365c97fa8300c8 [0,1,0,1,0,0|0,0,2]=4 16547 B13R1.158 CC(=O)CCN[C@H]1CCCC[C@H]1C 589eb8a00e4cec14d9a573e5dffda6c5 [0,1,0,1,0,0|0,0,2]=4 16548 B13R1.158 CC(=O)CCOC1CCCCC1C 2b689315deac13029a2e9a56162f4144 [0,1,0,1,0,0|0,0,2]=4 16549 B13R1.158 CC(=O)CCO[C@@H]1CCCC[C@@H]1C a5cddfa65a6eedede123a11ab64fa4d9 [0,1,0,1,0,0|0,0,2]=4 16550 B13R1.158 CC(=O)CCO[C@H]1CCCC[C@@H]1C e14d7e63677c92bc186a92ca659e32ac [0,1,0,1,0,0|0,0,2]=4 16551 B13R1.158 CC(=O)CCO[C@H]1CCCC[C@H]1C a7d8028dd162a246d23e5ae6c0e7c764 [0,1,0,1,0,0|0,0,2]=4 16552 B13R1.158 CC(C)CCCN1CCCCC1C 72a271c5f1d80c17d1acf92ec9868c19 [0,1,0,1,0,0|1,0,0]=3 16553 B13R1.158 CC(C)CCCN1CCCC[C@@H]1C 36c4865f40d9cbfc51d7f88a8c9b05c5 [0,1,0,1,0,0|1,0,0]=3 16554 B13R1.158 CC(C)CCCN1CCCC[C@H]1C 687be9faae0141838a591617a20e07fa [0,1,0,1,0,0|1,0,0]=3 16555 B13R1.158 CC(C)CCCN1CCOCC1C 90ca1aafe15f4eb05a606e28f2d63ae3 [0,1,0,1,0,0|2,0,0]=4 16556 B13R1.158 CC(C)CCCN1CCOC[C@@H]1C 5d60341e74f94e9e20f006f8163a1d6b [0,1,0,1,0,0|2,0,0]=4 16557 B13R1.158 CC(C)CCCN1CCOC[C@H]1C 19c655b31a2d4f3ba577052b2a767145 [0,1,0,1,0,0|2,0,0]=4 16558 B13R1.158 CC(C)CCNC1CCCCC1C c8e9f24120cd1d9b63735ace8a722734 [0,1,0,1,0,0|1,0,0]=3 16559 B13R1.158 CC(C)CCNC1CCCCC1F 4d9a12026d7dd8cb04e221a9f1677ace [0,1,0,1,0,0|2,0,0]=4 16560 B13R1.158 CC(C)CCNC1CCCCC1O 787d72070b07ecaf1ef4a723a9b809ec [0,1,0,1,0,0|2,0,0]=4 16561 B13R1.158 CC(C)CCNC1CCOCC1C 89997c77f8bdd02b6ce37bff0b6bf1c2 [0,1,0,1,0,0|2,0,0]=4 16562 B13R1.158 CC(C)CCN[C@@H]1CCCC[C@@H]1C d324fc70d5b1f16361cb010abbd8ce20 [0,1,0,1,0,0|1,0,0]=3 16563 B13R1.158 CC(C)CCN[C@@H]1CCCC[C@H]1C 5ca9cdd1d91560ae1bedd8191f2e3783 [0,1,0,1,0,0|1,0,0]=3 16564 B13R1.158 CC(C)CCN[C@@H]1CCCC[C@H]1O f256a27b227ce53a4d97a8827d6b1563 [0,1,0,1,0,0|2,0,0]=4 16565 B13R1.158 CC(C)CCN[C@@H]1CCOC[C@@H]1C 2dcefa3044e8019a0a85c4ced1adf212 [0,1,0,1,0,0|2,0,0]=4 16566 B13R1.158 CC(C)CCN[C@H]1CCCC[C@@H]1C b05c5bf4194d4e51fb370ef939bdd7e4 [0,1,0,1,0,0|1,0,0]=3 16567 B13R1.158 CC(C)CCN[C@H]1CCCC[C@@H]1O 1df95cc4387dcb0998f2eca9b42c4e8a [0,1,0,1,0,0|2,0,0]=4 16568 B13R1.158 CC(C)CCN[C@H]1CCCC[C@H]1C a159bd1a81768f1de7c41d29f5c301f3 [0,1,0,1,0,0|1,0,0]=3 16569 B13R1.158 CC(C)CCN[C@H]1CCCC[C@H]1O aadaf2c04b5ad7080c07c275f5dff4c8 [0,1,0,1,0,0|2,0,0]=4 16570 B13R1.158 CC(C)CCN[C@H]1CCOC[C@H]1C 602bfbe53fa85ec5b3acbc5e324ce40a [0,1,0,1,0,0|2,0,0]=4 16571 B13R1.158 CC(C)CCOC1CCCCC1C 04fac40bf942903f723af0445ad93f3e [0,1,0,1,0,0|1,0,0]=3 16572 B13R1.158 CC(C)CCOC1CCCCC1F 03f7423a985b5b2a8f071629954ad2e4 [0,1,0,1,0,0|2,0,0]=4 16573 B13R1.158 CC(C)CCOC1CCOCC1C a0a97eb6d70d50c235e5f36b49cb9afe [0,1,0,1,0,0|2,0,0]=4 16574 B13R1.158 CC(C)CCO[C@@H]1CCCC[C@@H]1C 8fdd3812279429f9607fc2befa812703 [0,1,0,1,0,0|1,0,0]=3 16575 B13R1.158 CC(C)CCO[C@@H]1CCCC[C@H]1F f953d04cf5eda25d56aea990e90e2a5d [0,1,0,1,0,0|2,0,0]=4 16576 B13R1.158 CC(C)CCO[C@H]1CCCC[C@@H]1C d0f15ace0a469a641f53b954d0530062 [0,1,0,1,0,0|1,0,0]=3 16577 B13R1.158 CC(C)CCO[C@H]1CCCC[C@H]1C 7d0d3c23e851cc1824f2ae223d5f5a05 [0,1,0,1,0,0|1,0,0]=3 16578 B13R1.158 CC(C)CNCC1CCCCC1C 0fbe12e25aff54285d3783cd49a68112 [0,1,0,1,0,0|1,0,0]=3 16579 B13R1.158 CC(C)CNCC1CCCCC1O 61a4254c7e0ed915268e33957fa76d4f [0,1,0,1,0,0|2,0,0]=4 16580 B13R1.158 CC(C)CNCC1CCCCN1C 3cdf7c3b78bc8f808689e9b4819655d8 [0,1,0,1,0,0|2,0,0]=4 16581 B13R1.158 CC(C)COCC1CCCCN1C 40585604522f83486dfd685c630b49c9 [0,1,0,1,0,0|2,0,0]=4 16582 B13R1.158 CC(C)COC[C@@H]1CCCCN1C 91bb27804c43dc0351375eab64c0e9fb [0,1,0,1,0,0|2,0,0]=4 16583 B13R1.158 CC(C)COC[C@H]1CCCCN1C 6970ace8cb3bb8f467c0e85a93c370ae [0,1,0,1,0,0|2,0,0]=4 16584 B13R1.158 CC(C)NCCC1CCCCN1C df87d50ab6a02161ca336c317adf7dc4 [0,1,0,1,0,0|2,0,0]=4 16585 B13R1.158 CC(C)NCCN1CCCCC1C c0c5ed1610ac1d5b3a73a649ea7f0af2 [0,1,0,1,0,0|2,0,0]=4 16586 B13R1.158 CC(C)OCCC1CCCCN1C 3278fc2b80d7cd33db1638bd5487a10f [0,1,0,1,0,0|2,0,0]=4 16587 B13R1.158 CC(C)OCCN1CCCCC1C 45cce1ca2bd5de121382785d0c0ee55c [0,1,0,1,0,0|2,0,0]=4 16588 B13R1.158 CC(C)OCCN1CCCC[C@@H]1C 47b5affa597d0d072c21488ffdc38784 [0,1,0,1,0,0|2,0,0]=4 16589 B13R1.158 CC(C)OCCN1CCCC[C@H]1C 7ba351888f61b6d0a2fa5f3935cc75b9 [0,1,0,1,0,0|2,0,0]=4 16590 B13R1.158 CC(C)OCNC1CCCCC1C 46036be9c8cd55a656fef424a40f005c [0,1,0,1,0,0|2,0,0]=4 16591 B13R1.158 CC(C)OCN[C@@H]1CCCC[C@@H]1C f96ea39a84803b25d21f3931270aa61e [0,1,0,1,0,0|2,0,0]=4 16592 B13R1.158 CC(C)OCN[C@@H]1CCCC[C@H]1C 5b399e14636ff65de7791330aeb8aed0 [0,1,0,1,0,0|2,0,0]=4 16593 B13R1.158 CC(C)OCN[C@H]1CCCC[C@@H]1C fdccd593caf59a1f6f26d3af7c2f717c [0,1,0,1,0,0|2,0,0]=4 16594 B13R1.158 CC(C)OCN[C@H]1CCCC[C@H]1C 87425f260aa725b2bb2c56b07f00a1ed [0,1,0,1,0,0|2,0,0]=4 16595 B13R1.158 CC(C)OCOC1CCCCC1C d8c46a78eda049a064f5ea193300af8d [0,1,0,1,0,0|2,0,0]=4 16596 B13R1.158 CC(C)OCO[C@@H]1CCCC[C@@H]1C 14413146b700fee48003685410c3bdf4 [0,1,0,1,0,0|2,0,0]=4 16597 B13R1.158 CC(C)OCO[C@H]1CCCC[C@@H]1C 0be443866c50e6df1257d8f0270c4303 [0,1,0,1,0,0|2,0,0]=4 16598 B13R1.158 CC(C)OCO[C@H]1CCCC[C@H]1C fe133d89d79a182622e0577287a97d61 [0,1,0,1,0,0|2,0,0]=4 16599 B13R1.158 CC(C)SCCN1CCCCC1C c60e3d11258938d340b547727caffc7f [0,1,0,1,0,0|2,0,0]=4 16600 B13R1.158 CC(C)SCCN1CCCC[C@@H]1C 492a5b0bba95c8f6153a99547c9fe9a7 [0,1,0,1,0,0|2,0,0]=4 16601 B13R1.158 CC(C)SCCN1CCCC[C@H]1C f8e3767f278b20cb03bfc174b77299df [0,1,0,1,0,0|2,0,0]=4 16602 B13R1.158 CC(F)COCC1CCCCN1C 7902cb153c02f8fb549a37f2cc275f52 [0,1,0,1,0,0|2,0,0]=4 16603 B13R1.158 CC(O)CCCN1CCCCC1C a6af93b693e0dad9f90f3a0137d09ff5 [0,1,0,1,0,0|0,0,0]=2 16604 B13R1.158 CC(O)CCCN1CCCC[C@@H]1C 25ab7d6c9cd80efbd122a1f1050edd8d [0,1,0,1,0,0|0,0,0]=2 16605 B13R1.158 CC(O)CCCN1CCCC[C@H]1C 9d0404cb560eb8335e0dc3ed85d0df53 [0,1,0,1,0,0|0,0,0]=2 16606 B13R1.158 CC(O)CCCN1CCOCC1C 4a75d727502c3476eb8c97451cf30b9b [0,1,0,1,0,0|1,0,0]=3 16607 B13R1.158 CC(O)CCCN1CCOC[C@@H]1C 284af670d8e62e3bd76742d107506e40 [0,1,0,1,0,0|1,0,0]=3 16608 B13R1.158 CC(O)CCCN1CCOC[C@H]1C 14bf50b4075319334727bfeed632a112 [0,1,0,1,0,0|1,0,0]=3 16609 B13R1.158 CC(O)CCNC1CCCCC1=O 855eed7a0ba6ac41ad3e984560ffa849 [0,1,0,1,0,0|1,0,1]=4 16610 B13R1.158 CC(O)CCNC1CCCCC1C 0f0a4fb8ed0713e350f5292b1650c777 [0,1,0,1,0,0|0,0,0]=2 16611 B13R1.158 CC(O)CCNC1CCCCC1F d1f687e0ec9c705610acac8288ebf0ea [0,1,0,1,0,0|1,0,0]=3 16612 B13R1.158 CC(O)CCNC1CCCCC1O a91885961d5f602b995bfddc52bb9dbd [0,1,0,1,0,0|1,0,0]=3 16613 B13R1.158 CC(O)CCNC1CCOCC1C 8e618eb326d45a7494c74a15737116e6 [0,1,0,1,0,0|1,0,0]=3 16614 B13R1.158 CC(O)CCNC1CCOCC1O badfb03fd7e6a81b01c460c71cefb051 [0,1,0,1,0,0|2,0,0]=4 16615 B13R1.158 CC(O)CCN[C@@H]1CCCC[C@@H]1C a0ffc52b8a7b279045ce672a6b08bbb1 [0,1,0,1,0,0|0,0,0]=2 16616 B13R1.158 CC(O)CCN[C@@H]1CCCC[C@H]1C 5de42b497ae01c98e2dea3364e35af16 [0,1,0,1,0,0|0,0,0]=2 16617 B13R1.158 CC(O)CCN[C@@H]1CCCC[C@H]1O 140e183d8d00582432adb1b91fd02ff3 [0,1,0,1,0,0|1,0,0]=3 16618 B13R1.158 CC(O)CCN[C@@H]1CCOC[C@@H]1C bafc0e4db8b0455fa33e9c579a1a07e5 [0,1,0,1,0,0|1,0,0]=3 16619 B13R1.158 CC(O)CCN[C@@H]1CCOC[C@@H]1O 91248a794ff055b124d4fefccff99dd5 [0,1,0,1,0,0|2,0,0]=4 16620 B13R1.158 CC(O)CCN[C@@H]1CCOC[C@H]1F e340a42f369550a4da56c487b175c442 [0,1,0,1,0,0|2,0,0]=4 16621 B13R1.158 CC(O)CCN[C@@H]1CCOC[C@H]1O b79ba847a1a539b0f2eb559b82d17bc1 [0,1,0,1,0,0|2,0,0]=4 16622 B13R1.158 CC(O)CCN[C@@H]1COCC[C@@H]1O e3ef886a9321efbbfdf0e4728c9c75ba [0,1,0,1,0,0|2,0,0]=4 16623 B13R1.158 CC(O)CCN[C@@H]1COCC[C@H]1O 0f117104d5d6c1cd9681f9e59c51b794 [0,1,0,1,0,0|2,0,0]=4 16624 B13R1.158 CC(O)CCN[C@H]1CCCC[C@@H]1C f957566389913c4b89270f14abef8b49 [0,1,0,1,0,0|0,0,0]=2 16625 B13R1.158 CC(O)CCN[C@H]1CCCC[C@@H]1O b500466a1490729d1698503ce6a282f2 [0,1,0,1,0,0|1,0,0]=3 16626 B13R1.158 CC(O)CCN[C@H]1CCCC[C@H]1C d2f9be3c6b617a218ca138cb25e6d614 [0,1,0,1,0,0|0,0,0]=2 16627 B13R1.158 CC(O)CCN[C@H]1CCCC[C@H]1O 828612b79cdb78aa04e893c0e2919afe [0,1,0,1,0,0|1,0,0]=3 16628 B13R1.158 CC(O)CCN[C@H]1CCOC[C@@H]1F 743ef8017d208830a9ac364dacd6c68d [0,1,0,1,0,0|2,0,0]=4 16629 B13R1.158 CC(O)CCN[C@H]1CCOC[C@@H]1O 667f1aa11caa11ed33ac2bf553dbcf02 [0,1,0,1,0,0|2,0,0]=4 16630 B13R1.158 CC(O)CCN[C@H]1CCOC[C@H]1C 1e7d7c168df3856f4939c4e7c5b16afc [0,1,0,1,0,0|1,0,0]=3 16631 B13R1.158 CC(O)CCN[C@H]1CCOC[C@H]1O 0530c97b255fdf5ef3a49f62846f6ea2 [0,1,0,1,0,0|2,0,0]=4 16632 B13R1.158 CC(O)CCN[C@H]1COCC[C@@H]1O 3f027be71db8d68579ddf08b971e48f2 [0,1,0,1,0,0|2,0,0]=4 16633 B13R1.158 CC(O)CCN[C@H]1COCC[C@H]1O 9d42e804b20bc64a00acd0a79e5779f6 [0,1,0,1,0,0|2,0,0]=4 16634 B13R1.158 CC(O)CNCC1CCCCC1C e3954a63248cbcd7f99ec878e27b3490 [0,1,0,1,0,0|0,0,0]=2 16635 B13R1.158 CC(O)CNCC1CCCCC1O f81f570c860b3b1b31cd6f7032d6bf0c [0,1,0,1,0,0|1,0,0]=3 16636 B13R1.158 CC(O)CNCC1CCCCN1C 09901cde122e8e84ef94066cef1ccc60 [0,1,0,1,0,0|1,0,0]=3 16637 B13R1.158 CC(O)CNCC1COCCN1C 5f1bb46c044b6d60f6dbc99d1e3bf165 [0,1,0,1,0,0|2,0,0]=4 16638 B13R1.158 CC(O)CNCC1CSCCC1O 5c78c86ab47f65eadce95e4eb72ec4cf [0,1,0,1,0,0|2,0,0]=4 16639 B13R1.158 CC(O)CNC[C@@H]1COCCN1C 3eb5e4ea52b78f37e5310ef6cb4100c4 [0,1,0,1,0,0|2,0,0]=4 16640 B13R1.158 CC(S)COCC1CCCCN1C 6356ed28d98dd9116d1997084b0577ee [0,1,0,1,0,0|1,1,0]=4 16641 B13R1.158 CC1CCCCC1CNCC(=O)O 4dd033528fcbc190e7d625a268908f17 [0,1,0,1,0,0|1,0,1]=4 16642 B13R1.158 CC1CCCCC1CNCC(F)F 8f7cbe75fc2d22201da12f9d54506ee8 [0,1,0,1,0,0|2,0,0]=4 16643 B13R1.158 CC1CCCCC1CNCN(C)C 49be6c5924f0b2b83d51dc3dc57cd81f [0,1,0,1,0,0|2,0,0]=4 16644 B13R1.158 CC1CCCCC1CNC[C@@H](C)O e06ff9a7781b8090e9f285823485c2dc [0,1,0,1,0,0|0,0,0]=2 16645 B13R1.158 CC1CCCCC1CNC[C@H](C)O 93d672d2a449a8767771c86768228866 [0,1,0,1,0,0|0,0,0]=2 16646 B13R1.158 CC1CCCCC1NCCC(=O)O 29242fa775e09dae5b05be0ad18a9856 [0,1,0,1,0,0|1,0,1]=4 16647 B13R1.158 CC1CCCCC1NCCN(C)C e5ff057498e59d6ca7444175a02c36fd [0,1,0,1,0,0|2,0,0]=4 16648 B13R1.158 CC1CCCCC1NCCS(=O)C 3504dee893612dadf184488a0c3370f7 [0,1,0,1,0,0|1,0,1]=4 16649 B13R1.158 CC1CCCCC1OCCC(=O)O 6da45ed9f18470aea1f2407b7f8b3529 [0,1,0,1,0,0|1,0,1]=4 16650 B13R1.158 CC1CCCCC1OCCN(C)C ed5efe65f2e5bc0cca200be9c766b11f [0,1,0,1,0,0|2,0,0]=4 16651 B13R1.158 CC1CCCCC1OCCS(=O)C 652f8648bbab01dfde277e5da7998ae1 [0,1,0,1,0,0|1,0,1]=4 16652 B13R1.158 CC1CCCCN1CCCN(C)C 1151b6288088f1be4082aecc63fdc894 [0,1,0,1,0,0|2,0,0]=4 16653 B13R1.158 C[C@@H](F)COCC1CCCCN1C 1cf18f221f2e425a9bf0865658afeed4 [0,1,0,1,0,0|2,0,0]=4 16654 B13R1.158 C[C@@H](O)CCNC1CCCCC1=O 77a2264a7269db3436a77044ea4beacb [0,1,0,1,0,0|1,0,1]=4 16655 B13R1.158 C[C@@H](O)CCNC1CCCCC1F d879578a9b65908118c2752255a8c55a [0,1,0,1,0,0|1,0,0]=3 16656 B13R1.158 C[C@@H](O)CCNC1CCCCC1O a2b711a5b1fed1b92d5c1f3d1ad1aae8 [0,1,0,1,0,0|1,0,0]=3 16657 B13R1.158 C[C@@H](O)CCN[C@H]1CCCC[C@@H]1O ef5fee5408c613ca568d7d51a0cb6cd7 [0,1,0,1,0,0|1,0,0]=3 16658 B13R1.158 C[C@@H](O)CNCC1CCCCC1O 1d7c2b29e4f4df98c37ecbad5f0fb0e0 [0,1,0,1,0,0|1,0,0]=3 16659 B13R1.158 C[C@@H](O)CNCC1CCCCN1C 847830fd745fa0d8f0b42e0b2e6339d3 [0,1,0,1,0,0|1,0,0]=3 16660 B13R1.158 C[C@@H](O)CNCC1COCCN1C 4e52590a4cf6e50c0f1ef7d2b1f082f6 [0,1,0,1,0,0|2,0,0]=4 16661 B13R1.158 C[C@@H](O)CNCC1CSCCC1O 43d3300838833312974adb101188b9e5 [0,1,0,1,0,0|2,0,0]=4 16662 B13R1.158 C[C@@H](O)CNC[C@@H]1COCCN1C 98b9710175945907d12708d33b4eeb95 [0,1,0,1,0,0|2,0,0]=4 16663 B13R1.158 C[C@@H]1CCCCN1CCCN(C)C 560780e7cdf15393d7608be888291fbb [0,1,0,1,0,0|2,0,0]=4 16664 B13R1.158 C[C@@H]1CCCC[C@@H]1NCCC(=O)O aa133be24944da604da62c85d412fe79 [0,1,0,1,0,0|1,0,1]=4 16665 B13R1.158 C[C@@H]1CCCC[C@@H]1NCCC(F)F 6b617428f519e09d2f52fe7c81e0f379 [0,1,0,1,0,0|2,0,0]=4 16666 B13R1.158 C[C@@H]1CCCC[C@@H]1NCCN(C)C 0c949493f3011b7599a1623d5a65c644 [0,1,0,1,0,0|2,0,0]=4 16667 B13R1.158 C[C@@H]1CCCC[C@@H]1NCCS(=O)C 8d44ad1107d5a8ce9be72bfef8996443 [0,1,0,1,0,0|1,0,1]=4 16668 B13R1.158 C[C@@H]1CCCC[C@@H]1NCCS(=O)O 995c1c6e1c05b04779374fb5189e8f9d [0,1,0,1,0,0|2,0,0]=4 16669 B13R1.158 C[C@@H]1CCCC[C@@H]1NCC[C@@H](C)O 89c35be1dcb411f15cf37172696c2283 [0,1,0,1,0,0|0,0,0]=2 16670 B13R1.158 C[C@@H]1CCCC[C@@H]1OCCC(=O)O 14aa046483f5020094adf032aad1e2fe [0,1,0,1,0,0|1,0,1]=4 16671 B13R1.158 C[C@@H]1CCCC[C@@H]1OCCC(F)F 2d94d2030a2dd19807174485ff62472c [0,1,0,1,0,0|2,0,0]=4 16672 B13R1.158 C[C@@H]1CCCC[C@@H]1OCCN(C)C 8429d860665cc527adfa466572336b15 [0,1,0,1,0,0|2,0,0]=4 16673 B13R1.158 C[C@@H]1CCCC[C@@H]1OCCS(=O)C 9fddf27818d28ed519c7ee0a7719ce14 [0,1,0,1,0,0|1,0,1]=4 16674 B13R1.158 C[C@@H]1CCCC[C@H]1NCCC(=O)O 15f110f00686dd7c1335531873944da7 [0,1,0,1,0,0|1,0,1]=4 16675 B13R1.158 C[C@@H]1CCCC[C@H]1NCCN(C)C f2087beeffd132c0c0a5393dd8ce309a [0,1,0,1,0,0|2,0,0]=4 16676 B13R1.158 C[C@@H]1CCCC[C@H]1NCCS(=O)C 915c1c9c75b880b5555c92433ad6f146 [0,1,0,1,0,0|1,0,1]=4 16677 B13R1.158 C[C@H](F)COCC1CCCCN1C 2ecdc446a31bbf4dd80987fe6b2cd35e [0,1,0,1,0,0|2,0,0]=4 16678 B13R1.158 C[C@H](O)CCNC1CCCCC1=O 58516e1e54cd6b172f7efca56813af8d [0,1,0,1,0,0|1,0,1]=4 16679 B13R1.158 C[C@H](O)CCNC1CCCCC1F 5e57c521c1acbcf3be44eb86faf23d5b [0,1,0,1,0,0|1,0,0]=3 16680 B13R1.158 C[C@H](O)CCNC1CCCCC1O c9c74de9b0da8f9e9f6d008bf309927b [0,1,0,1,0,0|1,0,0]=3 16681 B13R1.158 C[C@H](O)CCN[C@H]1CCCC[C@@H]1O 63d8529c4afa4f68f5184c8711d39445 [0,1,0,1,0,0|1,0,0]=3 16682 B13R1.158 C[C@H](O)CCN[C@H]1CCCC[C@H]1C b3d6009fca26183b4d520146094508a1 [0,1,0,1,0,0|0,0,0]=2 16683 B13R1.158 C[C@H](O)CNCC1CCCCC1O 20315480a61c605ba004c7f2beb85eab [0,1,0,1,0,0|1,0,0]=3 16684 B13R1.158 C[C@H](O)CNCC1CCCCN1C 844d039ec254748dfceb1aef22a5639b [0,1,0,1,0,0|1,0,0]=3 16685 B13R1.158 C[C@H](O)CNCC1COCCN1C 624fac20b58e6747f251e3b0e940fb25 [0,1,0,1,0,0|2,0,0]=4 16686 B13R1.158 C[C@H](O)CNCC1CSCCC1O 13c6c05ae3ec54a783c3dd227af038a3 [0,1,0,1,0,0|2,0,0]=4 16687 B13R1.158 C[C@H](O)CNC[C@@H]1COCCN1C 4ea1f7137618d32cb097bf5c55eef59b [0,1,0,1,0,0|2,0,0]=4 16688 B13R1.158 C[C@H]1CCCCN1CCCN(C)C 24e39b4b0fe9a4d28730193e88236241 [0,1,0,1,0,0|2,0,0]=4 16689 B13R1.158 C[C@H]1CCCC[C@@H]1NCCC(=O)O 06def0c103161c5828f1687f2b71a4ac [0,1,0,1,0,0|1,0,1]=4 16690 B13R1.158 C[C@H]1CCCC[C@@H]1NCCN(C)C 1e66dc1433ec1ef16d576c3aae943456 [0,1,0,1,0,0|2,0,0]=4 16691 B13R1.158 C[C@H]1CCCC[C@@H]1NCCS(=O)C 69df524aaafef82ce794093814c2df62 [0,1,0,1,0,0|1,0,1]=4 16692 B13R1.158 C[C@H]1CCCC[C@@H]1OCCC(=O)O 684a9187d1a4b0b817532ec3cc0b62c7 [0,1,0,1,0,0|1,0,1]=4 16693 B13R1.158 C[C@H]1CCCC[C@@H]1OCCN(C)C 972b21f784526923f93ffb759709dbfb [0,1,0,1,0,0|2,0,0]=4 16694 B13R1.158 C[C@H]1CCCC[C@@H]1OCCS(=O)C 0cd8b536fed84397244402d5f6543e13 [0,1,0,1,0,0|1,0,1]=4 16695 B13R1.158 C[C@H]1CCCC[C@H]1NCCC(=O)O b6e976e37238028790257ea61d8508e4 [0,1,0,1,0,0|1,0,1]=4 16696 B13R1.158 C[C@H]1CCCC[C@H]1NCCN(C)C 88ecf11b74b7c8c756e9966d5219714a [0,1,0,1,0,0|2,0,0]=4 16697 B13R1.158 C[C@H]1CCCC[C@H]1NCCS(=O)C 370451f63724eeef6cbc871557120ee9 [0,1,0,1,0,0|1,0,1]=4 16698 B13R1.158 C[C@H]1CCCC[C@H]1OCCC(=O)O fc7e2c2d95253e955ab98ea49ac717f7 [0,1,0,1,0,0|1,0,1]=4 16699 B13R1.158 C[C@H]1CCCC[C@H]1OCCN(C)C 4b96cc22dec11434a6e6a6b9f3bcc079 [0,1,0,1,0,0|2,0,0]=4 16700 B13R1.158 C[C@H]1CCCC[C@H]1OCCS(=O)C f52c6e4b8935626e0d5e8bfea54482e0 [0,1,0,1,0,0|1,0,1]=4 16701 B13R1.245 COC[C@@H]1C[C@@H]1NCCCC(C)C 4a80431a8dd98659e6d26a3b10db04a8 [0,1,0,1,0,0|2,0,0]=4 16702 B13R1.245 COC[C@@H]1C[C@@H]1NCCCC(C)O 1507575e12d88154310b34d9d9a2f787 [0,1,0,1,0,0|1,0,0]=3 16703 B13R1.245 COC[C@H]1C[C@@H]1NCCCC(C)C 25b7194363aeac76298e64ce67871455 [0,1,0,1,0,0|2,0,0]=4 16704 B13R1.245 COC[C@H]1C[C@@H]1NCCCC(C)O 21c1739d21b1de8bcbb9bc8a2741db5a [0,1,0,1,0,0|1,0,0]=3 16705 B13R1.337 C=C(C)CCCOC1CCCCC1 133163470daa67f7bfd4c618e958e14d [0,1,0,1,0,0|1,0,1]=4 16706 B13R1.337 C=C(C)CCNCC1CCCCC1 1876c7e5559b6415965d717e3c6c3ba8 [0,1,0,1,0,0|1,0,1]=4 16707 B13R1.337 C=C(C)CCOCC1CCCCC1 b44245d388803d1481f22a120d9460aa [0,1,0,1,0,0|1,0,1]=4 16708 B13R1.337 C=C(C)CNCCC1CCCCC1 ba0d1c8c7477091684f0b1b4f204af61 [0,1,0,1,0,0|1,0,1]=4 16709 B13R1.337 C=C(C)COCCC1CCCCC1 7cb24bd27fe56995092bf78bee214bba [0,1,0,1,0,0|1,0,1]=4 16710 B13R1.337 CC(=O)CCCOC1CCCCC1 c7fa77ae81b500d3328099e7ddeb3b58 [0,1,0,1,0,0|0,0,2]=4 16711 B13R1.337 CC(=O)CCNCC1CCCCC1 c7b108b7698dd0cc649fab8429ea1b33 [0,1,0,1,0,0|0,0,2]=4 16712 B13R1.337 CC(=O)CCOCC1CCCCC1 5687e83fb0dd15d3c1d7f8c6fb7f4873 [0,1,0,1,0,0|0,0,2]=4 16713 B13R1.337 CC(=O)CNCCC1CCCCC1 0efea03b6174db844c9dca1268780f04 [0,1,0,1,0,0|0,0,2]=4 16714 B13R1.337 CC(=O)COCCC1CCCCC1 5c6cbab903cfbcd18871046091020bc1 [0,1,0,1,0,0|0,0,2]=4 16715 B13R1.337 CC(=O)NCCCC1CCCCC1 f1a8e674ba84e06e43b29309f41a4da4 [0,1,0,1,0,0|0,0,2]=4 16716 B13R1.337 CC(C)CCCCN1CCCOC1 893c8b513d7541485d9a728b5d8774a7 [0,1,0,1,0,0|2,0,0]=4 16717 B13R1.337 CC(C)CCCCN1CCCSC1 d29caf941354c27d3aa0192b5d101ac9 [0,1,0,1,0,0|2,0,0]=4 16718 B13R1.337 CC(C)CCCCN1CCOCC1 99a386f0bf33aa9210490c93f9480a7d [0,1,0,1,0,0|2,0,0]=4 16719 B13R1.337 CC(C)CCCCN1CCSCC1 5969d7e678bf13219cf2b369ff8886e9 [0,1,0,1,0,0|2,0,0]=4 16720 B13R1.337 CC(C)CCCNC1CCCCC1 d95782d2aebacaf18123cba9d35d1249 [0,1,0,1,0,0|1,0,0]=3 16721 B13R1.337 CC(C)CCCNC1CCCCO1 fcdaa94b25d12d1b22b216964f7e4034 [0,1,0,1,0,0|2,0,0]=4 16722 B13R1.337 CC(C)CCCNC1CCCOC1 76848ee02753c19d2e82da7e8cfd2579 [0,1,0,1,0,0|2,0,0]=4 16723 B13R1.337 CC(C)CCCNC1CCOCC1 0fddba0dcdb0a7663298b245dd6349a5 [0,1,0,1,0,0|2,0,0]=4 16724 B13R1.337 CC(C)CCCNC1CCSCC1 6e563f1d39db4f0d185786ae9dbc3d42 [0,1,0,1,0,0|2,0,0]=4 16725 B13R1.337 CC(C)CCCN[C@@H]1CCCOC1 728c34c852cab88e2bc6a346244e1061 [0,1,0,1,0,0|2,0,0]=4 16726 B13R1.337 CC(C)CCCN[C@H]1CCCOC1 58e7e331ef8b12073c01629e16a89e5b [0,1,0,1,0,0|2,0,0]=4 16727 B13R1.337 CC(C)CCCOC1CCCCC1 331eb9414d7151c1413e522cf8d40fc1 [0,1,0,1,0,0|1,0,0]=3 16728 B13R1.337 CC(C)CCCOC1CCCCO1 7af379fc54c4f70c4fbbe8f86bceee65 [0,1,0,1,0,0|2,0,0]=4 16729 B13R1.337 CC(C)CCCOC1CCCOC1 417dd03202249e93fd422e4e77d71a17 [0,1,0,1,0,0|2,0,0]=4 16730 B13R1.337 CC(C)CCCOC1CCCSC1 2788b0fe50332c48687a6ce52ec70460 [0,1,0,1,0,0|2,0,0]=4 16731 B13R1.337 CC(C)CCCOC1CCOCC1 ec69119ed0b0e67d2e9642623f3c40cb [0,1,0,1,0,0|2,0,0]=4 16732 B13R1.337 CC(C)CCCOC1CCSCC1 beccae922c191a5c36a46bdbd49387ea [0,1,0,1,0,0|2,0,0]=4 16733 B13R1.337 CC(C)CCCO[C@@H]1CCCOC1 f78956787d61d14296e04a5ea78a7ad1 [0,1,0,1,0,0|2,0,0]=4 16734 B13R1.337 CC(C)CCCO[C@H]1CCCOC1 182ae72e8b0775bcaf0baa28ec85bdd7 [0,1,0,1,0,0|2,0,0]=4 16735 B13R1.337 CC(C)CCNCC1CCCCC1 10b6ecaabb30679cf2c7aa70c7929a55 [0,1,0,1,0,0|1,0,0]=3 16736 B13R1.337 CC(C)CCNCC1CCCCO1 c9ddb547173a93c6804eb5a2b2bbbdab [0,1,0,1,0,0|2,0,0]=4 16737 B13R1.337 CC(C)CCNCC1CCCOC1 9277d0f479e1417c7858e77b80040c15 [0,1,0,1,0,0|2,0,0]=4 16738 B13R1.337 CC(C)CCNCC1CCOCC1 15cdda8d714830f58460c1063c58090f [0,1,0,1,0,0|2,0,0]=4 16739 B13R1.337 CC(C)CCNCC1CCSCC1 0acb7f8ac238042cdee64340d94ebf94 [0,1,0,1,0,0|2,0,0]=4 16740 B13R1.337 CC(C)CCNC[C@@H]1CCCOC1 8cc3e044a117cf0b36683d1e73c521a1 [0,1,0,1,0,0|2,0,0]=4 16741 B13R1.337 CC(C)CCNC[C@H]1CCCOC1 c2fe820321246f4a26950f640ea08c87 [0,1,0,1,0,0|2,0,0]=4 16742 B13R1.337 CC(C)CCOCC1CCCCC1 b1d07272e894323f9930bc185e551d47 [0,1,0,1,0,0|1,0,0]=3 16743 B13R1.337 CC(C)CCOCC1CCCCO1 e6a1b3bd8e78a0eb3cb0ad87eb45fcbf [0,1,0,1,0,0|2,0,0]=4 16744 B13R1.337 CC(C)CCOCC1CCCOC1 afc57c9b3b904bffe29adf5ef1a9f4f7 [0,1,0,1,0,0|2,0,0]=4 16745 B13R1.337 CC(C)CCOCC1CCOCC1 e1938c5669ecdf9cff4c9b87255f622b [0,1,0,1,0,0|2,0,0]=4 16746 B13R1.337 CC(C)CCOCC1CCSCC1 dc531c5ed35829479c87bcd49ab814a8 [0,1,0,1,0,0|2,0,0]=4 16747 B13R1.337 CC(C)CCOC[C@@H]1CCCCO1 1e617222c1f3b2572f10689dfc2236b1 [0,1,0,1,0,0|2,0,0]=4 16748 B13R1.337 CC(C)CCOC[C@@H]1CCCOC1 fd55a7ac50ede42f7247eb53b0a9e632 [0,1,0,1,0,0|2,0,0]=4 16749 B13R1.337 CC(C)CCOC[C@H]1CCCCO1 a89f47735951a08b2800369f3054b680 [0,1,0,1,0,0|2,0,0]=4 16750 B13R1.337 CC(C)CCOC[C@H]1CCCOC1 602780d77f124ea1bac978cdfd1f49f8 [0,1,0,1,0,0|2,0,0]=4 16751 B13R1.337 CC(C)CNCCC1CCCCC1 d36b86f009d4952a6faefc94ff999c7b [0,1,0,1,0,0|1,0,0]=3 16752 B13R1.337 CC(C)CNCCC1CCCCO1 f45bfa5a9dd37654d90adb5d5b7ed8d8 [0,1,0,1,0,0|2,0,0]=4 16753 B13R1.337 CC(C)CNCCC1CCCOC1 bd8597a78fff0367f82813b80e83a354 [0,1,0,1,0,0|2,0,0]=4 16754 B13R1.337 CC(C)CNCCC1CCOCC1 8e1f4fe7638007328ac1fdde006715ad [0,1,0,1,0,0|2,0,0]=4 16755 B13R1.337 CC(C)CNCCC1CCSCC1 821b05fd3180737c0e948ac4479b4374 [0,1,0,1,0,0|2,0,0]=4 16756 B13R1.337 CC(C)CNCCN1CCCCC1 34925d68856c77c581f4e24923fd9096 [0,1,0,1,0,0|2,0,0]=4 16757 B13R1.337 CC(C)CNCOC1CCCCC1 25825bfd0771cbf30067f22ce741d685 [0,1,0,1,0,0|2,0,0]=4 16758 B13R1.337 CC(C)COCCC1CCCCC1 2b897724d5e29fe6722351b11c83d1e7 [0,1,0,1,0,0|1,0,0]=3 16759 B13R1.337 CC(C)COCCC1CCCCO1 dc5cd73ada9a8368a17638c60f9c50ef [0,1,0,1,0,0|2,0,0]=4 16760 B13R1.337 CC(C)COCCC1CCCOC1 0b93b412a963e7596e879d08881dd520 [0,1,0,1,0,0|2,0,0]=4 16761 B13R1.337 CC(C)COCCC1CCOCC1 e936e78ef327be303e9a15186dfedde0 [0,1,0,1,0,0|2,0,0]=4 16762 B13R1.337 CC(C)COCCC1CCSCC1 b5cb3cea34a7f73a89253a23f5cd9dbe [0,1,0,1,0,0|2,0,0]=4 16763 B13R1.337 CC(C)COCCN1CCCCC1 3d95a696e4bd249acd2851da544d4cc7 [0,1,0,1,0,0|2,0,0]=4 16764 B13R1.337 CC(C)COCOC1CCCCC1 1f9155293981b0d7ec57229a8c898e74 [0,1,0,1,0,0|2,0,0]=4 16765 B13R1.337 CC(C)NCCCC1CCCCC1 2af798ad6cb5263c8b5fe9b82fcc3fe4 [0,1,0,1,0,0|1,0,0]=3 16766 B13R1.337 CC(C)NCCCC1CCOCC1 73e1e4c82ebac46201ce9509e687644e [0,1,0,1,0,0|2,0,0]=4 16767 B13R1.337 CC(C)NCCCN1CCCCC1 6680685d80baf4b284543262eecc4427 [0,1,0,1,0,0|2,0,0]=4 16768 B13R1.337 CC(C)NCCSC1CCCCC1 786e7a86446491872052616667f044fa [0,1,0,1,0,0|2,0,0]=4 16769 B13R1.337 CC(C)OCCCC1CCCCC1 f23e30ec99353630473f5cfc639b0d9c [0,1,0,1,0,0|1,0,0]=3 16770 B13R1.337 CC(C)OCCCC1CCOCC1 edafcb8c9e48842a67d01304f06c5c79 [0,1,0,1,0,0|2,0,0]=4 16771 B13R1.337 CC(C)OCCCN1CCCCC1 d94dc17d3cbda7a716c95757cb320e18 [0,1,0,1,0,0|2,0,0]=4 16772 B13R1.337 CC(C)OCCNC1CCCCC1 1ee5a4b5156ff5cf7072127f08fd81d7 [0,1,0,1,0,0|2,0,0]=4 16773 B13R1.337 CC(C)OCCOC1CCCCC1 c2f59b72903b40c12837701ec462c626 [0,1,0,1,0,0|2,0,0]=4 16774 B13R1.337 CC(C)OCNCC1CCCCC1 2ac91880e22d5a7bb2bb0fe1f78b0479 [0,1,0,1,0,0|2,0,0]=4 16775 B13R1.337 CC(C)OCOCC1CCCCC1 aadf8ddcb001a2703c0fc7008cf8b2ea [0,1,0,1,0,0|2,0,0]=4 16776 B13R1.337 CC(C)SCCOC1CCCCC1 7aaf371e47fffdfb73986346a45a9549 [0,1,0,1,0,0|2,0,0]=4 16777 B13R1.337 CC(F)COCCC1CCCCC1 e480978250d210eb5f080d9e82450762 [0,1,0,1,0,0|1,0,0]=3 16778 B13R1.337 CC(F)COCCC1CCCOC1 7f344f2d028a8eb14f48feed1627e06e [0,1,0,1,0,0|2,0,0]=4 16779 B13R1.337 CC(F)COCCC1CCOCC1 c7b93e1809801ec47e5dd9962e28ee64 [0,1,0,1,0,0|2,0,0]=4 16780 B13R1.337 CC(F)COCCN1CCCCC1 f8a7bab815449fe2dac3181dd8cb1f0e [0,1,0,1,0,0|2,0,0]=4 16781 B13R1.337 CC(F)COCOC1CCCCC1 e07ba4d35db230677af1c69398be020f [0,1,0,1,0,0|2,0,0]=4 16782 B13R1.337 CC(O)CCCCN1CC=CCC1 2577ce5327c5586e6c517bb5bae8b604 [0,1,0,1,0,0|0,0,2]=4 16783 B13R1.337 CC(O)CCCCN1CCCOC1 74c5148d58773644dd3d37d92c2c2b27 [0,1,0,1,0,0|1,0,0]=3 16784 B13R1.337 CC(O)CCCCN1CCCSC1 d06a1579d3561c41d6cb7723236cf0f0 [0,1,0,1,0,0|1,0,0]=3 16785 B13R1.337 CC(O)CCCCN1CCOCC1 13cdba97bf9f56ae5cac97712eea881a [0,1,0,1,0,0|1,0,0]=3 16786 B13R1.337 CC(O)CCCCN1CCSCC1 ab8b9ac18c3a23e510d80027b600c301 [0,1,0,1,0,0|1,0,0]=3 16787 B13R1.337 CC(O)CCCNC1C=CCCC1 9445f70e95d4f0631de6f3f59eab8fc0 [0,1,0,1,0,0|0,0,2]=4 16788 B13R1.337 CC(O)CCCNC1CCCOC1 beccecec5056b08d65defb44371a7f23 [0,1,0,1,0,0|1,0,0]=3 16789 B13R1.337 CC(O)CCCNC1CCOCC1 4945e1d98af98594a56346732ae81817 [0,1,0,1,0,0|1,0,0]=3 16790 B13R1.337 CC(O)CCCNC1CCSCC1 70ab1fc855ded1c90455833106bb77ad [0,1,0,1,0,0|1,0,0]=3 16791 B13R1.337 CC(O)CCCNC1CSCSC1 5bca3d1a934984890c516ffd9d289f60 [0,1,0,1,0,0|2,0,0]=4 16792 B13R1.337 CC(O)CCCN[C@@H]1CCCOC1 ac349141f8ba69769d1a296512c9b111 [0,1,0,1,0,0|1,0,0]=3 16793 B13R1.337 CC(O)CCCN[C@H]1CCCOC1 0dfae5b27d94c424b50bf3ec7d8be369 [0,1,0,1,0,0|1,0,0]=3 16794 B13R1.337 CC(O)CCNCC1=CCCCC1 339edc7934d7e9ea007d1896302d9f8e [0,1,0,1,0,0|0,0,2]=4 16795 B13R1.337 CC(O)CCNCC1CC=CCC1 cb15f2d0e5793378bea6919b2ab3387f [0,1,0,1,0,0|0,0,2]=4 16796 B13R1.337 CC(O)CCNCC1CCCCC1 aaa866aa6079f3cccc3bbc58cf067181 [0,1,0,1,0,0|0,0,0]=2 16797 B13R1.337 CC(O)CCNCC1CCCCO1 86eb62a27237ca14982a960f176460f1 [0,1,0,1,0,0|1,0,0]=3 16798 B13R1.337 CC(O)CCNCC1CCCOC1 428c626bdba241c061015423acbc7209 [0,1,0,1,0,0|1,0,0]=3 16799 B13R1.337 CC(O)CCNCC1CCOCC1 560742f86231b80e03d9aa260020da59 [0,1,0,1,0,0|1,0,0]=3 16800 B13R1.337 CC(O)CCNCC1CCSCC1 4ed5930cd6eb1a6403147d43b2cfef18 [0,1,0,1,0,0|1,0,0]=3 16801 B13R1.337 CC(O)CCNCC1COCCO1 bbd77095eae61b8d8d83aead4488da2f [0,1,0,1,0,0|2,0,0]=4 16802 B13R1.337 CC(O)CCNC[C@@H]1CCCOC1 cca89d42698ebf90c09992b30a054917 [0,1,0,1,0,0|1,0,0]=3 16803 B13R1.337 CC(O)CCNC[C@H]1CCCOC1 5e20eed772b47845a21587e0795b5290 [0,1,0,1,0,0|1,0,0]=3 16804 B13R1.337 CC(O)CCNC[C@H]1COCCO1 5c65dfac09c4632c4b2e3ddeaff967fa [0,1,0,1,0,0|2,0,0]=4 16805 B13R1.337 CC(O)CNCCC1=CCCCC1 62f55293d73028181d5c8d80dc9ca9a0 [0,1,0,1,0,0|0,0,2]=4 16806 B13R1.337 CC(O)CNCCC1CCCCC1 ff36c113951703d24575b0d1948a60a9 [0,1,0,1,0,0|0,0,0]=2 16807 B13R1.337 CC(O)CNCCC1CCCCO1 83ff6c82428248e329c5e273c17ada8d [0,1,0,1,0,0|1,0,0]=3 16808 B13R1.337 CC(O)CNCCC1CCCOC1 1b7177c10c8d58711977d2d235d75a24 [0,1,0,1,0,0|1,0,0]=3 16809 B13R1.337 CC(O)CNCCC1CCOCC1 35ffcb09c396373427b5cf80ecd79d6a [0,1,0,1,0,0|1,0,0]=3 16810 B13R1.337 CC(O)CNCCC1CCSCC1 264dbd969cd7221180b550801b16392f [0,1,0,1,0,0|1,0,0]=3 16811 B13R1.337 CC(O)CNCCC1COCCO1 363fa7a156935c71ff359c81b20bd233 [0,1,0,1,0,0|2,0,0]=4 16812 B13R1.337 CC(O)CNCCN1CCCCC1 894d3c2111fdf97fdecd1941ad4483fa [0,1,0,1,0,0|1,0,0]=3 16813 B13R1.337 CC(O)CNCCN1CCCCO1 da47994cdbedc382a62dc389248bc0a9 [0,1,0,1,0,0|2,0,0]=4 16814 B13R1.337 CC(O)CNCCN1CCOCC1 e0c6a6a7473998f262a0f22ce81d05e0 [0,1,0,1,0,0|2,0,0]=4 16815 B13R1.337 CC(O)CNCCN1CCSCC1 a97e75ec2aa489078d8fe31125fbcc5f [0,1,0,1,0,0|2,0,0]=4 16816 B13R1.337 CC(O)CNCOC1CCCCC1 d02e9e2dd70970c873715155261b1ded [0,1,0,1,0,0|1,0,0]=3 16817 B13R1.337 CC(S)COCCC1CCCCC1 85f1107e09fba62c26127903457fb149 [0,1,0,1,0,0|0,1,0]=3 16818 B13R1.337 CC(S)COCCC1CCCOC1 4939a6d949488a735e769d25db6a3731 [0,1,0,1,0,0|1,1,0]=4 16819 B13R1.337 CC(S)COCCC1CCOCC1 28077d47f2ae2698f26803bc2fab77ba [0,1,0,1,0,0|1,1,0]=4 16820 B13R1.337 CC(S)COCCN1CCCCC1 0e09a55cbedd40de0e1f3070e51440a8 [0,1,0,1,0,0|1,1,0]=4 16821 B13R1.337 CC(S)COCOC1CCCCC1 e1efdd54bb9578e2162448117a1e42b0 [0,1,0,1,0,0|1,1,0]=4 16822 B13R1.337 CN(C)CCCNC1CCCCC1 7eae1fd548e20425160d50a124f00c12 [0,1,0,1,0,0|2,0,0]=4 16823 B13R1.337 CN(C)CCCOC1CCCCC1 51f171ab6398fff4ac550635e604d088 [0,1,0,1,0,0|2,0,0]=4 16824 B13R1.337 CN(C)CCNCC1CCCCC1 1c20d5e170ddecc82a3f6a085a38093c [0,1,0,1,0,0|2,0,0]=4 16825 B13R1.337 CN(C)CCOCC1CCCCC1 1e0b6fb7e3ae8c9a5410b095b750e225 [0,1,0,1,0,0|2,0,0]=4 16826 B13R1.337 CN(C)CNCCC1CCCCC1 a0aaf692a14615b4195d79c039bb1816 [0,1,0,1,0,0|2,0,0]=4 16827 B13R1.337 CN(C)COCCC1CCCCC1 d887ef43553e4f3bbc27920b2f184fe6 [0,1,0,1,0,0|2,0,0]=4 16828 B13R1.337 CS(=O)CCCNC1CCCCC1 ff40de71b9cfe91cac7221fd2c743f63 [0,1,0,1,0,0|1,0,1]=4 16829 B13R1.337 CS(=O)CCNCC1CCCCC1 90fbe2fc4497901a09af289b03c97c34 [0,1,0,1,0,0|1,0,1]=4 16830 B13R1.337 CS(=O)CCOCC1CCCCC1 bf3e68abf84d0e658f1d1f0e4d45b78d [0,1,0,1,0,0|1,0,1]=4 16831 B13R1.337 C[C@@H](F)COCCC1CCCCC1 b6385d1865c5b809e152b0741c11e8a1 [0,1,0,1,0,0|1,0,0]=3 16832 B13R1.337 C[C@@H](F)COCCC1CCCOC1 38ba8e68b238463e07269b45a9532b54 [0,1,0,1,0,0|2,0,0]=4 16833 B13R1.337 C[C@@H](F)COCCC1CCOCC1 f79d54b3b11fe615627c0e1cc739e843 [0,1,0,1,0,0|2,0,0]=4 16834 B13R1.337 C[C@@H](F)COCCN1CCCCC1 fc642a37e2bc69f5e1d0ae3e03b81436 [0,1,0,1,0,0|2,0,0]=4 16835 B13R1.337 C[C@@H](F)COCOC1CCCCC1 c4c7f14c9aec1ac93f6e6e2f29a20dfe [0,1,0,1,0,0|2,0,0]=4 16836 B13R1.337 C[C@@H](O)CCCCN1CC=CCC1 1cee3ee3285eb1e6109c2c39e3a371f3 [0,1,0,1,0,0|0,0,2]=4 16837 B13R1.337 C[C@@H](O)CCCCN1CCCOC1 f86fe68f724beeb23116f019a336ec28 [0,1,0,1,0,0|1,0,0]=3 16838 B13R1.337 C[C@@H](O)CCCCN1CCCSC1 71ea1ef06580363243f23fde2ef5d7ae [0,1,0,1,0,0|1,0,0]=3 16839 B13R1.337 C[C@@H](O)CCCCN1CCOCC1 d4e6ac6421727c67cca0ac9b1379d9d7 [0,1,0,1,0,0|1,0,0]=3 16840 B13R1.337 C[C@@H](O)CCCCN1CCSCC1 c36062b32d83d1654217efd53e0aac6a [0,1,0,1,0,0|1,0,0]=3 16841 B13R1.337 C[C@@H](O)CCNCC1=CCCCC1 962633004cec9de89b914f4e1489e4cf [0,1,0,1,0,0|0,0,2]=4 16842 B13R1.337 C[C@@H](O)CCNCC1CC=CCC1 754c07fa59cd97497880de780870ee1e [0,1,0,1,0,0|0,0,2]=4 16843 B13R1.337 C[C@@H](O)CCNCC1CCCCC1 dcd5a8cdbd3acbd69a699818c6d22921 [0,1,0,1,0,0|0,0,0]=2 16844 B13R1.337 C[C@@H](O)CCNCC1CCCCO1 cafed836845982e1936b11a008ee5a8f [0,1,0,1,0,0|1,0,0]=3 16845 B13R1.337 C[C@@H](O)CCNCC1CCCOC1 2e9d5d0a2ef5ffb67e114b087a61be82 [0,1,0,1,0,0|1,0,0]=3 16846 B13R1.337 C[C@@H](O)CCNCC1CCOCC1 5d8409d7c57713c2aa0d5c3e8d453987 [0,1,0,1,0,0|1,0,0]=3 16847 B13R1.337 C[C@@H](O)CCNCC1CCSCC1 65d66b3ec1f939236f2feabd215b533c [0,1,0,1,0,0|1,0,0]=3 16848 B13R1.337 C[C@@H](O)CCNCC1COCCO1 b4dc4b6b51172528c9b1d9ee9bb3742a [0,1,0,1,0,0|2,0,0]=4 16849 B13R1.337 C[C@@H](O)CNCCC1CCCCC1 c476ea8872dc4b71946dfacf5ed3db83 [0,1,0,1,0,0|0,0,0]=2 16850 B13R1.337 C[C@@H](O)CNCCC1CCCCO1 611aa75a0b827660ae9a899bbc8ac366 [0,1,0,1,0,0|1,0,0]=3 16851 B13R1.337 C[C@@H](O)CNCCC1CCCOC1 214b2aad1eac9cd50be26bce99bff9bf [0,1,0,1,0,0|1,0,0]=3 16852 B13R1.337 C[C@@H](O)CNCCC1CCOCC1 e85d3851ded574fae10c3ffcd3de5603 [0,1,0,1,0,0|1,0,0]=3 16853 B13R1.337 C[C@@H](O)CNCCC1CCSCC1 68e17719b1414ab4189337a5cd69d0cb [0,1,0,1,0,0|1,0,0]=3 16854 B13R1.337 C[C@@H](O)CNCCC1COCCO1 2e7e6b23b3256a3d4bc8f10a5a507a90 [0,1,0,1,0,0|2,0,0]=4 16855 B13R1.337 C[C@@H](O)CNCCN1CCCCC1 1a15c50e1cc0ce012553de8417fe517e [0,1,0,1,0,0|1,0,0]=3 16856 B13R1.337 C[C@@H](O)CNCCN1CCCCO1 7f285d365d12f72836f0de43c0af25d1 [0,1,0,1,0,0|2,0,0]=4 16857 B13R1.337 C[C@@H](O)CNCCN1CCOCC1 220014a15771c05ac3ba359df961d45a [0,1,0,1,0,0|2,0,0]=4 16858 B13R1.337 C[C@@H](O)CNCCN1CCSCC1 1a06e2bffc5714dbd5becc12a83adcab [0,1,0,1,0,0|2,0,0]=4 16859 B13R1.337 C[C@@H](O)CNCOC1CCCCC1 599c892aaab7527090afc401757e6ca0 [0,1,0,1,0,0|1,0,0]=3 16860 B13R1.337 C[C@H](F)COCCC1CCCCC1 f7562491357da8c0f85a54af2aaf5ab2 [0,1,0,1,0,0|1,0,0]=3 16861 B13R1.337 C[C@H](F)COCCC1CCCOC1 78a9f2e9b7ef849912fce6204da29be5 [0,1,0,1,0,0|2,0,0]=4 16862 B13R1.337 C[C@H](F)COCCC1CCOCC1 b2c5e4ae3c5ee5c19f424ebac564cd39 [0,1,0,1,0,0|2,0,0]=4 16863 B13R1.337 C[C@H](F)COCCN1CCCCC1 dbb1db7a40129d04ba57cb38e30f8d49 [0,1,0,1,0,0|2,0,0]=4 16864 B13R1.337 C[C@H](F)COCOC1CCCCC1 22560fa170cbac02f88e1e721ba9263b [0,1,0,1,0,0|2,0,0]=4 16865 B13R1.337 C[C@H](O)CCNCC1=CCCCC1 858f930e31d354c28088b776717c18f4 [0,1,0,1,0,0|0,0,2]=4 16866 B13R1.337 C[C@H](O)CCNCC1CC=CCC1 d0f2c1abcfd70f5e5932152d85e75a6e [0,1,0,1,0,0|0,0,2]=4 16867 B13R1.337 C[C@H](O)CCNCC1CCCCC1 4b29929b466d547feed553447a9db6af [0,1,0,1,0,0|0,0,0]=2 16868 B13R1.337 C[C@H](O)CCNCC1CCCCO1 cd815565f448b50a4c06a880576a578f [0,1,0,1,0,0|1,0,0]=3 16869 B13R1.337 C[C@H](O)CCNCC1CCCOC1 a635150c216974eee979a22afac71661 [0,1,0,1,0,0|1,0,0]=3 16870 B13R1.337 C[C@H](O)CCNCC1CCOCC1 57b0cf21a3d79b6dcd7ab04d31892f1e [0,1,0,1,0,0|1,0,0]=3 16871 B13R1.337 C[C@H](O)CCNCC1CCSCC1 5eda3759b4bcdd1dd929c45387e4f249 [0,1,0,1,0,0|1,0,0]=3 16872 B13R1.337 C[C@H](O)CCNCC1COCCO1 f1cd6bf0575bb6ffcdd6dc7823ac4c7d [0,1,0,1,0,0|2,0,0]=4 16873 B13R1.337 C[C@H](O)CNCCC1=CCCCC1 4b021612e295449fd5c060174715372f [0,1,0,1,0,0|0,0,2]=4 16874 B13R1.337 C[C@H](O)CNCCC1CCCCC1 1974e8d69ca558789317ffeffba1b7ff [0,1,0,1,0,0|0,0,0]=2 16875 B13R1.337 C[C@H](O)CNCCC1CCCCO1 0f2d6f2708f099ebbe28699ea2b36410 [0,1,0,1,0,0|1,0,0]=3 16876 B13R1.337 C[C@H](O)CNCCC1CCCOC1 96d390e4ecd277b27be56df417d4bfdd [0,1,0,1,0,0|1,0,0]=3 16877 B13R1.337 C[C@H](O)CNCCC1CCOCC1 bbd3bbbc36f1ccd6e4cc47a5b2eb3e18 [0,1,0,1,0,0|1,0,0]=3 16878 B13R1.337 C[C@H](O)CNCCC1CCSCC1 e9115d295ce4f3d4f9de3c80dc052ef6 [0,1,0,1,0,0|1,0,0]=3 16879 B13R1.337 C[C@H](O)CNCCC1COCCO1 b7fbb9324d95aff705e8d8ca5098c809 [0,1,0,1,0,0|2,0,0]=4 16880 B13R1.337 C[C@H](O)CNCCN1CCCCC1 39fa164c62faf664fdada4214384c79b [0,1,0,1,0,0|1,0,0]=3 16881 B13R1.337 C[C@H](O)CNCCN1CCCCO1 108a17e965c4ec3915e788d3febcd70e [0,1,0,1,0,0|2,0,0]=4 16882 B13R1.337 C[C@H](O)CNCCN1CCOCC1 f0edf70fc05e2cd0a7f60cec2592932f [0,1,0,1,0,0|2,0,0]=4 16883 B13R1.337 C[C@H](O)CNCCN1CCSCC1 b22ad52ac81f821734e3f76746c4ecb0 [0,1,0,1,0,0|2,0,0]=4 16884 B13R1.337 C[C@H](O)CNCOC1CCCCC1 c6a9a728f63b4969c3fed0505cc6e400 [0,1,0,1,0,0|1,0,0]=3 16885 B13R1.337 FC(F)CCNCC1CCCCC1 4ab7e8c1ffcd59e6d419ac7664c77daa [0,1,0,1,0,0|2,0,0]=4 16886 B13R1.337 FC(F)CCOCC1CCCCC1 a84b998993150eecae892370e7341779 [0,1,0,1,0,0|2,0,0]=4 16887 B13R1.337 FC(F)CNCCC1CCCCC1 b29c4a17ba488032d091ca06cab7ddf7 [0,1,0,1,0,0|2,0,0]=4 16888 B13R1.337 FC(F)COCCC1CCCCC1 d738be1f52b5a4e1393b47553b4e67ea [0,1,0,1,0,0|2,0,0]=4 16889 B13R1.337 O=C(O)CCCOC1CCCCC1 6b1e18a305e1bfd92970b29199a53f07 [0,1,0,1,0,0|1,0,1]=4 16890 B13R1.337 O=C(O)CCNCC1CCCCC1 fc75ae2f0974c7a29895ed4154af644e [0,1,0,1,0,0|1,0,1]=4 16891 B13R1.337 O=C(O)CCOCC1CCCCC1 7dce55788e1ee6d5eb1868483f5c473b [0,1,0,1,0,0|1,0,1]=4 16892 B13R1.337 O=C(O)CNCCC1CCCCC1 a22a934692edc7345f5e072a8623c5a6 [0,1,0,1,0,0|1,0,1]=4 16893 B13R1.337 O=C(O)COCCC1CCCCC1 42fb277ba160c66dc1d0322e91d18d3c [0,1,0,1,0,0|1,0,1]=4 16894 B13R1.337 O=S(O)CCNCC1CCCCC1 012fa50cc0d5e6e7b024e07f7f25c90c [0,1,0,1,0,0|2,0,0]=4 16895 B13R1.337 O=S(O)COCCC1CCCCC1 7c9af9b088605a0fff00d6e7fc0661f6 [0,1,0,1,0,0|2,0,0]=4 16896 B13R1.491 CCCOC1CN(C1)CCC(C)O 8862574e308e8c28a69139fb869e583e [0,1,0,1,0,0|2,0,0]=4 16897 B13R1.491 COCCC1CN(C1)CCC(C)O 6a58f85caec7afd28230a7cc8d8f53c0 [0,1,0,1,0,0|2,0,0]=4 16898 B13R1.568 CC(O)C1CCCN(C1)CCCF ffa96bfd75cddf248a44f6ed8a1dce3d [0,1,0,1,0,0|2,0,0]=4 16899 B13R1.568 CC(O)C1CCCN(C1)CCCO 148c9781d86620c7f3d72a047e972c37 [0,1,0,1,0,0|2,0,0]=4 16900 B13R1.568 CC(O)C1CCCN(C1)CCCS 54db9d98b88afb60c96ea9ba99ce3d34 [0,1,0,1,0,0|2,0,0]=4 16901 B13R1.568 CCCCN1CCCC(C1)C(C)C 6bd610ea6b4c4ae44579e3d97b8988cd [0,1,0,1,0,0|2,0,0]=4 16902 B13R1.568 CCCCN1CCCC(C1)C(C)O a231b925456f2c9e8aaedfd3f29402ef [0,1,0,1,0,0|1,0,0]=3 16903 B13R1.568 CCOCN1CCCC(C1)C(C)O 98bf3a3d559f4c63925680ba40b5bc0c [0,1,0,1,0,0|2,0,0]=4 16904 B13R1.568 COCCN1CCCC(C1)C(C)O 0690f9f3e740e11364b4fa127cd18c21 [0,1,0,1,0,0|2,0,0]=4 16905 B13R1.568 CSCCN1CCCC(C1)C(C)O e855bc3cb4a81269fe86e4b0d83c40be [0,1,0,1,0,0|2,0,0]=4 16906 B13R1.637 CC(O)CCCCN1CC(C1)CF e37e7c49e09c68d9d4e040cefaea38f8 [0,1,0,1,0,0|2,0,0]=4 16907 B13R1.637 CC(O)CCCCN1CC(C1)CO 92db5961e767390fe405c5e84b25225d [0,1,0,1,0,0|2,0,0]=4 16908 B13R1.637 CC(O)CCCNC1CC(C1)CO f25ca586a52b1b198bf19652399da543 [0,1,0,1,0,0|2,0,0]=4 16909 B13R1.637 CC(O)CCCN[C@H]1C[C@@H](C1)CO dfb054e0a475c063f18aa062a3c7abfc [0,1,0,1,0,0|2,0,0]=4 16910 B13R1.637 CC(O)CCCN[C@H]1C[C@H](C1)CO bcddb0135d6f00aafc2989d25bc6f3ec [0,1,0,1,0,0|2,0,0]=4 16911 B13R1.637 CC(O)CCNCC1CC(C1)CO aecba7a8ba8a2b6dd1b514abe31149c9 [0,1,0,1,0,0|2,0,0]=4 16912 B13R1.637 CCC1CN(C1)CCCCC(C)C b0d473b9dd48c9d915d30d942993c7d9 [0,1,0,1,0,0|2,0,0]=4 16913 B13R1.637 CCC1CN(C1)CCCCC(C)O ced033c60e7328bf9b64338910d2fa6b [0,1,0,1,0,0|1,0,0]=3 16914 B13R1.637 CCC1CN(C1)CCCC[C@@H](C)O a1b3d5de5e41a3063e1c6b8248dd25e0 [0,1,0,1,0,0|1,0,0]=3 16915 B13R1.637 CCN1CC(C1)CNCCC(C)O be5da67b14fbef1d3a3fcedf7e6ae9e0 [0,1,0,1,0,0|2,0,0]=4 16916 B13R1.637 CCN1CC(C1)NCCCC(C)O 1eaffa5ace9c43893e33e505a0d6e22d [0,1,0,1,0,0|2,0,0]=4 16917 B13R1.637 COC1CC(C1)CNCCC(C)O 913d250a15201f0e8e40ad2b5d979c6b [0,1,0,1,0,0|2,0,0]=4 16918 B13R1.637 COC1CC(C1)CNCC[C@@H](C)O b4037238c4a8bd65c0183d6d1577efb4 [0,1,0,1,0,0|2,0,0]=4 16919 B13R1.637 COC1CC(C1)CNCC[C@H](C)O 57d07da46663632c8b9077a3b1f280fb [0,1,0,1,0,0|2,0,0]=4 16920 B13R1.637 COC1CC(C1)NCCCC(C)O 7b12c75cc9bec3391e77c2df847a05a7 [0,1,0,1,0,0|2,0,0]=4 16921 B13R1.637 COC1CN(C1)CCCCC(C)O 7725678e1e7d503c315069c817b0b74f [0,1,0,1,0,0|2,0,0]=4 16922 B13R1.637 COC1CN(C1)CCCC[C@@H](C)O fb3b77f35827bc5f3d8032d6613d4a7f [0,1,0,1,0,0|2,0,0]=4 16923 B13R1.637 CO[C@H]1C[C@@H](C1)NCCCC(C)O ab28698c767d6e8f505042500edf4c4f [0,1,0,1,0,0|2,0,0]=4 16924 B13R1.637 CO[C@H]1C[C@H](C1)NCCCC(C)O 3443d6821d9d0c6dba43f0e592afd6ce [0,1,0,1,0,0|2,0,0]=4 16925 B13R1.637 CSC1CN(C1)CCCCC(C)O 69a2ce23f18668e31e7c16ff71a5a79c [0,1,0,1,0,0|2,0,0]=4 16926 B13R1.637 CSC1CN(C1)CCCC[C@@H](C)O ce4c378f412449eb1dd021203ccd2a9b [0,1,0,1,0,0|2,0,0]=4 16927 B13R1.637 C[C@@H](O)CCCCN1CC(C1)CF d887ddf60463870c895f6e8f7eccbdef [0,1,0,1,0,0|2,0,0]=4 16928 B13R1.637 C[C@@H](O)CCCCN1CC(C1)CO 75e4769587da8e3c995ee0cc85bb30b4 [0,1,0,1,0,0|2,0,0]=4 16929 B13R1.637 C[C@@H](O)CCNCC1CC(C1)CO 8e10019517ffb0bfe8bf2842ebc0e1d3 [0,1,0,1,0,0|2,0,0]=4 16930 B13R1.637 C[C@H](O)CCNCC1CC(C1)CO dfc09927f4920efdfabe62de875a7157 [0,1,0,1,0,0|2,0,0]=4 16931 B13R1.676 CCCCC(C)CCOCC1CC1 54cf9fc19ccfc500700cd11b087d151c [0,1,0,1,0,0|2,0,0]=4 16932 B13R1.676 CCCCC(C)COCCC1CC1 c70b38eed23e6d4bd3155e76dcc7be57 [0,1,0,1,0,0|2,0,0]=4 16933 B13R1.676 CCCCC(C)OCCCC1CC1 86be3f4322220d40600ac01ce5f1dc75 [0,1,0,1,0,0|2,0,0]=4 16934 B13R1.676 CCCCC(O)CNCCC1CC1 1273d9d2175ed2677baf4288856f1177 [0,1,0,1,0,0|2,0,0]=4 16935 B13R1.678 CC(CCCO)NCC1CC(C1)O 44de63ba1aea7959c7b40a3ec0fda7c8 [0,1,0,1,0,0|2,0,0]=4 16936 B13R1.678 CC(CCCO)NC[C@H]1C[C@@H](C1)O eb9734e2040ef6361222ba15bc74476f [0,1,0,1,0,0|2,0,0]=4 16937 B13R1.678 CC(CCCO)NC[C@H]1C[C@H](C1)O a039492a419ad4e94d95ae3b0f6dfb11 [0,1,0,1,0,0|2,0,0]=4 16938 B13R1.678 CCCCC(=O)NCC1CC(C1)O 576e1f79b4d748f25fbf890aa41575d4 [0,1,0,1,0,0|1,0,1]=4 16939 B13R1.678 CCCCC(=O)NC[C@H]1C[C@@H](C1)O 40e1e96ed687b2de0fa86b4d533380bf [0,1,0,1,0,0|1,0,1]=4 16940 B13R1.678 CCCCC(=O)NC[C@H]1C[C@H](C1)O aa434337369415dd7d1ab8528dec1f44 [0,1,0,1,0,0|1,0,1]=4 16941 B13R1.678 CCCCC(C)NCC1CC(C1)C cab67f22568e94c85e1399785fb53847 [0,1,0,1,0,0|2,0,0]=4 16942 B13R1.678 CCCCC(C)NCC1CC(C1)O b53933c198582596ddf49b89cded744a [0,1,0,1,0,0|1,0,0]=3 16943 B13R1.678 CCCCC(C)NC[C@H]1C[C@@H](C1)O 8d89dedbbd1a3e11e936ce4c01e909b8 [0,1,0,1,0,0|1,0,0]=3 16944 B13R1.678 CCCCC(C)NC[C@H]1C[C@H](C1)F ea21465f2f58c5ab94ccf03095d5d29e [0,1,0,1,0,0|2,0,0]=4 16945 B13R1.678 CCCCC(C)NC[C@H]1C[C@H](C1)O 49a3e46a75a91d79ca0c30d7878a967d [0,1,0,1,0,0|1,0,0]=3 16946 B13R1.678 CCCCC(C)OCC1CC(C1)C 1e9bb57f91508c298d1e10df4000e3ac [0,1,0,1,0,0|2,0,0]=4 16947 B13R1.678 CCCCC(C)OCC1CC(C1)F d97e2701b1671358fac63a1464b288b7 [0,1,0,1,0,0|2,0,0]=4 16948 B13R1.678 CCCCC(C)OC[C@H]1C[C@@H](C1)C a8285947a68adea002c8077dbe6a7245 [0,1,0,1,0,0|2,0,0]=4 16949 B13R1.678 CCCCC(C)OC[C@H]1C[C@H](C1)F 178cf3bf51fc6add5ea5e30d33947396 [0,1,0,1,0,0|2,0,0]=4 16950 B13R1.678 CCCCC(O)CNC1CC(C1)O 9d9154ea5a1263426847af6e0869e885 [0,1,0,1,0,0|1,0,0]=3 16951 B13R1.678 CCCC[C@@H](C)NCC1CC(C1)C 28610215fd0d3fcd581cda7712d2422c [0,1,0,1,0,0|2,0,0]=4 16952 B13R1.678 CCCC[C@@H](C)NCC1CC(C1)O b42b2cbfbf5dc1ffb2bd1a2501a1d4e5 [0,1,0,1,0,0|1,0,0]=3 16953 B13R1.678 CCCC[C@@H](C)NC[C@H]1C[C@H](C1)F 7743f95c56d643c43259b50aab27e5c0 [0,1,0,1,0,0|2,0,0]=4 16954 B13R1.678 CCCC[C@@H](C)OCC1CC(C1)C a60e45ddfea0e1ab64a20faef28a3d84 [0,1,0,1,0,0|2,0,0]=4 16955 B13R1.678 CCCC[C@@H](C)OC[C@H]1C[C@H](C1)F 5ff7171596c4c2c89f2fa1ae6ca9eb59 [0,1,0,1,0,0|2,0,0]=4 16956 B13R1.678 CCCC[C@H](C)OCC1CC(C1)C 722f4f0fdde9dab5a81f1bba6e25cbb1 [0,1,0,1,0,0|2,0,0]=4 16957 B13R1.678 CCCC[C@H](C)OC[C@H]1C[C@H](C1)F 95fb0bc5744071e8891215b29a55a44e [0,1,0,1,0,0|2,0,0]=4 16958 B13R1.678 CCOCC(O)CNC1CC(C1)O 79972d9a61047f9e7790453b82ad5fc0 [0,1,0,1,0,0|2,0,0]=4 16959 B13R1.678 C[C@H](CCCO)CNC1CC(C1)O b9164f8119a1708b14d299f27f5c5488 [0,1,0,1,0,0|2,0,0]=4 16960 B13R1.678 C[C@H](CCCO)NCC1CC(C1)O d2cb34582de2e02226471b74449db12f [0,1,0,1,0,0|2,0,0]=4 16961 B13R1.685 CCCCC(C)N1CCCC1(C)C 91961fcc18b511d846c25172b81147f2 [0,1,0,1,0,0|2,0,0]=4 16962 B13R1.685 CCCCN(C)[C@@H]1CCC[C@@]1(C)O 51f600c55afebc2f05a6221815584e8a [0,1,0,1,0,0|1,0,0]=3 16963 B13R1.685 CN(CCCF)[C@@H]1CCC[C@@]1(C)O 683548174e3724635490bf18898afe0c [0,1,0,1,0,0|2,0,0]=4 16964 B13R1.685 CN(CCCO)[C@@H]1CCC[C@@]1(C)O e61673d6f40ffe8b9c7618ce1c399925 [0,1,0,1,0,0|2,0,0]=4 16965 B13R1.685 CN(CCCS)[C@@H]1CCC[C@@]1(C)O 0fcbafd827b6e5913cb9083219b94a57 [0,1,0,1,0,0|2,0,0]=4 16966 B13R1.685 COCCN(C)[C@@H]1CCC[C@@]1(C)O ddd73ec64d8b0bb39e544df0febffd81 [0,1,0,1,0,0|2,0,0]=4 16967 B13R1.893 CC(C)CCN1CC(CCC1C)O 732421814de27677a90a3eb69b3fdff5 [0,1,0,1,0,0|2,0,0]=4 16968 B13R1.893 CC(C)CCN1C[C@@H](CC[C@H]1C)O 05282584440a017fe3bd210041eae680 [0,1,0,1,0,0|2,0,0]=4 16969 B13R1.893 CC(C)COC1CC(CCC1C)C 9432e8e0d37dd0fa1bd85edf6569a627 [0,1,0,1,0,0|2,0,0]=4 16970 B13R1.893 CC(O)CCN1CC(CCC1C)O fb9799df6c6b69e98ed939401caa1daf [0,1,0,1,0,0|1,0,0]=3 16971 B13R1.893 CC(O)CCN1CC(OCC1C)C 42d4767e47af1cd273f7f2210906803c [0,1,0,1,0,0|2,0,0]=4 16972 B13R1.893 CC(O)CCN1C[C@@H](CC[C@H]1C)O 8e5c8e2c45d8c8c16e269ffadd9bf2e1 [0,1,0,1,0,0|1,0,0]=3 16973 B13R1.893 CC(O)CCN1C[C@@H](OC[C@@H]1C)C 6de2e5b7ffdb32415efbdba192a5fe5f [0,1,0,1,0,0|2,0,0]=4 16974 B13R1.893 CC(O)CCN1C[C@@H](OC[C@H]1C)C e0e8cc526d6ceb9e0a67ccea165ab5b3 [0,1,0,1,0,0|2,0,0]=4 16975 B13R1.893 CC(O)CCN1C[C@H](OC[C@@H]1C)C c97e981d50064909681b07b38435ea28 [0,1,0,1,0,0|2,0,0]=4 16976 B13R1.893 CC(O)CCN1C[C@H](OC[C@H]1C)C 2435eefd714fbed1070e09401c22db0a [0,1,0,1,0,0|2,0,0]=4 16977 B13R1.1042 CC(C)CCCCN(C)C1CCC1 054258639e533a925ee4821668f6de45 [0,1,0,1,0,0|2,0,0]=4 16978 B13R1.1042 CC(C)CCCOC(C)C1CCC1 2972a0d2aa40e1ffb509993a079bf8ca [0,1,0,1,0,0|2,0,0]=4 16979 B13R1.1042 CC(C)CCCO[C@@H](C)C1CCC1 cd2ff5aa63683f38b74c7f311902728a [0,1,0,1,0,0|2,0,0]=4 16980 B13R1.1042 CC(O)CCCCN(C)C1CCC1 b10de376ed7633a7da6bc32f463e0478 [0,1,0,1,0,0|1,0,0]=3 16981 B13R1.1042 CC(O)CCCCN(C)C1COC1 84df6307fe64a1ee12000066a6416da8 [0,1,0,1,0,0|2,0,0]=4 16982 B13R1.1042 CC(O)CCCNC(C)C1COC1 2b57772fde674441bc525d982b990752 [0,1,0,1,0,0|2,0,0]=4 16983 B13R1.1042 CC(O)CCCN[C@@H](C)C1COC1 3642aebbce6baf3679105fe458e0f6ee [0,1,0,1,0,0|2,0,0]=4 16984 B13R1.1042 CC(O)CCCN[C@H](C)C1COC1 e2111b458f53e19da12a3bf6a1b08476 [0,1,0,1,0,0|2,0,0]=4 16985 B13R1.1042 CC(O)CCNCC(=O)C1CCC1 01e3f6f64efb80327a6ee2455f80f97b [0,1,0,1,0,0|1,0,1]=4 16986 B13R1.1042 C[C@@H](O)CCCCN(C)C1CCC1 27781d24d3c83ecd8c24a97488c10d1d [0,1,0,1,0,0|1,0,0]=3 16987 B13R1.1042 C[C@@H](O)CCCCN(C)C1COC1 8b77f87a43233dde44ed7a56a7976e72 [0,1,0,1,0,0|2,0,0]=4 16988 B13R1.1042 C[C@@H](O)CCNCC(=O)C1CCC1 0684b9fa40276c13e05357e48c7a8de8 [0,1,0,1,0,0|1,0,1]=4 16989 B13R1.1042 C[C@H](O)CCNCC(=O)C1CCC1 9364a61d1d366a71a5257c7c9ccbb38a [0,1,0,1,0,0|1,0,1]=4 16990 B13R1.1044 CC(C)CCCCN(C)CC1CC1 6250913ed91da6d3d06ad26b0adeb94e [0,1,0,1,0,0|2,0,0]=4 16991 B13R1.1044 CC(C)CCCOC(C)CC1CC1 9375585f26935e851eed7330298bf2d3 [0,1,0,1,0,0|2,0,0]=4 16992 B13R1.1044 CC(O)CCCCN(C)CC1CC1 300a5ad51d1ca556385105e71f7f13a1 [0,1,0,1,0,0|1,0,0]=3 16993 B13R1.1044 C[C@@H](O)CCCCN(C)CC1CC1 1347e588ab3c516142830c5e3bc5d0f6 [0,1,0,1,0,0|1,0,0]=3 16994 B13R1.1918 CC1(CCCCN(C1)CCCF)O b340c335d4387160c61afb85c9d45d50 [0,1,0,1,0,0|2,0,0]=4 16995 B13R1.1918 CC1(CCCCN(C1)CCCO)O def5296951de74864788cab2d8e88279 [0,1,0,1,0,0|2,0,0]=4 16996 B13R1.1918 CC1(CCCCN(C1)CCCS)O 804da89aa5644203ec1f12527acdff3c [0,1,0,1,0,0|2,0,0]=4 16997 B13R1.1918 CCCCN1CCCCC(C1)(C)C 38c61fb89537227236be5163adc58181 [0,1,0,1,0,0|2,0,0]=4 16998 B13R1.1918 CCCCN1CCCCC(C1)(C)O 3066e56875a926e979d29a6cc4598757 [0,1,0,1,0,0|1,0,0]=3 16999 B13R1.1918 CCCCN1CCOCC(C1)(C)O 17f2bc57978c4ede3f210863db4d8ac7 [0,1,0,1,0,0|2,0,0]=4 17000 B13R1.1918 CCOCN1CCCCC(C1)(C)O 94d29a93e39d7a12cc1ce175f879a107 [0,1,0,1,0,0|2,0,0]=4 17001 B13R1.1918 COCCN1CCCCC(C1)(C)O 44777178473abd8000300cdb87b01a69 [0,1,0,1,0,0|2,0,0]=4 17002 B13R1.1918 CSCCN1CCCCC(C1)(C)O 4afaac354fc32f1520ba2cd1e75b461b [0,1,0,1,0,0|2,0,0]=4 17003 B13R1.2068 CC(O)CCN1CC(CC1CO)O 8215df220d4242967c9ee6963a880170 [0,1,0,1,0,0|2,0,0]=4 17004 B13R1.2496 CCCCC(C)OC1CCC1(C)C 89afde39de9f05c92491de7e84935471 [0,1,0,1,0,0|2,0,0]=4 17005 B13R1.2498 CCCCC(C)COC1CC1(C)C 6168f6ee1b4b434b2aad022fa15154b2 [0,1,0,1,0,0|2,0,0]=4 17006 B13R1.2498 CCCCC(C)NC[C@@H]1CC1(C)C 02f6536e4a1539843f7e21040ba620e4 [0,1,0,1,0,0|2,0,0]=4 17007 B13R1.2498 CCCCC(C)NC[C@H]1CC1(C)C c7c65821c7822863b76c6710dc256755 [0,1,0,1,0,0|2,0,0]=4 17008 B13R1.2498 CCCCC(C)OCC1CC1(C)C 98e116993ba948756630a679bbe43756 [0,1,0,1,0,0|2,0,0]=4 17009 B13R1.2498 CCCCC(C)OC[C@@H]1CC1(C)C f58447b4dcbd6d06b652a7e394c0a0d2 [0,1,0,1,0,0|2,0,0]=4 17010 B13R1.2498 CCCCC(C)OC[C@H]1CC1(C)C 98fcc19f4b4a8936bd65d4273e430cbf [0,1,0,1,0,0|2,0,0]=4 17011 B13R1.2498 CCCCC(O)CNC1CC1(C)C 30406b2d0747892f9e81504262eabe53 [0,1,0,1,0,0|2,0,0]=4 17012 B13R1.3501 C=C(C)CCN1CCCCC(C1)O 5d9bd284576b8fe32111c356f8f49cef [0,1,0,1,0,0|1,0,1]=4 17013 B13R1.3501 C=C(C)CCN1CCCC[C@H](C1)O 3bb1beb168546513d62288b3f19fdaca [0,1,0,1,0,0|1,0,1]=4 17014 B13R1.3501 CC(=O)CCN1CCCCC(C1)O 31d33922907d70dbc4a0fbfbd15cf500 [0,1,0,1,0,0|1,0,1]=4 17015 B13R1.3501 CC(=O)CCN1CCCC[C@H](C1)O 414803ceb91961f06570d6e1f6e3257e [0,1,0,1,0,0|1,0,1]=4 17016 B13R1.3501 CC(C)CCN1CCCCC(C1)O 049e462305bbc601a432b6637b87872b [0,1,0,1,0,0|1,0,0]=3 17017 B13R1.3501 CC(C)CCN1CCCC[C@H](C1)O 5a751de13f658d374511a3b980a8dd52 [0,1,0,1,0,0|1,0,0]=3 17018 B13R1.3501 CC(C)CCN1CCOCC(C1)O 4f923c0c80a4c54064d803a011459478 [0,1,0,1,0,0|2,0,0]=4 17019 B13R1.3501 CC(C)CCN1CCOC[C@@H](C1)O f56f23430e6e8b73815a30640752d07f [0,1,0,1,0,0|2,0,0]=4 17020 B13R1.3501 CC(C)CCN1CCOC[C@H](C1)O f4bff5b75139a689d8be5fb97e5e65e2 [0,1,0,1,0,0|2,0,0]=4 17021 B13R1.3501 CC(C)OCN1CCCCC(C1)O 1160adec1ca9f201fb9eb47ee8e53894 [0,1,0,1,0,0|2,0,0]=4 17022 B13R1.3501 CC(C)OCN1CCCC[C@H](C1)O 9b69d6a15eaafc50e8a3ba08c9f8aa2b [0,1,0,1,0,0|2,0,0]=4 17023 B13R1.3501 CC(O)CCN1CCCCC(C1)O dba3cdcacdf539d065dbdfe7f2591115 [0,1,0,1,0,0|1,0,0]=3 17024 B13R1.3501 CC(O)CCN1CCCC[C@H](C1)O 942d87f27863a7cb20263bfb99360c63 [0,1,0,1,0,0|1,0,0]=3 17025 B13R1.3501 CC(O)CCN1CCCOC(C1)C cb1781c7b03ea0155049308c083de959 [0,1,0,1,0,0|2,0,0]=4 17026 B13R1.3501 CC(O)CCN1CCOCC(C1)F 584f0fd884b1ec8261dab3257e01cecb [0,1,0,1,0,0|2,0,0]=4 17027 B13R1.3501 CC(O)CCN1CCOCC(C1)O ec4f7aab9ef32d38d4f24877e9652c35 [0,1,0,1,0,0|2,0,0]=4 17028 B13R1.3501 CC(O)CCN1CCOC[C@@H](C1)F 6e8f2cdb19ef72ec5d455dcc33e6b739 [0,1,0,1,0,0|2,0,0]=4 17029 B13R1.3501 CC(O)CCN1CCOC[C@@H](C1)O e8c62bf6467f2b516f65fe8c258d6517 [0,1,0,1,0,0|2,0,0]=4 17030 B13R1.3501 CC(O)CCN1CCOC[C@H](C1)F 0a2847bddd0f2b4998b3e3b1d5be49e7 [0,1,0,1,0,0|2,0,0]=4 17031 B13R1.3501 CC(O)CCN1CCOC[C@H](C1)O d17abee1f3aeb12bd7b35ce1296b4586 [0,1,0,1,0,0|2,0,0]=4 17032 B13R1.3501 CC(O)CNC1CCCCN(C1)C 2b984e9bde80d92bd3396f4083af08b5 [0,1,0,1,0,0|2,0,0]=4 17033 B13R1.3501 CC(O)CN[C@@H]1CCCCN(C1)C 2a65603017f2afcaa615913a6cdeb943 [0,1,0,1,0,0|2,0,0]=4 17034 B13R1.3501 CC(O)CN[C@H]1CCCCN(C1)C 548742deb8661f5d1729aee6e2a70679 [0,1,0,1,0,0|2,0,0]=4 17035 B13R1.3501 CN(C)CCN1CCCCC(C1)O feb428eb87542ea9ccd82084cc12ebc5 [0,1,0,1,0,0|2,0,0]=4 17036 B13R1.3501 CN(C)CCN1CCCC[C@H](C1)O 2e0b705c10b7ca1b7adad28b6d8b9f63 [0,1,0,1,0,0|2,0,0]=4 17037 B13R1.3501 CS(=O)CCN1CCCCC(C1)O 175658c9363f54d23c705d11c2d6b11e [0,1,0,1,0,0|2,0,0]=4 17038 B13R1.3501 CS(=O)CCN1CCCC[C@H](C1)O 7ccd0c8ff87215b1153f3a468444eb2d [0,1,0,1,0,0|2,0,0]=4 17039 B13R1.3501 C[C@@H](O)CNC1CCCCN(C1)C 51c1857f21407d8adab5ccd640495508 [0,1,0,1,0,0|2,0,0]=4 17040 B13R1.3501 C[C@@H](O)CN[C@@H]1CCCCN(C1)C 6b794a0baf6e5148c6638e50402d906a [0,1,0,1,0,0|2,0,0]=4 17041 B13R1.3501 C[C@@H](O)CN[C@H]1CCCCN(C1)C 0c3c473f6e3f1d89e8eff9f6f4e60620 [0,1,0,1,0,0|2,0,0]=4 17042 B13R1.3501 C[C@H](O)CNC1CCCCN(C1)C 3637fd7e3a485fbebd304528975c696a [0,1,0,1,0,0|2,0,0]=4 17043 B13R1.3501 C[C@H](O)CN[C@@H]1CCCCN(C1)C 6daa0c7c16b4aed6633eba3721dbee08 [0,1,0,1,0,0|2,0,0]=4 17044 B13R1.3501 C[C@H](O)CN[C@H]1CCCCN(C1)C 37c8ba6bd2346972ca42294b2e4caba3 [0,1,0,1,0,0|2,0,0]=4 17045 B13R1.3529 CC(C)CCCN1C(CCC1C)C b13c8370eadbf202451e956e124e14ba [0,1,0,1,0,0|2,0,0]=4 17046 B13R1.3529 CC(C)CCCN1[C@@H](CC[C@@H]1C)C a4bed4979ca1637cd4723251f9d76448 [0,1,0,1,0,0|2,0,0]=4 17047 B13R1.3529 CC(C)CCCN1[C@@H](CC[C@H]1C)C fc5793a096736ecec723565d4f7e97d4 [0,1,0,1,0,0|2,0,0]=4 17048 B13R1.3529 CC(C)CCCN1[C@H](CC[C@@H]1C)C 9848c4e37a61c89f710e6f6ceac0b796 [0,1,0,1,0,0|2,0,0]=4 17049 B13R1.3529 CC(O)CCCN1C(CCC1C)C 61fc7b08d58e2034e713a5101a6e6dfb [0,1,0,1,0,0|1,0,0]=3 17050 B13R1.3529 CC(O)CCCN1[C@@H](CC[C@@H]1C)C 8fa916e4ab202c07fb40380de24c9b61 [0,1,0,1,0,0|1,0,0]=3 17051 B13R1.3529 CC(O)CCCN1[C@@H](CC[C@H]1C)C 69837aacc52c0feea999cba1e45f8cfe [0,1,0,1,0,0|1,0,0]=3 17052 B13R1.3529 CC(O)CCCN1[C@H](CC[C@@H]1C)C 7823ee3823ce64797d38deb4c60ac687 [0,1,0,1,0,0|1,0,0]=3 17053 B13R1.7746 CC(C)CCCNC1(CCCC1)C c337b657492008d6549deb0d6bf2b27a [0,1,0,1,0,0|2,0,0]=4 17054 B13R1.7746 CC(C)CCNCC1(CCCC1)C 875d86a2b538dc61b800eeefc32a5f69 [0,1,0,1,0,0|2,0,0]=4 17055 B13R1.7746 CC(C)CCNCC1(CCCC1)F b9e4b98efa7bb1e21eba5e806f751806 [0,1,0,1,0,0|2,0,0]=4 17056 B13R1.7746 CC(C)CCNCC1(CCCC1)O 2de5c7cc68ef161bfdccd51f68b7f5e0 [0,1,0,1,0,0|2,0,0]=4 17057 B13R1.7746 CC(C)CCOCC1(CCCC1)C b686dd2e1845cd792141397cbe0098de [0,1,0,1,0,0|2,0,0]=4 17058 B13R1.7746 CC(C)CCOCC1(CCCC1)F c459ab6a74225d1a91bbea8f273567ba [0,1,0,1,0,0|2,0,0]=4 17059 B13R1.7746 CC(C)CNCCC1(CCCC1)O fd69b9cffca2ec47e31c0e1e0eef8862 [0,1,0,1,0,0|2,0,0]=4 17060 B13R1.7746 CC(O)CCCNC1(CCCC1)C b3e28b4fda1fa65ade94eac7e9b014cc [0,1,0,1,0,0|1,0,0]=3 17061 B13R1.7746 CC(O)CCCNC1(CCOC1)C 315274589f843db040f7f82f7b06b6db [0,1,0,1,0,0|2,0,0]=4 17062 B13R1.7746 CC(O)CCNCC1(CCCC1)C b51b7078253fe5dfd286fae0f5065d92 [0,1,0,1,0,0|1,0,0]=3 17063 B13R1.7746 CC(O)CCNCC1(CCCC1)F 2d0073b47ea023f46c9c884b89e102e1 [0,1,0,1,0,0|1,0,0]=3 17064 B13R1.7746 CC(O)CCNCC1(CCCC1)O 05e82cbb03972d4ed007ef7e35ee11b3 [0,1,0,1,0,0|1,0,0]=3 17065 B13R1.7746 CC(O)CCNCC1(CCCO1)C 5f20c0a9d31c28876fd9dad8aab96f65 [0,1,0,1,0,0|2,0,0]=4 17066 B13R1.7746 CC(O)CCNCC1(CCOC1)C 8fb215e28858a2b76add84116c2adfbe [0,1,0,1,0,0|2,0,0]=4 17067 B13R1.7746 CC(O)CCNCC1(CCOC1)O 6a2bab35e59e39f432754b91da537934 [0,1,0,1,0,0|2,0,0]=4 17068 B13R1.7746 CC(O)CNCCC1(CCCC1)O b3bddd13b4d1ec391073ef4f1406b00c [0,1,0,1,0,0|1,0,0]=3 17069 B13R1.7746 C[C@@H](O)CCNCC1(CCCC1)C ce309924f39d4576d61c5ebd89ae2554 [0,1,0,1,0,0|1,0,0]=3 17070 B13R1.7746 C[C@@H](O)CCNCC1(CCCC1)F b6ffc77c5d5f4ef937ce41f17a344771 [0,1,0,1,0,0|1,0,0]=3 17071 B13R1.7746 C[C@@H](O)CNCCC1(CCCC1)O 19d9395d0636e6b026681cc0a5022d81 [0,1,0,1,0,0|1,0,0]=3 17072 B13R1.7746 C[C@H](O)CCNCC1(CCCC1)C baeabdb42397878bbddfcd1b37f3f53e [0,1,0,1,0,0|1,0,0]=3 17073 B13R1.7746 C[C@H](O)CCNCC1(CCCC1)F 690e81c06cb9b1e9d446719128066200 [0,1,0,1,0,0|1,0,0]=3 17074 B13R1.7746 C[C@H](O)CNCCC1(CCCC1)O b496285f24b9c07e9b91ccf55bf81545 [0,1,0,1,0,0|1,0,0]=3 17075 B13R1.100 CC(C)(O)CCN1CCCC1CO bcd0ef481df8e9e81e6a607dc3a2c6f4 [0,1,0,1,0,0|2,0,0]=4 17076 B13R1.100 CC(C)(O)CCN1CCC[C@@H]1CF cfb7579ed02b7bc0f887338b2205aa65 [0,1,0,1,0,0|2,0,0]=4 17077 B13R1.100 CC(C)(O)CCN1CCC[C@@H]1CO 6e459405342d7b87a9dd3c3eff90fcc0 [0,1,0,1,0,0|2,0,0]=4 17078 B13R1.100 CC(C)(O)CCN1CCC[C@H]1CF 7871d2a8f55bff950d55ce5bb6781365 [0,1,0,1,0,0|2,0,0]=4 17079 B13R1.100 CC(C)(O)CCN1CCC[C@H]1CO 8755490bb5a127098acf372dd17e343e [0,1,0,1,0,0|2,0,0]=4 17080 B13R1.100 CC(C)(O)CN[C@H]1CCC[C@H]1CO ee5f7eefa2b7f3f8b6aae24ee4ff72e5 [0,1,0,1,0,0|2,0,0]=4 17081 B13R1.100 CCC1CCCN1CCC(C)(C)C 6f0efd266c676d815eacc52cfa590826 [0,1,0,1,0,0|2,0,0]=4 17082 B13R1.100 CCC1CCCN1CCC(C)(C)O 71cdb38650c273a3358aca4cd09532b8 [0,1,0,1,0,0|1,0,0]=3 17083 B13R1.100 CCC1CCCN1CCC(C)(F)F 45a878f5b8da3ea89b5430a409c13b81 [0,1,0,1,0,0|2,0,0]=4 17084 B13R1.100 CC[C@@H]1CCCN1CCC(C)(C)C ae5119bdd4cd937d24765a031bfba6bf [0,1,0,1,0,0|2,0,0]=4 17085 B13R1.100 CC[C@@H]1CCCN1CCC(C)(C)O ad1044f6ca2f8f3872bd5dd7e432c165 [0,1,0,1,0,0|1,0,0]=3 17086 B13R1.100 CC[C@@H]1CCCN1CCC(C)(F)F cf1906b193302c6265ea804ea7562f25 [0,1,0,1,0,0|2,0,0]=4 17087 B13R1.100 CC[C@@H]1CCC[C@H]1NCC(C)(C)C 2995dfdb1e2548882d02a22874e19e9e [0,1,0,1,0,0|2,0,0]=4 17088 B13R1.100 CC[C@@H]1CCC[C@H]1NCC(C)(C)F 9b13465e5f3d090c030604988446fac1 [0,1,0,1,0,0|2,0,0]=4 17089 B13R1.100 CC[C@@H]1CCC[C@H]1NCC(C)(C)O ba1cd263711ec92fcc20e6ca383bb449 [0,1,0,1,0,0|1,0,0]=3 17090 B13R1.100 CC[C@@H]1CCC[C@H]1NCC(C)(F)F f421a62c13447517b5e16677f647555d [0,1,0,1,0,0|2,0,0]=4 17091 B13R1.100 COC1CCCC1NCC(C)(C)O 734cb558c3a49d8752030c0f8568d90b [0,1,0,1,0,0|2,0,0]=4 17092 B13R1.100 COC1CCCN1CCC(C)(C)O e9bdd4c635da8c3c92c343a556890aa0 [0,1,0,1,0,0|2,0,0]=4 17093 B13R1.100 CO[C@@H]1CCC[C@@H]1NCC(C)(C)O 837c49d70cd3109da79568e5ba486e8c [0,1,0,1,0,0|2,0,0]=4 17094 B13R1.100 CO[C@@H]1CCC[C@H]1NCC(C)(C)O bc63185b8b999edac3396aa5988398fa [0,1,0,1,0,0|2,0,0]=4 17095 B13R1.100 CO[C@H]1CCC[C@@H]1NCC(C)(C)O 5352701e426e098d6fc5ab0f3098be76 [0,1,0,1,0,0|2,0,0]=4 17096 B13R1.157 CC(C)(O)CNC1CCCCC1F 4fcfdf701d67015416c745a9fb5afa27 [0,1,0,1,0,0|2,0,0]=4 17097 B13R1.157 CC(C)(O)CNC1CCCCC1O b424be74bac47d378ab8c5580d5ac9e1 [0,1,0,1,0,0|2,0,0]=4 17098 B13R1.157 CC(C)(O)CN[C@@H]1CCCC[C@H]1O 72d43dd6038fcf5ecb5457bcd738c5d0 [0,1,0,1,0,0|2,0,0]=4 17099 B13R1.157 CC(C)(O)CN[C@H]1CCCC[C@@H]1O c823125d22daea95652dfa9bd57db07f [0,1,0,1,0,0|2,0,0]=4 17100 B13R1.157 CC(C)(O)CN[C@H]1CCCC[C@H]1O b5e75d87b61645b3674dbf71e28b3819 [0,1,0,1,0,0|2,0,0]=4 17101 B13R1.157 CC(C)(O)COC1CCCCC1F af89cf42e9eda964398c7a77157059e5 [0,1,0,1,0,0|2,0,0]=4 17102 B13R1.157 CC(C)(O)CO[C@@H]1CCCC[C@H]1F 4ac235315fbcdd6fae60dfd113649a4d [0,1,0,1,0,0|2,0,0]=4 17103 B13R1.157 CC1CCCCC1NCC(C)(C)C 9f6b770d1bc350ef77b3373273d82f60 [0,1,0,1,0,0|2,0,0]=4 17104 B13R1.157 CC1CCCCC1NCC(C)(C)F 463c7042cefc14193a861e7e3af1609a [0,1,0,1,0,0|2,0,0]=4 17105 B13R1.157 CC1CCCCC1NCC(C)(C)O 1ecfd2f9bdb837cbc272a079fa318ea4 [0,1,0,1,0,0|1,0,0]=3 17106 B13R1.157 CC1CCCCC1NCC(C)(F)F 073bec8e9d5ce81f748c85c7fa333e9f [0,1,0,1,0,0|2,0,0]=4 17107 B13R1.157 CC1CCCCC1OCC(C)(C)C b6f50f0dc63035a1ad73a36eedcd5da4 [0,1,0,1,0,0|2,0,0]=4 17108 B13R1.157 CC1CCCCC1OCC(C)(C)F d93358403f6cee3f4852fe54d204745b [0,1,0,1,0,0|2,0,0]=4 17109 B13R1.157 CC1CCCCC1OCC(C)(C)O 393348965ae0928ba55f4bd3f2799598 [0,1,0,1,0,0|1,0,0]=3 17110 B13R1.157 CC1CCCCC1OCC(C)(F)F 2132643218b25bacc4bcec666de40a76 [0,1,0,1,0,0|2,0,0]=4 17111 B13R1.157 CC1CCCCN1CCC(C)(C)C 31b880adb8ef2646a4ab7bb42fabc0dd [0,1,0,1,0,0|2,0,0]=4 17112 B13R1.157 CC1CCCCN1CCC(C)(C)O 07efc3d1b5611d790cd7f232c53b739e [0,1,0,1,0,0|1,0,0]=3 17113 B13R1.157 CC1CCCCN1CCC(C)(F)F 3c273a938c5247ae18ce4a221200cf45 [0,1,0,1,0,0|2,0,0]=4 17114 B13R1.157 CC1COCCC1NCC(C)(C)O 93de499fd6f919fa1cbf54800ad177b1 [0,1,0,1,0,0|2,0,0]=4 17115 B13R1.157 CC1COCCC1OCC(C)(C)O 91e167ff69ca8577d98d99a4a3077a33 [0,1,0,1,0,0|2,0,0]=4 17116 B13R1.157 CC1COCCN1CCC(C)(C)O e034bec3b50cebd7d48c716b98299392 [0,1,0,1,0,0|2,0,0]=4 17117 B13R1.157 C[C@@H]1CCCCN1CCC(C)(C)C fda48dd327397ef2290604c434c9b2fd [0,1,0,1,0,0|2,0,0]=4 17118 B13R1.157 C[C@@H]1CCCCN1CCC(C)(C)O 154247a40a95d327b8843d8df7480baa [0,1,0,1,0,0|1,0,0]=3 17119 B13R1.157 C[C@@H]1CCCCN1CCC(C)(F)F 568838b6778fe03132b171e4dcbbc337 [0,1,0,1,0,0|2,0,0]=4 17120 B13R1.157 C[C@@H]1CCCC[C@@H]1NCC(C)(C)C de478c77fd816bd96888aad992f98219 [0,1,0,1,0,0|2,0,0]=4 17121 B13R1.157 C[C@@H]1CCCC[C@@H]1NCC(C)(C)F d4c052cd1c08fb30545f45618fba9276 [0,1,0,1,0,0|2,0,0]=4 17122 B13R1.157 C[C@@H]1CCCC[C@@H]1NCC(C)(C)O 79b92550b9ebf8b04743e29cba09bcad [0,1,0,1,0,0|1,0,0]=3 17123 B13R1.157 C[C@@H]1CCCC[C@@H]1NCC(C)(F)F 411c28c370f0f5f545f660e08ebfe408 [0,1,0,1,0,0|2,0,0]=4 17124 B13R1.157 C[C@@H]1CCCC[C@@H]1OCC(C)(C)Br 1e066e02c91396efb53bcc96aeae8898 [0,1,0,1,0,0|2,0,0]=4 17125 B13R1.157 C[C@@H]1CCCC[C@@H]1OCC(C)(C)C 1fe664dbfc55b4f945a623b35cdc9575 [0,1,0,1,0,0|2,0,0]=4 17126 B13R1.157 C[C@@H]1CCCC[C@@H]1OCC(C)(C)F 99561475a92fe83115b547ae69f5ac39 [0,1,0,1,0,0|2,0,0]=4 17127 B13R1.157 C[C@@H]1CCCC[C@@H]1OCC(C)(C)O f72dfa087ae7d6a21a7cbe73465f2a29 [0,1,0,1,0,0|1,0,0]=3 17128 B13R1.157 C[C@@H]1CCCC[C@@H]1OCC(C)(C)S 0025bfa851c9f1c9aa4b702a3469de33 [0,1,0,1,0,0|1,1,0]=4 17129 B13R1.157 C[C@@H]1CCCC[C@@H]1OCC(C)(F)F be9eb1fbc4e98d53ef12609832a3045b [0,1,0,1,0,0|2,0,0]=4 17130 B13R1.157 C[C@@H]1CCCC[C@H]1NCC(C)(C)C 529ab49ce55ac0c173f500e4bf879314 [0,1,0,1,0,0|2,0,0]=4 17131 B13R1.157 C[C@@H]1CCCC[C@H]1NCC(C)(C)F 7bdc14effb479e9a1fa6b83d08ad7350 [0,1,0,1,0,0|2,0,0]=4 17132 B13R1.157 C[C@@H]1CCCC[C@H]1NCC(C)(C)O 4aa4e12f94601604fdd209b496e8b412 [0,1,0,1,0,0|1,0,0]=3 17133 B13R1.157 C[C@@H]1CCCC[C@H]1NCC(C)(F)F 6c6b3f2a30e4b61de497c84be95114ff [0,1,0,1,0,0|2,0,0]=4 17134 B13R1.157 C[C@@H]1COCCN1CCC(C)(C)O 996d26d46879197ec642f44098cfb74c [0,1,0,1,0,0|2,0,0]=4 17135 B13R1.157 C[C@@H]1COCC[C@@H]1NCC(C)(C)O c035d3b6fe08ce103eb655c1793f134d [0,1,0,1,0,0|2,0,0]=4 17136 B13R1.157 C[C@H]1CCCCN1CCC(C)(C)C ffec645548c2aa00b40617e1091d4593 [0,1,0,1,0,0|2,0,0]=4 17137 B13R1.157 C[C@H]1CCCCN1CCC(C)(C)O cf5902e0bf9303cb929552282c4dbc14 [0,1,0,1,0,0|1,0,0]=3 17138 B13R1.157 C[C@H]1CCCCN1CCC(C)(F)F 4ad85afcd1a013e9901bc1bf241c69de [0,1,0,1,0,0|2,0,0]=4 17139 B13R1.157 C[C@H]1CCCC[C@@H]1NCC(C)(C)C 765f1c3d29afeb6bad43c16a4eb72511 [0,1,0,1,0,0|2,0,0]=4 17140 B13R1.157 C[C@H]1CCCC[C@@H]1NCC(C)(C)F 5366eaea5dbf1cca958217ec74865714 [0,1,0,1,0,0|2,0,0]=4 17141 B13R1.157 C[C@H]1CCCC[C@@H]1NCC(C)(C)O 1f74bdcac6f95e53bb2a16b1600aba93 [0,1,0,1,0,0|1,0,0]=3 17142 B13R1.157 C[C@H]1CCCC[C@@H]1NCC(C)(F)F 0d51d35b4cf50e1759c58bc26d7184fd [0,1,0,1,0,0|2,0,0]=4 17143 B13R1.157 C[C@H]1CCCC[C@@H]1OCC(C)(C)C d4039ae4aecfe5fa484a0d53b9b20f58 [0,1,0,1,0,0|2,0,0]=4 17144 B13R1.157 C[C@H]1CCCC[C@@H]1OCC(C)(C)F 9da5be49b20ba412b5d63d5140e54c72 [0,1,0,1,0,0|2,0,0]=4 17145 B13R1.157 C[C@H]1CCCC[C@@H]1OCC(C)(C)O d3503498ac8690bfd06da696e0dc86b9 [0,1,0,1,0,0|1,0,0]=3 17146 B13R1.157 C[C@H]1CCCC[C@@H]1OCC(C)(F)F d2f1348f402c2d03e0f5b03e0174bcd4 [0,1,0,1,0,0|2,0,0]=4 17147 B13R1.157 C[C@H]1CCCC[C@H]1NCC(C)(C)C 3413f132f3119e94be14ab9bdae9b0cc [0,1,0,1,0,0|2,0,0]=4 17148 B13R1.157 C[C@H]1CCCC[C@H]1NCC(C)(C)F 66743fb2afde327d47bb40fefbac192e [0,1,0,1,0,0|2,0,0]=4 17149 B13R1.157 C[C@H]1CCCC[C@H]1NCC(C)(C)O 190636ae6372a25ecfe0a6b8f4faab5c [0,1,0,1,0,0|1,0,0]=3 17150 B13R1.157 C[C@H]1CCCC[C@H]1NCC(C)(F)F 7bd275ef51d1d068814dc1c771c4a3e3 [0,1,0,1,0,0|2,0,0]=4 17151 B13R1.157 C[C@H]1CCCC[C@H]1OCC(C)(C)C 0277f5c247ab284acc98f4d87764391c [0,1,0,1,0,0|2,0,0]=4 17152 B13R1.157 C[C@H]1CCCC[C@H]1OCC(C)(C)F 55c1fe8819980461484d4e69e729ed87 [0,1,0,1,0,0|2,0,0]=4 17153 B13R1.157 C[C@H]1CCCC[C@H]1OCC(C)(C)O 9abe366d8deeadfc00c33772ee8a35e1 [0,1,0,1,0,0|1,0,0]=3 17154 B13R1.157 C[C@H]1CCCC[C@H]1OCC(C)(F)F 25f39a7649b9687054454bca2890b344 [0,1,0,1,0,0|2,0,0]=4 17155 B13R1.157 C[C@H]1COCCN1CCC(C)(C)O 9ec6025aabd3c7eeac0205f25bda7f93 [0,1,0,1,0,0|2,0,0]=4 17156 B13R1.157 C[C@H]1COCC[C@H]1NCC(C)(C)O c44c0813ffe3496f2500548d6bf4e6a5 [0,1,0,1,0,0|2,0,0]=4 17157 B13R1.195 CC(C)(O)CCCN1CCCC1O 291b1e2b4aa73e310e3ccda25e5757eb [0,1,0,1,0,0|2,0,0]=4 17158 B13R1.195 CC(C)(O)CCNC1CCCC1O 873d09d4131baec1538f6df97fd609f7 [0,1,0,1,0,0|2,0,0]=4 17159 B13R1.195 CC(C)(O)CCN[C@@H]1CCC[C@@H]1O 779c850ba41664e8623a63b2c3bd5bb4 [0,1,0,1,0,0|2,0,0]=4 17160 B13R1.195 CC(C)(O)CCN[C@@H]1CCC[C@H]1O 381a18d11f70a18514c1e01692834627 [0,1,0,1,0,0|2,0,0]=4 17161 B13R1.195 CC(C)(O)CCN[C@H]1CCC[C@@H]1O 7587bf33acc68ebc8c29b52434e3bcb0 [0,1,0,1,0,0|2,0,0]=4 17162 B13R1.195 CC(C)(O)CCN[C@H]1CCC[C@H]1O e0c1e785c1e9dd5a62529b863b6ee126 [0,1,0,1,0,0|2,0,0]=4 17163 B13R1.195 CC(C)(O)CCO[C@@H]1CCC[C@H]1F eba3259463b1632bcdb25c71f460d46a [0,1,0,1,0,0|2,0,0]=4 17164 B13R1.195 CC(C)(O)CNCC1CCCC1O 1b5b3709f2a22565b4be9b0fdd4468fb [0,1,0,1,0,0|2,0,0]=4 17165 B13R1.195 CC(C)(O)COC[C@@H]1CCC[C@H]1F 3d6c37646ccc9971d95fb75f6348a059 [0,1,0,1,0,0|2,0,0]=4 17166 B13R1.195 CC1CCCC1COCC(C)(C)C baa19875130f303dea64a3cfe7c2a9f7 [0,1,0,1,0,0|2,0,0]=4 17167 B13R1.195 CC1CCCC1COCC(C)(C)F ec834f81384b45608839a7b6cec39442 [0,1,0,1,0,0|2,0,0]=4 17168 B13R1.195 CC1CCCC1COCC(C)(C)O 8b1b6f94a3037e66384ec4830c253a15 [0,1,0,1,0,0|1,0,0]=3 17169 B13R1.195 CC1CCCC1COCC(C)(F)F a1f3cf204863b0db5ecee076c33234e4 [0,1,0,1,0,0|2,0,0]=4 17170 B13R1.195 CC1CCCC1OCCC(C)(C)C 4865c3336ff9d96dc8355d3d5e43f3a4 [0,1,0,1,0,0|2,0,0]=4 17171 B13R1.195 CC1CCCC1OCCC(C)(C)O 5d5048c3f5c2c8e8173901ac48f1f4d7 [0,1,0,1,0,0|1,0,0]=3 17172 B13R1.195 CC1CCCC1OCCC(C)(F)F 972bb10c463c4a883e6a3796e45fe8a0 [0,1,0,1,0,0|2,0,0]=4 17173 B13R1.195 CC1CCCN1CCCC(C)(C)O 48d7eb45d39ba09385a4de545dc72773 [0,1,0,1,0,0|1,0,0]=3 17174 B13R1.195 CC1CCCN1CCCC(C)(F)F 27c4c6c2b2900cd06dc230991434d00e [0,1,0,1,0,0|2,0,0]=4 17175 B13R1.195 CC1CCOC1COCC(C)(C)O 7c2dbaedffb9410dacfe72e8cb6fa6a1 [0,1,0,1,0,0|2,0,0]=4 17176 B13R1.195 CC1COCC1CNCC(C)(C)O 144d2927b4f4049b42975dd5cf96236f [0,1,0,1,0,0|2,0,0]=4 17177 B13R1.195 CC1COCC1COCC(C)(C)O ea3b25a44c32f3c6fcf86a03fea6e030 [0,1,0,1,0,0|2,0,0]=4 17178 B13R1.195 CC1COCC1OCCC(C)(C)O 88147fada173b7ddf7029fb69aa9372f [0,1,0,1,0,0|2,0,0]=4 17179 B13R1.195 CC1SCCN1CCCC(C)(C)O 87fc473306ff2696a2f863be98a2cb75 [0,1,0,1,0,0|2,0,0]=4 17180 B13R1.195 CN1CCCC1CNCC(C)(C)O 153028ea33fa7dd78ad0848a0c6b7793 [0,1,0,1,0,0|2,0,0]=4 17181 B13R1.195 CN1CCCC1COCC(C)(C)O 6e5016f109b89e33757f498414c646e9 [0,1,0,1,0,0|2,0,0]=4 17182 B13R1.195 CN1CCC[C@@H]1CNCC(C)(C)O bf97af389fb2d30d67913ab40370236f [0,1,0,1,0,0|2,0,0]=4 17183 B13R1.195 CN1CCC[C@@H]1COCC(C)(C)O 2225ebb9a42ca604d2e3bee499f8c890 [0,1,0,1,0,0|2,0,0]=4 17184 B13R1.195 CN1CCC[C@H]1CNCC(C)(C)O 90f57838815c4dff5b93739e0aa0312c [0,1,0,1,0,0|2,0,0]=4 17185 B13R1.195 CN1CCC[C@H]1COCC(C)(C)O c6a46831db014f3b56eb471d2af0fd5a [0,1,0,1,0,0|2,0,0]=4 17186 B13R1.195 C[C@@H]1CCCN1CCCC(C)(C)O 3f2a46da46d0e96b5167a2046e61288d [0,1,0,1,0,0|1,0,0]=3 17187 B13R1.195 C[C@@H]1CCCN1CCCC(C)(F)F 8429dd36c0b38e92ff4a41d57271731e [0,1,0,1,0,0|2,0,0]=4 17188 B13R1.195 C[C@@H]1CCC[C@@H]1OCCC(C)(C)C 13d9dd00bc75e74de922451957829c60 [0,1,0,1,0,0|2,0,0]=4 17189 B13R1.195 C[C@@H]1CCC[C@@H]1OCCC(C)(C)O cbb81ace7e2565bccefbb22e2af03490 [0,1,0,1,0,0|1,0,0]=3 17190 B13R1.195 C[C@@H]1CCC[C@@H]1OCCC(C)(F)F fc669eeb4d855372d6b721404e502eca [0,1,0,1,0,0|2,0,0]=4 17191 B13R1.195 C[C@@H]1CCC[C@H]1OCCC(C)(C)C eb1b6bd18bec67e92a02982d34567b94 [0,1,0,1,0,0|2,0,0]=4 17192 B13R1.195 C[C@@H]1CCC[C@H]1OCCC(C)(C)O 560326f4cc860eb14482b38d24237bb9 [0,1,0,1,0,0|1,0,0]=3 17193 B13R1.195 C[C@@H]1CCC[C@H]1OCCC(C)(F)F 5242b9761234c54511f78f2cdb5788f3 [0,1,0,1,0,0|2,0,0]=4 17194 B13R1.195 C[C@@H]1COC[C@@H]1OCCC(C)(C)O a4caaa8302f010c792cae1a0daa7b42b [0,1,0,1,0,0|2,0,0]=4 17195 B13R1.195 C[C@H]1CCCN1CCCC(C)(C)O 4cd431bdd6cf5513259b712be632391a [0,1,0,1,0,0|1,0,0]=3 17196 B13R1.195 C[C@H]1CCCN1CCCC(C)(F)F e74092a9a076e2be86c2b81eeda678ea [0,1,0,1,0,0|2,0,0]=4 17197 B13R1.195 C[C@H]1CCC[C@@H]1OCCC(C)(C)C 806cd84567aa620e5d4f2c2ed7ca4d87 [0,1,0,1,0,0|2,0,0]=4 17198 B13R1.195 C[C@H]1CCC[C@@H]1OCCC(C)(C)O 049309ba07ab222d434cff388cce2e8f [0,1,0,1,0,0|1,0,0]=3 17199 B13R1.195 C[C@H]1CCC[C@@H]1OCCC(C)(F)F d1b79024cb98ac6e150ace84677d7795 [0,1,0,1,0,0|2,0,0]=4 17200 B13R1.195 C[C@H]1CCC[C@H]1OCCC(C)(C)C 9a3c9a6a95989a58555f4c6e428793f8 [0,1,0,1,0,0|2,0,0]=4 17201 B13R1.195 C[C@H]1CCC[C@H]1OCCC(C)(C)O 90ca551d54f0aab0bd823ff8604a776b [0,1,0,1,0,0|1,0,0]=3 17202 B13R1.195 C[C@H]1CCC[C@H]1OCCC(C)(F)F 5b5b8bca246780323103073d8571aec1 [0,1,0,1,0,0|2,0,0]=4 17203 B13R1.195 C[C@H]1COC[C@@H]1OCCC(C)(C)O 9c9d8025d17d2f889f2b4bea2d4045e5 [0,1,0,1,0,0|2,0,0]=4 17204 B13R1.195 C[C@H]1COC[C@H]1OCCC(C)(C)O 55aa0a2e8212a3431e8fc99f44888c81 [0,1,0,1,0,0|2,0,0]=4 17205 B13R1.195 C[C@H]1OCC[C@H]1COCC(C)(C)O f39d27bae5817370c13b946df1adebc2 [0,1,0,1,0,0|2,0,0]=4 17206 B13R1.204 CC(C)(O)CCCNC1CCC1F 69689d9c3cc97b0dfb73acabdc36ac92 [0,1,0,1,0,0|2,0,0]=4 17207 B13R1.204 CC(C)(O)CCCNC1CCC1O 62075f01787790d96c1a04fdde6b8881 [0,1,0,1,0,0|2,0,0]=4 17208 B13R1.204 CC(C)(O)CCCN[C@@H]1CC[C@@H]1O dbc7badaa6ce99641ef59d3188407bbe [0,1,0,1,0,0|2,0,0]=4 17209 B13R1.204 CC(C)(O)CCCN[C@@H]1CC[C@H]1O 95403a9861f37ef3ac192b1c114a983b [0,1,0,1,0,0|2,0,0]=4 17210 B13R1.204 CC(C)(O)CCCN[C@H]1CC[C@@H]1O a4d17194647bd2b2062e9a795008a439 [0,1,0,1,0,0|2,0,0]=4 17211 B13R1.204 CC(C)(O)CCCN[C@H]1CC[C@H]1O b9399875fcb4fda348c9ba90470ee5a3 [0,1,0,1,0,0|2,0,0]=4 17212 B13R1.204 CC(C)(O)CCOCC1CCC1F e390403c801fc7da6330307fc39958df [0,1,0,1,0,0|2,0,0]=4 17213 B13R1.204 CC1OCC1NCCCC(C)(C)O 778df042d8bc65dc6aceca5725fb4859 [0,1,0,1,0,0|2,0,0]=4 17214 B13R1.204 CC1OCC1OCCCC(C)(C)O c133a4ebb764502db1078fc50b7c0c10 [0,1,0,1,0,0|2,0,0]=4 17215 B13R1.204 CN1CCC1CNCCC(C)(C)O 119c4337d7ec8b42c9e4641432043c9f [0,1,0,1,0,0|2,0,0]=4 17216 B13R1.204 CN1CCC1COCCC(C)(C)O fec693f91cac3b650632b6f6cacfcdf0 [0,1,0,1,0,0|2,0,0]=4 17217 B13R1.204 CN1CC[C@@H]1COCCC(C)(C)O 5471d637305cf2614ee33041c5cddf4b [0,1,0,1,0,0|2,0,0]=4 17218 B13R1.204 CN1CC[C@H]1COCCC(C)(C)O 91735d15b4c1847f5d66d539dcddf76d [0,1,0,1,0,0|2,0,0]=4 17219 B13R1.204 C[C@@H]1CC[C@@H]1NCCCC(C)(C)O 4360a42b1deb925c147aeb497fcb7784 [0,1,0,1,0,0|1,0,0]=3 17220 B13R1.204 C[C@@H]1CC[C@@H]1NCCCC(C)(F)F 6f0cd639d885b3d61dd15ac4fd1e8006 [0,1,0,1,0,0|2,0,0]=4 17221 B13R1.204 C[C@@H]1CC[C@H]1NCCCC(C)(C)O c350946574221be742a66dbeef90259a [0,1,0,1,0,0|1,0,0]=3 17222 B13R1.204 C[C@@H]1CC[C@H]1NCCCC(C)(F)F 0f6cfe63d4e49f34d18936507d492b94 [0,1,0,1,0,0|2,0,0]=4 17223 B13R1.210 COC[C@@H]1C[C@@H]1NCCC(C)(C)O a19027db85060f79f60563bf1d2dca2f [0,1,0,1,0,0|2,0,0]=4 17224 B13R1.210 COC[C@H]1C[C@@H]1NCCC(C)(C)O 0e6b7c91d72e83abf4ba922fd799ef96 [0,1,0,1,0,0|2,0,0]=4 17225 B13R1.215 CC(C)(O)CCN1CCC1CCO 22c26417420a1d6d418403f84a8e0b86 [0,1,0,1,0,0|2,0,0]=4 17226 B13R1.215 COCC1CCN1CCC(C)(C)O c9463c36f680770e4cd4fb9d89b992f7 [0,1,0,1,0,0|2,0,0]=4 17227 B13R1.215 COC[C@@H]1CCN1CCC(C)(C)O 6983d95e32a7c5ea36c25889615c8b9f [0,1,0,1,0,0|2,0,0]=4 17228 B13R1.215 COC[C@H]1CCN1CCC(C)(C)O 1a5f895f61f2677374c47168150422b4 [0,1,0,1,0,0|2,0,0]=4 17229 B13R1.228 CC(C)(O)CN1CCCC1CCO 0c6387c6cb104fe3520279bbd03441c3 [0,1,0,1,0,0|2,0,0]=4 17230 B13R1.228 CC(C)(O)CN1CCC[C@@H]1CCO 6b4517c9c76b7eeab5d67f0b8f1486f8 [0,1,0,1,0,0|2,0,0]=4 17231 B13R1.228 CCCC1SCCN1CC(C)(C)O b47bd27ec6bcb7b83504e6363a895f4a [0,1,0,1,0,0|2,0,0]=4 17232 B13R1.228 COCC1CCCN1CC(C)(C)O a4cd0ec41560961246f5107a7f6af955 [0,1,0,1,0,0|2,0,0]=4 17233 B13R1.228 COC[C@@H]1CCCN1CC(C)(C)O fa9b3914d908427f916d0ecaf10dd85b [0,1,0,1,0,0|2,0,0]=4 17234 B13R1.228 COC[C@H]1CCCN1CC(C)(C)O 4db7566f79444fafb781d53937c90e8d [0,1,0,1,0,0|2,0,0]=4 17235 B13R1.228 CSCC1CCCN1CC(C)(C)O 9b1b361f423e187e7d3d03db4d3e87bd [0,1,0,1,0,0|2,0,0]=4 17236 B13R1.281 CC1CCCCCN1CC(C)(C)C a7c15fa6f1cb0d3fc38de9668d74c905 [0,1,0,1,0,0|2,0,0]=4 17237 B13R1.281 CC1CCCCCN1CC(C)(C)F c05f84941aba39bf7bd539dd9a3471e9 [0,1,0,1,0,0|2,0,0]=4 17238 B13R1.281 CC1CCCCCN1CC(C)(C)O 4803ec779a3afe9967b680c8e9eed288 [0,1,0,1,0,0|1,0,0]=3 17239 B13R1.281 CC1CCCCCN1CC(C)(F)F bbcae1e468dc1f0380979346722298da [0,1,0,1,0,0|2,0,0]=4 17240 B13R1.281 CC1CCOCCN1CC(C)(C)O 2855cc43da041d50438682debab6ff3d [0,1,0,1,0,0|2,0,0]=4 17241 B13R1.281 CC1CCSCCN1CC(C)(C)O 7c375d5c84604a2146cef90bcc01b069 [0,1,0,1,0,0|2,0,0]=4 17242 B13R1.281 CC1COCCCN1CC(C)(C)O fa4f8326fed2b646089c06e7f4335f64 [0,1,0,1,0,0|2,0,0]=4 17243 B13R1.286 CC(C)(O)CCCOC[C@@H]1C[C@@H]1F 07549e5b42678db9d476104f1b112443 [0,1,0,1,0,0|2,0,0]=4 17244 B13R1.286 CC(C)(O)CCCOC[C@@H]1C[C@H]1F f16af298b4319cc0e82b8870d5e24a4a [0,1,0,1,0,0|2,0,0]=4 17245 B13R1.286 CC(C)(O)CCCOC[C@H]1C[C@@H]1F e243f67201c49995659ac8cef35fabd3 [0,1,0,1,0,0|2,0,0]=4 17246 B13R1.286 CC(C)(O)CCCOC[C@H]1C[C@H]1F 550c8465145489544a7b91376b25c421 [0,1,0,1,0,0|2,0,0]=4 17247 B13R1.286 CC1CC1COCCCC(C)(C)O 7b925d7af2582c734282826bdf8f3dc4 [0,1,0,1,0,0|1,0,0]=3 17248 B13R1.286 CC1CC1COCCCC(C)(F)F c5489447ed9c944225aa16a0a017393a [0,1,0,1,0,0|2,0,0]=4 17249 B13R1.286 C[C@@H]1C[C@H]1COCCCC(C)(C)O 35cd08f774ccbb0402701e96470051eb [0,1,0,1,0,0|1,0,0]=3 17250 B13R1.286 C[C@@H]1C[C@H]1COCCCC(C)(F)F 766e6bfe3ed5cb97a3c2b854e49b4751 [0,1,0,1,0,0|2,0,0]=4 17251 B13R1.286 C[C@H]1C[C@@H]1COCCCC(C)(C)O 892edd9a06a08690cb7efa293455eecd [0,1,0,1,0,0|1,0,0]=3 17252 B13R1.286 C[C@H]1C[C@@H]1COCCCC(C)(F)F 5f15a9091c9cb9ce95a95df06bda8eda [0,1,0,1,0,0|2,0,0]=4 17253 B13R1.286 C[C@H]1C[C@H]1COCCCC(C)(C)O aa96f44fe46b25c1919136d9d8675e38 [0,1,0,1,0,0|1,0,0]=3 17254 B13R1.286 C[C@H]1C[C@H]1COCCCC(C)(F)F afb2a239f4fc911e5c64118fd5d1b679 [0,1,0,1,0,0|2,0,0]=4 17255 B13R1.381 CCNC1CCCCC1C(C)(C)C 109c58a2da27551aea32764be5942d0d [0,1,0,1,0,0|2,0,0]=4 17256 B13R1.381 CCOC1CCCCC1C(C)(C)C 2b3c2b83de82f8021c465ff7037f74d1 [0,1,0,1,0,0|2,0,0]=4 17257 B13R1.580 CC(C)(O)C1CCCN1CCCF b006e87af38d80c60ec402fade764d7a [0,1,0,1,0,0|2,0,0]=4 17258 B13R1.580 CC(C)(O)C1CCCN1CCCO d509f85d1fe39dfa0b18f7806b708ea6 [0,1,0,1,0,0|2,0,0]=4 17259 B13R1.580 CC(C)(O)C1CCCN1CCCS 4174998fd4c68a7c00c9d6cae0448be4 [0,1,0,1,0,0|2,0,0]=4 17260 B13R1.580 CC(C)(O)[C@@H]1CCCN1CCCF 593011f2349827913bb0fe590e4aad3d [0,1,0,1,0,0|2,0,0]=4 17261 B13R1.580 CC(C)(O)[C@@H]1CCCN1CCCO 5bb55347ed03037e2a1dc4cee5105f2b [0,1,0,1,0,0|2,0,0]=4 17262 B13R1.580 CC(C)(O)[C@@H]1CCCN1CCCS 517a200265f0e535370054d601a1d0d8 [0,1,0,1,0,0|2,0,0]=4 17263 B13R1.580 CC(C)(O)[C@H]1CCCN1CCCF 33b8d19b0e1ec4bf316ef57ec731b038 [0,1,0,1,0,0|2,0,0]=4 17264 B13R1.580 CC(C)(O)[C@H]1CCCN1CCCO 94c268622456ffd98b663d457e2dcbe0 [0,1,0,1,0,0|2,0,0]=4 17265 B13R1.580 CC(C)(O)[C@H]1CCCN1CCCS eec3575b6863b36cb3d1c99ebf12bdf3 [0,1,0,1,0,0|2,0,0]=4 17266 B13R1.580 CCCCN1CCCC1C(C)(C)O 189f2095fdec5aee4f7a81ffc0d6966f [0,1,0,1,0,0|1,0,0]=3 17267 B13R1.580 CCCCN1CCC[C@@H]1C(C)(C)O 25a1fb4014817a37a9b743089b58a38f [0,1,0,1,0,0|1,0,0]=3 17268 B13R1.580 CCCCN1CCC[C@H]1C(C)(C)O 88f4064faa6734b3afddd303e0654e21 [0,1,0,1,0,0|1,0,0]=3 17269 B13R1.580 CCOCN1CCCC1C(C)(C)O a709a6f6df0adaae45505547b2f65936 [0,1,0,1,0,0|2,0,0]=4 17270 B13R1.580 CCOCN1CCC[C@@H]1C(C)(C)O 9d6d64af404b93eefd0d0db74ee6e05b [0,1,0,1,0,0|2,0,0]=4 17271 B13R1.580 CCOCN1CCC[C@H]1C(C)(C)O eccdede08d45e65604f5dc6da774795f [0,1,0,1,0,0|2,0,0]=4 17272 B13R1.580 COCCN1CCCC1C(C)(C)O cc75d4bc50e83bc1ab06a6b630bfeb2b [0,1,0,1,0,0|2,0,0]=4 17273 B13R1.580 COCCN1CCC[C@@H]1C(C)(C)O 5dc2483d6fc0d6076c2b8c6f3eae5821 [0,1,0,1,0,0|2,0,0]=4 17274 B13R1.580 COCCN1CCC[C@H]1C(C)(C)O 200eea95912992e9648b83f53b4edeaf [0,1,0,1,0,0|2,0,0]=4 17275 B13R1.580 CSCCN1CCCC1C(C)(C)O 43b7b36a90dd086dfdc6fbc4d60f04cf [0,1,0,1,0,0|2,0,0]=4 17276 B13R1.580 CSCCN1CCC[C@@H]1C(C)(C)O c6ec204b3896c0ddc5de7129698a88d9 [0,1,0,1,0,0|2,0,0]=4 17277 B13R1.580 CSCCN1CCC[C@H]1C(C)(C)O 508da91fc6b4c634385d42808d27a58d [0,1,0,1,0,0|2,0,0]=4 17278 B13R1.605 CC(C)(O)CCCN1CCC1CO 99b390857d15f6aefb1e616e2c968885 [0,1,0,1,0,0|2,0,0]=4 17279 B13R1.605 CC(C)(O)CCCN1CC[C@@H]1CO 6a4c39d30e955a65fb5091a023ef4ee5 [0,1,0,1,0,0|2,0,0]=4 17280 B13R1.605 CC(C)(O)CCCN1CC[C@H]1CO ccd41c049dccdbad48b156cc887a3361 [0,1,0,1,0,0|2,0,0]=4 17281 B13R1.605 CCC1CCN1CCCC(C)(C)O 3bf3994f5f469564f87980b59ba89041 [0,1,0,1,0,0|1,0,0]=3 17282 B13R1.605 CCC1CCN1CCCC(C)(F)F d1b4d3310f0a061321b2986f3d377fb6 [0,1,0,1,0,0|2,0,0]=4 17283 B13R1.605 COC1CCC1COCC(C)(C)O cf48ebc503de48d986babb664ca7279d [0,1,0,1,0,0|2,0,0]=4 17284 B13R1.605 COC1CCC1NCCC(C)(C)O e2f0e0d46ff85d47f450d3c6d6bb7749 [0,1,0,1,0,0|2,0,0]=4 17285 B13R1.605 CO[C@@H]1CC[C@@H]1COCC(C)(C)O 4ff904ee211a476a9fcd06020207bc0b [0,1,0,1,0,0|2,0,0]=4 17286 B13R1.605 CO[C@@H]1CC[C@@H]1NCCC(C)(C)O 6a9d2e1802e6f3bfd9ad6e574b34ea88 [0,1,0,1,0,0|2,0,0]=4 17287 B13R1.605 CO[C@@H]1CC[C@H]1COCC(C)(C)O 13f157f83473c0e60727d12541f6d0ea [0,1,0,1,0,0|2,0,0]=4 17288 B13R1.605 CO[C@@H]1CC[C@H]1NCCC(C)(C)O 5b4e625fda0d6c1c136dafee060090bd [0,1,0,1,0,0|2,0,0]=4 17289 B13R1.605 CO[C@H]1CC[C@@H]1NCCC(C)(C)O 7c0e8c8a4b388058e29f4abd930773e3 [0,1,0,1,0,0|2,0,0]=4 17290 B13R1.605 CO[C@H]1CC[C@H]1NCCC(C)(C)O 7d45301a834c4997f1cbf6d099368882 [0,1,0,1,0,0|2,0,0]=4 17291 B13R1.622 CC(C)(O)CN1CCCCC1CO aae3d89d7f53661999834e26c1a9fe9f [0,1,0,1,0,0|2,0,0]=4 17292 B13R1.622 CC(C)(O)CN1CCCC[C@@H]1CO e12d1a159e9b7e788b7c90b1f95b4917 [0,1,0,1,0,0|2,0,0]=4 17293 B13R1.622 CC(C)(O)CN1CCCC[C@H]1CO c9082e786e01f1f51e6d1ac48d06628f [0,1,0,1,0,0|2,0,0]=4 17294 B13R1.622 CCC1CCCCN1CC(C)(C)C f9b2b664ebcef08ef62d504b5443ed17 [0,1,0,1,0,0|2,0,0]=4 17295 B13R1.622 CCC1CCCCN1CC(C)(C)F 091bc09ba97d43d39bbb3291561d1eff [0,1,0,1,0,0|2,0,0]=4 17296 B13R1.622 CCC1CCCCN1CC(C)(C)O e78dcd7909bb4d3bc8a0a7d38b4ce07b [0,1,0,1,0,0|1,0,0]=3 17297 B13R1.622 CCC1CCCCN1CC(C)(F)F 4cf37bbc1b426c988010ac358d82ce0e [0,1,0,1,0,0|2,0,0]=4 17298 B13R1.622 CCC1COCCN1CC(C)(C)O 451492505841e6a7c4289739aaa3ce85 [0,1,0,1,0,0|2,0,0]=4 17299 B13R1.622 CCN1CCCCC1CC(C)(C)C 7a5b38ac8b6bc479003906f0a4aa0e33 [0,1,0,1,0,0|2,0,0]=4 17300 B13R1.622 CC[C@@H]1CCCCN1CC(C)(C)C e9c1c5a651afd92a47b2dc39d911de8a [0,1,0,1,0,0|2,0,0]=4 17301 B13R1.622 CC[C@@H]1CCCCN1CC(C)(C)F 26ec3b71999695a2f08b0cb88115fdc4 [0,1,0,1,0,0|2,0,0]=4 17302 B13R1.622 CC[C@@H]1CCCCN1CC(C)(C)O 2e4b7c784ada500f1709f40729f21d78 [0,1,0,1,0,0|1,0,0]=3 17303 B13R1.622 CC[C@@H]1CCCCN1CC(C)(F)F bbef62ca877bc3dfd1bbfe04fa6d7393 [0,1,0,1,0,0|2,0,0]=4 17304 B13R1.622 CC[C@@H]1COCCN1CC(C)(C)O 7c5388a38335e21fa3b3179cdc0abee0 [0,1,0,1,0,0|2,0,0]=4 17305 B13R1.622 CC[C@H]1CCCCN1CC(C)(C)C ce1bc1734f4a024447dc47d8e7fcab38 [0,1,0,1,0,0|2,0,0]=4 17306 B13R1.622 CC[C@H]1CCCCN1CC(C)(C)F 877fa8ac3a1d1315d24f7c8041c54912 [0,1,0,1,0,0|2,0,0]=4 17307 B13R1.622 CC[C@H]1CCCCN1CC(C)(C)O a5756b7fce6b64f29238a45aca58e463 [0,1,0,1,0,0|1,0,0]=3 17308 B13R1.622 CC[C@H]1CCCCN1CC(C)(F)F bbdd9f383d2577d6c7ea17ff278c11b6 [0,1,0,1,0,0|2,0,0]=4 17309 B13R1.622 CC[C@H]1COCCN1CC(C)(C)O b9e78ce1da6274ab36e995633df2f5f8 [0,1,0,1,0,0|2,0,0]=4 17310 B13R1.625 CC(C)(O)CCCN[C@@H]1C[C@H]1CO b444bc585231b9e4ac88ab98459db2f4 [0,1,0,1,0,0|2,0,0]=4 17311 B13R1.625 CC(C)(O)CCCN[C@H]1C[C@@H]1CO 342dfd2d16653c2f2439fa304d6923cb [0,1,0,1,0,0|2,0,0]=4 17312 B13R1.625 CC(C)(O)CCCN[C@H]1C[C@H]1CO 5ad053a5c9e53370526a38a2dd44f444 [0,1,0,1,0,0|2,0,0]=4 17313 B13R1.625 CC(C)(O)CCNCC1CC1CO d36ebed5eea8de6f5c93c8354ecd3cba [0,1,0,1,0,0|2,0,0]=4 17314 B13R1.625 CO[C@H]1C[C@H]1NCCCC(C)(C)O a26b21e9ee8955b1dc8c467e4f40306b [0,1,0,1,0,0|2,0,0]=4 17315 B13R1.2854 CCCCO[C@H]1CC[C@H]1C(C)(C)C 2d141e01a02876014081c90a5b7fe21a [0,1,0,1,0,0|2,0,0]=4 17316 B13R1.2904 CC(C)(Br)COCCC1CCCC1 4ad654b0bad2687c87580bca416a4252 [0,1,0,1,0,0|2,0,0]=4 17317 B13R1.2904 CC(C)(C)CCCNC1CCCC1 0f7b47ac2b291477cad505633a90a945 [0,1,0,1,0,0|2,0,0]=4 17318 B13R1.2904 CC(C)(C)CCCOC1CCCC1 44e6ef28d8fee2633a95431927cc8197 [0,1,0,1,0,0|2,0,0]=4 17319 B13R1.2904 CC(C)(C)CCNCC1CCCC1 f1898d5d7af668c9682fb12ddc071882 [0,1,0,1,0,0|2,0,0]=4 17320 B13R1.2904 CC(C)(C)CCOCC1CCCC1 107f08f79723c90bf00d0c59185098ee [0,1,0,1,0,0|2,0,0]=4 17321 B13R1.2904 CC(C)(C)CNCCC1CCCC1 07aff2a316967297282ef9ce0236be4d [0,1,0,1,0,0|2,0,0]=4 17322 B13R1.2904 CC(C)(C)COCCC1CCCC1 cb04a28b45bb59179b8f9f3eb438ab1d [0,1,0,1,0,0|2,0,0]=4 17323 B13R1.2904 CC(C)(C)NCCCC1CCCC1 57b6c4b39df02f5fcc188afbc8928a18 [0,1,0,1,0,0|2,0,0]=4 17324 B13R1.2904 CC(C)(F)CCNCC1CCCC1 bf410b39719d652b5b23516dce97602d [0,1,0,1,0,0|2,0,0]=4 17325 B13R1.2904 CC(C)(F)CNCCC1CCCC1 cda0f67047de7d9b80f0db5539f95e10 [0,1,0,1,0,0|2,0,0]=4 17326 B13R1.2904 CC(C)(F)COCCC1CCCC1 bb2a346e0ecbb4ea7d3d1016a2681fdd [0,1,0,1,0,0|2,0,0]=4 17327 B13R1.2904 CC(C)(O)CCCNC1CCCC1 6fef8334b6dfc09e8782c904fd117d50 [0,1,0,1,0,0|1,0,0]=3 17328 B13R1.2904 CC(C)(O)CCCNC1CCOC1 83d3ca72277baab7019cc358d6df423b [0,1,0,1,0,0|2,0,0]=4 17329 B13R1.2904 CC(C)(O)CCCNC1CCSC1 d3394793a62ef485e215764469c141c2 [0,1,0,1,0,0|2,0,0]=4 17330 B13R1.2904 CC(C)(O)CCCN[C@@H]1CCOC1 92d70036209d75ab16dd49198c70f5e7 [0,1,0,1,0,0|2,0,0]=4 17331 B13R1.2904 CC(C)(O)CCCN[C@H]1CCOC1 f2407b39c9a2eb59f145bb203b591073 [0,1,0,1,0,0|2,0,0]=4 17332 B13R1.2904 CC(C)(O)CCCOC1CCCC1 bd396b4d4e22d72f8c9f8f7c17fd04ee [0,1,0,1,0,0|1,0,0]=3 17333 B13R1.2904 CC(C)(O)CCCOC1CCCO1 6b1981c21fbc49c687a853cf37902241 [0,1,0,1,0,0|2,0,0]=4 17334 B13R1.2904 CC(C)(O)CCCOC1CCOC1 332f5eed2263a98e76037f6ba12dce45 [0,1,0,1,0,0|2,0,0]=4 17335 B13R1.2904 CC(C)(O)CCCOC1CCSC1 51b546b3299700fd7ddf8ac78467b4a9 [0,1,0,1,0,0|2,0,0]=4 17336 B13R1.2904 CC(C)(O)CCCO[C@@H]1CCOC1 d5ffc2307ca867c061a2f2009c249b1b [0,1,0,1,0,0|2,0,0]=4 17337 B13R1.2904 CC(C)(O)CCCO[C@@H]1CCSC1 0c1ea713ff4599832e26512b44d42be9 [0,1,0,1,0,0|2,0,0]=4 17338 B13R1.2904 CC(C)(O)CCCO[C@H]1CCOC1 676cde4439b14552b537034220a64963 [0,1,0,1,0,0|2,0,0]=4 17339 B13R1.2904 CC(C)(O)CCCO[C@H]1CCSC1 cd51d539b8784afc4ea693103603184a [0,1,0,1,0,0|2,0,0]=4 17340 B13R1.2904 CC(C)(O)CCNCC1CCCC1 0fe65d98e115e71e19f52f75a0ee93d0 [0,1,0,1,0,0|1,0,0]=3 17341 B13R1.2904 CC(C)(O)CCNCC1CCCO1 7d875b647369732fc42e3fc5949028db [0,1,0,1,0,0|2,0,0]=4 17342 B13R1.2904 CC(C)(O)CCNCC1CCOC1 a3fe52e1b05ed0dafb1314527a0b9975 [0,1,0,1,0,0|2,0,0]=4 17343 B13R1.2904 CC(C)(O)CCNC[C@@H]1CCCO1 99ddd8d09d87dbb2527955b09a8b6390 [0,1,0,1,0,0|2,0,0]=4 17344 B13R1.2904 CC(C)(O)CCNC[C@@H]1CCOC1 45c40090c50c2231e509dd0b44541e6f [0,1,0,1,0,0|2,0,0]=4 17345 B13R1.2904 CC(C)(O)CCNC[C@H]1CCCO1 50191421c1295bc8e23447fac63fc96a [0,1,0,1,0,0|2,0,0]=4 17346 B13R1.2904 CC(C)(O)CCNC[C@H]1CCOC1 e85a04efcab9aa4e1637c1ea779fb2bd [0,1,0,1,0,0|2,0,0]=4 17347 B13R1.2904 CC(C)(O)CCOCC1CCCC1 36126f1187f6fb056d70e89d5211611e [0,1,0,1,0,0|1,0,0]=3 17348 B13R1.2904 CC(C)(O)CCOCC1CCCO1 c3e8a761d4ba483ebd3a6c777671105c [0,1,0,1,0,0|2,0,0]=4 17349 B13R1.2904 CC(C)(O)CCOCC1CCCS1 9c9e91c02ee18867a3f68123dd155242 [0,1,0,1,0,0|2,0,0]=4 17350 B13R1.2904 CC(C)(O)CCOCC1CCOC1 13b82648d12e51f31afbb65efa18ac17 [0,1,0,1,0,0|2,0,0]=4 17351 B13R1.2904 CC(C)(O)CCOCN1CCCC1 993f3b491b606e32c0ccca70ae2be2c5 [0,1,0,1,0,0|2,0,0]=4 17352 B13R1.2904 CC(C)(O)CCOC[C@@H]1CCCO1 4f8d1bec165dbd34d32780e39de9563f [0,1,0,1,0,0|2,0,0]=4 17353 B13R1.2904 CC(C)(O)CCOC[C@@H]1CCOC1 6ff3babe6ce3499aa3240d0986b345a2 [0,1,0,1,0,0|2,0,0]=4 17354 B13R1.2904 CC(C)(O)CCOC[C@H]1CCCO1 e0cf22ccec657d78e3ec8ad4a26670e6 [0,1,0,1,0,0|2,0,0]=4 17355 B13R1.2904 CC(C)(O)CCOC[C@H]1CCOC1 f1d84e8f08244ea67a6ca9698610be9f [0,1,0,1,0,0|2,0,0]=4 17356 B13R1.2904 CC(C)(O)CNCCC1CCCC1 e02438c4e53b6096b240bcbf7a173cef [0,1,0,1,0,0|1,0,0]=3 17357 B13R1.2904 CC(C)(O)CNCCC1CCCO1 6488dc3748daccacc36188a7f1432277 [0,1,0,1,0,0|2,0,0]=4 17358 B13R1.2904 CC(C)(O)CNCCC1CCOC1 86fac94bf308de5f34b6153fe917d2af [0,1,0,1,0,0|2,0,0]=4 17359 B13R1.2904 CC(C)(O)CNCCN1CCCC1 4061e46a496a7fa7260c48e601da1468 [0,1,0,1,0,0|2,0,0]=4 17360 B13R1.2904 CC(C)(O)COCCC1CCCC1 ddc756b35de1912120e51155cb97e13c [0,1,0,1,0,0|1,0,0]=3 17361 B13R1.2904 CC(C)(O)COCCC1CCCO1 0fd1d30076d949967d283a6e60d66254 [0,1,0,1,0,0|2,0,0]=4 17362 B13R1.2904 CC(C)(O)COCCC1CCOC1 d7fc629fa32ece2734fb26c5fd1b939f [0,1,0,1,0,0|2,0,0]=4 17363 B13R1.2904 CC(C)(O)COCCN1CCCC1 4332a74f5e6c46329a78a00e7f445829 [0,1,0,1,0,0|2,0,0]=4 17364 B13R1.2904 CC(C)(S)CCOCC1CCCC1 ceddee7072f01111e456bfc880819122 [0,1,0,1,0,0|1,1,0]=4 17365 B13R1.2904 CC(C)(S)COCCC1CCCC1 4d3d97eae762cb149eb1d094e8174da5 [0,1,0,1,0,0|1,1,0]=4 17366 B13R1.2904 CC(F)(F)CCCNC1CCCC1 2999874609a21407e2c6b5e0ca28b3a6 [0,1,0,1,0,0|2,0,0]=4 17367 B13R1.2904 CC(F)(F)CCCOC1CCCC1 0216c3b405809139630e599d9ed26062 [0,1,0,1,0,0|2,0,0]=4 17368 B13R1.2904 CC(F)(F)CCNCC1CCCC1 9f358899ea80b8ec90547c312f7b3bda [0,1,0,1,0,0|2,0,0]=4 17369 B13R1.2904 CC(F)(F)CCOCC1CCCC1 a9f789094434703ba73294c75f3f3026 [0,1,0,1,0,0|2,0,0]=4 17370 B13R1.2904 CC(F)(F)CNCCC1CCCC1 e6018116b91dcbd719d5c7af992b58b6 [0,1,0,1,0,0|2,0,0]=4 17371 B13R1.2904 CC(F)(F)COCCC1CCCC1 6942f1dd86f784db70e2ef174126e6c1 [0,1,0,1,0,0|2,0,0]=4 17372 B13R1.2905 CC(C)(C)CCCCOC1CCC1 d7335844df438e4fc3b055ed16279b33 [0,1,0,1,0,0|2,0,0]=4 17373 B13R1.2905 CC(C)(C)CCCNCC1CCC1 3699df88b049e068c1465f68e226c117 [0,1,0,1,0,0|2,0,0]=4 17374 B13R1.2905 CC(C)(C)CCCOCC1CCC1 bde8278dd758b466903aa274b3775ff2 [0,1,0,1,0,0|2,0,0]=4 17375 B13R1.2905 CC(C)(C)CCNCCC1CCC1 a75df9d8a0b0420b0074b22e73a5806a [0,1,0,1,0,0|2,0,0]=4 17376 B13R1.2905 CC(C)(C)CCOCCC1CCC1 5c58906f6d5b08249b2e6b827e3c1d82 [0,1,0,1,0,0|2,0,0]=4 17377 B13R1.2905 CC(C)(C)COCCCC1CCC1 2825746fba9d6fc8c9c51b741e425f46 [0,1,0,1,0,0|2,0,0]=4 17378 B13R1.2905 CC(C)(F)CCNCCC1CCC1 2cc71cdb3da8682b07983d75c81d53c1 [0,1,0,1,0,0|2,0,0]=4 17379 B13R1.2905 CC(C)(F)COCCCC1CCC1 0542b35a338ded0a0d4249a2ef72e013 [0,1,0,1,0,0|2,0,0]=4 17380 B13R1.2905 CC(C)(O)CCCCCN1CCC1 485c6affa2836aab92bbb9d8a5740dd2 [0,1,0,1,0,0|1,0,0]=3 17381 B13R1.2905 CC(C)(O)CCCNCC1CCC1 10e7a432b981f9c90f416aaa60fef297 [0,1,0,1,0,0|1,0,0]=3 17382 B13R1.2905 CC(C)(O)CCCNCC1CCO1 4cc228487f8da18c169837fec935fc24 [0,1,0,1,0,0|2,0,0]=4 17383 B13R1.2905 CC(C)(O)CCCNCC1COC1 9e1f70c25827e3cd2f5ee9da166fd51d [0,1,0,1,0,0|2,0,0]=4 17384 B13R1.2905 CC(C)(O)CCCNC[C@@H]1CCO1 aa5b1ad56beff02126f923b566129a46 [0,1,0,1,0,0|2,0,0]=4 17385 B13R1.2905 CC(C)(O)CCCNC[C@H]1CCO1 78b594c41c5bcaeb0006782ee4f3fbe6 [0,1,0,1,0,0|2,0,0]=4 17386 B13R1.2905 CC(C)(O)CCCOCC1CCC1 64655c4cc941d34996ce408b0a4d931d [0,1,0,1,0,0|1,0,0]=3 17387 B13R1.2905 CC(C)(O)CCCOCC1CCO1 fc4ba108f566eb1426e752b8bc4d5d06 [0,1,0,1,0,0|2,0,0]=4 17388 B13R1.2905 CC(C)(O)CCCOCC1COC1 aac6f96e99e2d939599c5c6ea8b7009d [0,1,0,1,0,0|2,0,0]=4 17389 B13R1.2905 CC(C)(O)CCCOCC1CSC1 c5f1a48c241da9f5cba366139e036852 [0,1,0,1,0,0|2,0,0]=4 17390 B13R1.2905 CC(C)(O)CCCOC[C@@H]1CCO1 fe81088f1f0fb1db2187d9f7d8e013f8 [0,1,0,1,0,0|2,0,0]=4 17391 B13R1.2905 CC(C)(O)CCCOC[C@H]1CCO1 8943f374cb7ad3eb4bb5bdb497b7bd91 [0,1,0,1,0,0|2,0,0]=4 17392 B13R1.2905 CC(C)(O)CCNCCC1CCC1 085aba4e44bce5f0f4ce09f00653145e [0,1,0,1,0,0|1,0,0]=3 17393 B13R1.2905 CC(C)(O)CCNCCC1CCO1 d45e6f80a340c74e32825f3127acff1e [0,1,0,1,0,0|2,0,0]=4 17394 B13R1.2905 CC(C)(O)CCNCCC1COC1 7740a21ea7ec40f7ad30459fe52d738f [0,1,0,1,0,0|2,0,0]=4 17395 B13R1.2905 CC(C)(O)CCNCCN1CCC1 c24288332500f2baa0cdc2e1c9830fc3 [0,1,0,1,0,0|2,0,0]=4 17396 B13R1.2905 CC(C)(O)CCNCC[C@@H]1CCO1 e71ff65e372b6c4f34731f9fa8b86dea [0,1,0,1,0,0|2,0,0]=4 17397 B13R1.2905 CC(C)(O)CCOCCC1CCC1 4afe7d7ce986644f5783be499758607f [0,1,0,1,0,0|1,0,0]=3 17398 B13R1.2905 CC(C)(O)CCOCCC1CCO1 123c262ced0a82550526e3239ea75b40 [0,1,0,1,0,0|2,0,0]=4 17399 B13R1.2905 CC(C)(O)CCOCCC1COC1 cc1e9a836678abc9e12bdbb1ba995950 [0,1,0,1,0,0|2,0,0]=4 17400 B13R1.2905 CC(C)(O)CCOCCN1CCC1 4abce4f7472dfdb143d5fbc65673c003 [0,1,0,1,0,0|2,0,0]=4 17401 B13R1.2905 CC(C)(O)CCOCC[C@@H]1CCO1 656007fc8efbcd49c650bd0b99a3d691 [0,1,0,1,0,0|2,0,0]=4 17402 B13R1.2905 CC(C)(O)CCOCC[C@H]1CCO1 16531029b060b6e546e2c06a282b7f1d [0,1,0,1,0,0|2,0,0]=4 17403 B13R1.2905 CC(C)(O)CNCCCN1CCC1 b1fa5769cb341f97ba1f286e2ec4dcdc [0,1,0,1,0,0|2,0,0]=4 17404 B13R1.2905 CC(C)(O)CNCCOC1CCC1 67311ae07ff06f854b382a8c7ba9c05f [0,1,0,1,0,0|2,0,0]=4 17405 B13R1.2905 CC(C)(O)COCCCC1CCC1 2cbcae2926ab7e42e6ca080d4801b6bf [0,1,0,1,0,0|1,0,0]=3 17406 B13R1.2905 CC(C)(O)COCCCC1COC1 91025c8920689ed5ed66071f63d1d0fa [0,1,0,1,0,0|2,0,0]=4 17407 B13R1.2905 CC(C)(O)COCCCN1CCC1 f3c26e7c1c88c81e1ab9c5f6f5de3794 [0,1,0,1,0,0|2,0,0]=4 17408 B13R1.2905 CC(C)(O)COCCOC1CCC1 65a472e23cc7f7b463a13ab982c7b80a [0,1,0,1,0,0|2,0,0]=4 17409 B13R1.2905 CC(C)(S)CCOCCC1CCC1 478f92c15691b91a680142db7ad00330 [0,1,0,1,0,0|1,1,0]=4 17410 B13R1.2905 CC(F)(F)CCCNCC1CCC1 1791e72071d9662a024ea83c777ff48d [0,1,0,1,0,0|2,0,0]=4 17411 B13R1.2905 CC(F)(F)CCCOCC1CCC1 ed2561964da6dd620776900ffc4c1b67 [0,1,0,1,0,0|2,0,0]=4 17412 B13R1.2905 CC(F)(F)CCNCCC1CCC1 b80fbade1dcec113bea8128526821dd2 [0,1,0,1,0,0|2,0,0]=4 17413 B13R1.2905 CC(F)(F)CCOCCC1CCC1 a3487b40c840a282f05fde6abbec41e6 [0,1,0,1,0,0|2,0,0]=4 17414 B13R1.2905 CC(F)(F)COCCCC1CCC1 42f630d3b1a60301cd7d12d1f711fca1 [0,1,0,1,0,0|2,0,0]=4 17415 B13R1.2938 CCCCCCCCNC1(CC1)C 0924c0c39e559835205016e559704109 [0,1,0,1,0,0|2,0,0]=4 17416 B13R1.2938 CCCCCCCNCC1(CC1)C 8feffc4a35efb6ad0ddfe5dc899519b1 [0,1,0,1,0,0|2,0,0]=4 17417 B13R1.2938 CCCCCCCNCC1(CC1)F f9e10acaf0fdec3e63936cb521a7fcaf [0,1,0,1,0,0|2,0,0]=4 17418 B13R1.2938 CCCCCCCNCC1(CC1)O 2ea347897794bf31c214436866349625 [0,1,0,1,0,0|1,0,0]=3 17419 B13R1.2938 CCCCCCCOCC1(CC1)Br 1f248d2fc461780498011dd056d37247 [0,1,0,1,0,0|2,0,0]=4 17420 B13R1.2938 CCCCCCCOCC1(CC1)C 0db3ce70d21a73664959a134b3ff8d1e [0,1,0,1,0,0|2,0,0]=4 17421 B13R1.2938 CCCCCCCOCC1(CC1)Cl 1a1fdb71c11c65629363603e18a8474e [0,1,0,1,0,0|2,0,0]=4 17422 B13R1.2938 CCCCCCCOCC1(CC1)F 3a3b7a191f3646435145e2ae37fc32d1 [0,1,0,1,0,0|2,0,0]=4 17423 B13R1.2938 CCCCCCNCCC1(CC1)O 1fb926a7ed5531ef4c29f4988a6fbe85 [0,1,0,1,0,0|1,0,0]=3 17424 B13R1.2938 CCCCCCOCCC1(CC1)C 4828bbaf04e052ea1dc299e80035b31d [0,1,0,1,0,0|2,0,0]=4 17425 B13R1.2938 CCCCOCCNCC1(CC1)O 79a1fb9f54fbe4525504a755a70c4a5d [0,1,0,1,0,0|2,0,0]=4 17426 B13R1.2938 CCCCOCNCCC1(CC1)O c8873a897b9bff42650b493cf6ec8d68 [0,1,0,1,0,0|2,0,0]=4 17427 B13R1.2938 CCCOCCCNCC1(CC1)O 7774fdcc94ad3ee09eabc03f5da6476f [0,1,0,1,0,0|2,0,0]=4 17428 B13R1.2938 CCCOCCNCCC1(CC1)O 16d2199de91b117358de96b02a4331ec [0,1,0,1,0,0|2,0,0]=4 17429 B13R1.2938 CCOCCCNCCC1(CC1)O 208f962511f48703f88dc67c416226d3 [0,1,0,1,0,0|2,0,0]=4 17430 B13R1.2938 CCSCCCNCCC1(CC1)O 6d138517d4dc258e43f39d32862641c4 [0,1,0,1,0,0|2,0,0]=4 17431 B13R1.2938 COCCCCCNCC1(CC1)O ca627dad00187f64c5c626ed0d70f3ae [0,1,0,1,0,0|2,0,0]=4 17432 B13R1.2938 COCCCCNCCC1(CC1)O bd488fbefac28d914d6e9516f2d97753 [0,1,0,1,0,0|2,0,0]=4 17433 B13R1.2938 OC1(CC1)CCNCCCCCF 7a5fe4fb287adeb26c186a63b7a452c7 [0,1,0,1,0,0|2,0,0]=4 17434 B13R1.2938 OC1(CC1)CNCCCCCCF b6956e1b2290fb9c6370f9f5fc4f346e [0,1,0,1,0,0|2,0,0]=4 17435 B13R1.2938 OCCCCCCNCC1(CC1)O a46cf483bd23acbff0dd5c6cfb3847a3 [0,1,0,1,0,0|2,0,0]=4 17436 B13R1.2938 OCCCCCNCCC1(CC1)O c39e6609699c828ec511a6505ad6ff74 [0,1,0,1,0,0|2,0,0]=4 17437 B13R1.3071 CC1(CCCC(C1)NCCCF)O 168529ae5e208036c57406bcf2b22728 [0,1,0,1,0,0|2,0,0]=4 17438 B13R1.3071 CC1(CCCC(C1)NCCCO)O 9d479f5205e06653d1be1b00d8dc5e29 [0,1,0,1,0,0|2,0,0]=4 17439 B13R1.3071 CC1(CCCC(C1)NCCCS)O 0af3a42810f458c9a13e67b4c9961e05 [0,1,0,1,0,0|2,0,0]=4 17440 B13R1.3071 CC1(CCCC(O1)COCCF)C a1cfb7b23e01540c10cb238b3263165f [0,1,0,1,0,0|2,0,0]=4 17441 B13R1.3071 CC1(CCCC(O1)COCCS)C 56d8e333b277ed144593e4aabe25790b [0,1,0,1,0,0|2,0,0]=4 17442 B13R1.3071 CC1(CCCN(C1)CCCCF)O fe5af229664101dc9f9d7d092cfc5d16 [0,1,0,1,0,0|2,0,0]=4 17443 B13R1.3071 CC1(CCCN(C1)CCCCO)O 2bccd02b5d100ee9c532641f898c0c60 [0,1,0,1,0,0|2,0,0]=4 17444 B13R1.3071 CCCCCN1CCCC(C1)(C)C ef6ef957a3294ed4eb5b957d36545160 [0,1,0,1,0,0|2,0,0]=4 17445 B13R1.3071 CCCCCN1CCCC(C1)(C)O 8d841c4e66a1ffe62232c690148a903b [0,1,0,1,0,0|1,0,0]=3 17446 B13R1.3071 CCCCCN1CCCC(C1)(F)F dd9d041c6caa850ba0bd066ee5a251d7 [0,1,0,1,0,0|2,0,0]=4 17447 B13R1.3071 CCCCCN1CCC[C@@](C1)(C)O fde201061d5dfe8ae8ca9e38b5be560e [0,1,0,1,0,0|1,0,0]=3 17448 B13R1.3071 CCCCCN1CCC[C@](C1)(C)O 9d9df4bad60e419923fe6af4e76411d9 [0,1,0,1,0,0|1,0,0]=3 17449 B13R1.3071 CCCCNC1CCCC(C1)(C)C b05ba0b33c1c1353a3a38eccdbac13e2 [0,1,0,1,0,0|2,0,0]=4 17450 B13R1.3071 CCCCNC1CCCC(C1)(C)O 49bdefd7ea8ce824355bf2a65251f148 [0,1,0,1,0,0|1,0,0]=3 17451 B13R1.3071 CCCCNC1CCCC(C1)(F)F 93f88556f80f6b6a3c66ee86d98682c4 [0,1,0,1,0,0|2,0,0]=4 17452 B13R1.3071 CCCCN[C@@H]1CCCC(C1)(C)C 340a77c7f791fc7c0f26f1ae49300508 [0,1,0,1,0,0|2,0,0]=4 17453 B13R1.3071 CCCCN[C@@H]1CCC[C@@](C1)(C)O 69a480622693b323553707c878729fbe [0,1,0,1,0,0|1,0,0]=3 17454 B13R1.3071 CCCCN[C@@H]1CCC[C@](C1)(C)O 14bd1a8b0f492d28d096375f66439277 [0,1,0,1,0,0|1,0,0]=3 17455 B13R1.3071 CCCCN[C@H]1CCCC(C1)(C)C a34827105b3f9ddf560945f9c74491bb [0,1,0,1,0,0|2,0,0]=4 17456 B13R1.3071 CCCCOC1CCCC(C1)(C)C bd93c087a3012f62676cd13a395677a0 [0,1,0,1,0,0|2,0,0]=4 17457 B13R1.3071 CCCNCC1CCCC(C1)(F)F 65f3969b960dfaede20b8bc98d162fdf [0,1,0,1,0,0|2,0,0]=4 17458 B13R1.3071 CCCOCC1CCCC(C1)(F)F e32f7142eb898a9e196c8104b096cb0e [0,1,0,1,0,0|2,0,0]=4 17459 B13R1.3071 CCCOCC1CCCC(O1)(C)C 65159e56d0f48ca857c360c9fd71eff3 [0,1,0,1,0,0|1,0,0]=3 17460 B13R1.3071 CCCOCC1COCC(O1)(C)C c91598ad67eb9f0b56db474922267fcd [0,1,0,1,0,0|2,0,0]=4 17461 B13R1.3071 CCCOC[C@@H]1CCCC(C1)(F)F a66856fb10bb7c662143fb8f76b2a1bf [0,1,0,1,0,0|2,0,0]=4 17462 B13R1.3071 CCCOC[C@H]1CCCC(C1)(F)F 511205c40350aa4a6bb584c032229c99 [0,1,0,1,0,0|2,0,0]=4 17463 B13R1.3071 CCOCCN1CCCC(C1)(C)O eb47e4c0b82b832d3cd8afe30f7a58c3 [0,1,0,1,0,0|2,0,0]=4 17464 B13R1.3071 CCOCCN1CCC[C@@](C1)(C)O 88f1ff87bdb33816eee4092d0eeeced1 [0,1,0,1,0,0|2,0,0]=4 17465 B13R1.3071 CCOCCN1CCC[C@](C1)(C)O a869781751f98a771336e12d93bf6a62 [0,1,0,1,0,0|2,0,0]=4 17466 B13R1.3071 CCSCCN1CCCC(C1)(C)O 23046144755a1d3901287fa37e65103e [0,1,0,1,0,0|2,0,0]=4 17467 B13R1.3071 CCSCCN1CCC[C@@](C1)(C)O 7ab6ab56cd5df274992f42593d61d2be [0,1,0,1,0,0|2,0,0]=4 17468 B13R1.3071 CCSCCN1CCC[C@](C1)(C)O d11833fa9719f0813855f259bfc78a12 [0,1,0,1,0,0|2,0,0]=4 17469 B13R1.3071 COCCCN1CCCC(C1)(C)O 11e6ea16fe303c79ae09d15e77dee0a3 [0,1,0,1,0,0|2,0,0]=4 17470 B13R1.3071 COCCCN1CCC[C@@](C1)(C)O cfbc3034e04dd16c2397f8fe2224e46e [0,1,0,1,0,0|2,0,0]=4 17471 B13R1.3071 COCCCN1CCC[C@](C1)(C)O 4517de0bf316f359b305a9b82926000c [0,1,0,1,0,0|2,0,0]=4 17472 B13R1.3071 COCCNC1CCCC(C1)(C)O df9e85e780c3958f5a834117b032f30e [0,1,0,1,0,0|2,0,0]=4 17473 B13R1.3071 COCCN[C@@H]1CCC[C@@](C1)(C)O 13fdb0281e946eddfd29bfc4fff4845c [0,1,0,1,0,0|2,0,0]=4 17474 B13R1.3071 COCCN[C@@H]1CCC[C@](C1)(C)O 03e93edb7ceb0b2a5437017e07b21192 [0,1,0,1,0,0|2,0,0]=4 17475 B13R1.3071 COCOCC1CCCC(O1)(C)C b7296e7e88d3b39db8d5204ebe7a73d2 [0,1,0,1,0,0|2,0,0]=4 17476 B13R1.3071 CSCCCN1CCCC(C1)(C)O 3d06d6ca5676a70dec14fd6d7cce6bec [0,1,0,1,0,0|2,0,0]=4 17477 B13R1.3071 CSCCCN1CCC[C@@](C1)(C)O 5f0df9994483a14bec995b66f8c7ad1d [0,1,0,1,0,0|2,0,0]=4 17478 B13R1.3071 CSCCCN1CCC[C@](C1)(C)O 3400558c6042b6313454cdb88d46ab79 [0,1,0,1,0,0|2,0,0]=4 17479 B13R1.3071 CSCCNC1CCCC(C1)(C)O 5f0f80a1b187907924b560f9c14e48f5 [0,1,0,1,0,0|2,0,0]=4 17480 B13R1.3071 CSCCN[C@@H]1CCC[C@@](C1)(C)O 365f03b532f2549852b90dff07646b75 [0,1,0,1,0,0|2,0,0]=4 17481 B13R1.3071 CSCCN[C@@H]1CCC[C@](C1)(C)O 1f4fd257a9f851c0b1f3364095a8b04b [0,1,0,1,0,0|2,0,0]=4 17482 B13R1.3071 CSCOCC1CCCC(O1)(C)C 0a92d74eed2a28884956b47ccab4039d [0,1,0,1,0,0|2,0,0]=4 17483 B13R1.3071 C[C@@]1(CCCN(C1)CCCCF)O a467bd3a1ec8993e5605395103702d93 [0,1,0,1,0,0|2,0,0]=4 17484 B13R1.3071 C[C@@]1(CCCN(C1)CCCCO)O e26a8b56bc2689eff4341c6c4a8c5f62 [0,1,0,1,0,0|2,0,0]=4 17485 B13R1.3071 C[C@@]1(CCC[C@H](C1)NCCCF)O 93f366f7b1e3ca0e0ef1e7d3708bc6e8 [0,1,0,1,0,0|2,0,0]=4 17486 B13R1.3071 C[C@@]1(CCC[C@H](C1)NCCCO)O b87beb279f0582f840ffd0a2d388f283 [0,1,0,1,0,0|2,0,0]=4 17487 B13R1.3071 C[C@@]1(CCC[C@H](C1)NCCCS)O 9a1935e66dbc93c942fbccd481b3b6e8 [0,1,0,1,0,0|2,0,0]=4 17488 B13R1.3071 C[C@]1(CCCN(C1)CCCCF)O 94e1282eb922071a00fece35c4c848f8 [0,1,0,1,0,0|2,0,0]=4 17489 B13R1.3071 C[C@]1(CCCN(C1)CCCCO)O bfe5904c82269d5349e21e31b13897c9 [0,1,0,1,0,0|2,0,0]=4 17490 B13R1.3071 C[C@]1(CCC[C@H](C1)NCCCF)O 58c42c8e128674898a6acc2a84ea9a69 [0,1,0,1,0,0|2,0,0]=4 17491 B13R1.3071 C[C@]1(CCC[C@H](C1)NCCCO)O 1e9ba393e883e1d28fdd59e9ec321786 [0,1,0,1,0,0|2,0,0]=4 17492 B13R1.3071 C[C@]1(CCC[C@H](C1)NCCCS)O 94a9fc6429fe5d61d76cc2f17128a43c [0,1,0,1,0,0|2,0,0]=4 17493 B13R1.3441 CC1(CCC(O1)CNCCCF)C 6bf4cb938f43c616b2ee56668542b0df [0,1,0,1,0,0|2,0,0]=4 17494 B13R1.3441 CC1(CCC(O1)CNCCCO)C 43d9392f2f79f19800ccfc001774e9ef [0,1,0,1,0,0|2,0,0]=4 17495 B13R1.3441 CC1(CCC(O1)CNCCCS)C 72de08f88130d3e5db47aea014c3f902 [0,1,0,1,0,0|2,0,0]=4 17496 B13R1.3441 CC1(CCC(O1)COCCCF)C 81579192cf2891081816ffeecedad053 [0,1,0,1,0,0|2,0,0]=4 17497 B13R1.3441 CC1(CCC(O1)COCCCS)C 4bfa1f6055551b1eb435fc7057f18430 [0,1,0,1,0,0|2,0,0]=4 17498 B13R1.3441 CC1(CCN(C1)CCCCCF)O f17848f03b94b51fae888dd3b41b4e52 [0,1,0,1,0,0|2,0,0]=4 17499 B13R1.3441 CC1(CCN(C1)CCCCCO)O 7fbc721ce626c91280ef61a6bd7e2c26 [0,1,0,1,0,0|2,0,0]=4 17500 B13R1.3441 CC1(CC[C@@H](O1)CNCCCF)C fae7f962f3efed262d672cb4d2b74d05 [0,1,0,1,0,0|2,0,0]=4 17501 B13R1.3441 CC1(CC[C@@H](O1)CNCCCO)C a51a446f57ce0ae7c19de08f3850e75a [0,1,0,1,0,0|2,0,0]=4 17502 B13R1.3441 CC1(CC[C@@H](O1)CNCCCS)C 32a0fd57bc13d6a9159d6eeb00d5e9d6 [0,1,0,1,0,0|2,0,0]=4 17503 B13R1.3441 CC1(CC[C@@H](O1)COCCCF)C e42bf8f488798c074f29c461e2c9bf7f [0,1,0,1,0,0|2,0,0]=4 17504 B13R1.3441 CC1(CC[C@@H](O1)COCCCS)C 76a088e1e7d078245eb0b4c67a60149f [0,1,0,1,0,0|2,0,0]=4 17505 B13R1.3441 CC1(CC[C@H](O1)COCCCF)C 98795a43dfc181d7975170f004470679 [0,1,0,1,0,0|2,0,0]=4 17506 B13R1.3441 CC1(CC[C@H](O1)COCCCS)C 6bdf00c9649c072dfb22c44ea3fc1567 [0,1,0,1,0,0|2,0,0]=4 17507 B13R1.3441 CCCCCCN1CCC(C1)(C)C 8852a0344a66ec5e7f1827564f70815b [0,1,0,1,0,0|2,0,0]=4 17508 B13R1.3441 CCCCCCN1CCC(C1)(C)F 906c0de1e0fe7fc906c65d6666975767 [0,1,0,1,0,0|2,0,0]=4 17509 B13R1.3441 CCCCCCN1CCC(C1)(C)O e9aaabfbfcbd41faa4a1e5f07f6fd0ea [0,1,0,1,0,0|1,0,0]=3 17510 B13R1.3441 CCCCCCN1CCC(C1)(F)F c6a931964b3caf341ad9c53242069ef6 [0,1,0,1,0,0|2,0,0]=4 17511 B13R1.3441 CCCCCCN1CC[C@@](C1)(C)O 846ff6c37e8ee2ee563f6e62a8f36f6d [0,1,0,1,0,0|1,0,0]=3 17512 B13R1.3441 CCCCCCN1CC[C@](C1)(C)O 25edc22956a9d5a01cb841585c0659d0 [0,1,0,1,0,0|1,0,0]=3 17513 B13R1.3441 CCCCCNC1CCC(C1)(C)C 7adf5ef2fe8cf7d39aa4c47c37ab2b00 [0,1,0,1,0,0|2,0,0]=4 17514 B13R1.3441 CCCCCNC1CCC(C1)(F)F f58c10b0434f173721c55b108ad26eb7 [0,1,0,1,0,0|2,0,0]=4 17515 B13R1.3441 CCCCCOC1CCC(C1)(C)C 9fcde7d194cf444cbfad718208cd27a3 [0,1,0,1,0,0|2,0,0]=4 17516 B13R1.3441 CCCCCOC1CCC(C1)(F)F 2e2722a2b62c22b6bccc94c12fedf28d [0,1,0,1,0,0|2,0,0]=4 17517 B13R1.3441 CCCCCO[C@@H]1CCC(C1)(F)F baeee66388d590dad8194d70c8494e2c [0,1,0,1,0,0|2,0,0]=4 17518 B13R1.3441 CCCCCO[C@H]1CCC(C1)(F)F bad7ff38a8c3ac0d8a8e1b1c8c2a08c8 [0,1,0,1,0,0|2,0,0]=4 17519 B13R1.3441 CCCCNCC1CCC(C1)(F)F de11d6ccf8dd14678744328c72de3a85 [0,1,0,1,0,0|2,0,0]=4 17520 B13R1.3441 CCCCNCC1CCC(O1)(C)C 70e321b79d958ea465d0078cc8c351aa [0,1,0,1,0,0|1,0,0]=3 17521 B13R1.3441 CCCCNC[C@@H]1CCC(C1)(F)F 8c2a514a2d98a865e4620637fa803e6a [0,1,0,1,0,0|2,0,0]=4 17522 B13R1.3441 CCCCNC[C@H]1CCC(C1)(F)F e799a142ef8bedded3a0418792bd7178 [0,1,0,1,0,0|2,0,0]=4 17523 B13R1.3441 CCCCNC[C@H]1CCC(O1)(C)C dd08865d3bf170cb2d03340b6b033150 [0,1,0,1,0,0|1,0,0]=3 17524 B13R1.3441 CCCCOCC1CCC(C1)(C)C 595c5fa0df3d5c5649d0386ec739dcc8 [0,1,0,1,0,0|2,0,0]=4 17525 B13R1.3441 CCCCOCC1CCC(C1)(F)F 8978db91dbe1d75408f8306117d6c52d [0,1,0,1,0,0|2,0,0]=4 17526 B13R1.3441 CCCCOCC1CCC(O1)(C)C bb70f3e8f1d946fc7677dd6007b55cd9 [0,1,0,1,0,0|1,0,0]=3 17527 B13R1.3441 CCCCOCN1CCC(C1)(C)O 97169e3cdfb8f74461c03c22d470548d [0,1,0,1,0,0|2,0,0]=4 17528 B13R1.3441 CCCCOCN1CC[C@@](C1)(C)O 3e79b758e8374817a069fb623c43027f [0,1,0,1,0,0|2,0,0]=4 17529 B13R1.3441 CCCCOCN1CC[C@](C1)(C)O 240968048613de03735849037d7461a5 [0,1,0,1,0,0|2,0,0]=4 17530 B13R1.3441 CCCCOC[C@@H]1CCC(C1)(F)F c7db511f31a624a2015572286f95c4c5 [0,1,0,1,0,0|2,0,0]=4 17531 B13R1.3441 CCCCOC[C@@H]1CCC(O1)(C)C 70950b8b1ed309015b02b75a225a7bd7 [0,1,0,1,0,0|1,0,0]=3 17532 B13R1.3441 CCCCOC[C@H]1CCC(C1)(F)F 31ec0dcc674ff55b6af8d02edfa62680 [0,1,0,1,0,0|2,0,0]=4 17533 B13R1.3441 CCCCOC[C@H]1CCC(O1)(C)C ca3f5f4f592aaef940f2f3e0153c7675 [0,1,0,1,0,0|1,0,0]=3 17534 B13R1.3441 CCCOCCN1CCC(C1)(C)O bd014f13554abc832fed7a92b46402fb [0,1,0,1,0,0|2,0,0]=4 17535 B13R1.3441 CCCOCCN1CC[C@@](C1)(C)O 0229c3b1dbb7463915a80af5b262b4a9 [0,1,0,1,0,0|2,0,0]=4 17536 B13R1.3441 CCCOCCN1CC[C@](C1)(C)O 38f9b1e02a46fbde8236062e0e5aeba0 [0,1,0,1,0,0|2,0,0]=4 17537 B13R1.3441 CCOCCCN1CCC(C1)(C)O 6cb52fbc0e71e296b337278326fa4e7e [0,1,0,1,0,0|2,0,0]=4 17538 B13R1.3441 CCOCCCN1CC[C@@](C1)(C)O c63975fe00e57a84e7a3c3b9ddae1faa [0,1,0,1,0,0|2,0,0]=4 17539 B13R1.3441 CCOCCCN1CC[C@](C1)(C)O 2154e81abffbd71e00860d0aca71326b [0,1,0,1,0,0|2,0,0]=4 17540 B13R1.3441 CCOCNCC1CCC(O1)(C)C 617ef41fb322c62c5c7289fac07fef2a [0,1,0,1,0,0|2,0,0]=4 17541 B13R1.3441 CCOCNC[C@H]1CCC(O1)(C)C e695076be44e1a40fa094a82b99df90f [0,1,0,1,0,0|2,0,0]=4 17542 B13R1.3441 CCOCOCC1CCC(O1)(C)C 75fb20d7b49ba61d0b62d371b42274ce [0,1,0,1,0,0|2,0,0]=4 17543 B13R1.3441 CCOCOC[C@@H]1CCC(O1)(C)C 4c86ec33d2be93aa0e61c1dbbc240dc5 [0,1,0,1,0,0|2,0,0]=4 17544 B13R1.3441 CCOCOC[C@H]1CCC(O1)(C)C c13e8b5e9b25c89dda68aeb1c9a41591 [0,1,0,1,0,0|2,0,0]=4 17545 B13R1.3441 CCSCCCN1CCC(C1)(C)O bba6c15212f616b588d9e2bb479aeadd [0,1,0,1,0,0|2,0,0]=4 17546 B13R1.3441 CCSCCCN1CC[C@@](C1)(C)O 57f047bf8db782f412718aca4cf044a0 [0,1,0,1,0,0|2,0,0]=4 17547 B13R1.3441 CCSCCCN1CC[C@](C1)(C)O 4e8d6a8d621812e792ba1e6ecaf573fe [0,1,0,1,0,0|2,0,0]=4 17548 B13R1.3441 COCCCCN1CCC(C1)(C)O 7e0ae7ce5af4be905388e59bbc75eee8 [0,1,0,1,0,0|2,0,0]=4 17549 B13R1.3441 COCCCCN1CC[C@@](C1)(C)O dcc31f28338f6e5d93ad5c6d69aa83ac [0,1,0,1,0,0|2,0,0]=4 17550 B13R1.3441 COCCCCN1CC[C@](C1)(C)O 4c43564cf057632202789b1eae9a553b [0,1,0,1,0,0|2,0,0]=4 17551 B13R1.3441 COCCNCC1CCC(O1)(C)C 47a6e88f0cd5dc2b830dd4ee012a6837 [0,1,0,1,0,0|2,0,0]=4 17552 B13R1.3441 COCCNC[C@H]1CCC(O1)(C)C efdd02e848c684072827af19ed098962 [0,1,0,1,0,0|2,0,0]=4 17553 B13R1.3441 COCCOCC1CCC(O1)(C)C 63e24cc8980be5a025fbc33ec3dbb7b1 [0,1,0,1,0,0|2,0,0]=4 17554 B13R1.3441 COCCOC[C@@H]1CCC(O1)(C)C 585abbde3294cd1c607133bd228c6ced [0,1,0,1,0,0|2,0,0]=4 17555 B13R1.3441 COCCOC[C@H]1CCC(O1)(C)C eaf83d9dca2df4d74732c897576cb11a [0,1,0,1,0,0|2,0,0]=4 17556 B13R1.3441 CSCCNCC1CCC(O1)(C)C 20a79eb7e85672821a9667736ebd0a76 [0,1,0,1,0,0|2,0,0]=4 17557 B13R1.3441 CSCCNC[C@H]1CCC(O1)(C)C 42b27d8a03f006eebfa68a55264092fa [0,1,0,1,0,0|2,0,0]=4 17558 B13R1.3441 CSCCOCC1CCC(O1)(C)C ae06dd16f2b4aaec6178955ba995a5f9 [0,1,0,1,0,0|2,0,0]=4 17559 B13R1.3441 CSCCOC[C@@H]1CCC(O1)(C)C db605bfb4d69ee96762477995430e207 [0,1,0,1,0,0|2,0,0]=4 17560 B13R1.3441 CSCCOC[C@H]1CCC(O1)(C)C 369e8648d85efc1de2f88a5d350e8224 [0,1,0,1,0,0|2,0,0]=4 17561 B13R1.3441 C[C@@]1(CCN(C1)CCCCCF)O a9c56f5dc074520f3f346bac2b963ef3 [0,1,0,1,0,0|2,0,0]=4 17562 B13R1.3441 C[C@@]1(CCN(C1)CCCCCO)O 84fc2bc7995eb044dcf0259c2859d524 [0,1,0,1,0,0|2,0,0]=4 17563 B13R1.3441 C[C@]1(CCN(C1)CCCCCF)O 2771c43016f895262775bb3f23182c98 [0,1,0,1,0,0|2,0,0]=4 17564 B13R1.3441 C[C@]1(CCN(C1)CCCCCO)O 93117ace7d0dba01c6225f461ad53543 [0,1,0,1,0,0|2,0,0]=4 17565 B13R1.3523 CC(C)(Br)COCC1CCCCC1 5a92b373d5b71c29b941537ffc06d1ef [0,1,0,1,0,0|2,0,0]=4 17566 B13R1.3523 CC(C)(C)CCNC1CCCCC1 8eeafc8f5b3156916e1a8a1bdebc7e51 [0,1,0,1,0,0|2,0,0]=4 17567 B13R1.3523 CC(C)(C)CCOC1CCCCC1 51126530e93de0e338c0532140bb3100 [0,1,0,1,0,0|2,0,0]=4 17568 B13R1.3523 CC(C)(C)CNCC1CCCCC1 7c4dd0a1d7eb3670f217ef20036cac2a [0,1,0,1,0,0|2,0,0]=4 17569 B13R1.3523 CC(C)(C)COCC1CCCCC1 61e7a4272153accc8a3e9def7fb8e0bc [0,1,0,1,0,0|2,0,0]=4 17570 B13R1.3523 CC(C)(C)NCCC1CCCCC1 acd91bb0305e8261bb3d64bd74bebf83 [0,1,0,1,0,0|2,0,0]=4 17571 B13R1.3523 CC(C)(F)CCNC1CCCCC1 036c5a8b2537850459e4ce9a639fd4ea [0,1,0,1,0,0|2,0,0]=4 17572 B13R1.3523 CC(C)(F)CNCC1CCCCC1 ef80dc01568de6fd29466e79b32eb4d1 [0,1,0,1,0,0|2,0,0]=4 17573 B13R1.3523 CC(C)(F)COCC1CCCCC1 e481a6f860ec8473b8d55f3cb452af1a [0,1,0,1,0,0|2,0,0]=4 17574 B13R1.3523 CC(C)(O)CCCN1CCCOC1 6a6dd58a9924760f2ae014fe3c4504ba [0,1,0,1,0,0|2,0,0]=4 17575 B13R1.3523 CC(C)(O)CCCN1CCCSC1 40b8ece09b19ece6ec56dab4c8f9aafe [0,1,0,1,0,0|2,0,0]=4 17576 B13R1.3523 CC(C)(O)CCCN1CCOCC1 125a35da2b3b13de517653de445475cb [0,1,0,1,0,0|2,0,0]=4 17577 B13R1.3523 CC(C)(O)CCCN1CCSCC1 c4c0f687adc6251e6515b3268aa3611c [0,1,0,1,0,0|2,0,0]=4 17578 B13R1.3523 CC(C)(O)CCNC1CCCCC1 dc65a28f748734fccef728e971c85324 [0,1,0,1,0,0|1,0,0]=3 17579 B13R1.3523 CC(C)(O)CCNC1CCCCO1 639e1d8af332592fd20cbd48f9948fad [0,1,0,1,0,0|2,0,0]=4 17580 B13R1.3523 CC(C)(O)CCNC1CCCOC1 f605c3979411e93e6cabe58c94949057 [0,1,0,1,0,0|2,0,0]=4 17581 B13R1.3523 CC(C)(O)CCNC1CCOCC1 acd9f6419bdc8aa3e594cfe018c5d7bc [0,1,0,1,0,0|2,0,0]=4 17582 B13R1.3523 CC(C)(O)CCNC1CCSCC1 db9b19e7f4af93a1e4bc9d0056239ef6 [0,1,0,1,0,0|2,0,0]=4 17583 B13R1.3523 CC(C)(O)CCN[C@@H]1CCCOC1 966ae24a08c25439b882f16230b0dd7b [0,1,0,1,0,0|2,0,0]=4 17584 B13R1.3523 CC(C)(O)CCN[C@H]1CCCOC1 19300dbc8abc7154441031349596cf41 [0,1,0,1,0,0|2,0,0]=4 17585 B13R1.3523 CC(C)(O)CCOC1CCCCC1 853438f3a8b92a809941dcbcaf3870c0 [0,1,0,1,0,0|1,0,0]=3 17586 B13R1.3523 CC(C)(O)CCOC1CCCCO1 a9246f486b4763e01bac6e852ee2e56f [0,1,0,1,0,0|2,0,0]=4 17587 B13R1.3523 CC(C)(O)CCOC1CCCOC1 6b22a1cbed7c5aa1959b2143bb32e6d3 [0,1,0,1,0,0|2,0,0]=4 17588 B13R1.3523 CC(C)(O)CCOC1CCCSC1 2339e5b43ee1c178d525bd1de9c7cf77 [0,1,0,1,0,0|2,0,0]=4 17589 B13R1.3523 CC(C)(O)CCOC1CCOCC1 4336264a106e822ad43401a3a153ebdc [0,1,0,1,0,0|2,0,0]=4 17590 B13R1.3523 CC(C)(O)CCOC1CCSCC1 67fa1299cbb56c5cb4f84d2166465c7a [0,1,0,1,0,0|2,0,0]=4 17591 B13R1.3523 CC(C)(O)CCO[C@@H]1CCCOC1 24f4f16716b49935c96bc8b35b0f0dad [0,1,0,1,0,0|2,0,0]=4 17592 B13R1.3523 CC(C)(O)CCO[C@H]1CCCOC1 86317b1ee09edfccec91d7d4edeada9b [0,1,0,1,0,0|2,0,0]=4 17593 B13R1.3523 CC(C)(O)CNCC1CCCCC1 e185332d6e76467ff77c34d87b543e04 [0,1,0,1,0,0|1,0,0]=3 17594 B13R1.3523 CC(C)(O)CNCC1CCCCO1 93b5c8ddcdf78ae6f80ce4abf7b7d64d [0,1,0,1,0,0|2,0,0]=4 17595 B13R1.3523 CC(C)(O)CNCC1CCCOC1 cc6f96bd11c889d73adf32d4f933d0db [0,1,0,1,0,0|2,0,0]=4 17596 B13R1.3523 CC(C)(O)CNCC1CCOCC1 096f8d51ba76fb3361fc322379b331cc [0,1,0,1,0,0|2,0,0]=4 17597 B13R1.3523 CC(C)(O)CNCC1CCSCC1 b07b8e58a02adc2993afe2717031d231 [0,1,0,1,0,0|2,0,0]=4 17598 B13R1.3523 CC(C)(O)CNC[C@@H]1CCCOC1 2ff3a7e58fc770ee3aa2b9026339a8e6 [0,1,0,1,0,0|2,0,0]=4 17599 B13R1.3523 CC(C)(O)CNC[C@H]1CCCOC1 86dadfaf78ee624931cbe69e6acf2e34 [0,1,0,1,0,0|2,0,0]=4 17600 B13R1.3523 CC(C)(O)COCC1CCCCC1 8af6575355eb2fb0cf9797e578c3d68d [0,1,0,1,0,0|1,0,0]=3 17601 B13R1.3523 CC(C)(O)COCC1CCCCO1 81d362a6f87b28a2a0306aacc52747b9 [0,1,0,1,0,0|2,0,0]=4 17602 B13R1.3523 CC(C)(O)COCC1CCCOC1 483d9b8612944cd706cd181b618d5ff7 [0,1,0,1,0,0|2,0,0]=4 17603 B13R1.3523 CC(C)(O)COCC1CCOCC1 6b69c3ae826ec10b84613e2c8de859de [0,1,0,1,0,0|2,0,0]=4 17604 B13R1.3523 CC(C)(O)COCC1CCSCC1 2e50383312b5d560d145646562bb82b8 [0,1,0,1,0,0|2,0,0]=4 17605 B13R1.3523 CC(C)(O)COC[C@@H]1CCCCO1 d89c0722e1dbe4877257cec1f89fb19d [0,1,0,1,0,0|2,0,0]=4 17606 B13R1.3523 CC(C)(O)COC[C@@H]1CCCOC1 c7c3a336fa6b4edd4086e7813d7387aa [0,1,0,1,0,0|2,0,0]=4 17607 B13R1.3523 CC(C)(O)COC[C@H]1CCCCO1 582ce8c646665d3dd44d8b5697a1d29e [0,1,0,1,0,0|2,0,0]=4 17608 B13R1.3523 CC(C)(O)COC[C@H]1CCCOC1 98cd96996b7a767ca57939244fbc7a6e [0,1,0,1,0,0|2,0,0]=4 17609 B13R1.3523 CC(C)(S)CCOC1CCCCC1 dbfb6692ff4b8cee5e6f7463e1b19b35 [0,1,0,1,0,0|1,1,0]=4 17610 B13R1.3523 CC(C)(S)COCC1CCCCC1 f6edfb9fa5a5bc42260712ebc91ccfa3 [0,1,0,1,0,0|1,1,0]=4 17611 B13R1.3523 CC(F)(F)CCOC1CCCCC1 f1da35b116f803c4f3da165b01f9a108 [0,1,0,1,0,0|2,0,0]=4 17612 B13R1.3523 CC(F)(F)CNCC1CCCCC1 201f0d463ef1a6ffadc25c34013a6cd1 [0,1,0,1,0,0|2,0,0]=4 17613 B13R1.3523 CC(F)(F)COCC1CCCCC1 0acd0f91a1466f524d86002bd37c0e88 [0,1,0,1,0,0|2,0,0]=4 17614 B13R1.3672 CC1(CC1COCCCCCF)C 43b2a9a54d026d858d820ee3846da1e5 [0,1,0,1,0,0|2,0,0]=4 17615 B13R1.3672 CC1(CC1NCCCCCCCl)C 2a7d791ca88c7f9459440460e2b64385 [0,1,0,1,0,0|2,0,0]=4 17616 B13R1.3672 CC1(CC1NCCCCCCF)C d2741cbfd48dfc6df5a27bd60c8edcd8 [0,1,0,1,0,0|2,0,0]=4 17617 B13R1.3672 CC1(CC1NCCCCCCO)C fb27e5dce6f8bb7fa2cd7d4a32cf3e07 [0,1,0,1,0,0|2,0,0]=4 17618 B13R1.3672 CC1(CC1OCCCCCCF)C 1c39c26a4d4bba01210628b6c08b5921 [0,1,0,1,0,0|2,0,0]=4 17619 B13R1.3672 CC1(CC1OCCCCCCS)C 7ec5711092ce6793bea0685af15c9274 [0,1,0,1,0,0|2,0,0]=4 17620 B13R1.3672 CC1(CN1CCCCCCCO)C e034bc7b8d9628b2549602a483f77091 [0,1,0,1,0,0|2,0,0]=4 17621 B13R1.3672 CC1(C[C@@H]1CNCCCCCF)C 69801bb318cc554b5b0ed26342888d5c [0,1,0,1,0,0|2,0,0]=4 17622 B13R1.3672 CC1(C[C@@H]1CNCCCCCO)C 6056b67fe4bcde3ee5731343430c2cae [0,1,0,1,0,0|2,0,0]=4 17623 B13R1.3672 CC1(C[C@@H]1COCCCCCF)C 1c8a15c40e88802e17a9e2c76055ce8f [0,1,0,1,0,0|2,0,0]=4 17624 B13R1.3672 CC1(C[C@@H]1NCCCCCCF)C eafe2e35f9044bb969aa8b6a4ca66739 [0,1,0,1,0,0|2,0,0]=4 17625 B13R1.3672 CC1(C[C@@H]1NCCCCCCO)C f944e77ed100cf7ed7238088c4d7d3b0 [0,1,0,1,0,0|2,0,0]=4 17626 B13R1.3672 CC1(C[C@H]1CNCCCCCF)C 6dafd7fbfe05cb574770eef1b56380c7 [0,1,0,1,0,0|2,0,0]=4 17627 B13R1.3672 CC1(C[C@H]1CNCCCCCO)C e7dd34c11bef57436ff1d7336555367b [0,1,0,1,0,0|2,0,0]=4 17628 B13R1.3672 CC1(C[C@H]1COCCCCCF)C b9a41890e982297171fc32ad076c3617 [0,1,0,1,0,0|2,0,0]=4 17629 B13R1.3672 CC1(C[C@H]1NCCCCCCF)C ddeff75cabc6c42d3099fc6a0799dff5 [0,1,0,1,0,0|2,0,0]=4 17630 B13R1.3672 CC1(C[C@H]1NCCCCCCO)C 5c4cb95d519d983e51364dde796c9db7 [0,1,0,1,0,0|2,0,0]=4 17631 B13R1.3672 CCCCCCCCN1CC1(C)C 62dd640a7bc1014775c48dac0da4969a [0,1,0,1,0,0|1,0,0]=3 17632 B13R1.3672 CCCCCCCNC1CC1(C)C 7f5e3dd73d93e2e97bb804011d37b752 [0,1,0,1,0,0|1,0,0]=3 17633 B13R1.3672 CCCCCCCNC1CC1(F)F 527bc75b7d4af54a223fe5620de6fc88 [0,1,0,1,0,0|2,0,0]=4 17634 B13R1.3672 CCCCCCCN[C@@H]1CC1(C)C 529e5ecdda94700eecfcf48a43428fd3 [0,1,0,1,0,0|1,0,0]=3 17635 B13R1.3672 CCCCCCCN[C@H]1CC1(C)C 068146bf50ff45966cc8119df18041ad [0,1,0,1,0,0|1,0,0]=3 17636 B13R1.3672 CCCCCCCOC1CC1(C)C 1fc22bba07b4f9fdb12546de03c97a4d [0,1,0,1,0,0|1,0,0]=3 17637 B13R1.3672 CCCCCCCOC1CC1(F)F 7559f1c6aa57aa6d3404b39dd561566c [0,1,0,1,0,0|2,0,0]=4 17638 B13R1.3672 CCCCCCNCC1CC1(F)F 15855e6a5ca79e8edd301719bd891185 [0,1,0,1,0,0|2,0,0]=4 17639 B13R1.3672 CCCCCCNC[C@@H]1CC1(C)C 4a4721444744ab6cae35444bf7d61d7c [0,1,0,1,0,0|1,0,0]=3 17640 B13R1.3672 CCCCCCNC[C@H]1CC1(C)C 8883d97f1453bef0a5239bfd31c999c5 [0,1,0,1,0,0|1,0,0]=3 17641 B13R1.3672 CCCCCCNC[C@H]1CC1(F)F 3e49a72fab24a8a5f6da558cf8c7dd98 [0,1,0,1,0,0|2,0,0]=4 17642 B13R1.3672 CCCCCCOCC1CC1(C)C d36b906ae700ec42df60b463d42eba09 [0,1,0,1,0,0|1,0,0]=3 17643 B13R1.3672 CCCCCCOCC1CC1(F)F c1b44010d2f737e5b988989ce5cc544f [0,1,0,1,0,0|2,0,0]=4 17644 B13R1.3672 CCCCCCOC[C@@H]1CC1(C)C 007d6e6c3b7bc4ea36f01076c49ed16b [0,1,0,1,0,0|1,0,0]=3 17645 B13R1.3672 CCCCCCOC[C@@H]1CC1(F)F d7cf06de6f3a60beca13bcf509360368 [0,1,0,1,0,0|2,0,0]=4 17646 B13R1.3672 CCCCCCOC[C@H]1CC1(C)C 953eee2afeb62c0d1d596d0b4dc800c2 [0,1,0,1,0,0|1,0,0]=3 17647 B13R1.3672 CCCCCCOC[C@H]1CC1(F)F 1a221a8503af3c0b7c1a6970cd6b3943 [0,1,0,1,0,0|2,0,0]=4 17648 B13R1.3672 CCCCCNCCC1CC1(F)F 521364efed789c835ffb81a94d22cc09 [0,1,0,1,0,0|2,0,0]=4 17649 B13R1.3672 CCCCCOCCC1CC1(F)F cdd4b9df619629319d0fc5de7daacda8 [0,1,0,1,0,0|2,0,0]=4 17650 B13R1.3672 CCCCOCCNC1CC1(C)C 17f46848c297f3951d1e6ac559b72fd3 [0,1,0,1,0,0|2,0,0]=4 17651 B13R1.3672 CCCCOCCN[C@@H]1CC1(C)C f1b98db6c234224cd9ede6340123a0da [0,1,0,1,0,0|2,0,0]=4 17652 B13R1.3672 CCCCOCCN[C@H]1CC1(C)C 03918817cd51c4f6498d9b433b2896cb [0,1,0,1,0,0|2,0,0]=4 17653 B13R1.3672 CCCCOCCOC1CC1(C)C bfff68b8663ce6047a6445665e44b9d6 [0,1,0,1,0,0|2,0,0]=4 17654 B13R1.3672 CCCCOCNC[C@@H]1CC1(C)C b150b1c7515bcec29b61d23e82f6d11e [0,1,0,1,0,0|2,0,0]=4 17655 B13R1.3672 CCCCOCNC[C@H]1CC1(C)C 3edb208827d42f0eb5db48632e6f0823 [0,1,0,1,0,0|2,0,0]=4 17656 B13R1.3672 CCCCOCOCC1CC1(C)C 21197613d4064c857d6c50c5b5079488 [0,1,0,1,0,0|2,0,0]=4 17657 B13R1.3672 CCCCOCOC[C@@H]1CC1(C)C 67db8b3501793c5027fb082622256264 [0,1,0,1,0,0|2,0,0]=4 17658 B13R1.3672 CCCCOCOC[C@H]1CC1(C)C 3b0cb1746a6ad459e914dd9aef9ca159 [0,1,0,1,0,0|2,0,0]=4 17659 B13R1.3672 CCCCSCCOC1CC1(C)C 6afeefedc92964eb4df6a41312be371c [0,1,0,1,0,0|2,0,0]=4 17660 B13R1.3672 CCCOCCCCC1CC1(F)F 91b19e458a532b31b15f63fe9962703e [0,1,0,1,0,0|2,0,0]=4 17661 B13R1.3672 CCCOCCCNC1CC1(C)C 25d877f7141f8965051964cd34bc7293 [0,1,0,1,0,0|2,0,0]=4 17662 B13R1.3672 CCCOCCCN[C@@H]1CC1(C)C 2071c1b0ca28869750b08e2ba873e758 [0,1,0,1,0,0|2,0,0]=4 17663 B13R1.3672 CCCOCCCN[C@H]1CC1(C)C 858f9e6427f79169564e5702c3053ef1 [0,1,0,1,0,0|2,0,0]=4 17664 B13R1.3672 CCCOCCNC[C@@H]1CC1(C)C 028522650a2780157efff44aa0bc358c [0,1,0,1,0,0|2,0,0]=4 17665 B13R1.3672 CCCOCCNC[C@H]1CC1(C)C cb378f98a857f5a3bc741fc7eb5eb2c5 [0,1,0,1,0,0|2,0,0]=4 17666 B13R1.3672 CCCOCCOCC1CC1(C)C ce8eff4c1ac2538e1d99c62a990abced [0,1,0,1,0,0|2,0,0]=4 17667 B13R1.3672 CCCOCCOC[C@@H]1CC1(C)C 9c23054ad957aed73e0e1177f820f6cf [0,1,0,1,0,0|2,0,0]=4 17668 B13R1.3672 CCCOCCOC[C@H]1CC1(C)C ebb2e3f9d7419a19784880abfe4af5ac [0,1,0,1,0,0|2,0,0]=4 17669 B13R1.3672 CCOCCCNC[C@@H]1CC1(C)C 73385be60e6f689eeab167e016b042bc [0,1,0,1,0,0|2,0,0]=4 17670 B13R1.3672 CCOCCCNC[C@H]1CC1(C)C 32f27c9bce3dff8aa30d5542816f31f7 [0,1,0,1,0,0|2,0,0]=4 17671 B13R1.3672 CCOCCCOCC1CC1(C)C c73575447dcb1426aa03f3fc7f94f534 [0,1,0,1,0,0|2,0,0]=4 17672 B13R1.3672 CCOCCCOC[C@@H]1CC1(C)C b1d603c0bb8076a8230789082323c587 [0,1,0,1,0,0|2,0,0]=4 17673 B13R1.3672 CCOCCCOC[C@H]1CC1(C)C e4d9e1eb8f9b00587a65cd5343242e8a [0,1,0,1,0,0|2,0,0]=4 17674 B13R1.3672 CCSCCCCNC1CC1(C)C 6782a6af1fa19350dd90253ed3ba92d0 [0,1,0,1,0,0|2,0,0]=4 17675 B13R1.3672 CCSCCCNC[C@@H]1CC1(C)C 6a19850dfdb4c15b867af165aacc1c91 [0,1,0,1,0,0|2,0,0]=4 17676 B13R1.3672 CCSCCCNC[C@H]1CC1(C)C 7efb61fd7f6040db8d2131f10971db6c [0,1,0,1,0,0|2,0,0]=4 17677 B13R1.3672 CCSCCCOCC1CC1(C)C 41fca17060210724d0da88aa336d880d [0,1,0,1,0,0|2,0,0]=4 17678 B13R1.3672 CCSCCCOC[C@@H]1CC1(C)C e3b19a4950feddb7821cee84e62fc26d [0,1,0,1,0,0|2,0,0]=4 17679 B13R1.3672 CCSCCCOC[C@H]1CC1(C)C d7a5e92d2ce7125d9b8f1033905049e1 [0,1,0,1,0,0|2,0,0]=4 17680 B13R1.3672 COCCCCCCN1CC1(C)C e4929ddec12bc7ad6698c10c9e8da85a [0,1,0,1,0,0|2,0,0]=4 17681 B13R1.3672 COCCCCCNC1CC1(C)C 6250c069f5247cbee862bb570e86b24a [0,1,0,1,0,0|2,0,0]=4 17682 B13R1.3672 COCCCCCN[C@@H]1CC1(C)C b81ca419026a91297c95ba5797f3650e [0,1,0,1,0,0|2,0,0]=4 17683 B13R1.3672 COCCCCCN[C@H]1CC1(C)C 7d4c18e1ecf3cdf6036b9bf561f16996 [0,1,0,1,0,0|2,0,0]=4 17684 B13R1.3672 COCCCCNC[C@@H]1CC1(C)C 121d0267906b20030c030055b257ed63 [0,1,0,1,0,0|2,0,0]=4 17685 B13R1.3672 COCCCCNC[C@H]1CC1(C)C 9ee36a544325e03aff731bc9c560aa14 [0,1,0,1,0,0|2,0,0]=4 17686 B13R1.3672 COCCCCOCC1CC1(C)C 2fb7b061253850698c1816e5dd501423 [0,1,0,1,0,0|2,0,0]=4 17687 B13R1.3672 COCCCCOC[C@@H]1CC1(C)C 3e32b2cf50525325a7c897d1472ae0e7 [0,1,0,1,0,0|2,0,0]=4 17688 B13R1.3672 COCCCCOC[C@H]1CC1(C)C 35fca4705a1ef73e5b8b564e24c5f1dc [0,1,0,1,0,0|2,0,0]=4 17689 B13R1.6268 CC(C)(Br)COC1CCCCCC1 c640dd3d4003f2ce1457847a959c5076 [0,1,0,1,0,0|2,0,0]=4 17690 B13R1.6268 CC(C)(C)CCN1CCCCCC1 ccf1e8cdd190339218ea2e0b4cd3a215 [0,1,0,1,0,0|2,0,0]=4 17691 B13R1.6268 CC(C)(C)CNC1CCCCCC1 68d7de19b547bf67acb5fc217b44617d [0,1,0,1,0,0|2,0,0]=4 17692 B13R1.6268 CC(C)(C)COC1CCCCCC1 07f259e13b4c3a6fd3643d942fc67818 [0,1,0,1,0,0|2,0,0]=4 17693 B13R1.6268 CC(C)(C)NCC1CCCCCC1 5b135afa9c0e2c048d7094e2bb01bc5f [0,1,0,1,0,0|2,0,0]=4 17694 B13R1.6268 CC(C)(F)CNC1CCCCCC1 a42021ea02a0f42d1ecc5aa382abc602 [0,1,0,1,0,0|2,0,0]=4 17695 B13R1.6268 CC(C)(F)COC1CCCCCC1 4db698a25703ce56d650be28affd8ab1 [0,1,0,1,0,0|2,0,0]=4 17696 B13R1.6268 CC(C)(O)CCN1CCCCCC1 df2a1f1d8f32c4e033fb407c5b96e471 [0,1,0,1,0,0|1,0,0]=3 17697 B13R1.6268 CC(C)(O)CCN1CCCOCC1 d6c5e77976f6d3f179b201e6d8a9692f [0,1,0,1,0,0|2,0,0]=4 17698 B13R1.6268 CC(C)(O)CNC1CCCCCC1 920bbc1b0f8ed56fd202c275212d15be [0,1,0,1,0,0|1,0,0]=3 17699 B13R1.6268 CC(C)(O)CNC1CCCOCC1 a94f7e3321614af7876ecc3219f62ec9 [0,1,0,1,0,0|2,0,0]=4 17700 B13R1.6268 CC(C)(O)COC1CCCCCC1 eba3c52c983e54dbe125fdfee6b034af [0,1,0,1,0,0|1,0,0]=3 17701 B13R1.6268 CC(C)(O)COC1CCCOCC1 7aae2c18bd4997ca328bdfcd739d1d45 [0,1,0,1,0,0|2,0,0]=4 17702 B13R1.6268 CC(C)(S)COC1CCCCCC1 0e91ce494e07f1e30a9d012fe904176c [0,1,0,1,0,0|1,1,0]=4 17703 B13R1.6268 CC(F)(F)CCN1CCCCCC1 7ae25245cb2c8c233f5e13fda5357ad0 [0,1,0,1,0,0|2,0,0]=4 17704 B13R1.6268 CC(F)(F)CNC1CCCCCC1 8f11375b93d693c41f426db8daf1becc [0,1,0,1,0,0|2,0,0]=4 17705 B13R1.6268 CC(F)(F)COC1CCCCCC1 871dd9d240e4bd656f5304413e05501c [0,1,0,1,0,0|2,0,0]=4 17706 B13R1.6271 CC(C)(C)CCCCOCC1CC1 2f350c97fb2e35f0ca4888cb009f20fc [0,1,0,1,0,0|2,0,0]=4 17707 B13R1.6271 CC(C)(C)CCCNCCC1CC1 01205f0a66eacc27649d91ca3da42407 [0,1,0,1,0,0|2,0,0]=4 17708 B13R1.6271 CC(C)(C)CCCOCCC1CC1 32e4e4a62c4641253232dfd883198f91 [0,1,0,1,0,0|2,0,0]=4 17709 B13R1.6271 CC(C)(C)CCOCCCC1CC1 10e0d53298131bac523f651975d2ad52 [0,1,0,1,0,0|2,0,0]=4 17710 B13R1.6271 CC(C)(O)CCCCCNC1CC1 196a94e989c833996dc47d1a5ffb324c [0,1,0,1,0,0|1,0,0]=3 17711 B13R1.6271 CC(C)(O)CCCCCOC1CC1 721014a31f1dffd67b505b4f83a7b69a [0,1,0,1,0,0|1,0,0]=3 17712 B13R1.6271 CC(C)(O)CCCNCCC1CC1 bf5a67ac54503fd4ffa57668b058b92a [0,1,0,1,0,0|1,0,0]=3 17713 B13R1.6271 CC(C)(O)CCCNCCN1CC1 c65992c63e6f7a4f0b40d38a5480eb03 [0,1,0,1,0,0|2,0,0]=4 17714 B13R1.6271 CC(C)(O)CCCOCCC1CC1 eeb0f1e8bc3c97bfe4ac11127c378e38 [0,1,0,1,0,0|1,0,0]=3 17715 B13R1.6271 CC(C)(O)CCCOCCN1CC1 27d86d6fd35712be0692773ec07930e6 [0,1,0,1,0,0|2,0,0]=4 17716 B13R1.6271 CC(C)(O)CCNCCOC1CC1 2c337a6b12931fc6142bad0b4c7cc6d9 [0,1,0,1,0,0|2,0,0]=4 17717 B13R1.6271 CC(C)(O)CCOCCCC1CC1 8c2d59ebb56a63f5de1e16e592f2eb56 [0,1,0,1,0,0|1,0,0]=3 17718 B13R1.6271 CC(C)(O)CCOCCOC1CC1 025dcc487b26a8a54c25fa6ee148271a [0,1,0,1,0,0|2,0,0]=4 17719 B13R1.6271 CC(C)(O)CNCCSCC1CC1 f0adf9ae047f1e0cd3531087e0702d50 [0,1,0,1,0,0|2,0,0]=4 17720 B13R1.6271 CC(C)(O)COCCCSC1CC1 9abdb63b5ae1cd2f75148ccf4f779780 [0,1,0,1,0,0|2,0,0]=4 17721 B13R1.6271 CC(C)(O)COCCOCC1CC1 055e71d641c37e19765622df13ff7108 [0,1,0,1,0,0|2,0,0]=4 17722 B13R1.6271 CC(F)(F)CCCNCCC1CC1 38862e316fe2f91bf04e62417b075402 [0,1,0,1,0,0|2,0,0]=4 17723 B13R1.6271 CC(F)(F)CCCOCCC1CC1 76f78ea4bdfc2429afbb6e042a53700f [0,1,0,1,0,0|2,0,0]=4 17724 B13R1.6271 CC(F)(F)CCOCCCC1CC1 bfd096324b5e6ea482f57f8aca86917b [0,1,0,1,0,0|2,0,0]=4 17725 B13R1.6279 CC(C)(C)CN1CCCCCCC1 8dbd4f403b89a46df3f8804913de901f [0,1,0,1,0,0|2,0,0]=4 17726 B13R1.6279 CC(C)(F)CN1CCCCCCC1 dec78702de0de923c5968f60aa46bb3f [0,1,0,1,0,0|2,0,0]=4 17727 B13R1.6279 CC(C)(O)CN1CCCCCCC1 5bbffa1a17f16106c8803f93f8aef73d [0,1,0,1,0,0|1,0,0]=3 17728 B13R1.6279 CC(F)(F)CN1CCCCCCC1 1679c76b1baac6598dbfd8a328d20957 [0,1,0,1,0,0|2,0,0]=4 17729 B13R1.15 C=C(CC)CNC1CCCC(C1)O 3d864ac0638f94fe1ad025dfb7b4f018 [0,1,0,1,0,0|1,0,1]=4 17730 B13R1.15 C=C(CC)CN[C@@H]1CCC[C@@H](C1)O 426c04e0d17b7bdd74589116b01ff7af [0,1,0,1,0,0|1,0,1]=4 17731 B13R1.15 C=C(CC)CN[C@@H]1CCC[C@H](C1)O 253bd451d4199981df05b227d9a93699 [0,1,0,1,0,0|1,0,1]=4 17732 B13R1.15 C=C(CC)CN[C@H]1CCC[C@@H](C1)O f85afdfa260889cea739f400f6bfac19 [0,1,0,1,0,0|1,0,1]=4 17733 B13R1.15 C=C(CC)CN[C@H]1CCC[C@H](C1)O ad0ab1906967a2e0c50316847d4a9b04 [0,1,0,1,0,0|1,0,1]=4 17734 B13R1.15 CC(CO)CCN1CCCC(C1)O c0d478156e566ac3c1e5502e7fb186db [0,1,0,1,0,0|2,0,0]=4 17735 B13R1.15 CC(CO)CCN1CCC[C@@H](C1)O 5987e0aaf9209f1c7d79f150dd7564ee [0,1,0,1,0,0|2,0,0]=4 17736 B13R1.15 CC(CO)CCN1CCC[C@H](C1)O 6c5a882eefada96efb7318f9c42b4fdc [0,1,0,1,0,0|2,0,0]=4 17737 B13R1.15 CC(CO)CNC1CCCC(C1)O 7b8f750083d02facfe0aacf0f640af76 [0,1,0,1,0,0|2,0,0]=4 17738 B13R1.15 CC(CO)CN[C@@H]1CCC[C@@H](C1)O c293f1715f47ef118d05effce7bf7654 [0,1,0,1,0,0|2,0,0]=4 17739 B13R1.15 CC(CO)CN[C@@H]1CCC[C@H](C1)O bbd8e1321411d25f1f266c54534e7488 [0,1,0,1,0,0|2,0,0]=4 17740 B13R1.15 CC(CO)CN[C@H]1CCC[C@@H](C1)O ce7d26b23e5d51ab65b34fe34fb23860 [0,1,0,1,0,0|2,0,0]=4 17741 B13R1.15 CC(CO)CN[C@H]1CCC[C@H](C1)O ef67cf7385f3ed94c1761e304c3de057 [0,1,0,1,0,0|2,0,0]=4 17742 B13R1.15 CC(CO)NCC1CCCC(C1)O 5e50d8c3df024754610597cb76ca2524 [0,1,0,1,0,0|2,0,0]=4 17743 B13R1.15 CC(CO)NC[C@H]1CCC[C@H](C1)O 6c605197e859e6970c12ca1d4ef59e50 [0,1,0,1,0,0|2,0,0]=4 17744 B13R1.15 CCC(=O)CNC1CCCC(C1)O 55254f548a56dbae52c7bef72bf88f2c [0,1,0,1,0,0|1,0,1]=4 17745 B13R1.15 CCC(=O)CN[C@@H]1CCC[C@@H](C1)O 23591fd7c1281a195b2679e5be141041 [0,1,0,1,0,0|1,0,1]=4 17746 B13R1.15 CCC(=O)CN[C@@H]1CCC[C@H](C1)O 8667a261dd7982f2457ea3f02b27582f [0,1,0,1,0,0|1,0,1]=4 17747 B13R1.15 CCC(=O)CN[C@H]1CCC[C@@H](C1)O f8fca1f2beb98cb621efc90d84439205 [0,1,0,1,0,0|1,0,1]=4 17748 B13R1.15 CCC(=O)CN[C@H]1CCC[C@H](C1)O eabda8c3ebfd51f26bfbeef1d084949b [0,1,0,1,0,0|1,0,1]=4 17749 B13R1.15 CCC(=O)NCC1CCCC(C1)O 962517b04465f6490823f5d8bb50238e [0,1,0,1,0,0|1,0,1]=4 17750 B13R1.15 CCC(=O)NC[C@H]1CCC[C@H](C1)O 52b86f3c5e83f65c0be450e994b73d61 [0,1,0,1,0,0|1,0,1]=4 17751 B13R1.15 CCC(C)CCN1CCCC(C1)C 3a5821b2123a4c6ae424ddb4149c1d54 [0,1,0,1,0,0|2,0,0]=4 17752 B13R1.15 CCC(C)CCN1CCCC(C1)F 05edf3b3e506b9970ba86e8e2b85167c [0,1,0,1,0,0|2,0,0]=4 17753 B13R1.15 CCC(C)CCN1CCCC(C1)O 081c04ec79090ba6fd5aabe5ec5e38e0 [0,1,0,1,0,0|1,0,0]=3 17754 B13R1.15 CCC(C)CCN1CCC[C@@H](C1)C 3127c8a1af4c97a40346919f2ed229c5 [0,1,0,1,0,0|2,0,0]=4 17755 B13R1.15 CCC(C)CCN1CCC[C@@H](C1)F 5503f62ba901ae819e961e0a47164a18 [0,1,0,1,0,0|2,0,0]=4 17756 B13R1.15 CCC(C)CCN1CCC[C@@H](C1)O 72d81f7aadade914bbbec2529cd3f73e [0,1,0,1,0,0|1,0,0]=3 17757 B13R1.15 CCC(C)CCN1CCC[C@H](C1)C e157b778c3f3db4074b1f07d842d5e10 [0,1,0,1,0,0|2,0,0]=4 17758 B13R1.15 CCC(C)CCN1CCC[C@H](C1)F f95c76a62c0d73fb5b76046f35792e3d [0,1,0,1,0,0|2,0,0]=4 17759 B13R1.15 CCC(C)CCN1CCC[C@H](C1)O 25ae001dd961ca0fe5d2663aa62edcd9 [0,1,0,1,0,0|1,0,0]=3 17760 B13R1.15 CCC(C)CNC1CCCC(C1)C 0cd8d4a60a99d9d4b94587555b8b9835 [0,1,0,1,0,0|2,0,0]=4 17761 B13R1.15 CCC(C)CNC1CCCC(C1)O 45c574a14a473bf094c64d44a21369e9 [0,1,0,1,0,0|1,0,0]=3 17762 B13R1.15 CCC(C)CNC1COCC(C1)O 34041e1c434b2b27ed90f21eda5f3aaa [0,1,0,1,0,0|2,0,0]=4 17763 B13R1.15 CCC(C)CN[C@@H]1CCC[C@@H](C1)O 1f6703dc1da44794344378f55ad9e666 [0,1,0,1,0,0|1,0,0]=3 17764 B13R1.15 CCC(C)CN[C@@H]1CCC[C@H](C1)C ea81c1ebc6dc6dd175e7a7388b33c8d0 [0,1,0,1,0,0|2,0,0]=4 17765 B13R1.15 CCC(C)CN[C@@H]1CCC[C@H](C1)O dbb07f85f9f6f2f73c2ca9ba6d99199b [0,1,0,1,0,0|1,0,0]=3 17766 B13R1.15 CCC(C)CN[C@@H]1COC[C@@H](C1)O 41bc19715b5c297efa28a1df8f83cb28 [0,1,0,1,0,0|2,0,0]=4 17767 B13R1.15 CCC(C)CN[C@H]1CCC[C@@H](C1)O 15e193793a63ce82471313b9e0da75be [0,1,0,1,0,0|1,0,0]=3 17768 B13R1.15 CCC(C)CN[C@H]1CCC[C@H](C1)O 5bf23b007433936275efac362f1ffd36 [0,1,0,1,0,0|1,0,0]=3 17769 B13R1.15 CCC(C)CN[C@H]1COC[C@H](C1)O d31edd46f73a29e6118a6a0be0778696 [0,1,0,1,0,0|2,0,0]=4 17770 B13R1.15 CCC(C)COC1CCCC(C1)C ba86d0c6e1ad72a1a19a9ff40613d74d [0,1,0,1,0,0|2,0,0]=4 17771 B13R1.15 CCC(C)CO[C@@H]1CCC[C@@H](C1)C 7de52af203a86ef5fc3cf8b31ddae6e6 [0,1,0,1,0,0|2,0,0]=4 17772 B13R1.15 CCC(C)CO[C@H]1CCC[C@@H](C1)C 8f2505421b4a8da315bb030cea1ff1e8 [0,1,0,1,0,0|2,0,0]=4 17773 B13R1.15 CCC(C)CO[C@H]1CCC[C@H](C1)C 10fdd9a1f0eef32ca7905ebd7b9ae0be [0,1,0,1,0,0|2,0,0]=4 17774 B13R1.15 CCC(C)NCC1CCCC(C1)C fa2968e01779ebe582992ab2749a2b90 [0,1,0,1,0,0|2,0,0]=4 17775 B13R1.15 CCC(C)NCC1CCCC(C1)O e8574b1fe106201cc03652347128381d [0,1,0,1,0,0|1,0,0]=3 17776 B13R1.15 CCC(C)NC[C@H]1CCC[C@H](C1)O df655e8031db06e3b1123a96c6178786 [0,1,0,1,0,0|1,0,0]=3 17777 B13R1.15 CCC(C)OCC1CCCC(C1)C 619ba929ba628de6a58973e46e9edb36 [0,1,0,1,0,0|2,0,0]=4 17778 B13R1.15 CCC(O)CNC1CCCC(C1)C a36abae68d02c85efb9f61d8a030df56 [0,1,0,1,0,0|2,0,0]=4 17779 B13R1.15 CCC(O)CNC1CCCC(C1)O fd680848240143827ca883a3a5d776c3 [0,1,0,1,0,0|1,0,0]=3 17780 B13R1.15 CCC(O)CNC1COCC(C1)O 3397a40a623c26e03638e4a823be6918 [0,1,0,1,0,0|2,0,0]=4 17781 B13R1.15 CCC(O)CN[C@@H]1CCC[C@@H](C1)O 2ca403b50813b938d9883dab6fcfa860 [0,1,0,1,0,0|1,0,0]=3 17782 B13R1.15 CCC(O)CN[C@@H]1CCC[C@H](C1)C 1d8172aa701ce14f55e98d14b19ff467 [0,1,0,1,0,0|2,0,0]=4 17783 B13R1.15 CCC(O)CN[C@@H]1CCC[C@H](C1)O a1d2142ffd4e0edc07c370650caf0c19 [0,1,0,1,0,0|1,0,0]=3 17784 B13R1.15 CCC(O)CN[C@@H]1COC[C@@H](C1)O 7f718c549f93d11f28eb1532ec537a8a [0,1,0,1,0,0|2,0,0]=4 17785 B13R1.15 CCC(O)CN[C@H]1CCC[C@@H](C1)O 09ad677a3b57b80a940ee318bb3799a3 [0,1,0,1,0,0|1,0,0]=3 17786 B13R1.15 CCC(O)CN[C@H]1CCC[C@H](C1)O 469265d9fe71f099b1bc3bcc900d73d7 [0,1,0,1,0,0|1,0,0]=3 17787 B13R1.15 CCC(O)CN[C@H]1COC[C@H](C1)O 0d43cf734dae5e7f37c6198afa787864 [0,1,0,1,0,0|2,0,0]=4 17788 B13R1.15 CCS(=O)CCN1CCCC(C1)O 853e7cf8386e2083f502a68d92a031db [0,1,0,1,0,0|2,0,0]=4 17789 B13R1.15 CCS(=O)CCN1CCC[C@@H](C1)O 6bb75ff9714f96cafe8b30b633015e64 [0,1,0,1,0,0|2,0,0]=4 17790 B13R1.15 CCS(=O)CCN1CCC[C@H](C1)O b70b3705f6515e1fad970ff76280e106 [0,1,0,1,0,0|2,0,0]=4 17791 B13R1.15 CC[C@@H](C)CNC1CCCC(C1)C 4c84465111128f2277b46dc45c06bf13 [0,1,0,1,0,0|2,0,0]=4 17792 B13R1.15 CC[C@@H](C)CNC1CCCC(C1)O 6db23c2842e55f1ecb3bbd49586a2e0c [0,1,0,1,0,0|1,0,0]=3 17793 B13R1.15 CC[C@@H](C)CNC1COCC(C1)O 3bcd504be45fcee3ff85c2da0c3a357b [0,1,0,1,0,0|2,0,0]=4 17794 B13R1.15 CC[C@@H](C)CN[C@@H]1CCC[C@@H](C1)O a43f6446e811821f42d8b7abc5f08326 [0,1,0,1,0,0|1,0,0]=3 17795 B13R1.15 CC[C@@H](C)CN[C@@H]1CCC[C@H](C1)C 68051d8c9d1c422bde1ad77256e6ffe8 [0,1,0,1,0,0|2,0,0]=4 17796 B13R1.15 CC[C@@H](C)CN[C@@H]1CCC[C@H](C1)O 3913831dce927909deceb8011137d007 [0,1,0,1,0,0|1,0,0]=3 17797 B13R1.15 CC[C@@H](C)CN[C@@H]1COC[C@@H](C1)O 477e5a2878f6616a2f60e7fbb1bd50b9 [0,1,0,1,0,0|2,0,0]=4 17798 B13R1.15 CC[C@@H](C)CN[C@H]1CCC[C@@H](C1)O bfb9802f7d56a98e19155350d4791819 [0,1,0,1,0,0|1,0,0]=3 17799 B13R1.15 CC[C@@H](C)CN[C@H]1CCC[C@H](C1)O d7595186c18593b15c98b467f72e62dd [0,1,0,1,0,0|1,0,0]=3 17800 B13R1.15 CC[C@@H](C)CN[C@H]1COC[C@H](C1)O 61e31653ac764289841235ce95056d54 [0,1,0,1,0,0|2,0,0]=4 17801 B13R1.15 CC[C@@H](C)COC1CCCC(C1)C 48d5c9eb46705e6d0beb2d2d1cbaed2b [0,1,0,1,0,0|2,0,0]=4 17802 B13R1.15 CC[C@@H](C)CO[C@@H]1CCC[C@@H](C1)C 78de78743fadc32bd0a4c40e4fe3e50c [0,1,0,1,0,0|2,0,0]=4 17803 B13R1.15 CC[C@@H](C)CO[C@H]1CCC[C@@H](C1)C 13f6df9b5505fb78e3184cdb5ccbf336 [0,1,0,1,0,0|2,0,0]=4 17804 B13R1.15 CC[C@@H](C)CO[C@H]1CCC[C@H](C1)C 0d6418f906aac344f78def4b2594be25 [0,1,0,1,0,0|2,0,0]=4 17805 B13R1.15 CC[C@H](C)CNC1CCCC(C1)C 57b000fa984b854ab32fefd02d5ebe55 [0,1,0,1,0,0|2,0,0]=4 17806 B13R1.15 CC[C@H](C)CNC1CCCC(C1)O 0a09668c3106ebe0997515efdabdc38e [0,1,0,1,0,0|1,0,0]=3 17807 B13R1.15 CC[C@H](C)CNC1COCC(C1)O d629e6566054d6eda50d0ca7f8813d69 [0,1,0,1,0,0|2,0,0]=4 17808 B13R1.15 CC[C@H](C)CN[C@@H]1CCC[C@@H](C1)O dfc4b563e25e51c06b6849ea8d39c9ad [0,1,0,1,0,0|1,0,0]=3 17809 B13R1.15 CC[C@H](C)CN[C@@H]1CCC[C@H](C1)C 6564baec63e645cbc25b4a8e03799470 [0,1,0,1,0,0|2,0,0]=4 17810 B13R1.15 CC[C@H](C)CN[C@@H]1CCC[C@H](C1)O efe720bfd85853c2ecb88db224ed7986 [0,1,0,1,0,0|1,0,0]=3 17811 B13R1.15 CC[C@H](C)CN[C@@H]1COC[C@@H](C1)O 0039c026e9f9433df425ac0ce538dab3 [0,1,0,1,0,0|2,0,0]=4 17812 B13R1.15 CC[C@H](C)CN[C@H]1CCC[C@@H](C1)O dfc8fdcdb1ea55d122e0561f3fd355df [0,1,0,1,0,0|1,0,0]=3 17813 B13R1.15 CC[C@H](C)CN[C@H]1CCC[C@H](C1)O 5039be87709891c14eb16e33c01bf080 [0,1,0,1,0,0|1,0,0]=3 17814 B13R1.15 CC[C@H](C)CN[C@H]1COC[C@H](C1)O 528f9f2a06b7e713b8d5dfdff049e11c [0,1,0,1,0,0|2,0,0]=4 17815 B13R1.15 CC[C@H](C)COC1CCCC(C1)C 268baffae02e937a77a51e9a177d873c [0,1,0,1,0,0|2,0,0]=4 17816 B13R1.15 CC[C@H](C)CO[C@@H]1CCC[C@@H](C1)C ecee076c911b11fc4d1349432687284b [0,1,0,1,0,0|2,0,0]=4 17817 B13R1.15 CC[C@H](C)CO[C@H]1CCC[C@@H](C1)C ce3430a2f740f739c9d2315178e0d741 [0,1,0,1,0,0|2,0,0]=4 17818 B13R1.15 CC[C@H](C)CO[C@H]1CCC[C@H](C1)C 728dee481810e8e4419eeb3721d92746 [0,1,0,1,0,0|2,0,0]=4 17819 B13R1.15 COC(C)CNC1CCCC(C1)O ecd4e78c874d6d5b9fc06fd9b97afcd3 [0,1,0,1,0,0|2,0,0]=4 17820 B13R1.15 COC(C)CN[C@@H]1CCC[C@@H](C1)O a28033c2437afe8c68eac19bd4116d01 [0,1,0,1,0,0|2,0,0]=4 17821 B13R1.15 COC(C)CN[C@@H]1CCC[C@H](C1)O 99575cefa93b4a008741de5d48645c68 [0,1,0,1,0,0|2,0,0]=4 17822 B13R1.15 COC(C)CN[C@H]1CCC[C@@H](C1)O e331d7442efdbd981e3dcb930da4d664 [0,1,0,1,0,0|2,0,0]=4 17823 B13R1.15 COC(C)CN[C@H]1CCC[C@H](C1)O 209344fa6446a330646741455a730c90 [0,1,0,1,0,0|2,0,0]=4 17824 B13R1.15 CO[C@@H](C)CNC1CCCC(C1)O f60a08127a448a9bd6753b5d92eb0204 [0,1,0,1,0,0|2,0,0]=4 17825 B13R1.15 CO[C@@H](C)CN[C@@H]1CCC[C@@H](C1)O 7ec2182ae1b8fbf93b9eb2905e547a59 [0,1,0,1,0,0|2,0,0]=4 17826 B13R1.15 CO[C@@H](C)CN[C@@H]1CCC[C@H](C1)O be91f96524b7b5b7ab6a1e5376b9fa1d [0,1,0,1,0,0|2,0,0]=4 17827 B13R1.15 CO[C@@H](C)CN[C@H]1CCC[C@@H](C1)O 648ffdd903e0fb972aed27be0e807c3f [0,1,0,1,0,0|2,0,0]=4 17828 B13R1.15 CO[C@@H](C)CN[C@H]1CCC[C@H](C1)O 2787b54749afcf5d0b0ea54195cd15dd [0,1,0,1,0,0|2,0,0]=4 17829 B13R1.15 CO[C@H](C)CNC1CCCC(C1)O be019d67099b3598aa9cf547b11e986a [0,1,0,1,0,0|2,0,0]=4 17830 B13R1.15 CO[C@H](C)CN[C@@H]1CCC[C@@H](C1)O c79704ad6319867027f86fdbc7bdd0ed [0,1,0,1,0,0|2,0,0]=4 17831 B13R1.15 CO[C@H](C)CN[C@@H]1CCC[C@H](C1)O a3a4d3975d5767962a036cb2a26c2038 [0,1,0,1,0,0|2,0,0]=4 17832 B13R1.15 CO[C@H](C)CN[C@H]1CCC[C@@H](C1)O 1e072d3de680e3a1cf6ffe9b366b8431 [0,1,0,1,0,0|2,0,0]=4 17833 B13R1.15 CO[C@H](C)CN[C@H]1CCC[C@H](C1)O be1f93c596dd7e176cc95d9608fc3a7b [0,1,0,1,0,0|2,0,0]=4 17834 B13R1.15 C[C@@H](CO)CNC1CCCC(C1)O 1691287772500bbd579fddd9c729fb72 [0,1,0,1,0,0|2,0,0]=4 17835 B13R1.15 C[C@@H](CO)CN[C@@H]1CCC[C@@H](C1)O b6e31ef23c32283e1e1086f0ed7ca80c [0,1,0,1,0,0|2,0,0]=4 17836 B13R1.15 C[C@@H](CO)CN[C@@H]1CCC[C@H](C1)O 55dd591ae332fd39c395c0cadc5672f6 [0,1,0,1,0,0|2,0,0]=4 17837 B13R1.15 C[C@@H](CO)CN[C@H]1CCC[C@@H](C1)O 692e9b71c1a802dbb438bf8763def1cf [0,1,0,1,0,0|2,0,0]=4 17838 B13R1.15 C[C@@H](CO)CN[C@H]1CCC[C@H](C1)O 363ea8953923bc4b92e7dd8b896b46a6 [0,1,0,1,0,0|2,0,0]=4 17839 B13R1.15 C[C@@H](CO)NCC1CCCC(C1)O 28a6fcb10cf489fca68bd2a704ae63b9 [0,1,0,1,0,0|2,0,0]=4 17840 B13R1.15 C[C@@H](CO)NC[C@H]1CCC[C@H](C1)O a967f3b80b859007675cdcccd6743756 [0,1,0,1,0,0|2,0,0]=4 17841 B13R1.15 C[C@H](CO)CNC1CCCC(C1)O ac8e38ba4205630d94923d9e8a9f7801 [0,1,0,1,0,0|2,0,0]=4 17842 B13R1.15 C[C@H](CO)CN[C@@H]1CCC[C@@H](C1)O 6724102c413b393d8118e13b55db6dc4 [0,1,0,1,0,0|2,0,0]=4 17843 B13R1.15 C[C@H](CO)CN[C@@H]1CCC[C@H](C1)O 51ac4d3d3be1303347fa937bbe39062b [0,1,0,1,0,0|2,0,0]=4 17844 B13R1.15 C[C@H](CO)CN[C@H]1CCC[C@@H](C1)O c5c2ceb72787a6f170a1c607d6ba014f [0,1,0,1,0,0|2,0,0]=4 17845 B13R1.15 C[C@H](CO)CN[C@H]1CCC[C@H](C1)O e4e5b75e23e4b4951bf3ce30fb9b9428 [0,1,0,1,0,0|2,0,0]=4 17846 B13R1.15 C[C@H](CO)NCC1CCCC(C1)O e6a000aea0a42fdc3e7ed068abdf21e9 [0,1,0,1,0,0|2,0,0]=4 17847 B13R1.15 C[C@H](CO)NC[C@H]1CCC[C@H](C1)O d9c12554ec7020b900beaeb2cb59fa6c [0,1,0,1,0,0|2,0,0]=4 17848 B13R1.15 OC(CF)CNC1CCCC(C1)O 8ecc17c6cd7e249460f587f51a9e7153 [0,1,0,1,0,0|2,0,0]=4 17849 B13R1.15 OC(CF)CN[C@@H]1CCC[C@@H](C1)O e4ba8b16cdb0d1135c0d1376398cb5b3 [0,1,0,1,0,0|2,0,0]=4 17850 B13R1.15 OC(CF)CN[C@@H]1CCC[C@H](C1)O 859f883c64cd43b8787cc8c0b19f179e [0,1,0,1,0,0|2,0,0]=4 17851 B13R1.15 OC(CF)CN[C@H]1CCC[C@@H](C1)O 49ec2bf00dc3db752c15b0239f4d5e8b [0,1,0,1,0,0|2,0,0]=4 17852 B13R1.15 OC(CF)CN[C@H]1CCC[C@H](C1)O 40d7f210ada694442be55335fa83bfed [0,1,0,1,0,0|2,0,0]=4 17853 B13R1.15 OCC(O)CNC1CCCC(C1)O 45604d817516a8f72ab98a6cad488ea0 [0,1,0,1,0,0|2,0,0]=4 17854 B13R1.15 OCC(O)CN[C@@H]1CCC[C@@H](C1)O 0b14f6ac1b4ee6f4d45b33ad70715586 [0,1,0,1,0,0|2,0,0]=4 17855 B13R1.15 OCC(O)CN[C@@H]1CCC[C@H](C1)O a281c9eda643ee5ed6f5d0e9f174b764 [0,1,0,1,0,0|2,0,0]=4 17856 B13R1.15 OCC(O)CN[C@H]1CCC[C@@H](C1)O 065690e879d54f0f16a6873bd7e04e83 [0,1,0,1,0,0|2,0,0]=4 17857 B13R1.15 OCC(O)CN[C@H]1CCC[C@H](C1)O 1d3dac2a91240ec3e99ddd4cfae2ee71 [0,1,0,1,0,0|2,0,0]=4 17858 B13R1.15 OC[C@@H](O)CNC1CCCC(C1)O 2847652dd40bb77d0474a23b781d8765 [0,1,0,1,0,0|2,0,0]=4 17859 B13R1.15 OC[C@@H](O)CN[C@@H]1CCC[C@@H](C1)O 86a60a32f9ab7664251399f66699d066 [0,1,0,1,0,0|2,0,0]=4 17860 B13R1.15 OC[C@@H](O)CN[C@@H]1CCC[C@H](C1)O f4ce14c2f5c0efa51f9917c3a1a0e2b0 [0,1,0,1,0,0|2,0,0]=4 17861 B13R1.15 OC[C@@H](O)CN[C@H]1CCC[C@@H](C1)O 5ab867c80e4f183c869e6136d5fa2e09 [0,1,0,1,0,0|2,0,0]=4 17862 B13R1.15 OC[C@@H](O)CN[C@H]1CCC[C@H](C1)O 9240637459b352c814a61dbf1d70fd56 [0,1,0,1,0,0|2,0,0]=4 17863 B13R1.15 OC[C@H](O)CNC1CCCC(C1)O 7243118d5e7e408c883dc7ecf69d6c32 [0,1,0,1,0,0|2,0,0]=4 17864 B13R1.15 OC[C@H](O)CN[C@@H]1CCC[C@@H](C1)O 67043b8e512833947a44e64c04ea1223 [0,1,0,1,0,0|2,0,0]=4 17865 B13R1.15 OC[C@H](O)CN[C@@H]1CCC[C@H](C1)O 2dd34171277eac79f774f6f7d2529d0f [0,1,0,1,0,0|2,0,0]=4 17866 B13R1.15 OC[C@H](O)CN[C@H]1CCC[C@@H](C1)O c61f5084fe916ce3bf13e199f7e533d8 [0,1,0,1,0,0|2,0,0]=4 17867 B13R1.15 OC[C@H](O)CN[C@H]1CCC[C@H](C1)O a6a56efc91f417cd3ff54cdd3da2c431 [0,1,0,1,0,0|2,0,0]=4 17868 B13R1.60 CC(O)CCCN1CCC(C1)CO 71282cc504a93f45ddbbf0afb5a72a0a [0,1,0,1,0,0|2,0,0]=4 17869 B13R1.60 CC(O)CCCN1CC[C@@H](C1)CO d471bc3ecaca5b08c542043f96eae1dc [0,1,0,1,0,0|2,0,0]=4 17870 B13R1.60 CC(O)CCCN1CC[C@H](C1)CO b2f83f47fed92cbf5166b61523992eaa [0,1,0,1,0,0|2,0,0]=4 17871 B13R1.60 CC(O)CCNC1CCC(C1)CO 42f3f76301d87cf76e42aab344ff1ebd [0,1,0,1,0,0|2,0,0]=4 17872 B13R1.60 CC(O)CCN[C@@H]1CC[C@@H](C1)CO dfd42668af0b0849c9d16d238b40ecb0 [0,1,0,1,0,0|2,0,0]=4 17873 B13R1.60 CC(O)CCN[C@@H]1CC[C@H](C1)CO ca7778adf420cf0ac08e70c2efd7ac0e [0,1,0,1,0,0|2,0,0]=4 17874 B13R1.60 CC(O)CCN[C@H]1CC[C@@H](C1)CO bb205bc9c60837cef8fa9015a958cbd3 [0,1,0,1,0,0|2,0,0]=4 17875 B13R1.60 CC(O)CCN[C@H]1CC[C@H](C1)CO 6ece09d364d95030ffaed8ab68fb1a59 [0,1,0,1,0,0|2,0,0]=4 17876 B13R1.60 CCC1CCN(C1)CCCC(C)C 79d7a9b132038574d4b6d7d1f63bb680 [0,1,0,1,0,0|2,0,0]=4 17877 B13R1.60 CCC1CCN(C1)CCCC(C)O 4e852a11d34711989e5d3c0619a94ddc [0,1,0,1,0,0|1,0,0]=3 17878 B13R1.60 CCN1CCC(C1)CNCC(C)O a6823ec240a219e48a9cc0972f3e2b0b [0,1,0,1,0,0|2,0,0]=4 17879 B13R1.60 CCN1CCC(C1)CNC[C@@H](C)O 7da42e5cc0f3186fc485fc72a00fdb1e [0,1,0,1,0,0|2,0,0]=4 17880 B13R1.60 CCN1CCC(C1)CNC[C@H](C)O 5c7b7cfd37dc42659ef98304e1c4e8fa [0,1,0,1,0,0|2,0,0]=4 17881 B13R1.60 CCN1CCC(C1)NCCC(C)O 466afd77f2a5a70e79627ea61e98a0c8 [0,1,0,1,0,0|2,0,0]=4 17882 B13R1.60 CCN1CCC(C1)NCC[C@@H](C)O 2c0b4e7aaada9f45bad2e60165211a48 [0,1,0,1,0,0|2,0,0]=4 17883 B13R1.60 CCN1CCC(C1)NCC[C@H](C)O 5e997f39423f58554a3a0ecaae509662 [0,1,0,1,0,0|2,0,0]=4 17884 B13R1.60 CCN1CC[C@@H](C1)NCCC(C)O 12acd8b44e4c38aa19bec3249ea28ed9 [0,1,0,1,0,0|2,0,0]=4 17885 B13R1.60 CCN1CC[C@H](C1)CNCC(C)O 66493da8b7ec75b4a29ef374296c0b5d [0,1,0,1,0,0|2,0,0]=4 17886 B13R1.60 CCN1CC[C@H](C1)CNC[C@@H](C)O d37161edc183b52b2c2defea5a5ac2a0 [0,1,0,1,0,0|2,0,0]=4 17887 B13R1.60 CCN1CC[C@H](C1)CNC[C@H](C)O 10f35d731df9024ef899c5749954688f [0,1,0,1,0,0|2,0,0]=4 17888 B13R1.60 CCN1CC[C@H](C1)NCCC(C)O 807f30aa69d299187ead213860f7baef [0,1,0,1,0,0|2,0,0]=4 17889 B13R1.60 COC1CCC(C1)NCCC(C)O 3f53be5b6e2626957d8c13ef7d6519cc [0,1,0,1,0,0|2,0,0]=4 17890 B13R1.60 COC1CCC(C1)NCC[C@@H](C)O a851995867bbe129647630e6111ade5b [0,1,0,1,0,0|2,0,0]=4 17891 B13R1.60 COC1CCC(C1)NCC[C@H](C)O 45d8285830bbe7f13d8b6ef726b5a85c [0,1,0,1,0,0|2,0,0]=4 17892 B13R1.60 COC1CCN(C1)CCCC(C)O 0d95450a0237268cfdb3bce240be3961 [0,1,0,1,0,0|2,0,0]=4 17893 B13R1.60 CO[C@@H]1CCN(C1)CCCC(C)O 08221c4d17126d272c9163ff9a9594b4 [0,1,0,1,0,0|2,0,0]=4 17894 B13R1.60 CO[C@H]1CCN(C1)CCCC(C)O 472a999ebbfd660fdc9c0923846bc16f [0,1,0,1,0,0|2,0,0]=4 17895 B13R1.60 CO[C@H]1CC[C@H](C1)NCCC(C)O bd45df4582b99973c5d5cafbfd18fcab [0,1,0,1,0,0|2,0,0]=4 17896 B13R1.150 CC(C)CCN1CCCC(C1C)O 294583e18b08721a499e2985fbb6fb9c [0,1,0,1,0,0|2,0,0]=4 17897 B13R1.150 CC(C)CCN1CCC[C@@H]([C@H]1C)O 5216e3c6e9355b3b0e569d398198e0fd [0,1,0,1,0,0|2,0,0]=4 17898 B13R1.150 CC(C)CCN1CCC[C@H]([C@@H]1C)O 95c246d52e0b7a1218fa33e43cdba0b9 [0,1,0,1,0,0|2,0,0]=4 17899 B13R1.150 CC(C)CNC1CCCC(C1C)C 779705df2592498227f42a5ad6a85fb3 [0,1,0,1,0,0|2,0,0]=4 17900 B13R1.150 CC(C)COC1CCCC(C1C)C d49192f7f4fab6419906d66edf700cf9 [0,1,0,1,0,0|2,0,0]=4 17901 B13R1.150 CC(O)CCN1CCCC(C1C)O e8b56945d28c04972a2feb764f54b52a [0,1,0,1,0,0|1,0,0]=3 17902 B13R1.150 CC(O)CCN1CCC[C@@H]([C@H]1C)O 05de0324419cab59ac40243558a7cb23 [0,1,0,1,0,0|1,0,0]=3 17903 B13R1.150 CC(O)CCN1CCC[C@H]([C@@H]1C)O 231d441b95552065d167c72b71914ad1 [0,1,0,1,0,0|1,0,0]=3 17904 B13R1.150 CC(O)CCN1CCOC(C1C)C e9772404690dd776d522b98fdfaa6f7b [0,1,0,1,0,0|2,0,0]=4 17905 B13R1.150 CC(O)CNC1CCCC(C1C)C 8d0d75aba459d76b06a6912a7a8b8e6c [0,1,0,1,0,0|1,0,0]=3 17906 B13R1.150 CC1CCCC(C1C)NC[C@@H](C)O 5fc56baa1d844245eb58a54c1e7a0a3e [0,1,0,1,0,0|1,0,0]=3 17907 B13R1.150 CC1CCCC(C1C)NC[C@H](C)O f6c423b3eec3062fea730364dd8b35e3 [0,1,0,1,0,0|1,0,0]=3 17908 B13R1.198 CC(=O)CCCCCNC1CC1C 0294d3898eab50c0ab1f7094b67116e2 [0,1,0,1,0,0|0,0,2]=4 17909 B13R1.198 CC(=O)CCCCOCC1CC1C 8bcd59a335c2dc7838a86cfc85b1c8d9 [0,1,0,1,0,0|0,0,2]=4 17910 B13R1.198 CC(=O)CCCCOC[C@@H]1C[C@@H]1C c15eb5a91639856e58555dba642629b2 [0,1,0,1,0,0|0,0,2]=4 17911 B13R1.198 CC(=O)CCCCOC[C@@H]1C[C@H]1C e6eeeb13ca8e0e797e20a734a8ed492b [0,1,0,1,0,0|0,0,2]=4 17912 B13R1.198 CC(=O)CCCCOC[C@H]1C[C@@H]1C b44df4b5c9356fc80bfed717b2c756bc [0,1,0,1,0,0|0,0,2]=4 17913 B13R1.198 CC(C)CCCCCNC1CC1C e907a73c5e1ddd6480d0b4ade670633d [0,1,0,1,0,0|1,0,0]=3 17914 B13R1.198 CC(C)CCCCCN[C@@H]1C[C@H]1F 109e19bb8d49987cc31901b2cd77f90f [0,1,0,1,0,0|2,0,0]=4 17915 B13R1.198 CC(C)CCCCCN[C@H]1C[C@@H]1F b151a9a5d52ac3b66feccc2baf704b7b [0,1,0,1,0,0|2,0,0]=4 17916 B13R1.198 CC(C)CCCCCN[C@H]1C[C@H]1F 535fb3dc87931c709350d234a0feaa7c [0,1,0,1,0,0|2,0,0]=4 17917 B13R1.198 CC(C)CCCCOCC1CC1C cb89b1e9f1c2f0c90adad85f030e0ef1 [0,1,0,1,0,0|1,0,0]=3 17918 B13R1.198 CC(C)CCCCOC[C@@H]1C[C@@H]1C e12666690253c0a4be500cd3c9bebe47 [0,1,0,1,0,0|1,0,0]=3 17919 B13R1.198 CC(C)CCCCOC[C@@H]1C[C@@H]1F 193fc83da512cbd94d4328e5eba1c654 [0,1,0,1,0,0|2,0,0]=4 17920 B13R1.198 CC(C)CCCCOC[C@@H]1C[C@H]1C 745b034b634191cef9f5e279b6dcfd2e [0,1,0,1,0,0|1,0,0]=3 17921 B13R1.198 CC(C)CCCCOC[C@@H]1C[C@H]1F a2bb4ebd5e11e28c87b539d20ec5de13 [0,1,0,1,0,0|2,0,0]=4 17922 B13R1.198 CC(C)CCCCOC[C@H]1C[C@@H]1C d5541a8c6d8f8585861b96f01aec1498 [0,1,0,1,0,0|1,0,0]=3 17923 B13R1.198 CC(C)CCCCOC[C@H]1C[C@@H]1F 60dd4cb841a6e833e768f7e0d6ed9125 [0,1,0,1,0,0|2,0,0]=4 17924 B13R1.198 CC(C)CCCCOC[C@H]1C[C@H]1F 9e1896dc33908851e63d09903e877e8f [0,1,0,1,0,0|2,0,0]=4 17925 B13R1.198 CC(C)COCCOCC1CC1C 8735413bb996817375c30fa5ce92d12f [0,1,0,1,0,0|2,0,0]=4 17926 B13R1.198 CC(C)COCCOC[C@@H]1C[C@@H]1C 36297642c24b8c0206499b82b8844f45 [0,1,0,1,0,0|2,0,0]=4 17927 B13R1.198 CC(C)COCCOC[C@@H]1C[C@H]1C 7d1f609bb0e1185385f765bc4e577eed [0,1,0,1,0,0|2,0,0]=4 17928 B13R1.198 CC(C)COCCOC[C@H]1C[C@@H]1C fd92c879711a797a27cd6e71a1724556 [0,1,0,1,0,0|2,0,0]=4 17929 B13R1.198 CC1CC1COCCCCC(=O)O 82025db2fdf03cce4d6c7488f51ace4d [0,1,0,1,0,0|1,0,1]=4 17930 B13R1.198 CC1CC1COCCCCN(C)C eef7296c8973c4ec66d015621286dad5 [0,1,0,1,0,0|2,0,0]=4 17931 B13R1.198 CC1CC1NCCCCCC(=O)O a9fdf29bedcc401bde731fad563d057d [0,1,0,1,0,0|1,0,1]=4 17932 B13R1.198 CC1CC1NCCCCCC(F)F 27e5c5984e1482319bef8452427d51df [0,1,0,1,0,0|2,0,0]=4 17933 B13R1.198 C[C@@H]1C[C@H]1COCCCCC(=O)O 6fc3f08065a56ed699c253dfa653beed [0,1,0,1,0,0|1,0,1]=4 17934 B13R1.198 C[C@@H]1C[C@H]1COCCCCN(C)C 5daf814baa9aac04d5918ed11746cea9 [0,1,0,1,0,0|2,0,0]=4 17935 B13R1.198 C[C@H]1C[C@@H]1COCCCCC(=O)O ae7c4f29b6068fe5386ad5040f091a18 [0,1,0,1,0,0|1,0,1]=4 17936 B13R1.198 C[C@H]1C[C@@H]1COCCCCN(C)C e0235b4fd5e734afebea97e457002a3d [0,1,0,1,0,0|2,0,0]=4 17937 B13R1.198 C[C@H]1C[C@H]1COCCCCC(=O)O 74b26c82add38a59e96127b321bd16a6 [0,1,0,1,0,0|1,0,1]=4 17938 B13R1.198 C[C@H]1C[C@H]1COCCCCN(C)C 93a631a080401100ea5323dabdff16ac [0,1,0,1,0,0|2,0,0]=4 17939 B13R1.297 CC(=O)CCCCN[C@@H]1CC[C@H]1C b40be7b2b1007d36d3b7a5eb0dc4daec [0,1,0,1,0,0|0,0,2]=4 17940 B13R1.297 CC(=O)CCCCN[C@H]1CC[C@H]1C 71a000e78e22b29df5401c396f78309d [0,1,0,1,0,0|0,0,2]=4 17941 B13R1.297 CC(C)CCCCNC1CCC1F 7dfea3532fd0472fe09bd7c46013e72b [0,1,0,1,0,0|2,0,0]=4 17942 B13R1.297 CC(C)CCCCNC1CCC1O 6be7997d210b0a0fcbb9eed0d8001df0 [0,1,0,1,0,0|2,0,0]=4 17943 B13R1.297 CC(C)CCCCNC1COC1C 0d2f5aeab8812668c26a1ca1b6062e5b [0,1,0,1,0,0|2,0,0]=4 17944 B13R1.297 CC(C)CCCCN[C@@H]1CC[C@@H]1O 65b55581c4867a8da89914d76e20d6ba [0,1,0,1,0,0|2,0,0]=4 17945 B13R1.297 CC(C)CCCCN[C@@H]1CC[C@H]1C e3f96a671e928627a341cf4b18bf2f07 [0,1,0,1,0,0|1,0,0]=3 17946 B13R1.297 CC(C)CCCCN[C@@H]1CC[C@H]1O 9c0424ad2e8d16a663acaa1efab4164a [0,1,0,1,0,0|2,0,0]=4 17947 B13R1.297 CC(C)CCCCN[C@H]1CC[C@@H]1O 17a23fd6f6904efb31b1bdef0f312b03 [0,1,0,1,0,0|2,0,0]=4 17948 B13R1.297 CC(C)CCCCN[C@H]1CC[C@H]1C bbb66af688e9bb0dd1fec66b7573a89a [0,1,0,1,0,0|1,0,0]=3 17949 B13R1.297 CC(C)CCCCN[C@H]1CC[C@H]1O 5477d24356b83f1e47cedd6b63044b20 [0,1,0,1,0,0|2,0,0]=4 17950 B13R1.297 CC(C)CCCCOC1COC1C d9f0e59b296f80a7a02ced22ca552ae9 [0,1,0,1,0,0|2,0,0]=4 17951 B13R1.297 CC(C)CCCNCC1CCN1C bbbef86618d405f7e19401137e14da4f [0,1,0,1,0,0|2,0,0]=4 17952 B13R1.297 CC(C)CCCOCC1CCC1F a18e0dbb2c4d6327f35c489f967d351f [0,1,0,1,0,0|2,0,0]=4 17953 B13R1.297 CC(C)CCCOCC1CCN1C 3b7936e6cde2792be963bf0c4f5c0d4c [0,1,0,1,0,0|2,0,0]=4 17954 B13R1.297 CC(C)CCCOC[C@@H]1CCN1C 656954ed1763b480d1778a1b6f16006f [0,1,0,1,0,0|2,0,0]=4 17955 B13R1.297 CC(C)CCCOC[C@H]1CCN1C 7ec6eba66b8521228ff87532bb01810f [0,1,0,1,0,0|2,0,0]=4 17956 B13R1.297 CC(C)COCCN[C@@H]1CC[C@H]1C e710b823db9e4018c2abd18d70792c16 [0,1,0,1,0,0|2,0,0]=4 17957 B13R1.297 CC(C)COCCN[C@H]1CC[C@H]1C c61713c2f80482e4ef9cf66e377ba6a2 [0,1,0,1,0,0|2,0,0]=4 17958 B13R1.297 CC(O)CCCCNC1CCC1F 4026353e3dd684db7cba0e7eee29193f [0,1,0,1,0,0|1,0,0]=3 17959 B13R1.297 CC(O)CCCCNC1CCC1O 256c565141030b6a11437d1c1869d1fc [0,1,0,1,0,0|1,0,0]=3 17960 B13R1.297 CC(O)CCCCNC1COC1C 35fb4d5b31421772049e2fa5fbaa3181 [0,1,0,1,0,0|1,0,0]=3 17961 B13R1.297 CC(O)CCCCN[C@@H]1CC[C@@H]1O d8c6a2f1da82a92a8f14cec484c12ad4 [0,1,0,1,0,0|1,0,0]=3 17962 B13R1.297 CC(O)CCCCN[C@@H]1CC[C@H]1C 419cc0a96babaecddb645c58982b200f [0,1,0,1,0,0|0,0,0]=2 17963 B13R1.297 CC(O)CCCCN[C@@H]1CC[C@H]1O 951ea1a71a18b4d5a3c68f8faa48c1da [0,1,0,1,0,0|1,0,0]=3 17964 B13R1.297 CC(O)CCCCN[C@H]1CC[C@@H]1O 3a5f6ff551a9379742b30aa3c3c85e78 [0,1,0,1,0,0|1,0,0]=3 17965 B13R1.297 CC(O)CCCCN[C@H]1CC[C@H]1C 4017bfc249ecdce7d2dada2a0b32b4cb [0,1,0,1,0,0|0,0,0]=2 17966 B13R1.297 CC(O)CCCCN[C@H]1CC[C@H]1O 461aaa6f50e50e6fa54e483b0d8060d5 [0,1,0,1,0,0|1,0,0]=3 17967 B13R1.297 CC(O)CCCNCC1CCN1C 901161c04542857b5245142c3c6e3685 [0,1,0,1,0,0|1,0,0]=3 17968 B13R1.297 CC(O)CCNCCC1CCC1=O e0e577d5dcc05f8ddeb2adf969cfa6c2 [0,1,0,1,0,0|1,0,1]=4 17969 B13R1.297 CC1OCC1NCCCC[C@@H](C)O b7ba1b470c5607f4aba3c07bb76cb7bd [0,1,0,1,0,0|1,0,0]=3 17970 B13R1.297 C[C@@H](O)CCCCNC1CCC1F f7170561f2469679d17dd324d2493255 [0,1,0,1,0,0|1,0,0]=3 17971 B13R1.297 C[C@@H](O)CCCCNC1CCC1O 0ae8b9c82ed25698e6ecb70a4689e0fa [0,1,0,1,0,0|1,0,0]=3 17972 B13R1.297 C[C@@H](O)CCCCN[C@@H]1CC[C@@H]1O fa6b6b544217090b93ef56aeb02790d9 [0,1,0,1,0,0|1,0,0]=3 17973 B13R1.297 C[C@@H](O)CCCCN[C@@H]1CC[C@H]1O 29f40298a4894843d16adc296c0e27c7 [0,1,0,1,0,0|1,0,0]=3 17974 B13R1.297 C[C@@H](O)CCCCN[C@H]1CC[C@@H]1O 07a5db90632227e2b97d5b025cf852b6 [0,1,0,1,0,0|1,0,0]=3 17975 B13R1.297 C[C@@H](O)CCCCN[C@H]1CC[C@H]1O fa73f0f902328ca93014d53609934eee [0,1,0,1,0,0|1,0,0]=3 17976 B13R1.297 C[C@@H](O)CCNCCC1CCC1=O ab2bd34a9a7da996edad243d37deba2a [0,1,0,1,0,0|1,0,1]=4 17977 B13R1.297 C[C@@H]1CC[C@@H]1NCCCCC(=O)O 21154fd80bbefdce333f5bd45933acc0 [0,1,0,1,0,0|1,0,1]=4 17978 B13R1.297 C[C@@H]1CC[C@@H]1NCCCCN(C)C bbd1a7092fab7a822aea4e3dd11cd45c [0,1,0,1,0,0|2,0,0]=4 17979 B13R1.297 C[C@@H]1CC[C@@H]1NCCCC[C@@H](C)O ee9a94ce825d327f29aace07fe60d758 [0,1,0,1,0,0|0,0,0]=2 17980 B13R1.297 C[C@@H]1CC[C@H]1NCCCCC(=O)O 37845ef947b63f6143c6acceb288e7c2 [0,1,0,1,0,0|1,0,1]=4 17981 B13R1.297 C[C@@H]1CC[C@H]1NCCCCN(C)C cfde7acf9dc078e89c2a63c86a715858 [0,1,0,1,0,0|2,0,0]=4 17982 B13R1.297 C[C@@H]1CC[C@H]1NCCCC[C@@H](C)O c7fd4852d299205e1958f7300c691818 [0,1,0,1,0,0|0,0,0]=2 17983 B13R1.297 C[C@H](O)CCNCCC1CCC1=O de36dc79f662d8c4086eeb123537ac6c [0,1,0,1,0,0|1,0,1]=4 17984 B13R1.513 C=C1CCC(CC1)CNCC(C)O 96876238e18267780693b62a135b6243 [0,1,0,1,0,0|1,0,1]=4 17985 B13R1.513 C=C1CCC(CC1)CNC[C@@H](C)O 92b2e8a58d4a6afd82cd5e0ff44b2861 [0,1,0,1,0,0|1,0,1]=4 17986 B13R1.513 C=C1CCC(CC1)CNC[C@H](C)O 7b6dfe997f028e0e683a35e819861d6a [0,1,0,1,0,0|1,0,1]=4 17987 B13R1.513 CC(C)CCCN1CCC(CC1)C 727b8533ebe158bdac890beff9c68200 [0,1,0,1,0,0|2,0,0]=4 17988 B13R1.513 CC(C)CCCN1CCC(CC1)Cl 032d598a58bff754a43678d121f23e99 [0,1,0,1,0,0|2,0,0]=4 17989 B13R1.513 CC(C)CCCN1CCC(CC1)F f9fc1c0a57c661357bafc0e29a772030 [0,1,0,1,0,0|2,0,0]=4 17990 B13R1.513 CC(C)CCCN1CCC(CC1)I 69044ed7ab07acc3ee94fc627d19f4fa [0,1,0,1,0,0|2,0,0]=4 17991 B13R1.513 CC(C)CCCN1CCC(CC1)O cb8db63f97bba1b3a4ffcc5a440bf67c [0,1,0,1,0,0|2,0,0]=4 17992 B13R1.513 CC(C)CCNC1CCC(CC1)C 7ab684ccebdae80c6b29b7528bf19874 [0,1,0,1,0,0|2,0,0]=4 17993 B13R1.513 CC(C)CCNC1CCC(CC1)Cl 1f94464b5725ffec61330d3daac22393 [0,1,0,1,0,0|2,0,0]=4 17994 B13R1.513 CC(C)CCNC1CCC(CC1)O cf434ec0a267ca660228699223e31e5e [0,1,0,1,0,0|2,0,0]=4 17995 B13R1.513 CC(C)CCN[C@H]1CC[C@@H](CC1)C 29750bf069aff3786cc6fca9421becf6 [0,1,0,1,0,0|2,0,0]=4 17996 B13R1.513 CC(C)CCN[C@H]1CC[C@@H](CC1)Cl 0a7b730866ad73e84415e33f23538325 [0,1,0,1,0,0|2,0,0]=4 17997 B13R1.513 CC(C)CCN[C@H]1CC[C@@H](CC1)O f4aae5f129e09d43517385985717de82 [0,1,0,1,0,0|2,0,0]=4 17998 B13R1.513 CC(C)CCN[C@H]1CC[C@H](CC1)C 024e6d692d0490b6a415e7697f5f814c [0,1,0,1,0,0|2,0,0]=4 17999 B13R1.513 CC(C)CCN[C@H]1CC[C@H](CC1)Cl 9f0c1bf2b681ea9ae3bba6b9a14db1e9 [0,1,0,1,0,0|2,0,0]=4 18000 B13R1.513 CC(C)CCN[C@H]1CC[C@H](CC1)O 124e5044e8879cc290955c1e47450de0 [0,1,0,1,0,0|2,0,0]=4 18001 B13R1.513 CC(C)CCOC1CCC(CC1)C 95c02e338d17875e90cd44c427272884 [0,1,0,1,0,0|2,0,0]=4 18002 B13R1.513 CC(C)CCOC1CCC(CC1)F 8486a31a1facd877c567e81ec8511d86 [0,1,0,1,0,0|2,0,0]=4 18003 B13R1.513 CC(C)CCO[C@H]1CC[C@@H](CC1)C 2ed4214782a37ed44800866c64aed91d [0,1,0,1,0,0|2,0,0]=4 18004 B13R1.513 CC(C)CCO[C@H]1CC[C@H](CC1)C 8a21ff357dbc547654a4236ebdcc232d [0,1,0,1,0,0|2,0,0]=4 18005 B13R1.513 CC(C)CNCC1CCC(CC1)C a571b81da08258e0614f5ad2b7f342d8 [0,1,0,1,0,0|2,0,0]=4 18006 B13R1.513 CC(C)CNCC1CCC(CC1)Cl c2e66150708847c140020418557a8961 [0,1,0,1,0,0|2,0,0]=4 18007 B13R1.513 CC(C)CNCC1CCC(CC1)O bddfa44f128d1cfe92fc1ec37ae60040 [0,1,0,1,0,0|2,0,0]=4 18008 B13R1.513 CC(C)CNC[C@H]1CC[C@@H](CC1)F 3128f632652fa65ad28b97b2b05cf48c [0,1,0,1,0,0|2,0,0]=4 18009 B13R1.513 CC(C)CNC[C@H]1CC[C@@H](CC1)O eaba0929196552a65a71f973c498e654 [0,1,0,1,0,0|2,0,0]=4 18010 B13R1.513 CC(C)CNC[C@H]1CC[C@H](CC1)F 3f76bf6c922b0d408a0014a6cfc43fd0 [0,1,0,1,0,0|2,0,0]=4 18011 B13R1.513 CC(C)COCC1CCC(CC1)C be85e4266b8f6b29b2493ef106e663fe [0,1,0,1,0,0|2,0,0]=4 18012 B13R1.513 CC(C)COC[C@H]1CC[C@@H](CC1)C 44457620eb1e00a484676cdcd18de25e [0,1,0,1,0,0|2,0,0]=4 18013 B13R1.513 CC(C)COC[C@H]1CC[C@H](CC1)C f5a1f7042578c97efb152064a9a624f1 [0,1,0,1,0,0|2,0,0]=4 18014 B13R1.513 CC(C)NCCC1CCC(CC1)O fc108c915426b54ee94452dabff0c1b8 [0,1,0,1,0,0|2,0,0]=4 18015 B13R1.513 CC(C)OCC[C@H]1CC[C@@H](CC1)C 525d699665a320a11def03b90cfde0e3 [0,1,0,1,0,0|2,0,0]=4 18016 B13R1.513 CC(F)COCC1CCC(CC1)C 383bc89ad3e5b871d7e5dc263ab32d97 [0,1,0,1,0,0|2,0,0]=4 18017 B13R1.513 CC(O)CCCN1CCC(CC1)C 47ac7e0fd39102386b7e17fbb6e50fda [0,1,0,1,0,0|1,0,0]=3 18018 B13R1.513 CC(O)CCCN1CCC(CC1)Cl a52495a69c10dd36537dbf7ef2284b4e [0,1,0,1,0,0|1,0,0]=3 18019 B13R1.513 CC(O)CCCN1CCC(CC1)F 974fe5b9aa8411c0d9b567f8369480ed [0,1,0,1,0,0|1,0,0]=3 18020 B13R1.513 CC(O)CCCN1CCC(CC1)I 01a3e46f0e114f2ec4f76a6e0e34c02e [0,1,0,1,0,0|1,0,0]=3 18021 B13R1.513 CC(O)CCCN1CCC(CC1)O d4ec83f5122b566bf0b7b634c182a81c [0,1,0,1,0,0|1,0,0]=3 18022 B13R1.513 CC(O)CCCN1CCN(CC1)C 985ed272c92f80f27144c417cdf5a353 [0,1,0,1,0,0|2,0,0]=4 18023 B13R1.513 CC(O)CCNC1CCC(CC1)C a4e05ff8940593d90c008acc5c642ea7 [0,1,0,1,0,0|1,0,0]=3 18024 B13R1.513 CC(O)CCNC1CCC(CC1)Cl 528d61528ca72b8e2020f72b4addfdab [0,1,0,1,0,0|1,0,0]=3 18025 B13R1.513 CC(O)CCNC1CCC(CC1)O 8150138763d6a3ff86b7d5cd57036d21 [0,1,0,1,0,0|1,0,0]=3 18026 B13R1.513 CC(O)CCNC1CCN(CC1)C 8a3303d76f047318dbc1371720bca0a3 [0,1,0,1,0,0|2,0,0]=4 18027 B13R1.513 CC(O)CCN[C@H]1CC[C@@H](CC1)C 114f97b116b6775243656ea01788b35e [0,1,0,1,0,0|1,0,0]=3 18028 B13R1.513 CC(O)CCN[C@H]1CC[C@@H](CC1)Cl 19633106d9760063aa91956fa9ec92a1 [0,1,0,1,0,0|1,0,0]=3 18029 B13R1.513 CC(O)CCN[C@H]1CC[C@@H](CC1)O 3996924ab17938891c66bc3bc0a1038f [0,1,0,1,0,0|1,0,0]=3 18030 B13R1.513 CC(O)CCN[C@H]1CC[C@H](CC1)C e5ab64e9c5250c725163668de3b6d0bb [0,1,0,1,0,0|1,0,0]=3 18031 B13R1.513 CC(O)CCN[C@H]1CC[C@H](CC1)Cl fb78ade380fedaa3b5f73f685ce6bcbb [0,1,0,1,0,0|1,0,0]=3 18032 B13R1.513 CC(O)CCN[C@H]1CC[C@H](CC1)O f9340650ae2f95e94625111ddc2426e8 [0,1,0,1,0,0|1,0,0]=3 18033 B13R1.513 CC(O)CNCC1CCC(=O)CC1 9c03d415380a1796f00ff7ccd4e021f4 [0,1,0,1,0,0|1,0,1]=4 18034 B13R1.513 CC(O)CNCC1CCC(CC1)C 13cd893b1a76600190f548c844007aaa [0,1,0,1,0,0|1,0,0]=3 18035 B13R1.513 CC(O)CNCC1CCC(CC1)Cl f05dcbe294aa6f5a1e98485a56e09233 [0,1,0,1,0,0|1,0,0]=3 18036 B13R1.513 CC(O)CNCC1CCC(CC1)O 665bb2e495d53e418b89990e64a1aa2e [0,1,0,1,0,0|1,0,0]=3 18037 B13R1.513 CC(O)CNCC1CCN(CC1)C 76f7465164c9ade677d240df6527e2ff [0,1,0,1,0,0|2,0,0]=4 18038 B13R1.513 CC(O)CNC[C@H]1CC[C@@H](CC1)F e2e5f712adf1a9654dc1215949f05e5b [0,1,0,1,0,0|1,0,0]=3 18039 B13R1.513 CC(O)CNC[C@H]1CC[C@@H](CC1)O e57e0633f0b8cb08258724ff8ca713a9 [0,1,0,1,0,0|1,0,0]=3 18040 B13R1.513 CC(O)CNC[C@H]1CC[C@H](CC1)F 3b2e0c153c2bdeec1c6a93c0ec00cccd [0,1,0,1,0,0|1,0,0]=3 18041 B13R1.513 CC(S)COCC1CCC(CC1)C f35cbb6257e639df58457d69a980879a [0,1,0,1,0,0|1,1,0]=4 18042 B13R1.513 CC1CCC(CC1)CNC[C@@H](C)O 1553732067d41ef563de5a4d6e3db365 [0,1,0,1,0,0|1,0,0]=3 18043 B13R1.513 CC1CCC(CC1)CNC[C@H](C)O e41561079ad072c71ec4675f48d0354a [0,1,0,1,0,0|1,0,0]=3 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C[C@@H](O)CNC[C@H]1CC[C@@H](CC1)F c9b799da1bd61eba1da52548b8696f9e [0,1,0,1,0,0|1,0,0]=3 18055 B13R1.513 C[C@@H](O)CNC[C@H]1CC[C@@H](CC1)O f102c465dfefe1eaa9ce3172d63f6509 [0,1,0,1,0,0|1,0,0]=3 18056 B13R1.513 C[C@@H](O)CNC[C@H]1CC[C@H](CC1)F 4c0bb03618488bfc9e6ffa959ade4edb [0,1,0,1,0,0|1,0,0]=3 18057 B13R1.513 C[C@H](O)CCNC1CCC(CC1)O 0c85e094768094556091f82745e7463f [0,1,0,1,0,0|1,0,0]=3 18058 B13R1.513 C[C@H](O)CCNC1CCN(CC1)C e5dbb90f71d5e63ed15ab21387cb0fbf [0,1,0,1,0,0|2,0,0]=4 18059 B13R1.513 C[C@H](O)CNCC1CCC(=O)CC1 600b525ff368ceed06d9e4d7a26dc1b5 [0,1,0,1,0,0|1,0,1]=4 18060 B13R1.513 C[C@H](O)CNCC1CCC(CC1)Cl 2e6f38429f5a818f0f122900bd9c8259 [0,1,0,1,0,0|1,0,0]=3 18061 B13R1.513 C[C@H](O)CNCC1CCC(CC1)O 932beb4ee1bdac258f37c0b697abca6f [0,1,0,1,0,0|1,0,0]=3 18062 B13R1.513 C[C@H](O)CNCC1CCN(CC1)C 021776789d8972b235ab35c7b2979f83 [0,1,0,1,0,0|2,0,0]=4 18063 B13R1.513 C[C@H](O)CNC[C@H]1CC[C@@H](CC1)F 478e01a3d4b16e58d58308d81b9be32d [0,1,0,1,0,0|1,0,0]=3 18064 B13R1.513 C[C@H](O)CNC[C@H]1CC[C@@H](CC1)O 58a48e4436fb360ab202c45303b0c03e [0,1,0,1,0,0|1,0,0]=3 18065 B13R1.513 C[C@H](O)CNC[C@H]1CC[C@H](CC1)F 2d3ddb28f379350fb6d9a8463d73bf2f [0,1,0,1,0,0|1,0,0]=3 18066 B13R1.530 CC(CO)CCCNC1CC(C1)O dfb3baaacdd6a8d56b25dab8940d199a [0,1,0,1,0,0|2,0,0]=4 18067 B13R1.530 CC(CO)CCNCC1CC(C1)O 7bc265b3d41607367ba96b6f8d698a90 [0,1,0,1,0,0|2,0,0]=4 18068 B13R1.530 CC(CO)CCNC[C@H]1C[C@@H](C1)O 3ac2347d43f72916a68064b0b551addd [0,1,0,1,0,0|2,0,0]=4 18069 B13R1.530 CC(CO)CCNC[C@H]1C[C@H](C1)O a373ac7d980be3b7d86bb75523666169 [0,1,0,1,0,0|2,0,0]=4 18070 B13R1.530 CCC(=O)CCCCN1CC(C1)O 4e048ca8bfaecc96297443734c770c54 [0,1,0,1,0,0|1,0,1]=4 18071 B13R1.530 CCC(C)CCNCC1CC(C1)C fd013640829a07c5ad5d3f0eaf35d53d [0,1,0,1,0,0|2,0,0]=4 18072 B13R1.530 CCC(C)CCNCC1CC(C1)O 835f8f23ad19546a0a32e11da3a632e5 [0,1,0,1,0,0|1,0,0]=3 18073 B13R1.530 CCC(C)CCNC[C@H]1C[C@@H](C1)O 67a4c6aecfc7107ae0ad6dba3dc56165 [0,1,0,1,0,0|1,0,0]=3 18074 B13R1.530 CCC(C)CCNC[C@H]1C[C@H](C1)F 9274d3b1f2df785c726d4d21ba00a655 [0,1,0,1,0,0|2,0,0]=4 18075 B13R1.530 CCC(C)CCNC[C@H]1C[C@H](C1)O f82ac6f26e1a957048cbcb14d6670543 [0,1,0,1,0,0|1,0,0]=3 18076 B13R1.530 CCC(C)CCOCC1CC(C1)C 6049054d1f3709108e06f13edfe90b58 [0,1,0,1,0,0|2,0,0]=4 18077 B13R1.530 CCC(C)CCOCC1CC(C1)F 91d8def37bd2985a3f66a262eb27de22 [0,1,0,1,0,0|2,0,0]=4 18078 B13R1.530 CCC(C)CCOC[C@H]1C[C@@H](C1)C de1f65e5cca8997f9a9c90fbf8ed921b [0,1,0,1,0,0|2,0,0]=4 18079 B13R1.530 CCC(C)CCOC[C@H]1C[C@H](C1)F ce8058b123be54592dc7db2cd9a2e67f [0,1,0,1,0,0|2,0,0]=4 18080 B13R1.530 CCC(C)CNCCN1CC(C1)O 156b86229c3f1f8a715b3cfe8849b5e9 [0,1,0,1,0,0|2,0,0]=4 18081 B13R1.530 CCC(C)NCCCN1CC(C1)O 995282fa3a5ed57266d74b73e49437ee [0,1,0,1,0,0|2,0,0]=4 18082 B13R1.530 CCC(O)CNCCN1CC(C1)O 340a3ac55210bc64c1d03996cc5fe0ec [0,1,0,1,0,0|2,0,0]=4 18083 B13R1.530 CCC(S)CCOCC1CC(C1)C 9cea1d7954cfb5ed9f083f1f92b7e382 [0,1,0,1,0,0|2,0,0]=4 18084 B13R1.530 CCC(S)CCOC[C@H]1C[C@H](C1)F a431d955f351c141768b0d358c6e43af [0,1,0,1,0,0|2,0,0]=4 18085 B13R1.530 CCN(C)CCCNC1CC(C1)O 11aa88d48fa76bb3fa41048046d5207f [0,1,0,1,0,0|2,0,0]=4 18086 B13R1.530 CCS(=O)CCNCC1CC(C1)O 4f6bcd3bd6bbe2b24830d958da4f76d0 [0,1,0,1,0,0|2,0,0]=4 18087 B13R1.530 CCS(=O)CCNC[C@H]1C[C@@H](C1)O ddd4839290c12aaf328594430632d230 [0,1,0,1,0,0|2,0,0]=4 18088 B13R1.530 CCS(=O)CCNC[C@H]1C[C@H](C1)O 14646fc58f4d97eaea221fe2e16785b2 [0,1,0,1,0,0|2,0,0]=4 18089 B13R1.530 CC[C@@H](C)CNCCN1CC(C1)O 341f310444643d47a0e9ad0ccd92b0bb [0,1,0,1,0,0|2,0,0]=4 18090 B13R1.530 CC[C@H](C)CCOCC1CC(C1)C abe2a50717f56d417c9d94a83d174557 [0,1,0,1,0,0|2,0,0]=4 18091 B13R1.530 CC[C@H](C)CCOC[C@H]1C[C@H](C1)F fa29f712e56f0d2710db85d64eb43ff1 [0,1,0,1,0,0|2,0,0]=4 18092 B13R1.530 CC[C@H](C)CNCCN1CC(C1)O d1df613bd962b26f1281d6ef921b173e [0,1,0,1,0,0|2,0,0]=4 18093 B13R1.530 C[C@@H](CO)CCNCC1CC(C1)O 2f06fdebc608eaff7b3e5f4590b8537d [0,1,0,1,0,0|2,0,0]=4 18094 B13R1.530 OCC(O)CCNCC1CC(C1)O 7bb4ef8cb837ff822f98f5ff347e8c0f [0,1,0,1,0,0|2,0,0]=4 18095 B13R1.551 CCC(C)N1CCCC1CC(C)C c14c6fc0f1e092ffe28ae344640d0a84 [0,1,0,1,0,0|2,0,0]=4 18096 B13R1.586 C=C(C)CCCNCCC1CCC1 66644ac594a500b02aabee69923db904 [0,1,0,1,0,0|1,0,1]=4 18097 B13R1.586 C=C(C)CCCOCCC1CCC1 4627803b009fb58e6379b02050f56393 [0,1,0,1,0,0|1,0,1]=4 18098 B13R1.586 C=C(C)CCOCCCC1CCC1 096d94a163588ffe6c50e8f3b8cacb47 [0,1,0,1,0,0|1,0,1]=4 18099 B13R1.586 CC(=O)CCCCCNC1CCC1 353ba0cf69cd2d4021f21ffc2f4e194f [0,1,0,1,0,0|0,0,2]=4 18100 B13R1.586 CC(=O)CCCCCOC1CCC1 1a691aa651e57d539a9967b1fc03179e [0,1,0,1,0,0|0,0,2]=4 18101 B13R1.586 CC(=O)CCCCNCC1CCC1 7a3ec919ee4aa79618e879e938d2467a [0,1,0,1,0,0|0,0,2]=4 18102 B13R1.586 CC(=O)CCCCOCC1CCC1 56671f5e4b1fe510f454d2d7d843f672 [0,1,0,1,0,0|0,0,2]=4 18103 B13R1.586 CC(=O)CCCNCCC1CCC1 4760eca560a79a1716f0c77604c58757 [0,1,0,1,0,0|0,0,2]=4 18104 B13R1.586 CC(=O)CCCOCCC1CCC1 a002bac941db3f191db4a6c6975d6c42 [0,1,0,1,0,0|0,0,2]=4 18105 B13R1.586 CC(=O)CCOCCCC1CCC1 99e64b7b30d0a04300ea4779d7a88de8 [0,1,0,1,0,0|0,0,2]=4 18106 B13R1.586 CC(C)CCCCCNC1CCC1 94ed6b125e2b7c70d9bb56bee9a1e08a [0,1,0,1,0,0|1,0,0]=3 18107 B13R1.586 CC(C)CCCCCNC1COC1 181127037fadcb33cdf8a7cfbb8b6116 [0,1,0,1,0,0|2,0,0]=4 18108 B13R1.586 CC(C)CCCCCOC1CCC1 2ce4e2806ac82af0906359e0fb231965 [0,1,0,1,0,0|1,0,0]=3 18109 B13R1.586 CC(C)CCCCCOC1COC1 85a0922528587182089470e89ccbc99e [0,1,0,1,0,0|2,0,0]=4 18110 B13R1.586 CC(C)CCCCCOC1CSC1 f6d9676ee8b15f59aa0f87a9790e2cc3 [0,1,0,1,0,0|2,0,0]=4 18111 B13R1.586 CC(C)CCCCNCC1CCC1 ee4dce8f7ce29b78883180ba38363435 [0,1,0,1,0,0|1,0,0]=3 18112 B13R1.586 CC(C)CCCCNCC1CCO1 6964a51d7061345c6d89b08118748ddf [0,1,0,1,0,0|2,0,0]=4 18113 B13R1.586 CC(C)CCCCNCC1COC1 e88c25dc94afe8084b7e9546106f9eb9 [0,1,0,1,0,0|2,0,0]=4 18114 B13R1.586 CC(C)CCCCNC[C@@H]1CCO1 367ea1b840a467b6803a805087085ad1 [0,1,0,1,0,0|2,0,0]=4 18115 B13R1.586 CC(C)CCCCNC[C@H]1CCO1 1016e54a49db87f3131db13635d59e17 [0,1,0,1,0,0|2,0,0]=4 18116 B13R1.586 CC(C)CCCCOCC1CCC1 f80fd81f9613222a5c7e4af010a1d6e7 [0,1,0,1,0,0|1,0,0]=3 18117 B13R1.586 CC(C)CCCCOCC1CCO1 2e3be9ec0329a28889574a8ac46762bd [0,1,0,1,0,0|2,0,0]=4 18118 B13R1.586 CC(C)CCCCOCC1COC1 32cf92d4844c7625ec193f7a30947e8b [0,1,0,1,0,0|2,0,0]=4 18119 B13R1.586 CC(C)CCCCOCC1CSC1 60dcf25ffad4d549f4f4ef121aab8b7a [0,1,0,1,0,0|2,0,0]=4 18120 B13R1.586 CC(C)CCCCOC[C@@H]1CCO1 f3f1873c55d88c481be0fb8d7e4f0ebc [0,1,0,1,0,0|2,0,0]=4 18121 B13R1.586 CC(C)CCCCOC[C@H]1CCO1 aba2642e320c8f9f96b9d1fd788e6977 [0,1,0,1,0,0|2,0,0]=4 18122 B13R1.586 CC(C)CCCNCCC1CCC1 239d5bfd51b10a5312084c7867a32fcf [0,1,0,1,0,0|1,0,0]=3 18123 B13R1.586 CC(C)CCCNCCC1CCO1 535b357a59c2757ee21a96c6e8c5b69a [0,1,0,1,0,0|2,0,0]=4 18124 B13R1.586 CC(C)CCCNCCC1COC1 220171e27f012e9bb669637785bc2d29 [0,1,0,1,0,0|2,0,0]=4 18125 B13R1.586 CC(C)CCCNCCN1CCC1 dd7d364518573e23b6812680e5dd6de9 [0,1,0,1,0,0|2,0,0]=4 18126 B13R1.586 CC(C)CCCNCC[C@@H]1CCO1 2d739dff612bd427d89940c600dbb923 [0,1,0,1,0,0|2,0,0]=4 18127 B13R1.586 CC(C)CCCOCCC1CCC1 2b88ddd6e95a5df18f5a6fccdd53fe34 [0,1,0,1,0,0|1,0,0]=3 18128 B13R1.586 CC(C)CCCOCCC1CCO1 296be7173f4bfbe88846fbc93c0b0694 [0,1,0,1,0,0|2,0,0]=4 18129 B13R1.586 CC(C)CCCOCCC1COC1 74c7cdc9f61f9e57a16e93957aed5121 [0,1,0,1,0,0|2,0,0]=4 18130 B13R1.586 CC(C)CCCOCCN1CCC1 7334dd3131228dc40abb496bd1bd9631 [0,1,0,1,0,0|2,0,0]=4 18131 B13R1.586 CC(C)CCCOCC[C@@H]1CCO1 731b6d8b3b42f03a75803c859e4ace0c [0,1,0,1,0,0|2,0,0]=4 18132 B13R1.586 CC(C)CCCOCC[C@H]1CCO1 4f5a6879ffa4b8cf553b5a8e9d91a17a [0,1,0,1,0,0|2,0,0]=4 18133 B13R1.586 CC(C)CCNCCCN1CCC1 54096e92ab6686a0d908654911806f39 [0,1,0,1,0,0|2,0,0]=4 18134 B13R1.586 CC(C)CCNCCOC1CCC1 4099a00eb85418a724cdecd735541532 [0,1,0,1,0,0|2,0,0]=4 18135 B13R1.586 CC(C)CCOCCCC1CCC1 5bacf24d4c140d2d65f073e7678d6043 [0,1,0,1,0,0|1,0,0]=3 18136 B13R1.586 CC(C)CCOCCCC1COC1 45c62b5c7b8ac03c053a3979a9cdd34f [0,1,0,1,0,0|2,0,0]=4 18137 B13R1.586 CC(C)CCOCCCN1CCC1 024d6bb6a2e5fd15f29d5af21b45e17d [0,1,0,1,0,0|2,0,0]=4 18138 B13R1.586 CC(C)CCOCCOC1CCC1 0d0ba3cb6f8f15421e51cbc3d9af966e [0,1,0,1,0,0|2,0,0]=4 18139 B13R1.586 CC(C)COCCCNC1CCC1 bb6961a3dfa60663103374fd196beecd [0,1,0,1,0,0|2,0,0]=4 18140 B13R1.586 CC(C)COCCCOC1CCC1 f4602ca85365134441da21330d12d45a [0,1,0,1,0,0|2,0,0]=4 18141 B13R1.586 CC(C)COCCNCC1CCC1 cf5f3c50a5652bcf0fba0234d08b0531 [0,1,0,1,0,0|2,0,0]=4 18142 B13R1.586 CC(C)COCCOCC1CCC1 52bfdf340abfae5fd5c57f94ae171dbf [0,1,0,1,0,0|2,0,0]=4 18143 B13R1.586 CC(C)CSCCCOC1CCC1 531dc112424baa00ce7505f899c25886 [0,1,0,1,0,0|2,0,0]=4 18144 B13R1.586 CC(C)CSCCOCC1CCC1 bfb9af002dbff9f2d858277d15e348a0 [0,1,0,1,0,0|2,0,0]=4 18145 B13R1.586 CC(C)OCCCNCC1CCC1 91ee6bf627bceaa289cbf0a6b1ebb2aa [0,1,0,1,0,0|2,0,0]=4 18146 B13R1.586 CC(C)OCCCOCC1CCC1 84099fcc6e5cd973c611e61a9aef09da [0,1,0,1,0,0|2,0,0]=4 18147 B13R1.586 CC(C)OCCNCCC1CCC1 1f760876b6211b21698d69dd16c6ceef [0,1,0,1,0,0|2,0,0]=4 18148 B13R1.586 CC(C)OCCOCCC1CCC1 404d6e4618ebefd431999c5e8cd55e9e [0,1,0,1,0,0|2,0,0]=4 18149 B13R1.586 CC(C)OCOCCCC1CCC1 aea78e3c53b7253c9d80b90e6bafab10 [0,1,0,1,0,0|2,0,0]=4 18150 B13R1.586 CC(C)SCCCNCC1CCC1 428e00f05804fcb0b32685310470534e [0,1,0,1,0,0|2,0,0]=4 18151 B13R1.586 CC(C)SCCCOCC1CCC1 dd064605d1063e03429557f7cc297193 [0,1,0,1,0,0|2,0,0]=4 18152 B13R1.586 CC(C)SCCNCCC1CCC1 a90badb58646e8aab5206f458fcc32ff [0,1,0,1,0,0|2,0,0]=4 18153 B13R1.586 CC(C)SCCOCCC1CCC1 a47a249958d2dbcf64c5febc9c1f284a [0,1,0,1,0,0|2,0,0]=4 18154 B13R1.586 CC(O)CCCCNCC1CCC1 58dc10e139a0618840cd86294aaefaf7 [0,1,0,1,0,0|0,0,0]=2 18155 B13R1.586 CC(O)CCCCNCC1CCO1 37bca8130ccb95f94765d1a173343c7b [0,1,0,1,0,0|1,0,0]=3 18156 B13R1.586 CC(O)CCCCNCC1COC1 d736bb6419145d082cb1d62cc17f3604 [0,1,0,1,0,0|1,0,0]=3 18157 B13R1.586 CC(O)CCCCNC[C@@H]1CCO1 f43a29cd0ebebf50c3d857b8f8c1f881 [0,1,0,1,0,0|1,0,0]=3 18158 B13R1.586 CC(O)CCCCNC[C@H]1CCO1 f95713715bb17885ac1ce032fd3938f4 [0,1,0,1,0,0|1,0,0]=3 18159 B13R1.586 CC(O)CCCNCCC1CCC1 5a5f8e249c6ec5298b3928a6977b7b9f [0,1,0,1,0,0|0,0,0]=2 18160 B13R1.586 CC(O)CCCNCCC1CCO1 27607b371907a840085366b8383a460e [0,1,0,1,0,0|1,0,0]=3 18161 B13R1.586 CC(O)CCCNCCC1COC1 d26051ba80cd0a01b631b74ed7fcfc53 [0,1,0,1,0,0|1,0,0]=3 18162 B13R1.586 CC(O)CCCNCCN1CCC1 7c1c0239a78dbacebe77a1753cb8c035 [0,1,0,1,0,0|1,0,0]=3 18163 B13R1.586 CC(O)CCCNCC[C@@H]1CCO1 884e3fba297b1a63b9f82559bb66de22 [0,1,0,1,0,0|1,0,0]=3 18164 B13R1.586 CC(O)CCNCCCN1CCC1 d8330219c0189c7a4a5d37221b047dcc [0,1,0,1,0,0|1,0,0]=3 18165 B13R1.586 CC(O)CCNCCOC1CCC1 0aca348db65223636d38ded5e2c4c76b [0,1,0,1,0,0|1,0,0]=3 18166 B13R1.586 CN(C)CCCCCNC1CCC1 ba83e3e5d28e398ebd7d39eb84a58e4b [0,1,0,1,0,0|2,0,0]=4 18167 B13R1.586 CN(C)CCCCCOC1CCC1 b9cf39b756279867dee9a51dc48f83a4 [0,1,0,1,0,0|2,0,0]=4 18168 B13R1.586 CN(C)CCCCNCC1CCC1 e85cb79e9e4eb9792d51e52abf89348a [0,1,0,1,0,0|2,0,0]=4 18169 B13R1.586 CN(C)CCCCOCC1CCC1 98ae101651457f0f1951209e29ecd915 [0,1,0,1,0,0|2,0,0]=4 18170 B13R1.586 CN(C)CCCNCCC1CCC1 db7cb8db64013522b76c34c06f6879b8 [0,1,0,1,0,0|2,0,0]=4 18171 B13R1.586 CN(C)CCCOCCC1CCC1 4fc3d00044b47d93b37f0658a0f249f6 [0,1,0,1,0,0|2,0,0]=4 18172 B13R1.586 CN(C)CCOCCCC1CCC1 f988673da4047e42f8057f8e93c697fb [0,1,0,1,0,0|2,0,0]=4 18173 B13R1.586 CS(=O)CCCNCCC1CCC1 29222aa2005a33f8477655523cc3d842 [0,1,0,1,0,0|1,0,1]=4 18174 B13R1.586 CS(=O)CCOCCCC1CCC1 a966646c0ab02eca7df850099b22ad78 [0,1,0,1,0,0|1,0,1]=4 18175 B13R1.586 C[C@@H](O)CCCCNCC1CCC1 74b56b766182ed1806910274dcd24ef3 [0,1,0,1,0,0|0,0,0]=2 18176 B13R1.586 C[C@@H](O)CCCCNCC1CCO1 d3f2967f0d3630246485572ef4e972d1 [0,1,0,1,0,0|1,0,0]=3 18177 B13R1.586 C[C@@H](O)CCCCNCC1COC1 906df7aec9f71684e630c8b23cdabb71 [0,1,0,1,0,0|1,0,0]=3 18178 B13R1.586 C[C@@H](O)CCCCNC[C@@H]1CCO1 ec7f15e11fb2de303b3f6abb579e648a [0,1,0,1,0,0|1,0,0]=3 18179 B13R1.586 C[C@@H](O)CCCCNC[C@H]1CCO1 f8c0735d0e800e29667a468e569adb97 [0,1,0,1,0,0|1,0,0]=3 18180 B13R1.586 C[C@@H](O)CCNCCOC1CCC1 35884b2af0dd7bdf2af4ae3bd38b577b [0,1,0,1,0,0|1,0,0]=3 18181 B13R1.586 C[C@H](O)CCNCCOC1CCC1 ef35517e2e922fe2d54c50c70c8d8792 [0,1,0,1,0,0|1,0,0]=3 18182 B13R1.586 FC(F)CCCCCNC1CCC1 842bb6327a9319bfdf01a4929bae25df [0,1,0,1,0,0|2,0,0]=4 18183 B13R1.586 FC(F)CCCCCOC1CCC1 2b43395381f9cd948886e78b3bc25c04 [0,1,0,1,0,0|2,0,0]=4 18184 B13R1.586 FC(F)CCCCNCC1CCC1 1ea6ed9854e63e4e21d85f97fb1e38fb [0,1,0,1,0,0|2,0,0]=4 18185 B13R1.586 O=C(O)CCCCCNC1CCC1 1f11b742e92af36a50b91d1c10018dc7 [0,1,0,1,0,0|1,0,1]=4 18186 B13R1.586 O=C(O)CCCCCOC1CCC1 83bdfc9af9b5b76de697dae7ce6f91cf [0,1,0,1,0,0|1,0,1]=4 18187 B13R1.586 O=C(O)CCCCNCC1CCC1 fd6b90481cc4401105cfe42d3b62cfe4 [0,1,0,1,0,0|1,0,1]=4 18188 B13R1.586 O=C(O)CCCCOCC1CCC1 48418b33c90d313fb601c34d13ed3001 [0,1,0,1,0,0|1,0,1]=4 18189 B13R1.586 O=C(O)CCCNCCC1CCC1 74e340dbb04c0ec783abd443f16a22e9 [0,1,0,1,0,0|1,0,1]=4 18190 B13R1.586 O=C(O)CCOCCCC1CCC1 8c70b3ef4e434128cebf751c3896f6e1 [0,1,0,1,0,0|1,0,1]=4 18191 B13R1.594 C#CC(O)CCCCCNC1CC1 aed871e2c11360ee909a84e6c152db10 [0,1,0,1,0,0|1,0,1]=4 18192 B13R1.594 CC(CO)CCCNCCC1CC1 d54066c3650fc5b8dcf1cc9667e4299b [0,1,0,1,0,0|1,0,0]=3 18193 B13R1.594 CC(CO)CCNCCOC1CC1 c072d500ca4018dbeca3b65cac74cd4d [0,1,0,1,0,0|2,0,0]=4 18194 B13R1.594 CC(CO)CNCCSCC1CC1 cb8e68bef976830547e03cfea86f1439 [0,1,0,1,0,0|2,0,0]=4 18195 B13R1.594 CC(CO)NCCCOCC1CC1 b7157330da6c8a7dfa1852781eb00cf7 [0,1,0,1,0,0|2,0,0]=4 18196 B13R1.594 CCC(C)CCCCCOC1CC1 85d4a3b5237534a66322808496d216e4 [0,1,0,1,0,0|2,0,0]=4 18197 B13R1.594 CCC(C)CCCCOCC1CC1 58187a8ee6608aec9ef07e3272765fb6 [0,1,0,1,0,0|2,0,0]=4 18198 B13R1.594 CCC(C)CCCOCCC1CC1 60bbd6842747042b77e7330800129261 [0,1,0,1,0,0|2,0,0]=4 18199 B13R1.594 CCC(C)CCOCCCC1CC1 041ec1d1063567a8f947bf22720ce9c8 [0,1,0,1,0,0|2,0,0]=4 18200 B13R1.594 CCC(O)CNCCSCC1CC1 75fa0db463338ca349bd93097d6087f1 [0,1,0,1,0,0|2,0,0]=4 18201 B13R1.594 CC[C@H](C)CCCCCOC1CC1 2404ef8e150f13a7e854a4255d7c6410 [0,1,0,1,0,0|2,0,0]=4 18202 B13R1.594 CC[C@H](C)CCCCOCC1CC1 647fd35a726ce9cc0654122307b160cf [0,1,0,1,0,0|2,0,0]=4 18203 B13R1.594 CC[C@H](C)CCCOCCC1CC1 8ee5d682fb0cba450e9258469300aeda [0,1,0,1,0,0|2,0,0]=4 18204 B13R1.594 COC(C)CCOCCOC1CC1 1d11c018e793ff29cb73bd1d91df7df2 [0,1,0,1,0,0|2,0,0]=4 18205 B13R1.594 COC(C)CNCCSCC1CC1 9b03fd41fe368f3cb7091ec261f5b6eb [0,1,0,1,0,0|2,0,0]=4 18206 B13R1.594 COC(C)COCCCSC1CC1 18a45e55906b0225937c16db295f2c6a [0,1,0,1,0,0|2,0,0]=4 18207 B13R1.594 COC(C)COCCOCC1CC1 a40f51a8cf6df727982153cf829cfd3b [0,1,0,1,0,0|2,0,0]=4 18208 B13R1.594 CO[C@@H](C)CNCCSCC1CC1 b887bbb6d0425765058bb018f4b2ac0d [0,1,0,1,0,0|2,0,0]=4 18209 B13R1.594 CO[C@@H](C)COCCCSC1CC1 1f19256b690cf9d48537f21806e0e63c [0,1,0,1,0,0|2,0,0]=4 18210 B13R1.594 CO[C@@H](C)COCCOCC1CC1 c4f9f2c2ac4d2371fea517496b89c622 [0,1,0,1,0,0|2,0,0]=4 18211 B13R1.594 CO[C@H](C)CNCCSCC1CC1 847fe69c90d65363b3e89d34de4b3036 [0,1,0,1,0,0|2,0,0]=4 18212 B13R1.594 CO[C@H](C)COCCCSC1CC1 a86f39ffdf13cd59cc9e7a95c015d269 [0,1,0,1,0,0|2,0,0]=4 18213 B13R1.594 CO[C@H](C)COCCOCC1CC1 ff4e90e5967506a3ba1a60b08aac3931 [0,1,0,1,0,0|2,0,0]=4 18214 B13R1.594 C[C@@H](CO)CCNCCOC1CC1 3a81c22528d8d0947287c5b92f6899c4 [0,1,0,1,0,0|2,0,0]=4 18215 B13R1.594 C[C@@H](CO)CNCCSCC1CC1 e4204fa2ef1081b9e4f054cfba6d267f [0,1,0,1,0,0|2,0,0]=4 18216 B13R1.594 C[C@@H](CO)NCCCOCC1CC1 d0ccc13a9d18a56bf4e3c0093a4b5086 [0,1,0,1,0,0|2,0,0]=4 18217 B13R1.594 C[C@H](CO)CNCCSCC1CC1 98ab8a8f72127a3e5ea385bf9fe9dec3 [0,1,0,1,0,0|2,0,0]=4 18218 B13R1.594 C[C@H](CO)NCCCOCC1CC1 ed9850935f1f13bc829935851d0fafa4 [0,1,0,1,0,0|2,0,0]=4 18219 B13R1.594 OC(CF)CNCCSCC1CC1 6b75e531c21b0507c5fb7409fc778a74 [0,1,0,1,0,0|2,0,0]=4 18220 B13R1.594 OCC(O)CCNCCOC1CC1 1fc7d88e4f9db09d1c649b85e7d9e24f [0,1,0,1,0,0|2,0,0]=4 18221 B13R1.594 OCC(O)CNCCSCC1CC1 069d9cbaad62821d7bd19154b9562d54 [0,1,0,1,0,0|2,0,0]=4 18222 B13R1.594 OCC(O)COCCCSC1CC1 e4b121406c5aaf55b07211b30c7f6d42 [0,1,0,1,0,0|2,0,0]=4 18223 B13R1.594 OCC(O)COCCOCC1CC1 de881bdbe6c941b877d2be95b97a81b8 [0,1,0,1,0,0|2,0,0]=4 18224 B13R1.594 OC[C@@H](O)CNCCSCC1CC1 9116be475bdec0da66ac0613319bf815 [0,1,0,1,0,0|2,0,0]=4 18225 B13R1.594 OC[C@@H](O)COCCCSC1CC1 5fb357e7ddf19904ef98808f95246577 [0,1,0,1,0,0|2,0,0]=4 18226 B13R1.594 OC[C@@H](O)COCCOCC1CC1 031fbb1f4896531f1ba279f72f66112e [0,1,0,1,0,0|2,0,0]=4 18227 B13R1.594 OC[C@H](O)CNCCSCC1CC1 7660fa4a38b6557b4199f515129d4733 [0,1,0,1,0,0|2,0,0]=4 18228 B13R1.594 OC[C@H](O)COCCCSC1CC1 557353bfbbec1d190526b0d401d9acf3 [0,1,0,1,0,0|2,0,0]=4 18229 B13R1.594 OC[C@H](O)COCCOCC1CC1 6cb8e63df1c1392e4f53491894840853 [0,1,0,1,0,0|2,0,0]=4 18230 B13R1.598 C=C(CC)CNC1CCCC1(C)O b229d5b6e58ab5cf20538c70e71f98c1 [0,1,0,1,0,0|1,0,1]=4 18231 B13R1.598 C=C(CC)CN[C@@H]1CCC[C@@]1(C)O 41aee63e920729e083b312186fac77b0 [0,1,0,1,0,0|1,0,1]=4 18232 B13R1.598 C=C(CC)CN[C@H]1CCC[C@]1(C)O 75f297e50cc7c1c58af136219138eca6 [0,1,0,1,0,0|1,0,1]=4 18233 B13R1.598 CC(CO)CNC1CCCC1(C)O 679da0a10888b3af166bb72de67822c9 [0,1,0,1,0,0|2,0,0]=4 18234 B13R1.598 CC(CO)CN[C@@H]1CCC[C@@]1(C)O 85c61b015d1d760ef4ce5daf798f0147 [0,1,0,1,0,0|2,0,0]=4 18235 B13R1.598 CC(CO)CN[C@H]1CCC[C@]1(C)O f48f655835cdee8b96db071a6efb2337 [0,1,0,1,0,0|2,0,0]=4 18236 B13R1.598 CC1(CCCC1NCC(O)CF)O 4ce1f303062dda19e66443e03148b8c9 [0,1,0,1,0,0|2,0,0]=4 18237 B13R1.598 CC1(CCCC1NCC(O)CO)O 530240ebae45e68bb76df72476b66115 [0,1,0,1,0,0|2,0,0]=4 18238 B13R1.598 CC1(CCCC1NC[C@@H](O)CO)O 31d1a40e791cb5f1f4825d04a887050c [0,1,0,1,0,0|2,0,0]=4 18239 B13R1.598 CC1(CCCC1NC[C@H](O)CO)O ac9bb12f0917e42810ceb19ecb0e6286 [0,1,0,1,0,0|2,0,0]=4 18240 B13R1.598 CCC(=O)CNC1CCCC1(C)O 490dfa258cf7af3a6c61cc17b2318770 [0,1,0,1,0,0|1,0,1]=4 18241 B13R1.598 CCC(=O)CN[C@@H]1CCC[C@@]1(C)O d7cb74a6b5b24dcb890a6f85b9d0089e [0,1,0,1,0,0|1,0,1]=4 18242 B13R1.598 CCC(=O)CN[C@H]1CCC[C@]1(C)O 0095856a08d01724d9db1748637ed95c [0,1,0,1,0,0|1,0,1]=4 18243 B13R1.598 CCC(C)CCN1CCCC1(C)C 2c59007cb0ebd44faaad1e8b1b5830c0 [0,1,0,1,0,0|2,0,0]=4 18244 B13R1.598 CCC(C)CNC1CCCC1(C)C d89d652b74c6a92358060440cd8e0579 [0,1,0,1,0,0|2,0,0]=4 18245 B13R1.598 CCC(C)CNC1CCCC1(C)O 85a48a05c5e99f6b318db3e46981c1a6 [0,1,0,1,0,0|1,0,0]=3 18246 B13R1.598 CCC(C)CN[C@@H]1CCC[C@@]1(C)O 037297fee7eeac6072c28a49a7ee0a08 [0,1,0,1,0,0|1,0,0]=3 18247 B13R1.598 CCC(C)CN[C@H]1CCC[C@]1(C)O 525d8f99521f2aae232a2b0c543465ff [0,1,0,1,0,0|1,0,0]=3 18248 B13R1.598 CCC(C)COC1CCCC1(C)C b1397f7f277c9bd3f767f725fd40ce9f [0,1,0,1,0,0|2,0,0]=4 18249 B13R1.598 CCC(C)CO[C@@H]1CCCC1(C)C a67ea2e1c48100457e01b6b904312ad0 [0,1,0,1,0,0|2,0,0]=4 18250 B13R1.598 CCC(C)CO[C@H]1CCCC1(C)C f2b49e9c20f1751b403f8181de48d1bd [0,1,0,1,0,0|2,0,0]=4 18251 B13R1.598 CCC(O)CNC1CCCC1(C)C 027ca0316c1b52feae04a0117305384c [0,1,0,1,0,0|2,0,0]=4 18252 B13R1.598 CCC(O)CNC1CCCC1(C)O 250936ad3439b574dfabc5c8b5fe7742 [0,1,0,1,0,0|1,0,0]=3 18253 B13R1.598 CCC(O)CN[C@@H]1CCC[C@@]1(C)O 157215df2092bacb72be242701c701b2 [0,1,0,1,0,0|1,0,0]=3 18254 B13R1.598 CCC(O)CN[C@H]1CCC[C@]1(C)O 5ea599ee0077002d36735dd94f3d0192 [0,1,0,1,0,0|1,0,0]=3 18255 B13R1.598 CC[C@@H](C)CNC1CCCC1(C)C 570272c22dac53c30448d4b42dc937f5 [0,1,0,1,0,0|2,0,0]=4 18256 B13R1.598 CC[C@@H](C)CNC1CCCC1(C)O a21f7ba6064b2690130f4a874c5296d8 [0,1,0,1,0,0|1,0,0]=3 18257 B13R1.598 CC[C@@H](C)CN[C@@H]1CCC[C@@]1(C)O 9bd04617560f0aa0bbc5109e8060aa2a [0,1,0,1,0,0|1,0,0]=3 18258 B13R1.598 CC[C@@H](C)CN[C@H]1CCC[C@]1(C)O 0d235fbcbc6c86e3b9d2a09386a4bccb [0,1,0,1,0,0|1,0,0]=3 18259 B13R1.598 CC[C@@H](C)COC1CCCC1(C)C 0d69cc9fd28729c8bc0a08fc815bd629 [0,1,0,1,0,0|2,0,0]=4 18260 B13R1.598 CC[C@@H](C)CO[C@@H]1CCCC1(C)C f65e9666d26785e8d7987ce108df9e8e [0,1,0,1,0,0|2,0,0]=4 18261 B13R1.598 CC[C@@H](C)CO[C@H]1CCCC1(C)C c6760e03bd8dc82ffdadbffca911943e [0,1,0,1,0,0|2,0,0]=4 18262 B13R1.598 CC[C@H](C)CNC1CCCC1(C)C 02db843a55234cbc68cc83906051a554 [0,1,0,1,0,0|2,0,0]=4 18263 B13R1.598 CC[C@H](C)CNC1CCCC1(C)O d38f5c1783a0e70bcfbc7a8c72e3b24f [0,1,0,1,0,0|1,0,0]=3 18264 B13R1.598 CC[C@H](C)CN[C@@H]1CCC[C@@]1(C)O 99851d0085cd79c54285b0ff6c0d2862 [0,1,0,1,0,0|1,0,0]=3 18265 B13R1.598 CC[C@H](C)CN[C@H]1CCC[C@]1(C)O 46580bb69237bf6b0d84d5dd45a1c275 [0,1,0,1,0,0|1,0,0]=3 18266 B13R1.598 CC[C@H](C)COC1CCCC1(C)C 796dd9bbe4196c8bc51a8b9faf3a07e9 [0,1,0,1,0,0|2,0,0]=4 18267 B13R1.598 CC[C@H](C)CO[C@@H]1CCCC1(C)C dbf07128f78d6c5f2993c2e5dfcb1e99 [0,1,0,1,0,0|2,0,0]=4 18268 B13R1.598 CC[C@H](C)CO[C@H]1CCCC1(C)C 32e9ba4547e23c279618858feb65db20 [0,1,0,1,0,0|2,0,0]=4 18269 B13R1.598 COC(C)CNC1CCCC1(C)O a51603ae03a0fff6b99578d5c5000f37 [0,1,0,1,0,0|2,0,0]=4 18270 B13R1.598 COC(C)CN[C@@H]1CCC[C@@]1(C)O 513bad271cf953c025424d7c2db9ba22 [0,1,0,1,0,0|2,0,0]=4 18271 B13R1.598 COC(C)CN[C@H]1CCC[C@]1(C)O d1b51c2f413ce144fd83b3617783ae63 [0,1,0,1,0,0|2,0,0]=4 18272 B13R1.598 CO[C@@H](C)CNC1CCCC1(C)O 539adf80f509ef11a8caf37896b5210b [0,1,0,1,0,0|2,0,0]=4 18273 B13R1.598 CO[C@@H](C)CN[C@@H]1CCC[C@@]1(C)O 965415daf4888c619a069855ca311180 [0,1,0,1,0,0|2,0,0]=4 18274 B13R1.598 CO[C@@H](C)CN[C@H]1CCC[C@]1(C)O 077ab38afe998ad4ee80ff52e3f33762 [0,1,0,1,0,0|2,0,0]=4 18275 B13R1.598 CO[C@H](C)CNC1CCCC1(C)O d8312737347257186de8ec1af7583d67 [0,1,0,1,0,0|2,0,0]=4 18276 B13R1.598 CO[C@H](C)CN[C@@H]1CCC[C@@]1(C)O d6e5a6a98c74425473361063b1917e8a [0,1,0,1,0,0|2,0,0]=4 18277 B13R1.598 CO[C@H](C)CN[C@H]1CCC[C@]1(C)O 4d1c0414740a861b55949fd7fd36ca0a [0,1,0,1,0,0|2,0,0]=4 18278 B13R1.598 C[C@@H](CO)CNC1CCCC1(C)O bfbac20e83fcf03c2b08fe8cc9b1e8f8 [0,1,0,1,0,0|2,0,0]=4 18279 B13R1.598 C[C@@H](CO)CN[C@@H]1CCC[C@@]1(C)O fdabf4154ae19913cd5f10208232afb1 [0,1,0,1,0,0|2,0,0]=4 18280 B13R1.598 C[C@@H](CO)CN[C@H]1CCC[C@]1(C)O 72adefea990dcdd392bfb21e9fd099d2 [0,1,0,1,0,0|2,0,0]=4 18281 B13R1.598 C[C@@]1(CCC[C@@H]1NCC(O)CF)O 1eb9d8f26bf7e428a34913084ce895a6 [0,1,0,1,0,0|2,0,0]=4 18282 B13R1.598 C[C@@]1(CCC[C@@H]1NCC(O)CO)O a19e1f4d70e3ef90f3f250accaebdcca [0,1,0,1,0,0|2,0,0]=4 18283 B13R1.598 C[C@@]1(CCC[C@@H]1NC[C@@H](O)CO)O 4fb5db9bee0805c32a8b2a0f54e80193 [0,1,0,1,0,0|2,0,0]=4 18284 B13R1.598 C[C@@]1(CCC[C@@H]1NC[C@H](O)CO)O b6d0ebeb42e3c3131308c035289ff915 [0,1,0,1,0,0|2,0,0]=4 18285 B13R1.598 C[C@H](CO)CNC1CCCC1(C)O c077c5e3e732a6b3d62403513f6fbf06 [0,1,0,1,0,0|2,0,0]=4 18286 B13R1.598 C[C@H](CO)CN[C@@H]1CCC[C@@]1(C)O 0fb40bd47e4e3f5f1135e5f1565dac9a [0,1,0,1,0,0|2,0,0]=4 18287 B13R1.598 C[C@H](CO)CN[C@H]1CCC[C@]1(C)O c1293a06a5fcff290e480f57a703a388 [0,1,0,1,0,0|2,0,0]=4 18288 B13R1.598 C[C@]1(CCC[C@H]1NCC(O)CF)O 80c0402c89cbe04e5a23c565ab93c7fa [0,1,0,1,0,0|2,0,0]=4 18289 B13R1.598 C[C@]1(CCC[C@H]1NCC(O)CO)O 54d76cd79682f39d25a33f2ee904841b [0,1,0,1,0,0|2,0,0]=4 18290 B13R1.598 C[C@]1(CCC[C@H]1NC[C@@H](O)CO)O 07ee25e3649268472eafac2259487e5f [0,1,0,1,0,0|2,0,0]=4 18291 B13R1.598 C[C@]1(CCC[C@H]1NC[C@H](O)CO)O 2a3b905f1669637f990fd3d28bda0c51 [0,1,0,1,0,0|2,0,0]=4 18292 B13R1.601 CC(C)CCCCN[C@@H]1C[C@H]1CO 9d28395c81c7eadf2d26ecffa04aa4b1 [0,1,0,1,0,0|2,0,0]=4 18293 B13R1.601 CC(C)CCCCN[C@H]1C[C@@H]1CO ed9c793e4f7ab9f9c3135c0ed2a84692 [0,1,0,1,0,0|2,0,0]=4 18294 B13R1.601 CC(C)CCCCN[C@H]1C[C@H]1CO ce2d16c06fa6dc67c0aa0ed49b6a1423 [0,1,0,1,0,0|2,0,0]=4 18295 B13R1.601 CC(C)CCCNCC1CC1CO 5c04c67303872f477dc1b53fa15f7502 [0,1,0,1,0,0|2,0,0]=4 18296 B13R1.601 CC(O)CCCCN[C@@H]1C[C@H]1CO 1763ab2b2e4e2fd6f72377b8136093a6 [0,1,0,1,0,0|1,0,0]=3 18297 B13R1.601 CC(O)CCCCN[C@H]1C[C@@H]1CO ff41e549288d3295e29b890d6ddddf9d [0,1,0,1,0,0|1,0,0]=3 18298 B13R1.601 CC(O)CCCCN[C@H]1C[C@H]1CO 65813e53374cbe8ec2f2559074c41ff8 [0,1,0,1,0,0|1,0,0]=3 18299 B13R1.601 CC(O)CCCNCC1CC1CO 22958fcce7eea2ce890993c3ac02ed5c [0,1,0,1,0,0|1,0,0]=3 18300 B13R1.601 CO[C@H]1C[C@H]1NCCCCC(C)C 811abb6f3f571c3c7b2896bac866ebe8 [0,1,0,1,0,0|2,0,0]=4 18301 B13R1.601 CO[C@H]1C[C@H]1NCCCCC(C)O 1efbb02776322d868a4ff760730f3f94 [0,1,0,1,0,0|1,0,0]=3 18302 B13R1.601 CO[C@H]1C[C@H]1NCCCC[C@@H](C)O 99470bf8ff20d2e3c5cf00bc8ad58c74 [0,1,0,1,0,0|1,0,0]=3 18303 B13R1.601 C[C@@H](O)CCCCN[C@@H]1C[C@H]1CO 5e1f60792e010e9ce7ca5e27b2a6fa2b [0,1,0,1,0,0|1,0,0]=3 18304 B13R1.601 C[C@@H](O)CCCCN[C@H]1C[C@@H]1CO f506593306f082ce7c5ec8079e2a9260 [0,1,0,1,0,0|1,0,0]=3 18305 B13R1.601 C[C@@H](O)CCCCN[C@H]1C[C@H]1CO e786ac3f411b45d993435f335c2791e1 [0,1,0,1,0,0|1,0,0]=3 18306 B13R1.643 CC(O)CCN1CCCC(C1)CO 41f44a352edfbf8b8f8e5654061c803b [0,1,0,1,0,0|2,0,0]=4 18307 B13R1.643 CC(O)CCN1CCC[C@@H](C1)CO 90064b8a57df479419c9e52d03abaa32 [0,1,0,1,0,0|2,0,0]=4 18308 B13R1.643 CC(O)CCN1CCC[C@H](C1)CO 96042f6747c0c4950161aaf22aeb52e2 [0,1,0,1,0,0|2,0,0]=4 18309 B13R1.643 CC(O)CNC1CCCC(C1)CO f6b3d2d8c0c81bebda3de0eba125bafe [0,1,0,1,0,0|2,0,0]=4 18310 B13R1.643 CC(O)CN[C@@H]1CCC[C@@H](C1)CO 2f73b0b7a0d967a96a83bf33db363dea [0,1,0,1,0,0|2,0,0]=4 18311 B13R1.643 CC(O)CN[C@@H]1CCC[C@H](C1)CO 7253dc8d8dfd96700fb6001e0c894169 [0,1,0,1,0,0|2,0,0]=4 18312 B13R1.643 CC(O)CN[C@H]1CCC[C@@H](C1)CO 637d1bfad885a285f3a0259b86f3f90e [0,1,0,1,0,0|2,0,0]=4 18313 B13R1.643 CC(O)CN[C@H]1CCC[C@H](C1)CO 4c51ab476033102248bb295cdb8a5d3f [0,1,0,1,0,0|2,0,0]=4 18314 B13R1.643 CCC1CCCC(C1)OCC(C)C 1d016f3fb021ee7e1e86c204a68d1540 [0,1,0,1,0,0|2,0,0]=4 18315 B13R1.643 CCC1CCCN(C1)CCC(C)C d21839205a7ff052a26ffe88fcb9d26f [0,1,0,1,0,0|2,0,0]=4 18316 B13R1.643 CCC1CCCN(C1)CCC(C)O b4f1de14d1713b4f3f57e7d4c0eda52b [0,1,0,1,0,0|1,0,0]=3 18317 B13R1.643 CCC1CN(CCO1)CCC(C)O c09d38c2375207ad6ecb6812de2d1262 [0,1,0,1,0,0|2,0,0]=4 18318 B13R1.643 CCN1CCCC(C1)NCC(C)O d6eccf09660e51fdc2141d3bc06c8d1e [0,1,0,1,0,0|2,0,0]=4 18319 B13R1.643 CCN1CCCC(C1)NC[C@@H](C)O 6efb16bcdd0234c90500a8e0c129ef05 [0,1,0,1,0,0|2,0,0]=4 18320 B13R1.643 CCN1CCCC(C1)NC[C@H](C)O 8e024a4c7ec6cdc44f2f96e62f02fb94 [0,1,0,1,0,0|2,0,0]=4 18321 B13R1.643 CCN1CCC[C@@H](C1)NCC(C)O 998c739097240bb7064168b1fbcee6d9 [0,1,0,1,0,0|2,0,0]=4 18322 B13R1.643 CCN1CCC[C@@H](C1)NC[C@@H](C)O 90c8eafd9abd0efefc26ebe4ad3be332 [0,1,0,1,0,0|2,0,0]=4 18323 B13R1.643 CCN1CCC[C@@H](C1)NC[C@H](C)O 17884c8d6333ec3f53d1a0e6efb1a76f [0,1,0,1,0,0|2,0,0]=4 18324 B13R1.643 CCN1CCC[C@H](C1)NCC(C)O 69d30fb98aa501081215e99a4bb0eeec [0,1,0,1,0,0|2,0,0]=4 18325 B13R1.643 CCN1CCC[C@H](C1)NC[C@@H](C)O 7b8a01556feff309993483514497b825 [0,1,0,1,0,0|2,0,0]=4 18326 B13R1.643 CCN1CCC[C@H](C1)NC[C@H](C)O 63d4f926059b00aaba3fb4f06d28aaa6 [0,1,0,1,0,0|2,0,0]=4 18327 B13R1.643 CC[C@@H]1CN(CCO1)CCC(C)O 0f5cdf6810bd4f889e2b935da368af8e [0,1,0,1,0,0|2,0,0]=4 18328 B13R1.643 CC[C@H]1CN(CCO1)CCC(C)O 349c4007e5bd1ed5d316627415af61a4 [0,1,0,1,0,0|2,0,0]=4 18329 B13R1.643 COC1CCCC(C1)NCC(C)O 0b1b78a7b68604ff26e4f02fad13fe6d [0,1,0,1,0,0|2,0,0]=4 18330 B13R1.643 COC1CCCC(C1)NC[C@@H](C)O 31d0b23107c44144189e18432982f643 [0,1,0,1,0,0|2,0,0]=4 18331 B13R1.643 COC1CCCC(C1)NC[C@H](C)O 351027da3a0df2fe7b6a9f7715846469 [0,1,0,1,0,0|2,0,0]=4 18332 B13R1.643 COC1CCCN(C1)CCC(C)O da8c10c83699d9ddb2557385e20f5700 [0,1,0,1,0,0|2,0,0]=4 18333 B13R1.643 CO[C@@H]1CCCN(C1)CCC(C)O 11addf834632c9aac0835eeeffb59e8b [0,1,0,1,0,0|2,0,0]=4 18334 B13R1.643 CO[C@@H]1CCC[C@@H](C1)NCC(C)O c86d8ca8555ac15b2f75592ecb3cf4ce [0,1,0,1,0,0|2,0,0]=4 18335 B13R1.643 CO[C@@H]1CCC[C@@H](C1)NC[C@@H](C)O 80f47c95420251fb0557ea6480ca842b [0,1,0,1,0,0|2,0,0]=4 18336 B13R1.643 CO[C@@H]1CCC[C@@H](C1)NC[C@H](C)O 6d2c14b9450cdeb952f128d080d16fe6 [0,1,0,1,0,0|2,0,0]=4 18337 B13R1.643 CO[C@@H]1CCC[C@H](C1)NCC(C)O 89c4104f01df21f3cb81f249b0fbf465 [0,1,0,1,0,0|2,0,0]=4 18338 B13R1.643 CO[C@@H]1CCC[C@H](C1)NC[C@@H](C)O f12d8675d2e2e57fc19d967bb18ba7e0 [0,1,0,1,0,0|2,0,0]=4 18339 B13R1.643 CO[C@@H]1CCC[C@H](C1)NC[C@H](C)O a53e0c0cbf679f31e6a949cdad8b9191 [0,1,0,1,0,0|2,0,0]=4 18340 B13R1.643 CO[C@H]1CCCN(C1)CCC(C)O 5812518c9acfa24742af0e1341495d61 [0,1,0,1,0,0|2,0,0]=4 18341 B13R1.643 CO[C@H]1CCC[C@@H](C1)NCC(C)O e7199092bd4adce02a66171d6adccfd7 [0,1,0,1,0,0|2,0,0]=4 18342 B13R1.643 CO[C@H]1CCC[C@@H](C1)NC[C@@H](C)O 9380dc839446f5fc0f31b8490d5038e6 [0,1,0,1,0,0|2,0,0]=4 18343 B13R1.643 CO[C@H]1CCC[C@@H](C1)NC[C@H](C)O 9aa66eb33a505088002703a737bedf0b [0,1,0,1,0,0|2,0,0]=4 18344 B13R1.643 CO[C@H]1CCC[C@H](C1)NCC(C)O 3f05c9de2600d42359953d8a1d430292 [0,1,0,1,0,0|2,0,0]=4 18345 B13R1.643 CO[C@H]1CCC[C@H](C1)NC[C@@H](C)O 218ac91f5f5bdc76740565fa1ad1cf15 [0,1,0,1,0,0|2,0,0]=4 18346 B13R1.643 CO[C@H]1CCC[C@H](C1)NC[C@H](C)O 95cd2d7cb6b725ffe3a3b5b9cf4df124 [0,1,0,1,0,0|2,0,0]=4 18347 B13R1.643 C[C@@H](O)CNC1CCCC(C1)CO 3ace84697c604cac14626fe8dc4cd562 [0,1,0,1,0,0|2,0,0]=4 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[0,1,0,1,0,0|1,0,1]=4 18358 B13R1.717 C=C(CC)COCC1CCC(O1)C 296e9c1e26b226e03e21da6cadd1b1ee [0,1,0,1,0,0|1,0,1]=4 18359 B13R1.717 C=C(CC)COC[C@@H]1CC[C@@H](O1)C 47265b494c627070bf0c14bf8396c798 [0,1,0,1,0,0|1,0,1]=4 18360 B13R1.717 CC(CO)CCNC1CCC(C1)O d10feffae67c27e0663207a1299d0e64 [0,1,0,1,0,0|2,0,0]=4 18361 B13R1.717 CC(CO)CCN[C@@H]1CC[C@@H](C1)O 749e27862ea2e0e3c14e1117b096a727 [0,1,0,1,0,0|2,0,0]=4 18362 B13R1.717 CC(CO)CCN[C@@H]1CC[C@H](C1)O 5eda09fa790df78f4188f0277d368a07 [0,1,0,1,0,0|2,0,0]=4 18363 B13R1.717 CC(CO)CCN[C@H]1CC[C@@H](C1)O fbe2672455c2608801581783a8418a03 [0,1,0,1,0,0|2,0,0]=4 18364 B13R1.717 CC(CO)CCN[C@H]1CC[C@H](C1)O b07ef28d6347cec78f1f7da1a43560f9 [0,1,0,1,0,0|2,0,0]=4 18365 B13R1.717 CC(CO)CNCC1CCC(C1)O 55ef7fd954eb154bcd62e9b8b27d7b49 [0,1,0,1,0,0|2,0,0]=4 18366 B13R1.717 CC1CCC(O1)COCC(O)CO d9710286e108f2818d5ce8cebf3ab025 [0,1,0,1,0,0|2,0,0]=4 18367 B13R1.717 CC1CCC(O1)COC[C@@H](O)CO ce8f03bac4da02c074e73be0d14e6a83 [0,1,0,1,0,0|2,0,0]=4 18368 B13R1.717 CC1CCC(O1)COC[C@H](O)CO aaa85b704b8ae8277e2aa3ba699cebdc [0,1,0,1,0,0|2,0,0]=4 18369 B13R1.717 CCC(=O)CNCC1CCC(C1)O 915d9ed73c3ee5afc1b60286a9586fab [0,1,0,1,0,0|1,0,1]=4 18370 B13R1.717 CCC(=O)COCC1CCC(O1)C 2f11a6655eb5cdf5a510b63449493fee [0,1,0,1,0,0|1,0,1]=4 18371 B13R1.717 CCC(=O)COC[C@@H]1CC[C@@H](O1)C e683247aff35ac125460c3a273a3e1de [0,1,0,1,0,0|1,0,1]=4 18372 B13R1.717 CCC(C)CCNC1CCC(C1)C 12ca9511f534daaf4571419efd706dc0 [0,1,0,1,0,0|2,0,0]=4 18373 B13R1.717 CCC(C)CCNC1CCC(C1)O c5ddf22e11c496bd367095de56e2832e [0,1,0,1,0,0|1,0,0]=3 18374 B13R1.717 CCC(C)CCN[C@@H]1CC[C@@H](C1)O 9fbf5d0d09cb30dee4ff2ad069a45096 [0,1,0,1,0,0|1,0,0]=3 18375 B13R1.717 CCC(C)CCN[C@@H]1CC[C@H](C1)O 247563805f83151d57460761042678a9 [0,1,0,1,0,0|1,0,0]=3 18376 B13R1.717 CCC(C)CCN[C@H]1CC[C@@H](C1)O 5b927dbcaf3dc9bdb1c2c1f5d48bdc78 [0,1,0,1,0,0|1,0,0]=3 18377 B13R1.717 CCC(C)CCN[C@H]1CC[C@H](C1)O af5ead59959f6ebc7ce64b05af3f756f [0,1,0,1,0,0|1,0,0]=3 18378 B13R1.717 CCC(C)CCOC1CCC(C1)C d83ba7674f7cddbb4a43cbc66e5c3672 [0,1,0,1,0,0|2,0,0]=4 18379 B13R1.717 CCC(C)CCOC1CCC(C1)F f86e3c8e4f7311a84be44736e807fb52 [0,1,0,1,0,0|2,0,0]=4 18380 B13R1.717 CCC(C)CNCC1CCC(C1)O 4a9d96596531d9283d10c5e094b120fb [0,1,0,1,0,0|1,0,0]=3 18381 B13R1.717 CCC(C)COCC1CCC(C1)C 747671875002917ad77930d53f6f94ee [0,1,0,1,0,0|2,0,0]=4 18382 B13R1.717 CCC(C)COCC1CCC(C1)F 4f0929e2dfdc9ee78770116aa161beb5 [0,1,0,1,0,0|2,0,0]=4 18383 B13R1.717 CCC(C)COCC1CCC(O1)C a1026ce5b4a8bae34f778c95b889b9e0 [0,1,0,1,0,0|1,0,0]=3 18384 B13R1.717 CCC(C)COC[C@@H]1CC[C@@H](O1)C 6879201bb243135480affea5942f3081 [0,1,0,1,0,0|1,0,0]=3 18385 B13R1.717 CCC(C)COC[C@@H]1CC[C@H](C1)F 9eb6fdb4ea6b0456077da1f047a45b0e [0,1,0,1,0,0|2,0,0]=4 18386 B13R1.717 CCC(C)COC[C@H]1CC[C@H](C1)F 63cc1f9fefd2d6a0074e964d332700c4 [0,1,0,1,0,0|2,0,0]=4 18387 B13R1.717 CCC(C)NCCN1CCC(C1)O 52cf02427a158a93e9744458edcf8245 [0,1,0,1,0,0|2,0,0]=4 18388 B13R1.717 CCC(C)NCCN1CC[C@@H](C1)O cdf0d26f74f97cbdb547f9ce02ce273f [0,1,0,1,0,0|2,0,0]=4 18389 B13R1.717 CCC(O)CNCC1CCC(C1)O e4fed6eb26db21c84ad78348f2a7838b [0,1,0,1,0,0|1,0,0]=3 18390 B13R1.717 CCS(=O)CCNC1CCC(C1)O b0194c7ac52b713447e89b72d8fb4b8d [0,1,0,1,0,0|2,0,0]=4 18391 B13R1.717 CCS(=O)CCN[C@@H]1CC[C@@H](C1)O 346c008f0335c75363354f2bd79c24b7 [0,1,0,1,0,0|2,0,0]=4 18392 B13R1.717 CCS(=O)CCN[C@@H]1CC[C@H](C1)O 89f548da3628860fc6916f7b90fa0e87 [0,1,0,1,0,0|2,0,0]=4 18393 B13R1.717 CCS(=O)CCN[C@H]1CC[C@@H](C1)O c1a4b0d1d44c45aa59ee9d42c9c696da [0,1,0,1,0,0|2,0,0]=4 18394 B13R1.717 CCS(=O)CCN[C@H]1CC[C@H](C1)O 740ac41b74f88257b9dbe35d8a4f7c63 [0,1,0,1,0,0|2,0,0]=4 18395 B13R1.717 CC[C@@H](C)CNCC1CCC(C1)O 12a5051522d92fc8f5c5d99cbfed49a4 [0,1,0,1,0,0|1,0,0]=3 18396 B13R1.717 CC[C@@H](C)COCC1CCC(C1)C 2bf92773b27e851c0f6564ae8caa8ed5 [0,1,0,1,0,0|2,0,0]=4 18397 B13R1.717 CC[C@@H](C)COCC1CCC(C1)F 1052ad50b7e8f024a48da42ce4174097 [0,1,0,1,0,0|2,0,0]=4 18398 B13R1.717 CC[C@@H](C)COCC1CCC(O1)C e794956362f5be217d491aeba0a25234 [0,1,0,1,0,0|1,0,0]=3 18399 B13R1.717 CC[C@@H](C)COC[C@@H]1CC[C@@H](O1)C 751074abde9da10e736c94cfe63d55ac [0,1,0,1,0,0|1,0,0]=3 18400 B13R1.717 CC[C@@H](C)COC[C@@H]1CC[C@H](C1)F a1d8d4838fb27c5f4044d27e9ad768c9 [0,1,0,1,0,0|2,0,0]=4 18401 B13R1.717 CC[C@@H](C)COC[C@H]1CC[C@H](C1)F 57859f24c52cbc13ee6fd7d64ae45388 [0,1,0,1,0,0|2,0,0]=4 18402 B13R1.717 CC[C@H](C)CNCC1CCC(C1)O 0b5b4304299b37c65f45be7a212241bf [0,1,0,1,0,0|1,0,0]=3 18403 B13R1.717 CC[C@H](C)COCC1CCC(C1)C 78f59028bdae25bbae4de58dde2aa913 [0,1,0,1,0,0|2,0,0]=4 18404 B13R1.717 CC[C@H](C)COCC1CCC(C1)F 665738ed2787127fcb5f31f17aa62c46 [0,1,0,1,0,0|2,0,0]=4 18405 B13R1.717 CC[C@H](C)COCC1CCC(O1)C 0dd9aa06a6ea0aa4a07ba5918d94ae0a [0,1,0,1,0,0|1,0,0]=3 18406 B13R1.717 CC[C@H](C)COC[C@@H]1CC[C@@H](O1)C 5dd1317f52b877f539b78336498e52b3 [0,1,0,1,0,0|1,0,0]=3 18407 B13R1.717 CC[C@H](C)COC[C@@H]1CC[C@H](C1)F 5b50e118a4feb3315c9b2b26093f9850 [0,1,0,1,0,0|2,0,0]=4 18408 B13R1.717 CC[C@H](C)COC[C@H]1CC[C@H](C1)F 9da7731507e49a890321c4c5915ed9cf [0,1,0,1,0,0|2,0,0]=4 18409 B13R1.717 COC(C)CNCC1CCC(C1)O 6da409cc5ac52a744acc3482571abaf9 [0,1,0,1,0,0|2,0,0]=4 18410 B13R1.717 COC(C)COCC1CCC(O1)C b52cf789f009fa851bd76c418473a8ca [0,1,0,1,0,0|2,0,0]=4 18411 B13R1.717 COC(C)COC[C@@H]1CC[C@@H](O1)C ef716f2bca35243a35ab1f04f0bf8f1c [0,1,0,1,0,0|2,0,0]=4 18412 B13R1.717 CO[C@@H](C)CNCC1CCC(C1)O 567f47dde1625afc12cfca974a4d9cf9 [0,1,0,1,0,0|2,0,0]=4 18413 B13R1.717 CO[C@@H](C)COCC1CCC(O1)C 32478b588ee022b260b65c7b0c4670a5 [0,1,0,1,0,0|2,0,0]=4 18414 B13R1.717 CO[C@@H](C)COC[C@@H]1CC[C@@H](O1)C 01bc62c4edc9e767ff0d5487f38a45d0 [0,1,0,1,0,0|2,0,0]=4 18415 B13R1.717 CO[C@H](C)CNCC1CCC(C1)O ea4baffc94f7064ae84b70c97832537f [0,1,0,1,0,0|2,0,0]=4 18416 B13R1.717 CO[C@H](C)COCC1CCC(O1)C 2f149c201d52f89e499a67360c2397f6 [0,1,0,1,0,0|2,0,0]=4 18417 B13R1.717 CO[C@H](C)COC[C@@H]1CC[C@@H](O1)C 39adaecd890f04398f93b9e8d2eab998 [0,1,0,1,0,0|2,0,0]=4 18418 B13R1.717 C[C@@H](CO)CNCC1CCC(C1)O 993b20737aad3e95f060fe7b70e9ba76 [0,1,0,1,0,0|2,0,0]=4 18419 B13R1.717 C[C@H](CO)CNCC1CCC(C1)O ba91d45069e8958eb2edadac958f9999 [0,1,0,1,0,0|2,0,0]=4 18420 B13R1.717 C[C@H]1CC[C@H](O1)COCC(O)CO f827bd6fd32bb000afbf5abad8e8c43d [0,1,0,1,0,0|2,0,0]=4 18421 B13R1.717 C[C@H]1CC[C@H](O1)COC[C@@H](O)CO cabfd2f9641faa244d29ef881e945482 [0,1,0,1,0,0|2,0,0]=4 18422 B13R1.717 C[C@H]1CC[C@H](O1)COC[C@H](O)CO 19ba4a1a12157ab8b64f34cc8650bf66 [0,1,0,1,0,0|2,0,0]=4 18423 B13R1.717 OC(CF)CNCC1CCC(C1)O 2b946bab2f688a25c2ab4cd7c9ae661a [0,1,0,1,0,0|2,0,0]=4 18424 B13R1.717 OCC(O)CNCC1CCC(C1)O 2f9a4b17270c8a56750e8df034749c6e [0,1,0,1,0,0|2,0,0]=4 18425 B13R1.717 OC[C@@H](O)CNCC1CCC(C1)O 374d1b38c83f0bfabd7118836a6056c6 [0,1,0,1,0,0|2,0,0]=4 18426 B13R1.717 OC[C@H](O)CNCC1CCC(C1)O d407ac7b51ae0e3da64285af4f5f3475 [0,1,0,1,0,0|2,0,0]=4 18427 B13R1.1067 CC(C)CCCCCNC1(CC1)C ea7ce719a2a722b26cdc8bf43fba8617 [0,1,0,1,0,0|2,0,0]=4 18428 B13R1.1067 CC(C)CCCCNCC1(CC1)F bbb945e9ec4b2b1d81dae09b859b4a39 [0,1,0,1,0,0|2,0,0]=4 18429 B13R1.1067 CC(C)CCCCNCC1(CC1)O 3f64fe6854a20561a848cccf9f8647ec [0,1,0,1,0,0|2,0,0]=4 18430 B13R1.1067 CC(C)CCCCOCC1(CC1)Br 817b0de892e833e5a25b6bd14adb57c7 [0,1,0,1,0,0|2,0,0]=4 18431 B13R1.1067 CC(C)CCCCOCC1(CC1)C bf0c449c15ffbcd463ebe099c238b7dc [0,1,0,1,0,0|2,0,0]=4 18432 B13R1.1067 CC(C)CCCCOCC1(CC1)Cl e700d1552f0234156452c4df948ac1c6 [0,1,0,1,0,0|2,0,0]=4 18433 B13R1.1067 CC(C)CCCCOCC1(CC1)F 74b1f917c0b58c1ba6cc437745eb622f [0,1,0,1,0,0|2,0,0]=4 18434 B13R1.1067 CC(C)CCCNCCC1(CC1)O f0dae865be7e463f98b292725886c7fe [0,1,0,1,0,0|2,0,0]=4 18435 B13R1.1067 CC(C)CCCOCCC1(CC1)C 30580b37d8c6e4d9917ccb5b3c63477a [0,1,0,1,0,0|2,0,0]=4 18436 B13R1.1067 CC(O)CCCCNCC1(CC1)F 497cfaafb2e787f8d804d45ee1706232 [0,1,0,1,0,0|1,0,0]=3 18437 B13R1.1067 CC(O)CCCCNCC1(CC1)O 1162d2afd4e1332adfe899899770102c [0,1,0,1,0,0|1,0,0]=3 18438 B13R1.1067 CC(O)CCCNCCC1(CC1)O 2ca6d84b2abd39f20a37b841b51fdd8f [0,1,0,1,0,0|1,0,0]=3 18439 B13R1.1067 C[C@@H](O)CCCCNCC1(CC1)F 96d80168ad152f6fc2a012487c1e4eeb [0,1,0,1,0,0|1,0,0]=3 18440 B13R1.1067 C[C@@H](O)CCCCNCC1(CC1)O de12ce15278801716138d9e00914df97 [0,1,0,1,0,0|1,0,0]=3 18441 B13R1.1868 C=C(CC)CN1CCCCC(C1)O dd009b73736084a93539ca3c7ebe6a10 [0,1,0,1,0,0|1,0,1]=4 18442 B13R1.1868 C=C(CC)CN1CCCC[C@H](C1)O 815a7691a2da98ad61ab02ad2e38314b [0,1,0,1,0,0|1,0,1]=4 18443 B13R1.1868 CC(CO)CN1CCCCC(C1)O 3a9998167124204c3b3c8258e05f96b7 [0,1,0,1,0,0|2,0,0]=4 18444 B13R1.1868 CC(CO)CN1CCCC[C@H](C1)O 8f5c8abd8927eb26f6022500686afe32 [0,1,0,1,0,0|2,0,0]=4 18445 B13R1.1868 CCC(=O)CN1CCCCC(C1)O 855a8728d865c7bdcaa2dfb83af8d8d4 [0,1,0,1,0,0|1,0,1]=4 18446 B13R1.1868 CCC(=O)CN1CCCC[C@H](C1)O a6ecbc20a9dd38e37d00de1c051fdc8f [0,1,0,1,0,0|1,0,1]=4 18447 B13R1.1868 CCC(C)CN1CCCCC(C1)O 0997cce89ce4a237ae04b39a4f67622f [0,1,0,1,0,0|1,0,0]=3 18448 B13R1.1868 CCC(C)CN1CCCC[C@H](C1)O d75783aacb589073082dc9653d6996b5 [0,1,0,1,0,0|1,0,0]=3 18449 B13R1.1868 CCC(C)CN1CCOCC(C1)O 627388fcd3429274cdaf48bfa513de8c [0,1,0,1,0,0|2,0,0]=4 18450 B13R1.1868 CCC(C)CN1CCOC[C@@H](C1)O ce7ac5a33a27c14cbec608804cdc5d7d [0,1,0,1,0,0|2,0,0]=4 18451 B13R1.1868 CCC(C)CN1CCOC[C@H](C1)O 9eaff047efa9a5a7cb160b9ff6e6d9fc [0,1,0,1,0,0|2,0,0]=4 18452 B13R1.1868 CCC(O)CN1CCCCC(C1)O e1372f637641309b00f35db025ee4559 [0,1,0,1,0,0|1,0,0]=3 18453 B13R1.1868 CCC(O)CN1CCCC[C@H](C1)O e523daef23722df9c230e200000bd3ed [0,1,0,1,0,0|1,0,0]=3 18454 B13R1.1868 CCC(O)CN1CCOCC(C1)O 428c00b6c6c16712c9c3cfabc203323a [0,1,0,1,0,0|2,0,0]=4 18455 B13R1.1868 CCC(O)CN1CCOC[C@@H](C1)O e125b8f4dc159f34896cfd1bb34a0a5f [0,1,0,1,0,0|2,0,0]=4 18456 B13R1.1868 CCC(O)CN1CCOC[C@H](C1)O 89a5017006f58051ee6696d901c15aae [0,1,0,1,0,0|2,0,0]=4 18457 B13R1.1868 CC[C@@H](C)CN1CCCCC(C1)O ffa9f7bed30c506bc2054ed8a7f8e625 [0,1,0,1,0,0|1,0,0]=3 18458 B13R1.1868 CC[C@@H](C)CN1CCCC[C@H](C1)O 81b3b53345e03d5748a715f06998eca2 [0,1,0,1,0,0|1,0,0]=3 18459 B13R1.1868 CC[C@@H](C)CN1CCOCC(C1)O bc7a57ae8c03da418b4b1080e64bb0f5 [0,1,0,1,0,0|2,0,0]=4 18460 B13R1.1868 CC[C@@H](C)CN1CCOC[C@@H](C1)O a8ce25f0b38e64e89f805328dfd7803a [0,1,0,1,0,0|2,0,0]=4 18461 B13R1.1868 CC[C@@H](C)CN1CCOC[C@H](C1)O be32c058db2ed655531f5164fd9d28c7 [0,1,0,1,0,0|2,0,0]=4 18462 B13R1.1868 CC[C@H](C)CN1CCCCC(C1)O 51e3ead53c9ed26165a513692af7c8e7 [0,1,0,1,0,0|1,0,0]=3 18463 B13R1.1868 CC[C@H](C)CN1CCCC[C@H](C1)O b8c5c1e13dce4d06689e00731ea7c93c [0,1,0,1,0,0|1,0,0]=3 18464 B13R1.1868 CC[C@H](C)CN1CCOCC(C1)O e22a3e87b63562135c9b039dbefa6be6 [0,1,0,1,0,0|2,0,0]=4 18465 B13R1.1868 CC[C@H](C)CN1CCOC[C@@H](C1)O 5260132cd8873c0ca073eda591fadc73 [0,1,0,1,0,0|2,0,0]=4 18466 B13R1.1868 CC[C@H](C)CN1CCOC[C@H](C1)O f9ceced1e9d0b1701bf972096370c999 [0,1,0,1,0,0|2,0,0]=4 18467 B13R1.1868 COC(C)CN1CCCCC(C1)O 0c7c234a3bd7ed34f2b4aeb6aa30c6ff [0,1,0,1,0,0|2,0,0]=4 18468 B13R1.1868 COC(C)CN1CCCC[C@H](C1)O fea2b5743a2523492bfa6bda5e4629ef [0,1,0,1,0,0|2,0,0]=4 18469 B13R1.1868 CO[C@@H](C)CN1CCCCC(C1)O 06267454764ff70c7bbfa6f2ef83e0d1 [0,1,0,1,0,0|2,0,0]=4 18470 B13R1.1868 CO[C@@H](C)CN1CCCC[C@H](C1)O f446b17687e986ff676c4c6d73e4f5a7 [0,1,0,1,0,0|2,0,0]=4 18471 B13R1.1868 CO[C@H](C)CN1CCCCC(C1)O 45a33574b76a0f5622cc100d1d315c9b [0,1,0,1,0,0|2,0,0]=4 18472 B13R1.1868 CO[C@H](C)CN1CCCC[C@H](C1)O 295d3adbc0738dc282d81247442fc240 [0,1,0,1,0,0|2,0,0]=4 18473 B13R1.1868 C[C@@H](CO)CN1CCCCC(C1)O b4ee20e437f2fd412555eac087760875 [0,1,0,1,0,0|2,0,0]=4 18474 B13R1.1868 C[C@@H](CO)CN1CCCC[C@H](C1)O 4adf50be4353948336ba434e70c69d2a [0,1,0,1,0,0|2,0,0]=4 18475 B13R1.1868 C[C@H](CO)CN1CCCCC(C1)O 1a3a46a58b65049a7b6005358cc27d9a [0,1,0,1,0,0|2,0,0]=4 18476 B13R1.1868 C[C@H](CO)CN1CCCC[C@H](C1)O 767ba24e48ef99b681196ac12540ae4f [0,1,0,1,0,0|2,0,0]=4 18477 B13R1.1868 OC(CF)CN1CCCCC(C1)O 8e618b1cab40e7df18f5be52e0c80f13 [0,1,0,1,0,0|2,0,0]=4 18478 B13R1.1868 OC(CF)CN1CCCC[C@H](C1)O bb25aa2496632717c36ba51002d2b18a [0,1,0,1,0,0|2,0,0]=4 18479 B13R1.1868 OCC(O)CN1CCCCC(C1)O 6d2ee48a543e7a15d4519976df6701bf [0,1,0,1,0,0|2,0,0]=4 18480 B13R1.1868 OCC(O)CN1CCCC[C@H](C1)O d14854c13b30bc55ec91d66f3e379c59 [0,1,0,1,0,0|2,0,0]=4 18481 B13R1.1868 OC[C@@H](O)CN1CCCCC(C1)O 12409d842a83f3e877a70a508ca0d503 [0,1,0,1,0,0|2,0,0]=4 18482 B13R1.1868 OC[C@@H](O)CN1CCCC[C@H](C1)O b17b0df0b3b3a622dae97c9ce2269a6a [0,1,0,1,0,0|2,0,0]=4 18483 B13R1.1868 OC[C@H](O)CN1CCCCC(C1)O 95c3f38f9754434a319655ab3c919f0f [0,1,0,1,0,0|2,0,0]=4 18484 B13R1.1868 OC[C@H](O)CN1CCCC[C@H](C1)O 3f8495df9fa91fc7682e7e97176ed793 [0,1,0,1,0,0|2,0,0]=4 18485 B13R1.2029 CCC(C)CCOC1CCC1(C)C fd21dafd72648a15be4ba995a36acdb3 [0,1,0,1,0,0|2,0,0]=4 18486 B13R1.2030 CCC(C)CCCOC1CC1(C)C 0b984b13b5c9f786a06ec6cfb867ad37 [0,1,0,1,0,0|2,0,0]=4 18487 B13R1.2030 CCC(C)CCNC[C@@H]1CC1(C)C a11883cb19b7a889db7493642eb496fc [0,1,0,1,0,0|2,0,0]=4 18488 B13R1.2030 CCC(C)CCNC[C@H]1CC1(C)C c6c2bf6970eb83f2421bc3fbd1f39190 [0,1,0,1,0,0|2,0,0]=4 18489 B13R1.2030 CCC(C)CCOCC1CC1(C)C bb2bc6e41634b09ab0ea2e18ed671e4d [0,1,0,1,0,0|2,0,0]=4 18490 B13R1.2030 CCC(C)CCOC[C@@H]1CC1(C)C f9c29e39e92a74e9c81fa3a35eb6c5c1 [0,1,0,1,0,0|2,0,0]=4 18491 B13R1.2030 CCC(C)CCOC[C@H]1CC1(C)C 1b8edf68744bd96b0e438586f7afd178 [0,1,0,1,0,0|2,0,0]=4 18492 B13R1.2030 CC[C@H](C)CCCOC1CC1(C)C db7443abb9b17bcef3cd208aa689795a [0,1,0,1,0,0|2,0,0]=4 18493 B13R1.2878 CC(CO)NC1CCCCC1(C)O 611aea1a7d25dce67b3c8cc8b242035e [0,1,0,1,0,0|2,0,0]=4 18494 B13R1.2878 CCC(=O)NC1CCCCC1(C)O a19ea8ddc3bcd75cfdf454018db8996a [0,1,0,1,0,0|1,0,1]=4 18495 B13R1.2878 CCC(C)CN1CCCCC1(C)C 56b53bec6478410a79f57880f42a2f47 [0,1,0,1,0,0|2,0,0]=4 18496 B13R1.2878 CCC(C)NC1CCCCC1(C)C 5cdeb5c1c7c1b4385356c5628268c88d [0,1,0,1,0,0|2,0,0]=4 18497 B13R1.2878 CCC(C)NC1CCCCC1(C)O 1886fa1ffc7e935ba510b203457d24f5 [0,1,0,1,0,0|1,0,0]=3 18498 B13R1.2878 CCC(C)OC1CCCCC1(C)C 3e7e6d0820f1d4058d0d3859be84c9ab [0,1,0,1,0,0|2,0,0]=4 18499 B13R1.2878 CCC(O)CN1CCCCC1(C)C 41e16e420f2c0f61af13452cd5d32bfc [0,1,0,1,0,0|2,0,0]=4 18500 B13R1.2878 CC[C@@H](C)CN1CCCCC1(C)C 42df2cc2f28dd6ab561231d9e66ca557 [0,1,0,1,0,0|2,0,0]=4 18501 B13R1.2878 CC[C@H](C)CN1CCCCC1(C)C 2b981068ad90c305e1a4218611ef56bd [0,1,0,1,0,0|2,0,0]=4 18502 B13R1.2878 C[C@@H](CO)NC1CCCCC1(C)O a23e5617fa292ff2b7cded5ef625af05 [0,1,0,1,0,0|2,0,0]=4 18503 B13R1.2878 C[C@H](CO)NC1CCCCC1(C)O 16e31bef9d5d022366a5367e10e5cce4 [0,1,0,1,0,0|2,0,0]=4 18504 B13R1.2880 C=C(CC)CN1CCCC1C(C)O f4e8bdbf90c97460ad44b73fce8c6048 [0,1,0,1,0,0|1,0,1]=4 18505 B13R1.2880 C=C(CC)CN1CCC[C@@H]1C(C)O ed9b5b57615cf0639e8d2931bcd348bc [0,1,0,1,0,0|1,0,1]=4 18506 B13R1.2880 C=C(CC)CN1CCC[C@H]1[C@H](C)O c4a874a1cb5ca957d87714c1ff58d790 [0,1,0,1,0,0|1,0,1]=4 18507 B13R1.2880 CC(CO)CN1CCCC1C(C)O c7cae543bb869ea7d276eed6310f9d54 [0,1,0,1,0,0|2,0,0]=4 18508 B13R1.2880 CC(CO)CN1CCC[C@@H]1C(C)O 015c36ba958c1c2f7bc37408cf287cb7 [0,1,0,1,0,0|2,0,0]=4 18509 B13R1.2880 CC(CO)CN1CCC[C@H]1[C@H](C)O 09f478b46c947e2d0302fdf063583988 [0,1,0,1,0,0|2,0,0]=4 18510 B13R1.2880 CC(O)C1CCCN1CC(O)CF 00ae3b22cc036a652fb1884f66fa41f2 [0,1,0,1,0,0|2,0,0]=4 18511 B13R1.2880 CC(O)C1CCCN1CC(O)CO 11d9df3c31705671419d5c7f99d6b841 [0,1,0,1,0,0|2,0,0]=4 18512 B13R1.2880 CC(O)C1CCCN1C[C@@H](C)CO 707ac68fd17c07e537f613e277132f10 [0,1,0,1,0,0|2,0,0]=4 18513 B13R1.2880 CC(O)C1CCCN1C[C@@H](O)CO 78019e34ca76112b92a25c9937688c42 [0,1,0,1,0,0|2,0,0]=4 18514 B13R1.2880 CC(O)C1CCCN1C[C@H](C)CO 0c512fc3490f2efa95595e9d45b07d20 [0,1,0,1,0,0|2,0,0]=4 18515 B13R1.2880 CC(O)C1CCCN1C[C@H](O)CO 331c3710c3b73cb3d877a464a424d128 [0,1,0,1,0,0|2,0,0]=4 18516 B13R1.2880 CC(O)[C@H]1CCCN1CC(O)CF a38b78b3d06f09b346b60437982fe650 [0,1,0,1,0,0|2,0,0]=4 18517 B13R1.2880 CC(O)[C@H]1CCCN1CC(O)CO 021d938893f85b3567bbaaa112c8be74 [0,1,0,1,0,0|2,0,0]=4 18518 B13R1.2880 CC(O)[C@H]1CCCN1C[C@@H](C)CO 7dc55dbbb6c3c5b7ec0096c127886fee [0,1,0,1,0,0|2,0,0]=4 18519 B13R1.2880 CC(O)[C@H]1CCCN1C[C@@H](O)CO bb029fa675107ec0e971a2678289867f [0,1,0,1,0,0|2,0,0]=4 18520 B13R1.2880 CC(O)[C@H]1CCCN1C[C@H](C)CO 13eb8560066fe4f6c5ace0e2624b02b7 [0,1,0,1,0,0|2,0,0]=4 18521 B13R1.2880 CC(O)[C@H]1CCCN1C[C@H](O)CO ab355c127d36f664cee2e6f433aab43c [0,1,0,1,0,0|2,0,0]=4 18522 B13R1.2880 CCC(=O)CN1CCCC1C(C)O cdab94ea72d351c193a5ff2b95c024f0 [0,1,0,1,0,0|1,0,1]=4 18523 B13R1.2880 CCC(=O)CN1CCC[C@@H]1C(C)O 5eac9898f0872139e7eb57cc8ac69316 [0,1,0,1,0,0|1,0,1]=4 18524 B13R1.2880 CCC(=O)CN1CCC[C@H]1[C@H](C)O 566e20cb5ff25c1682f45d3145c1724c [0,1,0,1,0,0|1,0,1]=4 18525 B13R1.2880 CCC(C)CN1CCCC1C(C)C 5679b4a848f8cc5d40f38b06ca60f49c [0,1,0,1,0,0|2,0,0]=4 18526 B13R1.2880 CCC(C)CN1CCCC1C(C)O 8e5e2d82025cb8b94fc8834bebcf1269 [0,1,0,1,0,0|1,0,0]=3 18527 B13R1.2880 CCC(C)CN1CCC[C@@H]1C(C)O f1b6af1c06ee8edd88468d420a17bd52 [0,1,0,1,0,0|1,0,0]=3 18528 B13R1.2880 CCC(C)CN1CCC[C@H]1C(C)C 4e3e6b13efb05871fb197194c9216a5a [0,1,0,1,0,0|2,0,0]=4 18529 B13R1.2880 CCC(C)CN1CCC[C@H]1[C@H](C)O 2c16b164299b141d390b98648b0ab885 [0,1,0,1,0,0|1,0,0]=3 18530 B13R1.2880 CCC(C)OC1CCCC1C(C)C 644fb4052b414037f65b168c838a0543 [0,1,0,1,0,0|2,0,0]=4 18531 B13R1.2880 CCC(O)CN1CCCC1C(C)C 1d43853eefeaad20ed1731a4c0313d42 [0,1,0,1,0,0|2,0,0]=4 18532 B13R1.2880 CCC(O)CN1CCCC1C(C)O 51f64deff4e71b6df781e5486d672b1d [0,1,0,1,0,0|1,0,0]=3 18533 B13R1.2880 CCC(O)CN1CCC[C@@H]1C(C)O 6e2072bada03316071201541661f2212 [0,1,0,1,0,0|1,0,0]=3 18534 B13R1.2880 CCC(O)CN1CCC[C@H]1C(C)C 0f7d7e52b26b3db366a95693df7492cb [0,1,0,1,0,0|2,0,0]=4 18535 B13R1.2880 CCC(O)CN1CCC[C@H]1[C@H](C)O d958a67ec2deb3a9ac75babf8ed25908 [0,1,0,1,0,0|1,0,0]=3 18536 B13R1.2880 CC[C@@H](C)CN1CCCC1C(C)C aa67802fd8963cc4aab8d2acc2f0d139 [0,1,0,1,0,0|2,0,0]=4 18537 B13R1.2880 CC[C@@H](C)CN1CCCC1C(C)O 9b518e8ac506b93913261c498a51a92b [0,1,0,1,0,0|1,0,0]=3 18538 B13R1.2880 CC[C@@H](C)CN1CCC[C@@H]1C(C)O 422b9e3742d585f777dbb35dd1488246 [0,1,0,1,0,0|1,0,0]=3 18539 B13R1.2880 CC[C@@H](C)CN1CCC[C@H]1C(C)C c4d14e9cf97ad6621a134a0235c0eed1 [0,1,0,1,0,0|2,0,0]=4 18540 B13R1.2880 CC[C@@H](C)CN1CCC[C@H]1[C@H](C)O d2c12d9f6d38158238a76b0e37aa6f29 [0,1,0,1,0,0|1,0,0]=3 18541 B13R1.2880 CC[C@H](C)CN1CCCC1C(C)C 20668f25ca0a548c5f8d4c69b8147894 [0,1,0,1,0,0|2,0,0]=4 18542 B13R1.2880 CC[C@H](C)CN1CCCC1C(C)O 7c6759f7a27972a5ba683d61c5c71417 [0,1,0,1,0,0|1,0,0]=3 18543 B13R1.2880 CC[C@H](C)CN1CCC[C@@H]1C(C)O 416dd12308ad8fe798419475a2459282 [0,1,0,1,0,0|1,0,0]=3 18544 B13R1.2880 CC[C@H](C)CN1CCC[C@H]1C(C)C 3429b641f6ba8904e952377f2932b6ee [0,1,0,1,0,0|2,0,0]=4 18545 B13R1.2880 CC[C@H](C)CN1CCC[C@H]1[C@H](C)O f3d043ae502ac237beebe64d36b98c10 [0,1,0,1,0,0|1,0,0]=3 18546 B13R1.2880 COC(C)CN1CCCC1C(C)O 9ad4208827bf95c1a3c3a5ef460c76b1 [0,1,0,1,0,0|2,0,0]=4 18547 B13R1.2880 COC(C)CN1CCC[C@@H]1C(C)O 4029949c85dc58ce0b0c6eb83c92cb2c [0,1,0,1,0,0|2,0,0]=4 18548 B13R1.2880 COC(C)CN1CCC[C@H]1[C@H](C)O 6a2a75070515862dd2466a118642924f [0,1,0,1,0,0|2,0,0]=4 18549 B13R1.2880 CO[C@@H](C)CN1CCCC1C(C)O e9fb7fa714cf53d3b0cd25488452ba6a [0,1,0,1,0,0|2,0,0]=4 18550 B13R1.2880 CO[C@@H](C)CN1CCC[C@@H]1C(C)O ca223ebd71110aa4eeb611ab68830c64 [0,1,0,1,0,0|2,0,0]=4 18551 B13R1.2880 CO[C@@H](C)CN1CCC[C@H]1[C@H](C)O 1b09421c1d300742e4938b06696b5c7f [0,1,0,1,0,0|2,0,0]=4 18552 B13R1.2880 CO[C@H](C)CN1CCCC1C(C)O 993fd0eb71b5bc6992d5cdc9fc7a91ce [0,1,0,1,0,0|2,0,0]=4 18553 B13R1.2880 CO[C@H](C)CN1CCC[C@@H]1C(C)O ab1222f3817f619cfffaa03d7ab8617f [0,1,0,1,0,0|2,0,0]=4 18554 B13R1.2880 CO[C@H](C)CN1CCC[C@H]1[C@H](C)O 2471c6918df99bb2db057e72433e5e8b [0,1,0,1,0,0|2,0,0]=4 18555 B13R1.2880 C[C@@H](CO)CN1CCC[C@H]1[C@H](C)O 5a5c2d5fc7379b9bb05c467d9f1f5247 [0,1,0,1,0,0|2,0,0]=4 18556 B13R1.2880 C[C@H](CO)CN1CCC[C@H]1[C@H](C)O ebcb7f98cc253ab760a0452c796cb49a [0,1,0,1,0,0|2,0,0]=4 18557 B13R1.2880 C[C@H](O)[C@@H]1CCCN1CC(O)CF ce18981b3061a908607c2329221d08cb [0,1,0,1,0,0|2,0,0]=4 18558 B13R1.2880 C[C@H](O)[C@@H]1CCCN1CC(O)CO 1708fd6b3149d34b739e14d2495adc81 [0,1,0,1,0,0|2,0,0]=4 18559 B13R1.2880 C[C@H](O)[C@@H]1CCCN1C[C@@H](O)CO b7534feb797e4eaae27d7fb790877845 [0,1,0,1,0,0|2,0,0]=4 18560 B13R1.2880 C[C@H](O)[C@@H]1CCCN1C[C@H](O)CO 5810026633a397275849cb0bc13987dd [0,1,0,1,0,0|2,0,0]=4 18561 B13R1.3127 CC(O)CCN1CCCC1(C)CO ed270790c2c34b9a2948d4562ff6dbc0 [0,1,0,1,0,0|2,0,0]=4 18562 B13R1.3796 CC(C)CCN1CCCC(CC1)C c0f5ec395481090876740df9bbdec62e [0,1,0,1,0,0|2,0,0]=4 18563 B13R1.3796 CC(C)CCN1CCCC(CC1)F 19212acc801ab24203651aa09c5e97f7 [0,1,0,1,0,0|2,0,0]=4 18564 B13R1.3796 CC(C)CCN1CCCC(CC1)O 07ba451c35aaa47c2e99e54917beb5aa [0,1,0,1,0,0|2,0,0]=4 18565 B13R1.3796 CC(C)CCN1CCC[C@@H](CC1)O 1dd531f18758fb2437c92768db27900a [0,1,0,1,0,0|2,0,0]=4 18566 B13R1.3796 CC(C)CCN1CCC[C@H](CC1)O 0e019d85d1b2c673d8d77de9a90a561d [0,1,0,1,0,0|2,0,0]=4 18567 B13R1.3796 CC(O)CCN1CCCC(=O)CC1 0a7b1e01a8b8e421241f0b1602e006d4 [0,1,0,1,0,0|1,0,1]=4 18568 B13R1.3796 CC(O)CCN1CCCC(CC1)C f6a4e40a5a8de2c93d091343ffb57a90 [0,1,0,1,0,0|1,0,0]=3 18569 B13R1.3796 CC(O)CCN1CCCC(CC1)F 5b3e34f73539a70c4ff052cd09711b25 [0,1,0,1,0,0|1,0,0]=3 18570 B13R1.3796 CC(O)CCN1CCCC(CC1)O ada41dd6417d73b497cf3ac30dfa8f37 [0,1,0,1,0,0|1,0,0]=3 18571 B13R1.3796 CC(O)CCN1CCCN(CC1)C 18a3215d8d1cc18403d5f70eba28ca5f [0,1,0,1,0,0|2,0,0]=4 18572 B13R1.3796 CC(O)CCN1CCC[C@@H](CC1)O adb25f7861fef1d7945389c0e7f58588 [0,1,0,1,0,0|1,0,0]=3 18573 B13R1.3796 CC(O)CCN1CCC[C@H](CC1)O fdcdef914276ac0c603ad1c79c60e497 [0,1,0,1,0,0|1,0,0]=3 18574 B13R1.3796 CC(O)CNC1CCCN(CC1)C 723270834def6596dbaf9fb8c356564e [0,1,0,1,0,0|2,0,0]=4 18575 B13R1.3796 C[C@@H](O)CNC1CCCN(CC1)C 5f10a1c0e2a04ad159c69c878b03d6e7 [0,1,0,1,0,0|2,0,0]=4 18576 B13R1.3796 C[C@H](O)CNC1CCCN(CC1)C 746613b6ba58a8cd2471f38154a03e2d [0,1,0,1,0,0|2,0,0]=4 18577 B13R1.7544 CC(C)CCCN1CCC(C1C)O f70a95f2563414da978a22b72701e676 [0,1,0,1,0,0|2,0,0]=4 18578 B13R1.7544 CC(C)CCCN1CC[C@@H]([C@@H]1C)O 55f52f05d023d5886389f158ade0a86c [0,1,0,1,0,0|2,0,0]=4 18579 B13R1.7544 CC(C)CCCN1CC[C@H]([C@H]1C)O f156e8d44ec07e9808eaa57c7936c232 [0,1,0,1,0,0|2,0,0]=4 18580 B13R1.7544 CC(O)CCCN1CCC(C1C)O 58f76dc10ab7e19f908451714905fcb5 [0,1,0,1,0,0|1,0,0]=3 18581 B13R1.7544 CC(O)CCCN1CC[C@@H]([C@@H]1C)O 648cb7df3c0b44b649a3d45a6074c302 [0,1,0,1,0,0|1,0,0]=3 18582 B13R1.7544 CC(O)CCCN1CC[C@H]([C@H]1C)O aea6a23189e759517a68bdd4b860b7c7 [0,1,0,1,0,0|1,0,0]=3 18583 B13R1.23 CC(CCCCO)N1CCC(C1)O db85101474132b04c3623d012432488a [0,1,0,1,0,0|2,0,0]=4 18584 B13R1.23 CC(CCCCO)N1CC[C@@H](C1)O 8b157a8f89ccaa8b55d75546387b9eaa [0,1,0,1,0,0|2,0,0]=4 18585 B13R1.23 CC(CCCCO)N1CC[C@H](C1)O 1b80f893444d0061aa1e97a7ad5982a0 [0,1,0,1,0,0|2,0,0]=4 18586 B13R1.23 CCCCCC(=O)N1CCC(C1)O 4f1562986c327ac39ad832834d8c4e1e [0,1,0,1,0,0|1,0,1]=4 18587 B13R1.23 CCCCCC(=O)N1CC[C@@H](C1)O aeaad036b32af486e985f5157a3a39cc [0,1,0,1,0,0|1,0,1]=4 18588 B13R1.23 CCCCCC(=O)N1CC[C@H](C1)O 986ff20eed5fe8bd335a8d65a7fe4887 [0,1,0,1,0,0|1,0,1]=4 18589 B13R1.23 CCCCCC(C)N1CCC(C1)C ab7b179119879cb9c684ee396f25709d [0,1,0,1,0,0|2,0,0]=4 18590 B13R1.23 CCCCCC(C)N1CCC(C1)F f5d2f5b24dfeed6cde9da0a5647fdcb0 [0,1,0,1,0,0|2,0,0]=4 18591 B13R1.23 CCCCCC(C)N1CCC(C1)O 1794e6d263299303f95344c64908cc00 [0,1,0,1,0,0|1,0,0]=3 18592 B13R1.23 CCCCCC(C)N1CC[C@@H](C1)F 79eb4149359d4e1c4c187a337c033b81 [0,1,0,1,0,0|2,0,0]=4 18593 B13R1.23 CCCCCC(C)N1CC[C@@H](C1)O 44d29b1818eff3363ac1b10740bc9537 [0,1,0,1,0,0|1,0,0]=3 18594 B13R1.23 CCCCCC(C)N1CC[C@H](C1)F 2751d41553b97386e767236d50fce018 [0,1,0,1,0,0|2,0,0]=4 18595 B13R1.23 CCCCCC(C)N1CC[C@H](C1)O e40a055bd6cca8aea5e1c97f1ccbf1cc [0,1,0,1,0,0|1,0,0]=3 18596 B13R1.23 CCCCCN(C)C1CCC(C1)O 9934112b417f47daaaf54f2e11c53724 [0,1,0,1,0,0|1,0,0]=3 18597 B13R1.23 CCCCCN(C)[C@@H]1CC[C@@H](C1)O d16adc3ef0a0fc1f90538958017a1f4b [0,1,0,1,0,0|1,0,0]=3 18598 B13R1.23 CCCCC[C@H](C)N1CCC(C1)C 96d551f9a106a9a97a87bc6e978b1cf2 [0,1,0,1,0,0|2,0,0]=4 18599 B13R1.23 CCCCC[C@H](C)N1CCC(C1)F d538ede805f4ec7940be85ad934b42e1 [0,1,0,1,0,0|2,0,0]=4 18600 B13R1.23 CCCCC[C@H](C)N1CCC(C1)O 0a089caef102e8c0862b38c21a868f0c [0,1,0,1,0,0|1,0,0]=3 18601 B13R1.23 CCCCC[C@H](C)N1CC[C@@H](C1)F eb83501b787ceaa2d601c6f897cdbea7 [0,1,0,1,0,0|2,0,0]=4 18602 B13R1.23 CCCCC[C@H](C)N1CC[C@@H](C1)O c0f3294c68752d4de7551b9aa2dc79ab [0,1,0,1,0,0|1,0,0]=3 18603 B13R1.23 CCCCC[C@H](C)N1CC[C@H](C1)F 6f7f45f863375be10396b5aff12a9548 [0,1,0,1,0,0|2,0,0]=4 18604 B13R1.23 CCCCC[C@H](C)N1CC[C@H](C1)O d557c157cd4bef7942733e0543dbae59 [0,1,0,1,0,0|1,0,0]=3 18605 B13R1.23 CCCCNC(=O)C1CCC(O1)C baf0712303c837aceed1dd1deaa71af5 [0,1,0,1,0,0|1,0,1]=4 18606 B13R1.23 CCCCNC(=O)[C@H]1CC[C@H](O1)C b853c1d076a5b1e23bbe1627cc3fd677 [0,1,0,1,0,0|1,0,1]=4 18607 B13R1.23 CCOCCN(C)C1CCC(C1)O 67c43cc4a49b561abd19c08d6b61c523 [0,1,0,1,0,0|2,0,0]=4 18608 B13R1.23 CCOCCN(C)[C@@H]1CC[C@@H](C1)O 5c51209746ec57a4a708c386b9025fc1 [0,1,0,1,0,0|2,0,0]=4 18609 B13R1.23 CCSCCN(C)C1CCC(C1)O 877d53bbbd9f669afc5332e535796aa9 [0,1,0,1,0,0|2,0,0]=4 18610 B13R1.23 CCSCCN(C)[C@@H]1CC[C@@H](C1)O a3f9dd0a8bb6cf03baaa3003e984391a [0,1,0,1,0,0|2,0,0]=4 18611 B13R1.23 CN(CCCCF)C1CCC(C1)O d2b8eb35eb6e23433f7c4cde1f079eea [0,1,0,1,0,0|2,0,0]=4 18612 B13R1.23 CN(CCCCF)[C@@H]1CC[C@@H](C1)O 530ffb37fd1db0cb9bcae1c28743e91a [0,1,0,1,0,0|2,0,0]=4 18613 B13R1.23 CN(CCCCO)C1CCC(C1)O 76b97516abbeba8c5179fb7fe92d931f [0,1,0,1,0,0|2,0,0]=4 18614 B13R1.23 CN(CCCCO)[C@@H]1CC[C@@H](C1)O e270e405f8126ce5c0298de723fa1fd1 [0,1,0,1,0,0|2,0,0]=4 18615 B13R1.23 COCCCN(C)C1CCC(C1)O 725fa3c6244e871e2d201235c1265c16 [0,1,0,1,0,0|2,0,0]=4 18616 B13R1.23 COCCCN(C)[C@@H]1CC[C@@H](C1)O df4a5f82b6eaef7edb0422b1ade44a49 [0,1,0,1,0,0|2,0,0]=4 18617 B13R1.23 CSCCCN(C)C1CCC(C1)O edeb067acba4fb2d21dadb1d381d298a [0,1,0,1,0,0|2,0,0]=4 18618 B13R1.23 CSCCCN(C)[C@@H]1CC[C@@H](C1)O c64d1bf9b8dc4d247cc11fbf62dd7aa9 [0,1,0,1,0,0|2,0,0]=4 18619 B13R1.149 C=C(C)CCCN1CCCC(C1)O 8be4e68586a1b8ab201dc601302ea123 [0,1,0,1,0,0|1,0,1]=4 18620 B13R1.149 C=C(C)CCCN1CCC[C@@H](C1)O e768f5aa635a82fe70a1a6062558fa5e [0,1,0,1,0,0|1,0,1]=4 18621 B13R1.149 C=C(C)CCCN1CCC[C@H](C1)O e299721afcf2ddf90d6f98e5cb873deb [0,1,0,1,0,0|1,0,1]=4 18622 B13R1.149 C=C(C)CCNC1CCCC(C1)O bb0b03b2e5be32b4784f714cd6433ae8 [0,1,0,1,0,0|1,0,1]=4 18623 B13R1.149 C=C(C)CCN[C@@H]1CCC[C@@H](C1)O 8b3b7284b63a5efa030bf3dd511588d7 [0,1,0,1,0,0|1,0,1]=4 18624 B13R1.149 C=C(C)CCN[C@@H]1CCC[C@H](C1)O d6e03063a914a39f30a7fb16261e6722 [0,1,0,1,0,0|1,0,1]=4 18625 B13R1.149 C=C(C)CCN[C@H]1CCC[C@@H](C1)O 202159cfdee60e6afb9cf55d67a0d1f0 [0,1,0,1,0,0|1,0,1]=4 18626 B13R1.149 C=C(C)CCN[C@H]1CCC[C@H](C1)O ded71dfd1a6a3ed831658ada6d98657d [0,1,0,1,0,0|1,0,1]=4 18627 B13R1.149 C=C(C)CNCC1CCCC(C1)O a1ffe82ef693282c108ad56e5c715683 [0,1,0,1,0,0|1,0,1]=4 18628 B13R1.149 C=C(C)CNC[C@H]1CCC[C@H](C1)O ec70d6c4b379efc77e894a349f0e0d55 [0,1,0,1,0,0|1,0,1]=4 18629 B13R1.149 CC(=O)CCCN1CCCC(C1)O 191c65b62c22a442bebf10fb5008f306 [0,1,0,1,0,0|1,0,1]=4 18630 B13R1.149 CC(=O)CCCN1CCC[C@@H](C1)O 952e7bba93ed8df4203b833ae0643715 [0,1,0,1,0,0|1,0,1]=4 18631 B13R1.149 CC(=O)CCCN1CCC[C@H](C1)O 2851f4d5880bbc28ed86aedbf3b0956f [0,1,0,1,0,0|1,0,1]=4 18632 B13R1.149 CC(=O)CCNC1CCCC(C1)O ec9817033a7056dc52c29af4029b9511 [0,1,0,1,0,0|1,0,1]=4 18633 B13R1.149 CC(=O)CCN[C@@H]1CCC[C@@H](C1)O 070a2c711da167422f156ca8e35bfdca [0,1,0,1,0,0|1,0,1]=4 18634 B13R1.149 CC(=O)CCN[C@@H]1CCC[C@H](C1)O 9ff1220a2896224a2e9c2ef724dc37bf [0,1,0,1,0,0|1,0,1]=4 18635 B13R1.149 CC(=O)CCN[C@H]1CCC[C@@H](C1)O 48d1b2cd3fdf105d4e4ebcf7523dbae0 [0,1,0,1,0,0|1,0,1]=4 18636 B13R1.149 CC(=O)CCN[C@H]1CCC[C@H](C1)O 2ba7f02201f31152f38611a00a06d1a0 [0,1,0,1,0,0|1,0,1]=4 18637 B13R1.149 CC(C)CCCN1CCCC(C1)C 34885d805ff375fe856f5f799a183436 [0,1,0,1,0,0|2,0,0]=4 18638 B13R1.149 CC(C)CCCN1CCCC(C1)F ca65a27964ad7cd7b7971a68180bbccd [0,1,0,1,0,0|2,0,0]=4 18639 B13R1.149 CC(C)CCCN1CCCC(C1)O 89e4c6fab311960d8f9f1e46966a6627 [0,1,0,1,0,0|1,0,0]=3 18640 B13R1.149 CC(C)CCCN1CCC[C@@H](C1)C 5b4764f8c8ffc47f3def38e5b7b7fc0d [0,1,0,1,0,0|2,0,0]=4 18641 B13R1.149 CC(C)CCCN1CCC[C@@H](C1)F 3e1c799cfa95b9dce166077cd7fb704c [0,1,0,1,0,0|2,0,0]=4 18642 B13R1.149 CC(C)CCCN1CCC[C@@H](C1)O 4ddffca17f7e5ae9fd199362d34b773f [0,1,0,1,0,0|1,0,0]=3 18643 B13R1.149 CC(C)CCCN1CCC[C@H](C1)C 94096634d3434299088ebd68aa01099b [0,1,0,1,0,0|2,0,0]=4 18644 B13R1.149 CC(C)CCCN1CCC[C@H](C1)F 3d070858def27fb225861685f8e911e8 [0,1,0,1,0,0|2,0,0]=4 18645 B13R1.149 CC(C)CCCN1CCC[C@H](C1)O 75e55a659b45adfc689dd3e2e7eee5e3 [0,1,0,1,0,0|1,0,0]=3 18646 B13R1.149 CC(C)CCNC1CCCC(C1)C 39d78f4993ab3f7dd1236c8e65d27208 [0,1,0,1,0,0|2,0,0]=4 18647 B13R1.149 CC(C)CCNC1CCCC(C1)O 40d7ad6742ffd3559d68c108f9fd4ff6 [0,1,0,1,0,0|1,0,0]=3 18648 B13R1.149 CC(C)CCNC1COCC(C1)O dba68c87ef71e410e7a33d89ef255ee3 [0,1,0,1,0,0|2,0,0]=4 18649 B13R1.149 CC(C)CCN[C@@H]1CCC[C@@H](C1)O d1015358e896cf63796d859de958a74b [0,1,0,1,0,0|1,0,0]=3 18650 B13R1.149 CC(C)CCN[C@@H]1CCC[C@H](C1)C 590ef44fdf9024cd45acb2a1337dc9ee [0,1,0,1,0,0|2,0,0]=4 18651 B13R1.149 CC(C)CCN[C@@H]1CCC[C@H](C1)O 51e3ac6bc01609b185da38ef52c587fb [0,1,0,1,0,0|1,0,0]=3 18652 B13R1.149 CC(C)CCN[C@@H]1COC[C@@H](C1)O 8b3e12b57f77d2d6163b154b113919ae [0,1,0,1,0,0|2,0,0]=4 18653 B13R1.149 CC(C)CCN[C@H]1CCC[C@@H](C1)O 6ff34e806b57e06eb2d2a98775541261 [0,1,0,1,0,0|1,0,0]=3 18654 B13R1.149 CC(C)CCN[C@H]1CCC[C@H](C1)O 964eebfbf56a127fc6fe5f708e3826b3 [0,1,0,1,0,0|1,0,0]=3 18655 B13R1.149 CC(C)CCN[C@H]1COC[C@H](C1)O 87c4bc88ce143a0868c15def4145fe1e [0,1,0,1,0,0|2,0,0]=4 18656 B13R1.149 CC(C)CCOC1CCCC(C1)C 898365f280e460c83d3acfc24563b549 [0,1,0,1,0,0|2,0,0]=4 18657 B13R1.149 CC(C)CCO[C@@H]1CCC[C@@H](C1)C 98c310b6156c0220f812e898055516a2 [0,1,0,1,0,0|2,0,0]=4 18658 B13R1.149 CC(C)CCO[C@H]1CCC[C@@H](C1)C 8cc453164969c3a00d495b2295d29db4 [0,1,0,1,0,0|2,0,0]=4 18659 B13R1.149 CC(C)CCO[C@H]1CCC[C@H](C1)C b9aecdc296d75e9540f3fb0da1feb796 [0,1,0,1,0,0|2,0,0]=4 18660 B13R1.149 CC(C)CNCC1CCCC(C1)C 00df0bdb99346db62b624873ddde50d5 [0,1,0,1,0,0|2,0,0]=4 18661 B13R1.149 CC(C)CNCC1CCCC(C1)O c41561b3a9682b24e99f19e1ea5a7dab [0,1,0,1,0,0|1,0,0]=3 18662 B13R1.149 CC(C)CNC[C@H]1CCC[C@H](C1)O 73440aba52246e55ccfa0c273e56ec04 [0,1,0,1,0,0|1,0,0]=3 18663 B13R1.149 CC(C)COCC1CCCC(C1)C c86d5515826f971bb1c30bf7114fceeb [0,1,0,1,0,0|2,0,0]=4 18664 B13R1.149 CC(C)NCCN1CCCC(C1)O d85b315bb8ebc40d266924cabaeecfd7 [0,1,0,1,0,0|2,0,0]=4 18665 B13R1.149 CC(C)OCCN1CCCC(C1)O f715266abb43a12d1ba5de6d3bb4a43d [0,1,0,1,0,0|2,0,0]=4 18666 B13R1.149 CC(C)OCCN1CCC[C@@H](C1)O 7b1f07c8ad7bb368c5e4a6c6c3d2c7e8 [0,1,0,1,0,0|2,0,0]=4 18667 B13R1.149 CC(C)OCCN1CCC[C@H](C1)O 8f85485ec3497307d4195cac4c30857a [0,1,0,1,0,0|2,0,0]=4 18668 B13R1.149 CC(C)OCNC1CCCC(C1)O 2e5ae853acf29c8af97e205b6cd9ecc8 [0,1,0,1,0,0|2,0,0]=4 18669 B13R1.149 CC(C)OCN[C@@H]1CCC[C@@H](C1)O 33b72796ad56746e21bd71e0ff5bfa91 [0,1,0,1,0,0|2,0,0]=4 18670 B13R1.149 CC(C)OCN[C@@H]1CCC[C@H](C1)O 0a4f8e8159cf59b12935b8ba49a82d46 [0,1,0,1,0,0|2,0,0]=4 18671 B13R1.149 CC(C)OCN[C@H]1CCC[C@@H](C1)O bb92d5574f96e8c4e3b9ce3e5b4a63fb [0,1,0,1,0,0|2,0,0]=4 18672 B13R1.149 CC(C)OCN[C@H]1CCC[C@H](C1)O 713eeb99a0cf2d83bcccd9d615e3d81e [0,1,0,1,0,0|2,0,0]=4 18673 B13R1.149 CC(C)SCCN1CCCC(C1)O 1ba5c9fe1dd32420f1078f70296786c8 [0,1,0,1,0,0|2,0,0]=4 18674 B13R1.149 CC(C)SCCN1CCC[C@@H](C1)O b70c022ba650123123827b46969309b1 [0,1,0,1,0,0|2,0,0]=4 18675 B13R1.149 CC(C)SCCN1CCC[C@H](C1)O 5fb7812b46502fa002186e388be372e5 [0,1,0,1,0,0|2,0,0]=4 18676 B13R1.149 CC(O)CCCN1CCCC(=O)C1 9de23a43ec232bee064a35c601f7ec83 [0,1,0,1,0,0|1,0,1]=4 18677 B13R1.149 CC(O)CCCN1CCCC(C1)C 2d173145b9683b65080b93f0cf9f6e61 [0,1,0,1,0,0|1,0,0]=3 18678 B13R1.149 CC(O)CCCN1CCCC(C1)F 0cd9904634509db7bb1e5cd9a1524383 [0,1,0,1,0,0|1,0,0]=3 18679 B13R1.149 CC(O)CCCN1CCCC(C1)O 6b3a9bdcab8501d6e19134adbf454ad7 [0,1,0,1,0,0|1,0,0]=3 18680 B13R1.149 CC(O)CCCN1CCC[C@@H](C1)C bc6026d93438587418d1e52d584bbae6 [0,1,0,1,0,0|1,0,0]=3 18681 B13R1.149 CC(O)CCCN1CCC[C@@H](C1)F 9c8b22241542b18e157790b48eaff38a [0,1,0,1,0,0|1,0,0]=3 18682 B13R1.149 CC(O)CCCN1CCC[C@@H](C1)O 3dc4461e14e89fef38ebeb98e3b9487b [0,1,0,1,0,0|1,0,0]=3 18683 B13R1.149 CC(O)CCCN1CCC[C@H](C1)C 1c825f3d34d50602c8dd222da1161624 [0,1,0,1,0,0|1,0,0]=3 18684 B13R1.149 CC(O)CCCN1CCC[C@H](C1)F 1488dda40539ca1491ac11971247b37f [0,1,0,1,0,0|1,0,0]=3 18685 B13R1.149 CC(O)CCCN1CCC[C@H](C1)O b973e935a1148127e62d9a70c491586f [0,1,0,1,0,0|1,0,0]=3 18686 B13R1.149 CC(O)CCCN1CCOC(C1)C 0fa1d87bef8e6d829f95babf9ea53264 [0,1,0,1,0,0|2,0,0]=4 18687 B13R1.149 CC(O)CCCN1CCO[C@@H](C1)C ccb4e0ef8513158b236467bd184dbe94 [0,1,0,1,0,0|2,0,0]=4 18688 B13R1.149 CC(O)CCCN1CCO[C@H](C1)C 6a2b5d54431768d8972f4107361f974a [0,1,0,1,0,0|2,0,0]=4 18689 B13R1.149 CC(O)CCNC1CCCC(=O)C1 67b24784a28d693db3a216436cf1b6ac [0,1,0,1,0,0|1,0,1]=4 18690 B13R1.149 CC(O)CCNC1CCCC(C1)C dd151a785e39aff2c2ed203dd4120a02 [0,1,0,1,0,0|1,0,0]=3 18691 B13R1.149 CC(O)CCNC1CCCC(C1)O acda320c21c29ef239e9d84abcd3a9c5 [0,1,0,1,0,0|1,0,0]=3 18692 B13R1.149 CC(O)CCNC1CCCN(C1)C 59bec3690d3ea9e02ccba203edc2c0f1 [0,1,0,1,0,0|2,0,0]=4 18693 B13R1.149 CC(O)CCNC1CCOC(C1)C f7f28a6f9c9ee98d6d4d1e4bc100b463 [0,1,0,1,0,0|2,0,0]=4 18694 B13R1.149 CC(O)CCNC1COCC(C1)O 1dbe6f43aac5e5e4d6d0f0e64585f662 [0,1,0,1,0,0|2,0,0]=4 18695 B13R1.149 CC(O)CCN[C@@H]1CCCN(C1)C 817172ea22c03e3ef182a1bf82af4ada [0,1,0,1,0,0|2,0,0]=4 18696 B13R1.149 CC(O)CCN[C@@H]1CCC[C@@H](C1)O fdbecbda45cac011f8a987d6e455c9c9 [0,1,0,1,0,0|1,0,0]=3 18697 B13R1.149 CC(O)CCN[C@@H]1CCC[C@H](C1)C b6e2bd2d10835ac83d0100bf65297321 [0,1,0,1,0,0|1,0,0]=3 18698 B13R1.149 CC(O)CCN[C@@H]1CCC[C@H](C1)O caec6e70ab58d24daf10eb016c5acadf [0,1,0,1,0,0|1,0,0]=3 18699 B13R1.149 CC(O)CCN[C@@H]1CCO[C@@H](C1)C a9ee8d87233a6dc650886f585f816065 [0,1,0,1,0,0|2,0,0]=4 18700 B13R1.149 CC(O)CCN[C@@H]1CCO[C@H](C1)C d85f7030065d55daa39eb237afd42082 [0,1,0,1,0,0|2,0,0]=4 18701 B13R1.149 CC(O)CCN[C@@H]1COC[C@@H](C1)O 03ba78fc8f54523ffdd94263680e11f6 [0,1,0,1,0,0|2,0,0]=4 18702 B13R1.149 CC(O)CCN[C@H]1CCCN(C1)C 096a8a0c132ba1b9c64d3323bc70c5f5 [0,1,0,1,0,0|2,0,0]=4 18703 B13R1.149 CC(O)CCN[C@H]1CCC[C@@H](C1)O 3c6aa8a5ed12076b5d9eeda22475cab7 [0,1,0,1,0,0|1,0,0]=3 18704 B13R1.149 CC(O)CCN[C@H]1CCC[C@H](C1)O 50fc8d862eabbcbb18d547ec6b4265ec [0,1,0,1,0,0|1,0,0]=3 18705 B13R1.149 CC(O)CCN[C@H]1CCO[C@@H](C1)C 1a77725e16841c88a729a19a842fc164 [0,1,0,1,0,0|2,0,0]=4 18706 B13R1.149 CC(O)CCN[C@H]1CCO[C@H](C1)C b42127fb7d3592250d09c5827da445b8 [0,1,0,1,0,0|2,0,0]=4 18707 B13R1.149 CC(O)CCN[C@H]1COC[C@H](C1)O 218307020995a656627109c0072c093b [0,1,0,1,0,0|2,0,0]=4 18708 B13R1.149 CC(O)CNCC1CCCC(C1)C 69075fbb1d316968ad46334c17b0dc41 [0,1,0,1,0,0|1,0,0]=3 18709 B13R1.149 CC(O)CNCC1CCCC(C1)O e21bdd824d82762084932f56ded2470f [0,1,0,1,0,0|1,0,0]=3 18710 B13R1.149 CC(O)CNCC1CCCN(C1)C 125cb41c62299214125f0ef464561155 [0,1,0,1,0,0|2,0,0]=4 18711 B13R1.149 CC(O)CNC[C@@H]1CCCN(C1)C 185405859739cbc10d509dcb6f1df611 [0,1,0,1,0,0|2,0,0]=4 18712 B13R1.149 CC(O)CNC[C@H]1CCCN(C1)C bddb4ec8f478b7b89fae2cdfa4bd763a [0,1,0,1,0,0|2,0,0]=4 18713 B13R1.149 CC(O)CNC[C@H]1CCC[C@H](C1)O d45fa2e2ab470709ec07b847ca55717b [0,1,0,1,0,0|1,0,0]=3 18714 B13R1.149 CC1CCCC(C1)CNC[C@@H](C)O d5681b118f4965596c155519771b82d6 [0,1,0,1,0,0|1,0,0]=3 18715 B13R1.149 CC1CCCC(C1)CNC[C@H](C)O e5537ddff72082e9eb28dca56b85bce7 [0,1,0,1,0,0|1,0,0]=3 18716 B13R1.149 CN(C)CCCN1CCCC(C1)O 99c077c96311ee6c4b51af89663d7a7d [0,1,0,1,0,0|2,0,0]=4 18717 B13R1.149 CN(C)CCCN1CCC[C@@H](C1)O aebd289153f2beb83c3c95b6e5d7ad9b [0,1,0,1,0,0|2,0,0]=4 18718 B13R1.149 CN(C)CCCN1CCC[C@H](C1)O ddfe77cb61c2c44326b1e7c3edb62787 [0,1,0,1,0,0|2,0,0]=4 18719 B13R1.149 CN(C)CCNC1CCCC(C1)O 0a49601094ec7e81dacdf3c41f8fe970 [0,1,0,1,0,0|2,0,0]=4 18720 B13R1.149 CN(C)CCN[C@@H]1CCC[C@@H](C1)O e431da32753e6e4c110c25b918249fa9 [0,1,0,1,0,0|2,0,0]=4 18721 B13R1.149 CN(C)CCN[C@@H]1CCC[C@H](C1)O bf4f264ebca6f73b74df9dfd0a751409 [0,1,0,1,0,0|2,0,0]=4 18722 B13R1.149 CN(C)CCN[C@H]1CCC[C@@H](C1)O 92280dd96139e3e3bed0bbd481c1181c [0,1,0,1,0,0|2,0,0]=4 18723 B13R1.149 CN(C)CCN[C@H]1CCC[C@H](C1)O e2575dfa72c8232a7f276f635f7997c2 [0,1,0,1,0,0|2,0,0]=4 18724 B13R1.149 CN(C)CNCC1CCCC(C1)O 0aa24fd6ba778bd18e569e4ee5116812 [0,1,0,1,0,0|2,0,0]=4 18725 B13R1.149 CN(C)CNC[C@H]1CCC[C@H](C1)O 5df6846ab54ae197e3e638891a3f9fb6 [0,1,0,1,0,0|2,0,0]=4 18726 B13R1.149 CS(=O)CCNC1CCCC(C1)O 45ed132262df2ec33fb3a198cc5365ef [0,1,0,1,0,0|2,0,0]=4 18727 B13R1.149 CS(=O)CCN[C@@H]1CCC[C@@H](C1)O dfa553c8fe213efed716b36dbfbfecd9 [0,1,0,1,0,0|2,0,0]=4 18728 B13R1.149 CS(=O)CCN[C@@H]1CCC[C@H](C1)O fb2c9dc41d45ae643825312b397d212c [0,1,0,1,0,0|2,0,0]=4 18729 B13R1.149 CS(=O)CCN[C@H]1CCC[C@@H](C1)O e20d26086b5b32c28c64a46df8e8443b [0,1,0,1,0,0|2,0,0]=4 18730 B13R1.149 CS(=O)CCN[C@H]1CCC[C@H](C1)O 6d403e8c5c0bf3e0d4508c9a975b1e76 [0,1,0,1,0,0|2,0,0]=4 18731 B13R1.149 C[C@@H](O)CCNC1CCCC(=O)C1 ec51928178e2d4f769d6f0d631258ee3 [0,1,0,1,0,0|1,0,1]=4 18732 B13R1.149 C[C@@H](O)CCN[C@@H]1CCCN(C1)C 74313e0c129a904f9eccbd76cb89b501 [0,1,0,1,0,0|2,0,0]=4 18733 B13R1.149 C[C@@H](O)CCN[C@H]1CCCN(C1)C 2b9acda282ff94f0bc4bdecb924c22df [0,1,0,1,0,0|2,0,0]=4 18734 B13R1.149 C[C@@H](O)CNCC1CCCC(C1)O 7495b482fe1eaedf763ed2b2e4de68e5 [0,1,0,1,0,0|1,0,0]=3 18735 B13R1.149 C[C@@H](O)CNCC1CCCN(C1)C 5faf2642c670efe4b6790c0a72fd408a [0,1,0,1,0,0|2,0,0]=4 18736 B13R1.149 C[C@@H](O)CNC[C@@H]1CCCN(C1)C 2a8cec72bdf9231b88253195996bdbb1 [0,1,0,1,0,0|2,0,0]=4 18737 B13R1.149 C[C@@H](O)CNC[C@H]1CCCN(C1)C e9e0761ce4fa819fb60a4d8e7a454e87 [0,1,0,1,0,0|2,0,0]=4 18738 B13R1.149 C[C@@H](O)CNC[C@H]1CCC[C@H](C1)O cb9d09677e15889ef883b45867b4ee7a [0,1,0,1,0,0|1,0,0]=3 18739 B13R1.149 C[C@H](O)CCNC1CCCC(=O)C1 35b661d9e263f12892e78eaec4b2ada7 [0,1,0,1,0,0|1,0,1]=4 18740 B13R1.149 C[C@H](O)CCN[C@@H]1CCCN(C1)C a89201e9708b7746246203824aa6021b [0,1,0,1,0,0|2,0,0]=4 18741 B13R1.149 C[C@H](O)CCN[C@H]1CCCN(C1)C cc8d1dffbd8e8f2bd4b38c700c0a61b1 [0,1,0,1,0,0|2,0,0]=4 18742 B13R1.149 C[C@H](O)CNCC1CCCC(C1)O 93ed74a281e86a20e221f7e90c09bf90 [0,1,0,1,0,0|1,0,0]=3 18743 B13R1.149 C[C@H](O)CNCC1CCCN(C1)C 9088afd223b3442c6b9effcda184f57b [0,1,0,1,0,0|2,0,0]=4 18744 B13R1.149 C[C@H](O)CNC[C@@H]1CCCN(C1)C 2a55d61ee0d914b8ffae6850c03e1cf7 [0,1,0,1,0,0|2,0,0]=4 18745 B13R1.149 C[C@H](O)CNC[C@H]1CCCN(C1)C 195c1911449294b56face47e3c0f47ea [0,1,0,1,0,0|2,0,0]=4 18746 B13R1.149 C[C@H](O)CNC[C@H]1CCC[C@H](C1)O 0bb23540404d421cca321e183c74a2e6 [0,1,0,1,0,0|1,0,0]=3 18747 B13R1.149 OC1CCCC(C1)CNCC(F)F f4c998b06b6ddca23474669de741278c [0,1,0,1,0,0|2,0,0]=4 18748 B13R1.149 O[C@@H]1CCC[C@@H](C1)CNCC(F)F 2d32bf5446529522f3cecd61f278ccf1 [0,1,0,1,0,0|2,0,0]=4 18749 B13R1.232 CCCC1CN(C1)CCCC(C)C 0e807f9264bc5d4f542705089c320abc [0,1,0,1,0,0|2,0,0]=4 18750 B13R1.232 CCCC1CN(C1)CCCC(C)O 83e48ef4f6c3c95f91968b21fc712d4c [0,1,0,1,0,0|1,0,0]=3 18751 B13R1.232 CCOC1CN(C1)CCCC(C)O e06a82425af5176eba04ef1db1de81ea [0,1,0,1,0,0|2,0,0]=4 18752 B13R1.232 COCC1CC(C1)NCCC(C)O f131346d590d2a44be8b569314c07851 [0,1,0,1,0,0|2,0,0]=4 18753 B13R1.232 COCC1CN(C1)CCCC(C)O 4bfbb0f8dc8204439d06748758657de4 [0,1,0,1,0,0|2,0,0]=4 18754 B13R1.280 C=C(C)CCN1CCCCCC1C b031aa53b1239d05ba4cdedfe8ee3c94 [0,1,0,1,0,0|1,0,1]=4 18755 B13R1.280 CC(=O)CCN1CCCCCC1C c79a0ebee0bdabca74d1f6ecc15aafc4 [0,1,0,1,0,0|0,0,2]=4 18756 B13R1.280 CC(C)CCN1CCCCCC1C 4188c9f120b3bb34e94651de40dc1c39 [0,1,0,1,0,0|1,0,0]=3 18757 B13R1.280 CC(C)CCN1CCCOCC1C 6887c1e093b520f84ee9919cd501cd6c [0,1,0,1,0,0|2,0,0]=4 18758 B13R1.280 CC(C)CCN1CCOCCC1C 966a21510a10c7cd5452a7d7d1891386 [0,1,0,1,0,0|2,0,0]=4 18759 B13R1.280 CC(C)CCN1CCSCCC1C 141b2f9cf13d716b67c0db17ac5402e9 [0,1,0,1,0,0|2,0,0]=4 18760 B13R1.280 CC(C)CN[C@@H]1CCCCC[C@@H]1O 4bf15dc83dfae2187d1836d4d1ab2754 [0,1,0,1,0,0|2,0,0]=4 18761 B13R1.280 CC(C)CN[C@@H]1CCCCC[C@H]1O ac394bb8b6941b834a18168fc15e8490 [0,1,0,1,0,0|2,0,0]=4 18762 B13R1.280 CC(C)CN[C@H]1CCCCC[C@@H]1O 6910fdf6f8e1f3cf9de881a3287cd53e [0,1,0,1,0,0|2,0,0]=4 18763 B13R1.280 CC(C)OCC1CCCCCN1C 95defc86e8302a145d3efbf52d7c8cca [0,1,0,1,0,0|2,0,0]=4 18764 B13R1.280 CC(C)OCN1CCCCCC1C c15c30d95fe5e0f4fa597ff15db68f09 [0,1,0,1,0,0|2,0,0]=4 18765 B13R1.280 CC(O)CCN1CCCCCC1C 9ca67d3f66c625573bd643121f0a73be [0,1,0,1,0,0|0,0,0]=2 18766 B13R1.280 CC(O)CCN1CCCOCC1C fe28282951a5114ce0e06f45ffd9d599 [0,1,0,1,0,0|1,0,0]=3 18767 B13R1.280 CC(O)CCN1CCOCCC1C ce5da2736d8a3c2c0379ef3d0c6490c4 [0,1,0,1,0,0|1,0,0]=3 18768 B13R1.280 CC(O)CCN1CCSCCC1C 9b25d9a4d77aab4eee27d5052f4e81a3 [0,1,0,1,0,0|1,0,0]=3 18769 B13R1.280 CC(O)CNC1CCCCCC1=O 69aa6c5dd51c52e0ce46573259ff958d [0,1,0,1,0,0|1,0,1]=4 18770 B13R1.280 CC(O)CN[C@@H]1CCCCC[C@@H]1O d8e3224970885f39187d916dac5300e4 [0,1,0,1,0,0|1,0,0]=3 18771 B13R1.280 CC(O)CN[C@@H]1CCCCC[C@H]1O aab696b7b158fe056f41a3db87c8d791 [0,1,0,1,0,0|1,0,0]=3 18772 B13R1.280 CC(O)CN[C@H]1CCCCC[C@@H]1O e6a83a203a82d90071607d7785ff1b65 [0,1,0,1,0,0|1,0,0]=3 18773 B13R1.280 CC1CCCCCN1CCC(=O)O aac07d5b66022a5ccb6d9e1724419074 [0,1,0,1,0,0|1,0,1]=4 18774 B13R1.280 CC1CCCCCN1CCN(C)C 0ce708c2f4995547c01d6eb59290c95b [0,1,0,1,0,0|2,0,0]=4 18775 B13R1.280 CC1CCCCCN1CCS(=O)C e28bbb8ef1cddbd87ee6b9146e7a4abd [0,1,0,1,0,0|1,0,1]=4 18776 B13R1.280 C[C@@H](O)CNC1CCCCCC1=O 28177f7c168b947cd0c204e13ae55ee1 [0,1,0,1,0,0|1,0,1]=4 18777 B13R1.280 C[C@@H](O)CN[C@@H]1CCCCC[C@@H]1O 1eacaff29da437ca846574987ee3ec7a [0,1,0,1,0,0|1,0,0]=3 18778 B13R1.280 C[C@@H](O)CN[C@@H]1CCCCC[C@H]1O 6c0e10891644a3f209a4b03ded7bce8c [0,1,0,1,0,0|1,0,0]=3 18779 B13R1.280 C[C@@H](O)CN[C@H]1CCCCC[C@@H]1O 9f28f978122516df2e429597a7b124cc [0,1,0,1,0,0|1,0,0]=3 18780 B13R1.280 C[C@H](O)CNC1CCCCCC1=O 4b24d35c5d06c4c88820474ce9ed420e [0,1,0,1,0,0|1,0,1]=4 18781 B13R1.280 C[C@H](O)CN[C@@H]1CCCCC[C@@H]1O 27a6c46d1c994aa42f5efa74c487a202 [0,1,0,1,0,0|1,0,0]=3 18782 B13R1.280 C[C@H](O)CN[C@@H]1CCCCC[C@H]1O 5ee4719d7783aea390f818f3c0957779 [0,1,0,1,0,0|1,0,0]=3 18783 B13R1.280 C[C@H](O)CN[C@H]1CCCCC[C@@H]1O 82ed4643ba3e352421cbee21c0b631b6 [0,1,0,1,0,0|1,0,0]=3 18784 B13R1.342 CC(C)CCCN(C)C1CCCC1 2b66092dd2ae72d8661aea28c53ae7d2 [0,1,0,1,0,0|2,0,0]=4 18785 B13R1.342 CC(C)CCNC(C)C1CCCC1 f982ce4ed68d88813461f58b60715275 [0,1,0,1,0,0|2,0,0]=4 18786 B13R1.342 CC(C)CCOC(C)C1CCCC1 261a19d5539820a5bcd5f860e02a935f [0,1,0,1,0,0|2,0,0]=4 18787 B13R1.342 CC(CNC[C@@H](C)O)N1CCCC1 e8c2c59a28122e7250cab4b82f75caff [0,1,0,1,0,0|2,0,0]=4 18788 B13R1.342 CC(CNC[C@H](C)O)N1CCCC1 5f2a175e75868219290bf1b2f72cfc89 [0,1,0,1,0,0|2,0,0]=4 18789 B13R1.342 CC(O)CCCN(C)C1CCCC1 9bfffb242dea1a5b6249c91d6fc97e8d [0,1,0,1,0,0|1,0,0]=3 18790 B13R1.342 CC(O)CCCN(C)C1CCOC1 8f7bfb47729c7a66e0c807f3bf275707 [0,1,0,1,0,0|2,0,0]=4 18791 B13R1.342 CC(O)CCCN(C)[C@@H]1CCOC1 c1847d081d6579a81ddafb982df984c8 [0,1,0,1,0,0|2,0,0]=4 18792 B13R1.342 CC(O)CCCN(C)[C@H]1CCOC1 c7ffdd404b202cf7211fbfaacb27d0b6 [0,1,0,1,0,0|2,0,0]=4 18793 B13R1.342 CC(O)CCNC(C)C1CCCC1 7ee79064896fdd27daec276c787b037c [0,1,0,1,0,0|1,0,0]=3 18794 B13R1.342 CC(O)CCNC(C)C1CCCO1 f75c5f8a3a30d3d4f17e8508cbddabea [0,1,0,1,0,0|2,0,0]=4 18795 B13R1.342 CC(O)CCN[C@@H](C)[C@@H]1CCCO1 007dc13daffeaba45e5093220ea962f7 [0,1,0,1,0,0|2,0,0]=4 18796 B13R1.342 CC(O)CCN[C@H](C)C1CCOC1 0e0436304a6565697883abe526b16d5f [0,1,0,1,0,0|2,0,0]=4 18797 B13R1.342 CC(O)CNCC(=O)C1CCCC1 89c57bef6a48794ae3cd64f9c8b54969 [0,1,0,1,0,0|1,0,1]=4 18798 B13R1.342 CC(O)CNCC(C)N1CCCC1 004c89eb4470395208701f58d46b5ce7 [0,1,0,1,0,0|2,0,0]=4 18799 B13R1.342 C[C@@H](O)CNCC(=O)C1CCCC1 7683af89c211018b6fb4e6e1d9ce6c48 [0,1,0,1,0,0|1,0,1]=4 18800 B13R1.342 C[C@H](O)CNCC(=O)C1CCCC1 7e96dc2a8b74eba11b6b731180b7278b [0,1,0,1,0,0|1,0,1]=4 18801 B13R1.356 CCNC1CC(CCC1C(C)C)C c12fbb3b42e250f986bc4a272798d3f6 [0,1,0,1,0,0|2,0,0]=4 18802 B13R1.356 CCN[C@@H]1C[C@@H](CC[C@H]1C(C)C)C b4f73fc1596fb56801fffab50eb307d3 [0,1,0,1,0,0|2,0,0]=4 18803 B13R1.356 CCN[C@@H]1C[C@H](CC[C@@H]1C(C)C)C 7bfb1e937b80250f557dceb7e733d8af [0,1,0,1,0,0|2,0,0]=4 18804 B13R1.356 CCN[C@H]1C[C@H](CC[C@@H]1C(C)C)C 3cd17cd9fc3fff8bd63f3c007cdada2b [0,1,0,1,0,0|2,0,0]=4 18805 B13R1.356 CCOC1CC(CCC1C(C)C)C ecb0f618cab246aa17f733d54a6347aa [0,1,0,1,0,0|2,0,0]=4 18806 B13R1.356 CCO[C@@H]1C[C@@H](CC[C@@H]1C(C)C)C b94938aeb3889c97244e51a1e98af8c1 [0,1,0,1,0,0|2,0,0]=4 18807 B13R1.356 CCO[C@@H]1C[C@@H](CC[C@H]1C(C)C)C 6be64ae419c73c6cd94d79986bb709ad [0,1,0,1,0,0|2,0,0]=4 18808 B13R1.356 CCO[C@H]1C[C@@H](CC[C@@H]1C(C)C)C 5f259e01e4d90af0bd35d224bbba8d4b [0,1,0,1,0,0|2,0,0]=4 18809 B13R1.356 CCO[C@H]1C[C@@H](CC[C@H]1C(C)C)C 98849c958990c845c7384253eba7601d [0,1,0,1,0,0|2,0,0]=4 18810 B13R1.356 CCO[C@H]1C[C@H](CC[C@@H]1C(C)C)C 94b870f75bc0421a92aaac9d78ee86db [0,1,0,1,0,0|2,0,0]=4 18811 B13R1.727 CC(CCCCO)NC1CC(C1)O d77cc53bf05219e89510ff028ce7aeea [0,1,0,1,0,0|2,0,0]=4 18812 B13R1.727 CC(CCCCO)N[C@H]1C[C@@H](C1)O 3d252a4148fae3fef7e06cc17424addb [0,1,0,1,0,0|2,0,0]=4 18813 B13R1.727 CC(CCCCO)N[C@H]1C[C@H](C1)O 21895ecd6451fb2e899ee3623407f4fd [0,1,0,1,0,0|2,0,0]=4 18814 B13R1.727 CCCCCC(=O)CN1CC(C1)O c1236cf6f40a2f38d0f260784d2c3b34 [0,1,0,1,0,0|1,0,1]=4 18815 B13R1.727 CCCCCC(=O)NC1CC(C1)O 476b0dab4a008daa09918af49f4dd052 [0,1,0,1,0,0|1,0,1]=4 18816 B13R1.727 CCCCCC(=O)N[C@H]1C[C@@H](C1)O f243787c8a6742379c532063c0a4c722 [0,1,0,1,0,0|1,0,1]=4 18817 B13R1.727 CCCCCC(=O)N[C@H]1C[C@H](C1)O cb8106b015f4d5fc8c957ba5458106aa [0,1,0,1,0,0|1,0,1]=4 18818 B13R1.727 CCCCCC(C)NC1CC(C1)F 3e0eb3abda152f6399771d817a756a0d [0,1,0,1,0,0|2,0,0]=4 18819 B13R1.727 CCCCCC(C)NC1CC(C1)O 10e592d973d629338c7d52eff1afbb08 [0,1,0,1,0,0|1,0,0]=3 18820 B13R1.727 CCCCCC(C)N[C@H]1C[C@@H](C1)F fd2b2ff4a9d8b23af785c3d830e553e6 [0,1,0,1,0,0|2,0,0]=4 18821 B13R1.727 CCCCCC(C)N[C@H]1C[C@@H](C1)O 1908b06d702e14bff00ca56982e52dca [0,1,0,1,0,0|1,0,0]=3 18822 B13R1.727 CCCCCC(C)N[C@H]1C[C@H](C1)F dc4e8b19be55de8ef80a3c0a1580ffd3 [0,1,0,1,0,0|2,0,0]=4 18823 B13R1.727 CCCCCC(C)N[C@H]1C[C@H](C1)O 218934cf0a9da48c3e137c163b04b7dc [0,1,0,1,0,0|1,0,0]=3 18824 B13R1.727 CCCCCC(C)OC1CC(C1)C 351cd421d3892bcd844fd4c745d01c0f [0,1,0,1,0,0|2,0,0]=4 18825 B13R1.727 CCCCCN(C)CC1CC(C1)C 2d969a79e37baf6a416c7064d41dbeaf [0,1,0,1,0,0|2,0,0]=4 18826 B13R1.727 CCCCCN(C)CC1CC(C1)O 9cbbb51bf2adc734bfa5a1b833d32e53 [0,1,0,1,0,0|1,0,0]=3 18827 B13R1.727 CCCCCN(C)C[C@H]1C[C@H](C1)F c349a9ea029f58179a6ab2f77546bfb0 [0,1,0,1,0,0|2,0,0]=4 18828 B13R1.727 CCCCC[C@H](C)NC1CC(C1)F 847699322c79fef1c53a218518fbf013 [0,1,0,1,0,0|2,0,0]=4 18829 B13R1.727 CCCCC[C@H](C)NC1CC(C1)O 9d8008ade1240302e4ea9b31ce6b5a29 [0,1,0,1,0,0|1,0,0]=3 18830 B13R1.727 CCCCC[C@H](C)N[C@H]1C[C@@H](C1)F 0252e948f46ff1d1fb8488afe8150023 [0,1,0,1,0,0|2,0,0]=4 18831 B13R1.727 CCCCC[C@H](C)N[C@H]1C[C@@H](C1)O 86cb0ac337d6cebe32b7ae411a03d8f7 [0,1,0,1,0,0|1,0,0]=3 18832 B13R1.727 CCCCC[C@H](C)N[C@H]1C[C@H](C1)F 0ec07aea450dcf806baf867e24ec7cb0 [0,1,0,1,0,0|2,0,0]=4 18833 B13R1.727 CCCCC[C@H](C)N[C@H]1C[C@H](C1)O 546f03cfbe0bd16b0d2163739989b7a8 [0,1,0,1,0,0|1,0,0]=3 18834 B13R1.727 CCCCC[C@H](C)OC1CC(C1)C a5f12a900f783310cd3449b0185f833c [0,1,0,1,0,0|2,0,0]=4 18835 B13R1.727 CCCCC[C@H](C)OC1CC(C1)F efb17edb5519075bea11e0b2a1bf01fd [0,1,0,1,0,0|2,0,0]=4 18836 B13R1.727 CCCCC[C@H](C)O[C@H]1C[C@@H](C1)F e1fd9313fd80a132d9cc0f62e0638f41 [0,1,0,1,0,0|2,0,0]=4 18837 B13R1.727 CCCCC[C@H](C)O[C@H]1C[C@H](C1)F bc3d35ef9b26f8325a88b14a1c30823a [0,1,0,1,0,0|2,0,0]=4 18838 B13R1.727 CCCCNC(=O)C[C@H]1C[C@@H](C1)O b18120eba32ea742523ab509038065a8 [0,1,0,1,0,0|1,0,1]=4 18839 B13R1.727 CCCCNC(=O)C[C@H]1C[C@H](C1)O d9e55c0c39624e3f371109e84fbe86a9 [0,1,0,1,0,0|1,0,1]=4 18840 B13R1.727 CCOCCN(C)CC1CC(C1)O ab3b4c6fff07cf5800c1df58508931ab [0,1,0,1,0,0|2,0,0]=4 18841 B13R1.727 CN(CCCCO)CC1CC(C1)O 076f6e1ad0084c90a13f2e100f50aebf [0,1,0,1,0,0|2,0,0]=4 18842 B13R1.727 COCCCN(C)CC1CC(C1)O 13c7129554e549efd9a34b30935c3819 [0,1,0,1,0,0|2,0,0]=4 18843 B13R1.729 CCCCCC(C)COCC1CC1 e41df99d61153ac9d0275d1e677b5eb6 [0,1,0,1,0,0|2,0,0]=4 18844 B13R1.729 CCCCCC(C)NCCC1CC1 8cf7e45501fba1451c9fcb88c337f511 [0,1,0,1,0,0|2,0,0]=4 18845 B13R1.729 CCCCCC(C)OCCC1CC1 d3ca60a8481133700615d65d8f905e46 [0,1,0,1,0,0|2,0,0]=4 18846 B13R1.729 CCCCC[C@@H](C)OCCC1CC1 a4fadb70904beff3645c3447b6960e07 [0,1,0,1,0,0|2,0,0]=4 18847 B13R1.729 CCCCC[C@H](C)NCCC1CC1 25cc81c252f4fdfdeb9a80d8d971b97b [0,1,0,1,0,0|2,0,0]=4 18848 B13R1.729 CCCCC[C@H](C)OCCC1CC1 93d1b5fd793fbea2b67c5bb011bbe89c [0,1,0,1,0,0|2,0,0]=4 18849 B13R1.1047 CC(C)CCCC(C)NC1CCC1 52601979534a05280d059375f342eaa1 [0,1,0,1,0,0|2,0,0]=4 18850 B13R1.1047 CC(C)CCCC(C)OC1CCC1 474022d3a980c2b9ef397a131dbcefb1 [0,1,0,1,0,0|2,0,0]=4 18851 B13R1.1047 CC(C)CCCN(C)CC1CCC1 6692ca6974e5f7e081211e661c8031f7 [0,1,0,1,0,0|2,0,0]=4 18852 B13R1.1047 CC(O)CCCN(C)CC1CCC1 44161a2b69cb0de2b6eaabc1c2932e28 [0,1,0,1,0,0|1,0,0]=3 18853 B13R1.1047 CC(O)CCCN(C)CC1COC1 01868b8479de3b45fee9fc3a703f828c [0,1,0,1,0,0|2,0,0]=4 18854 B13R1.1047 CC(O)CCNC(=O)CC1CCC1 e4fb48ea6a059deb1c866a03b028ede4 [0,1,0,1,0,0|1,0,1]=4 18855 B13R1.1047 C[C@@H](O)CCNC(=O)CC1CCC1 b44833ddd82f1b75cae344cbe50c4df0 [0,1,0,1,0,0|1,0,1]=4 18856 B13R1.1047 C[C@H](O)CCNC(=O)CC1CCC1 c3da4c05bd4f50521caf7eb24ba6d65b [0,1,0,1,0,0|1,0,1]=4 18857 B13R1.1048 CC(C)CCCC(C)NCC1CC1 e4799e89b06e2e864e1358bacbf70558 [0,1,0,1,0,0|2,0,0]=4 18858 B13R1.1048 CC(C)CCCC(C)OCC1CC1 8d957b647bf7831e3e202e66ac267bd5 [0,1,0,1,0,0|2,0,0]=4 18859 B13R1.1048 CC(O)CCNC(=O)CCC1CC1 cea723a20a439c3da4893733a942063e [0,1,0,1,0,0|1,0,1]=4 18860 B13R1.1048 C[C@@H](O)CCNC(=O)CCC1CC1 149498051be86dd0bc22068e750f42d1 [0,1,0,1,0,0|1,0,1]=4 18861 B13R1.1048 C[C@H](O)CCNC(=O)CCC1CC1 f2a59ea64a1b710eb312623398229a69 [0,1,0,1,0,0|1,0,1]=4 18862 B13R1.1149 CCCCCN1CCCC(CC1)C 986100fbe50f4984b093c165b3ba34fe [0,1,0,1,0,0|2,0,0]=4 18863 B13R1.1149 CCCCCN1CCCC(CC1)F bfb0a002255ee390885cfa4f42e6d8dc [0,1,0,1,0,0|2,0,0]=4 18864 B13R1.1149 CCCCCN1CCCC(CC1)O 3ffb572efc9b7e4b2a63db74e9a18003 [0,1,0,1,0,0|1,0,0]=3 18865 B13R1.1149 CCCCCN1CCC[C@@H](CC1)O 47fccbfeab77e9717af01ae9af82cc44 [0,1,0,1,0,0|1,0,0]=3 18866 B13R1.1149 CCCCCN1CCC[C@H](CC1)O b76e4ad054f742774eddaeee335dc7c9 [0,1,0,1,0,0|1,0,0]=3 18867 B13R1.1149 CCOCCN1CCCC(CC1)O 7cf753c81ef3debe1e3d452f47adf94f [0,1,0,1,0,0|2,0,0]=4 18868 B13R1.1149 CCOCCN1CCC[C@@H](CC1)O bd3ff64493498efd383d32e108a4cca8 [0,1,0,1,0,0|2,0,0]=4 18869 B13R1.1149 CCOCCN1CCC[C@H](CC1)O 8395dc1452feab090e3449bb9ddd24ae [0,1,0,1,0,0|2,0,0]=4 18870 B13R1.1149 CCSCCN1CCCC(CC1)O d4bc43606db495742b5fed276af4bee2 [0,1,0,1,0,0|2,0,0]=4 18871 B13R1.1149 CCSCCN1CCC[C@@H](CC1)O a56ec7084eb02ea9dbe9020eb008b73f [0,1,0,1,0,0|2,0,0]=4 18872 B13R1.1149 CCSCCN1CCC[C@H](CC1)O d19fff87e45cca6807a3ebbc88ef1b26 [0,1,0,1,0,0|2,0,0]=4 18873 B13R1.1149 COCCCN1CCCC(CC1)O b0bf2a570136525807033a640af5dfd7 [0,1,0,1,0,0|2,0,0]=4 18874 B13R1.1149 COCCCN1CCC[C@@H](CC1)O 7c6633e3bf114dff8a2fc66017495e33 [0,1,0,1,0,0|2,0,0]=4 18875 B13R1.1149 COCCCN1CCC[C@H](CC1)O ed165cb73ed606f545f7464f40d60bbd [0,1,0,1,0,0|2,0,0]=4 18876 B13R1.1149 CSCCCN1CCCC(CC1)O beee566e5b8e04557a7ba7e00b642858 [0,1,0,1,0,0|2,0,0]=4 18877 B13R1.1149 CSCCCN1CCC[C@@H](CC1)O 71a8ba2fb4191b760d20bbd7ef53db07 [0,1,0,1,0,0|2,0,0]=4 18878 B13R1.1149 CSCCCN1CCC[C@H](CC1)O 0624a986c26ddda0eae548445a4ede39 [0,1,0,1,0,0|2,0,0]=4 18879 B13R1.1149 OC1CCCN(CC1)CCCCF b00316bce00864d5e190f148632c2485 [0,1,0,1,0,0|2,0,0]=4 18880 B13R1.1149 OCCCCN1CCCC(CC1)O 15943ccdd74d41abb59450a29157c922 [0,1,0,1,0,0|2,0,0]=4 18881 B13R1.1149 OCCCCN1CCC[C@@H](CC1)O 3168f787c0dc476d86cb7216d9df5fe0 [0,1,0,1,0,0|2,0,0]=4 18882 B13R1.1149 OCCCCN1CCC[C@H](CC1)O 9799fce6c4595d22c6949aa7c96ab6c4 [0,1,0,1,0,0|2,0,0]=4 18883 B13R1.1149 O[C@@H]1CCCN(CC1)CCCCF 5982ed7689a6d64ef81227b5c83242c1 [0,1,0,1,0,0|2,0,0]=4 18884 B13R1.1149 O[C@H]1CCCN(CC1)CCCCF e130dab2114c9fc6449eac464cbd7e01 [0,1,0,1,0,0|2,0,0]=4 18885 B13R1.1988 C=C(C)CCCN1CCCCCC1 d96452eb24b8e1e4af829c9f5cbbf490 [0,1,0,1,0,0|1,0,1]=4 18886 B13R1.1988 C=C(C)CCNC1CCCCCC1 ff835d641957b0892f1ed6253a58d4f3 [0,1,0,1,0,0|1,0,1]=4 18887 B13R1.1988 C=C(C)CCOC1CCCCCC1 bb4a8ad6a2a06cd9e0186250687d9a3e [0,1,0,1,0,0|1,0,1]=4 18888 B13R1.1988 C=C(C)CNCC1CCCCCC1 63390056effee502d1a532f5af5b3cbb [0,1,0,1,0,0|1,0,1]=4 18889 B13R1.1988 C=C(C)COCC1CCCCCC1 27a5bc6ce4ff7a67161f8c766bd81bbc [0,1,0,1,0,0|1,0,1]=4 18890 B13R1.1988 CC(=O)CCCN1CCCCCC1 5e834cf4fef9fc7d36f0f335d82867e8 [0,1,0,1,0,0|0,0,2]=4 18891 B13R1.1988 CC(=O)CCNC1CCCCCC1 13ca331e58b790dcb3c60e7974f3fd86 [0,1,0,1,0,0|0,0,2]=4 18892 B13R1.1988 CC(=O)CCOC1CCCCCC1 ef9a2e6bd369585408cb1685ae54ea83 [0,1,0,1,0,0|0,0,2]=4 18893 B13R1.1988 CC(=O)CNCC1CCCCCC1 d8b16388775849e6cc095d458b7a2138 [0,1,0,1,0,0|0,0,2]=4 18894 B13R1.1988 CC(=O)COCC1CCCCCC1 9acf124b47c1412004cf89ddea82ce09 [0,1,0,1,0,0|0,0,2]=4 18895 B13R1.1988 CC(=O)NCCC1CCCCCC1 1390abe9276021635d4d4fa1d93352cd [0,1,0,1,0,0|0,0,2]=4 18896 B13R1.1988 CC(C)CCCN1CCCCCC1 0d73bf450e83e2d264103c1c499f888b [0,1,0,1,0,0|1,0,0]=3 18897 B13R1.1988 CC(C)CCCN1CCCOCC1 b9ad803b1aaee10742db1f7c46f11a8b [0,1,0,1,0,0|2,0,0]=4 18898 B13R1.1988 CC(C)CCNC1CCCCCC1 ac323269fb9321df878c7112ac37ff07 [0,1,0,1,0,0|1,0,0]=3 18899 B13R1.1988 CC(C)CCNC1CCCOCC1 cd31765561ede2a412f65b242962970f [0,1,0,1,0,0|2,0,0]=4 18900 B13R1.1988 CC(C)CCOC1CCCCCC1 bee70db201ff475d29d97aeb1c5a9ac7 [0,1,0,1,0,0|1,0,0]=3 18901 B13R1.1988 CC(C)CCOC1CCCOCC1 bd7bdcb08143e6a4a690cd1ab30bcfd0 [0,1,0,1,0,0|2,0,0]=4 18902 B13R1.1988 CC(C)CNCC1CCCCCC1 9349f9c711ea3d8a9acfdbf5affd81da [0,1,0,1,0,0|1,0,0]=3 18903 B13R1.1988 CC(C)COCC1CCCCCC1 f3fd937a87fb512bc4c7e135fee899de [0,1,0,1,0,0|1,0,0]=3 18904 B13R1.1988 CC(C)NCCC1CCCCCC1 11b09589d7736fed2485cec1551ca7f8 [0,1,0,1,0,0|1,0,0]=3 18905 B13R1.1988 CC(C)NCCN1CCCCCC1 33a19a14aa191eeda11ee8e2d229b55c [0,1,0,1,0,0|2,0,0]=4 18906 B13R1.1988 CC(C)OCCN1CCCCCC1 eb1b33bd459d9019098a5101cd4f1eba [0,1,0,1,0,0|2,0,0]=4 18907 B13R1.1988 CC(C)OCNC1CCCCCC1 379da2aba9117a574baca1525f1a08bb [0,1,0,1,0,0|2,0,0]=4 18908 B13R1.1988 CC(C)OCOC1CCCCCC1 5b109f00976ef439c4e423d3c0118353 [0,1,0,1,0,0|2,0,0]=4 18909 B13R1.1988 CC(C)SCCN1CCCCCC1 920d0003ca8382cb411b8bcb81791297 [0,1,0,1,0,0|2,0,0]=4 18910 B13R1.1988 CC(F)COCC1CCCCCC1 4c12d04ff6fc116a1b57b98aab95d8f4 [0,1,0,1,0,0|1,0,0]=3 18911 B13R1.1988 CC(O)CCCN1CCCCCC1 5a8c7d664e88a7f7afd4987c3f87a309 [0,1,0,1,0,0|0,0,0]=2 18912 B13R1.1988 CC(O)CCCN1CCCOCC1 3ed6d5fe7d4e0ca4522b71676ace3ca0 [0,1,0,1,0,0|1,0,0]=3 18913 B13R1.1988 CC(O)CCNC1CCC=CCC1 c8b0182362280114a806fb315373e386 [0,1,0,1,0,0|0,0,2]=4 18914 B13R1.1988 CC(O)CCNC1CCCCCC1 c1e3e2c105787c8414dd6778a37fb5be [0,1,0,1,0,0|0,0,0]=2 18915 B13R1.1988 CC(O)CCNC1CCCOCC1 d2d5a7640b86758729364f0699460641 [0,1,0,1,0,0|1,0,0]=3 18916 B13R1.1988 CC(O)CNCC1CCCCCC1 691e6ec02206fc582c49fee1a3ae7b03 [0,1,0,1,0,0|0,0,0]=2 18917 B13R1.1988 CC(O)CNCC1COCCOC1 31e743ccd997e72658eaa7b9a42afdda [0,1,0,1,0,0|2,0,0]=4 18918 B13R1.1988 CC(S)COCC1CCCCCC1 f269e2616bf82c41ead998284855c422 [0,1,0,1,0,0|0,1,0]=3 18919 B13R1.1988 CN(C)CCCN1CCCCCC1 7753701bc469f2d32b7117655ff465ee [0,1,0,1,0,0|2,0,0]=4 18920 B13R1.1988 CN(C)CCNC1CCCCCC1 5453d098a9ff520150ed82cd263bbe74 [0,1,0,1,0,0|2,0,0]=4 18921 B13R1.1988 CN(C)CCOC1CCCCCC1 6db704a6222433b761324dd7e5e6bac0 [0,1,0,1,0,0|2,0,0]=4 18922 B13R1.1988 CN(C)CNCC1CCCCCC1 25f307603b9f5d795013a77915b09633 [0,1,0,1,0,0|2,0,0]=4 18923 B13R1.1988 CN(C)COCC1CCCCCC1 8d0eb5a4f6924a276dad3ca270d5df92 [0,1,0,1,0,0|2,0,0]=4 18924 B13R1.1988 CS(=O)CCNC1CCCCCC1 cfb37ccb0ee91ee400bb5793c4380550 [0,1,0,1,0,0|1,0,1]=4 18925 B13R1.1988 CS(=O)CCOC1CCCCCC1 7011ddb4e790a02c86189bbf34a94df2 [0,1,0,1,0,0|1,0,1]=4 18926 B13R1.1988 C[C@@H](F)COCC1CCCCCC1 184f67233c55745f527be84bd4ff66d1 [0,1,0,1,0,0|1,0,0]=3 18927 B13R1.1988 C[C@@H](O)CCNC1CCCCCC1 5ba735c89c1bae6f3bc567885acf5444 [0,1,0,1,0,0|0,0,0]=2 18928 B13R1.1988 C[C@@H](O)CCNC1CCCOCC1 5c18e00cd561b5392b39bd92a65bf21b [0,1,0,1,0,0|1,0,0]=3 18929 B13R1.1988 C[C@@H](O)CNCC1CCCCCC1 48415738e536ac8e2b1a337918a27be6 [0,1,0,1,0,0|0,0,0]=2 18930 B13R1.1988 C[C@@H](O)CNCC1COCCOC1 f808d7e31ed763526a1d5a7844409733 [0,1,0,1,0,0|2,0,0]=4 18931 B13R1.1988 C[C@H](F)COCC1CCCCCC1 025fd6a5372d6df1544b986af3a92a13 [0,1,0,1,0,0|1,0,0]=3 18932 B13R1.1988 C[C@H](O)CCNC1CCCCCC1 fabc3bb461034e4f545c1d8a94c4248e [0,1,0,1,0,0|0,0,0]=2 18933 B13R1.1988 C[C@H](O)CCNC1CCCOCC1 687f6470bf911bf3da02c3ae9ac4b6f3 [0,1,0,1,0,0|1,0,0]=3 18934 B13R1.1988 C[C@H](O)CNCC1CCCCCC1 bbb758185a80c0a63aff2e6e97985379 [0,1,0,1,0,0|0,0,0]=2 18935 B13R1.1988 C[C@H](O)CNCC1COCCOC1 3df2cceaaa163734f50ff5d85031c0b4 [0,1,0,1,0,0|2,0,0]=4 18936 B13R1.1988 FC(F)CCNC1CCCCCC1 dcdeaaea5431ef2fd44765f98f1ab4df [0,1,0,1,0,0|2,0,0]=4 18937 B13R1.1988 FC(F)CCOC1CCCCCC1 b645101981fa6c9ab078b86663850703 [0,1,0,1,0,0|2,0,0]=4 18938 B13R1.1988 FC(F)CNCC1CCCCCC1 f12ae7790650d8ce6d5da68b11c6afb2 [0,1,0,1,0,0|2,0,0]=4 18939 B13R1.1988 FC(F)COCC1CCCCCC1 28b80d7df805aacdac17fd6a65d2f544 [0,1,0,1,0,0|2,0,0]=4 18940 B13R1.1988 O=C(O)CCNC1CCCCCC1 51bae8bd8ca06ecb222203d37d82a38a [0,1,0,1,0,0|1,0,1]=4 18941 B13R1.1988 O=C(O)CCOC1CCCCCC1 83377bc176c2f458b0089e2ea5f2a7a2 [0,1,0,1,0,0|1,0,1]=4 18942 B13R1.1988 O=C(O)CNCC1CCCCCC1 b81c26e321048c84da841e7c0538bc42 [0,1,0,1,0,0|1,0,1]=4 18943 B13R1.1988 O=C(O)COCC1CCCCCC1 09f27392c9363f19623c7a83beb1c055 [0,1,0,1,0,0|1,0,1]=4 18944 B13R1.1988 O=S(O)CCNC1CCCCCC1 4a5ea46a402006f4d20e31207df1adb8 [0,1,0,1,0,0|2,0,0]=4 18945 B13R1.1988 O=S(O)COCC1CCCCCC1 387058646d538475a51a384a948c701a [0,1,0,1,0,0|2,0,0]=4 18946 B13R1.2769 CCCCCC(C)NC1CC1(C)C a1048c74074a392278cc329e863790bb [0,1,0,1,0,0|2,0,0]=4 18947 B13R1.2769 CCCCCC(C)N[C@@H]1CC1(C)C 159b28be04604f9df1429c6cd4ce47e4 [0,1,0,1,0,0|2,0,0]=4 18948 B13R1.2769 CCCCCC(C)N[C@H]1CC1(C)C c99b590f5b160f1b597b3b4b80e314be [0,1,0,1,0,0|2,0,0]=4 18949 B13R1.2769 CCCCCC(C)OC1CC1(C)C 8930cde4d25a6b0622fc0fedf95cf5b5 [0,1,0,1,0,0|2,0,0]=4 18950 B13R1.2769 CCCCC[C@@H](C)OC1CC1(C)C 0880edc3b82fa5e8d96c2d6e829ece21 [0,1,0,1,0,0|2,0,0]=4 18951 B13R1.2769 CCCCC[C@H](C)NC1CC1(C)C 653817eea78c46ea56b5758a124a5d3e [0,1,0,1,0,0|2,0,0]=4 18952 B13R1.2769 CCCCC[C@H](C)N[C@@H]1CC1(C)C 9c640d5a59a014e607e21233fb836711 [0,1,0,1,0,0|2,0,0]=4 18953 B13R1.2769 CCCCC[C@H](C)N[C@H]1CC1(C)C b57ba3bb4ef0495113bd467b27f58968 [0,1,0,1,0,0|2,0,0]=4 18954 B13R1.2769 CCCCC[C@H](C)OC1CC1(C)C ad975f6de8e081cb05b2c947470a500a [0,1,0,1,0,0|2,0,0]=4 18955 B13R1.3089 CCC1COC(CN1CC(C)O)C 9ba91e5a378968adab3f1fa1ba9feeaf [0,1,0,1,0,0|2,0,0]=4 18956 B13R1.3089 CCC1COC(CN1C[C@@H](C)O)C 4a20cc3251549166d5d7b5239d9f8706 [0,1,0,1,0,0|2,0,0]=4 18957 B13R1.3089 CCC1COC(CN1C[C@H](C)O)C 3e177c3019670f56e0fe3d3af5ab39fd [0,1,0,1,0,0|2,0,0]=4 18958 B13R1.3537 CCCCCC(C)OCC1CC1C 81514ddfaa210f274618f9b76b705cec [0,1,0,1,0,0|2,0,0]=4 18959 B13R1.3537 CCCCCC(C)OC[C@@H]1C[C@@H]1C 975a1623668ae4d29cbf533d9324c19b [0,1,0,1,0,0|2,0,0]=4 18960 B13R1.3537 CCCCCC(C)OC[C@@H]1C[C@@H]1F 01d7b32958b2d10ee8f1d1aac631eb9d [0,1,0,1,0,0|2,0,0]=4 18961 B13R1.3537 CCCCCC(C)OC[C@@H]1C[C@H]1C 382afaad3d8cd4a27e3c4415d012848d [0,1,0,1,0,0|2,0,0]=4 18962 B13R1.3537 CCCCCC(C)OC[C@@H]1C[C@H]1F 86c5742380ba8d267f43b057eecb6cb7 [0,1,0,1,0,0|2,0,0]=4 18963 B13R1.3537 CCCCCC(C)OC[C@H]1C[C@@H]1C 2db1abc8680bb9a4fbd1c39726b36046 [0,1,0,1,0,0|2,0,0]=4 18964 B13R1.3537 CCCCCC(C)OC[C@H]1C[C@@H]1F d2e170e91275beeaec87dbe8a4b551f9 [0,1,0,1,0,0|2,0,0]=4 18965 B13R1.3537 CCCCCC(C)OC[C@H]1C[C@H]1F 103b9abf75ced01885ced2b12b1f1334 [0,1,0,1,0,0|2,0,0]=4 18966 B13R1.3537 CCCCC[C@H](C)OCC1CC1C 28125bb1239b64930a3db9bf3dd3ce3f [0,1,0,1,0,0|2,0,0]=4 18967 B13R1.3537 CCCCC[C@H](C)OC[C@@H]1C[C@@H]1C 8c9d1fb2edfdaa87f1ffcd7854e8c5cf [0,1,0,1,0,0|2,0,0]=4 18968 B13R1.3537 CCCCC[C@H](C)OC[C@@H]1C[C@@H]1F 7225004a7338b9eaee7a71c3a97c774e [0,1,0,1,0,0|2,0,0]=4 18969 B13R1.3537 CCCCC[C@H](C)OC[C@@H]1C[C@H]1C 5fa5119e17fb349ab43a5526b0e6e9c4 [0,1,0,1,0,0|2,0,0]=4 18970 B13R1.3537 CCCCC[C@H](C)OC[C@@H]1C[C@H]1F 5acda7e76776700a14523dd3122e97d8 [0,1,0,1,0,0|2,0,0]=4 18971 B13R1.3537 CCCCC[C@H](C)OC[C@H]1C[C@@H]1C 2b47ef2ea2e4457075cd491dbd20cb11 [0,1,0,1,0,0|2,0,0]=4 18972 B13R1.3537 CCCCC[C@H](C)OC[C@H]1C[C@@H]1F 2e819f22210bcf429c297e0255b04ab9 [0,1,0,1,0,0|2,0,0]=4 18973 B13R1.3537 CCCCC[C@H](C)OC[C@H]1C[C@H]1F 5cdcc43ace59dc6d0c4be2d2cb9722fc [0,1,0,1,0,0|2,0,0]=4 18974 B13R1.3787 CC(C)CCN1C(CCCC1C)C 5532dcceeed8786fde5dd2b302790902 [0,1,0,1,0,0|2,0,0]=4 18975 B13R1.3787 CC(C)CCN1[C@@H](CCC[C@@H]1C)C 5ada5bd757f2850b1847423d17743704 [0,1,0,1,0,0|2,0,0]=4 18976 B13R1.3787 CC(C)CCN1[C@@H](CCC[C@H]1C)C f79155bad5a312640c10b9058b6ee7be [0,1,0,1,0,0|2,0,0]=4 18977 B13R1.3787 CC(C)CCN1[C@H](CCC[C@@H]1C)C 76c5d90e55487b44353d17be3e7b98ff [0,1,0,1,0,0|2,0,0]=4 18978 B13R1.3787 CC(C)COC1C(CCCC1C)C 4bdc9ea2842557a6403a0eca7aa52dd1 [0,1,0,1,0,0|2,0,0]=4 18979 B13R1.3787 CC(C)OCC1C(CCCC1C)C 1b7e848b7e6f2c874774fbfd79518fde [0,1,0,1,0,0|2,0,0]=4 18980 B13R1.3787 CC(O)CCN1C(CCCC1C)C 63db9dac621965b98d260d4ef4813f89 [0,1,0,1,0,0|1,0,0]=3 18981 B13R1.3787 CC(O)CCN1C(COCC1C)C 949b65b1f6cfdaed50a274fe7e5e1ca6 [0,1,0,1,0,0|2,0,0]=4 18982 B13R1.3787 CC(O)CCN1[C@@H](CCC[C@@H]1C)C 23baabaf5f588c363422b00958cd3699 [0,1,0,1,0,0|1,0,0]=3 18983 B13R1.3787 CC(O)CCN1[C@@H](CCC[C@H]1C)C 29a9de5c07e543e4163815bc782a4299 [0,1,0,1,0,0|1,0,0]=3 18984 B13R1.3787 CC(O)CCN1[C@@H](COC[C@@H]1C)C 467135008b1692a5337210a5da533a15 [0,1,0,1,0,0|2,0,0]=4 18985 B13R1.3787 CC(O)CCN1[C@@H](COC[C@H]1C)C 709399be450d42a630c6a53b1c1797fa [0,1,0,1,0,0|2,0,0]=4 18986 B13R1.3787 CC(O)CCN1[C@H](CCC[C@@H]1C)C 42cb14cff4944bc9a716db31621786cc [0,1,0,1,0,0|1,0,0]=3 18987 B13R1.3787 CC(O)CCN1[C@H](COC[C@@H]1C)C 01b8baba6245d3780b1531351f5c0e70 [0,1,0,1,0,0|2,0,0]=4 18988 B13R1.3787 CC(O)CN[C@H]1[C@@H](CCC[C@@H]1O)O f97ab3a742ae084d8f1b291a9533ddb8 [0,1,0,1,0,0|2,0,0]=4 18989 B13R1.3787 C[C@@H](O)CN[C@H]1[C@@H](CCC[C@@H]1O)O f4ee4b04b86234b2035f2b64285f4ede [0,1,0,1,0,0|2,0,0]=4 18990 B13R1.3787 C[C@H](O)CN[C@H]1[C@@H](CCC[C@@H]1O)O c44baaad80c0c4c0698fd3d72191e40f [0,1,0,1,0,0|2,0,0]=4 18991 B13R1.5134 CC(C)CCNC1(CCCCC1)C c01c270b42097d13dcd2d7c0a23b664e [0,1,0,1,0,0|2,0,0]=4 18992 B13R1.5134 CC(C)CNCC1(CCCCC1)C 249e4bbe56f44ce1cc5361381d476e4e [0,1,0,1,0,0|2,0,0]=4 18993 B13R1.5134 CC(C)CNCC1(CCCCC1)O 9bba2f9e8efcbebc103cf036ea975660 [0,1,0,1,0,0|2,0,0]=4 18994 B13R1.5134 CC(C)COCC1(CCCCC1)C c6fb66e9ec8a52d74158c04f517306f3 [0,1,0,1,0,0|2,0,0]=4 18995 B13R1.5134 CC(C)COCC1(CCCCC1)F 73913da4c3635ba7c397c3a34040bfba [0,1,0,1,0,0|2,0,0]=4 18996 B13R1.5134 CC(C)NCCC1(CCCCC1)O 760042b2f091f8afdf857f940052d795 [0,1,0,1,0,0|2,0,0]=4 18997 B13R1.5134 CC(F)COCC1(CCCCC1)C a371674478300d926925cedede02b9b0 [0,1,0,1,0,0|2,0,0]=4 18998 B13R1.5134 CC(O)CCNC1(CCCCC1)C 13f68e51d3722976086c98e0251cfb72 [0,1,0,1,0,0|1,0,0]=3 18999 B13R1.5134 CC(O)CCNC1(CCOCC1)C 53813784376954e875c9d15a4213eca1 [0,1,0,1,0,0|2,0,0]=4 19000 B13R1.5134 CC(O)CNCC1(CCCCC1)C 1618041577aedbc50ee41aace76299f2 [0,1,0,1,0,0|1,0,0]=3 19001 B13R1.5134 CC(O)CNCC1(CCCCC1)O 96b07f4c217de77344e235d29b3b2384 [0,1,0,1,0,0|1,0,0]=3 19002 B13R1.5134 CC(O)CNCC1(CCOCC1)C 8338f1b8029756a5f09a48177be945d1 [0,1,0,1,0,0|2,0,0]=4 19003 B13R1.5134 CC(O)CNCC1(CCOCC1)F 1141fb401cc176fe771fa2a436b0fcba [0,1,0,1,0,0|2,0,0]=4 19004 B13R1.5134 CC(O)CNCC1(CCOCC1)O fd9cda82d3c0dc8c29dd2db7d1b9caee [0,1,0,1,0,0|2,0,0]=4 19005 B13R1.5134 CC(O)CNCC1(CCSCC1)O 54c4f219e1239ab3bf9c407e247f23c6 [0,1,0,1,0,0|2,0,0]=4 19006 B13R1.5134 CC(S)COCC1(CCCCC1)C 147b701a2d8e166920d5e4d9e5f00b14 [0,1,0,1,0,0|1,1,0]=4 19007 B13R1.5134 C[C@@H](F)COCC1(CCCCC1)C 798a3547b63530230d45698a359e8b3e [0,1,0,1,0,0|2,0,0]=4 19008 B13R1.5134 C[C@@H](O)CNCC1(CCCCC1)C 4c8904a1209e37342a30b5f1f4309467 [0,1,0,1,0,0|1,0,0]=3 19009 B13R1.5134 C[C@@H](O)CNCC1(CCCCC1)O a9a8e26fa55db1b0cc6fcaaec3172032 [0,1,0,1,0,0|1,0,0]=3 19010 B13R1.5134 C[C@@H](O)CNCC1(CCOCC1)C cbce36afebbddcbfd27f1e583d66cb14 [0,1,0,1,0,0|2,0,0]=4 19011 B13R1.5134 C[C@@H](O)CNCC1(CCOCC1)F c8f888583066e6e81c8750a263b93ff4 [0,1,0,1,0,0|2,0,0]=4 19012 B13R1.5134 C[C@@H](O)CNCC1(CCOCC1)O e4d9b7295ab370f11341dfee675312b6 [0,1,0,1,0,0|2,0,0]=4 19013 B13R1.5134 C[C@@H](O)CNCC1(CCSCC1)O 7f79469b342742154219dc0fef8bb80c [0,1,0,1,0,0|2,0,0]=4 19014 B13R1.5134 C[C@H](F)COCC1(CCCCC1)C fec87d8a619aca945fb931e85cff2092 [0,1,0,1,0,0|2,0,0]=4 19015 B13R1.5134 C[C@H](O)CNCC1(CCCCC1)C 3e2c9a89b94b0867336eb72beb2537ed [0,1,0,1,0,0|1,0,0]=3 19016 B13R1.5134 C[C@H](O)CNCC1(CCCCC1)O e630946ed001b6508d655a876fc48387 [0,1,0,1,0,0|1,0,0]=3 19017 B13R1.5134 C[C@H](O)CNCC1(CCOCC1)C 3ed178850b09f79301494c4c48db1313 [0,1,0,1,0,0|2,0,0]=4 19018 B13R1.5134 C[C@H](O)CNCC1(CCOCC1)F 606ea084432c05858a014748f3c17946 [0,1,0,1,0,0|2,0,0]=4 19019 B13R1.5134 C[C@H](O)CNCC1(CCOCC1)O 4b1c240be4e8fc4bab46a1ca53de3a12 [0,1,0,1,0,0|2,0,0]=4 19020 B13R1.5134 C[C@H](O)CNCC1(CCSCC1)O a18205c8ebe3377413b729d17f63cd88 [0,1,0,1,0,0|2,0,0]=4 19021 B13R1.8936 CCCNCC1(CCCC(C1)C)O da7bedb69682ec7d0122bd7aab0016a6 [0,1,0,1,0,0|2,0,0]=4 19022 B13R1.6 C#CCCCCN1CCCC(C1)O e5bf75962b32fbef4f0e4e9b952936b8 [0,1,0,1,0,0|0,0,2]=4 19023 B13R1.6 C#CCCCCN1CCC[C@@H](C1)O 3dcba8d1bffff877ecaa5ee654c811d2 [0,1,0,1,0,0|0,0,2]=4 19024 B13R1.6 C#CCCCCN1CCC[C@H](C1)O 630248267056c315476784d5d3e107aa [0,1,0,1,0,0|0,0,2]=4 19025 B13R1.6 C#CCCCNC1CCCC(C1)O 9fa5ad203cb3f3b3f2925e2cb20a16dd [0,1,0,1,0,0|0,0,2]=4 19026 B13R1.6 C#CCCCN[C@@H]1CCC[C@@H](C1)O 5e323c4373494a21b983f7c078709b32 [0,1,0,1,0,0|0,0,2]=4 19027 B13R1.6 C#CCCCN[C@@H]1CCC[C@H](C1)O bb2468e203d5e0264ea1ba6a823e65ae [0,1,0,1,0,0|0,0,2]=4 19028 B13R1.6 C#CCCCN[C@H]1CCC[C@@H](C1)O 57e95090c228c48332f1cfa90ba6a0f6 [0,1,0,1,0,0|0,0,2]=4 19029 B13R1.6 C#CCCCN[C@H]1CCC[C@H](C1)O ae8722303accf5976668fb4e0a322f65 [0,1,0,1,0,0|0,0,2]=4 19030 B13R1.6 C#CCCNCC1CCCC(C1)O 8963ec34cb413cc76e5899277cd26f61 [0,1,0,1,0,0|0,0,2]=4 19031 B13R1.6 C#CCCNC[C@H]1CCC[C@H](C1)O 706d29f2dedd2f060f086b796fd7f6f6 [0,1,0,1,0,0|0,0,2]=4 19032 B13R1.6 C/C=C/CNCC1CCCC(C1)O 3148210881b01e4bc3c25ccfce355f39 [0,1,0,1,0,0|0,0,2]=4 19033 B13R1.6 C/C=C/CNC[C@H]1CCC[C@H](C1)O 077eee87af8385282afcd2ac1ed66253 [0,1,0,1,0,0|0,0,2]=4 19034 B13R1.6 C/C=C\CCCN1CCCC(C1)O 574c725bcb16b3001e6e845975531302 [0,1,0,1,0,0|0,0,2]=4 19035 B13R1.6 C/C=C\CCCN1CCC[C@@H](C1)O bf19ba2cf8746b6e96cb7fbbdb48b1ac [0,1,0,1,0,0|0,0,2]=4 19036 B13R1.6 C/C=C\CCCN1CCC[C@H](C1)O 119a48bba501a1ca852b00cf6d4cfe3b [0,1,0,1,0,0|0,0,2]=4 19037 B13R1.6 C/C=C\CNCC1CCCC(C1)O 5f5cf33262253746b1adcc0b54b31d3e [0,1,0,1,0,0|0,0,2]=4 19038 B13R1.6 C/C=C\CNC[C@H]1CCC[C@H](C1)O 5f25a3bd9f3b71c205e4f8ec0cec5fe2 [0,1,0,1,0,0|0,0,2]=4 19039 B13R1.6 C=CCCCCN1CCCC(C1)O 516f02731af482eaf34910f4e9aebe3f [0,1,0,1,0,0|0,0,2]=4 19040 B13R1.6 C=CCCCCN1CCC[C@@H](C1)O dd72c1368909905fd00db8e868883c68 [0,1,0,1,0,0|0,0,2]=4 19041 B13R1.6 C=CCCCCN1CCC[C@H](C1)O 4c3aa5d23588519816323c4108a7e18e [0,1,0,1,0,0|0,0,2]=4 19042 B13R1.6 C=CCCCNC1CCCC(C1)O 7dae4059b30249ad345ccbdfa32de2e2 [0,1,0,1,0,0|0,0,2]=4 19043 B13R1.6 C=CCCCN[C@@H]1CCC[C@@H](C1)O 4569ce9e73240a0a839843b041bf3583 [0,1,0,1,0,0|0,0,2]=4 19044 B13R1.6 C=CCCCN[C@@H]1CCC[C@H](C1)O da2c4faebc605cf1553313d71e50e188 [0,1,0,1,0,0|0,0,2]=4 19045 B13R1.6 C=CCCCN[C@H]1CCC[C@@H](C1)O 7e3e15dbe6defd0a7551968e08e9333a [0,1,0,1,0,0|0,0,2]=4 19046 B13R1.6 C=CCCCN[C@H]1CCC[C@H](C1)O c44299b49206f8d462b8b2429588f782 [0,1,0,1,0,0|0,0,2]=4 19047 B13R1.6 C=CCCNCC1CCCC(C1)O 71a5847519e6b9d604c8a204738b6ef3 [0,1,0,1,0,0|0,0,2]=4 19048 B13R1.6 C=CCCNC[C@H]1CCC[C@H](C1)O aea190c4dbfbbcde02cd553251787964 [0,1,0,1,0,0|0,0,2]=4 19049 B13R1.6 CC#CCCCN1CCCC(C1)O a21acdb04307a0e3a59184ca79788c45 [0,1,0,1,0,0|0,0,2]=4 19050 B13R1.6 CC#CCCCN1CCC[C@@H](C1)O e720ca7a6aec684dff22ff46bc4dbdc2 [0,1,0,1,0,0|0,0,2]=4 19051 B13R1.6 CC#CCCCN1CCC[C@H](C1)O 2192058f070e482cf9b95ce657e0e195 [0,1,0,1,0,0|0,0,2]=4 19052 B13R1.6 CC#CCNCC1CCCC(C1)O e84c6b26949e99e7070fe1101b9071ec [0,1,0,1,0,0|0,0,2]=4 19053 B13R1.6 CC#CCNC[C@H]1CCC[C@H](C1)O f073a4a8c14930d491cfb4c0d716b0ec [0,1,0,1,0,0|0,0,2]=4 19054 B13R1.6 CC/C=C/CNC1CCCC(C1)O 54a2f577de50bb95a7c48d7a7547a7be [0,1,0,1,0,0|0,0,2]=4 19055 B13R1.6 CC/C=C/CN[C@@H]1CCC[C@@H](C1)O ea0964af34f832e27c3144bb9e2c3740 [0,1,0,1,0,0|0,0,2]=4 19056 B13R1.6 CC/C=C/CN[C@@H]1CCC[C@H](C1)O 6c0e7de98bbda8834762ed011070ffc7 [0,1,0,1,0,0|0,0,2]=4 19057 B13R1.6 CC/C=C/CN[C@H]1CCC[C@@H](C1)O 1e13566483a36ddf611f7df858dddba2 [0,1,0,1,0,0|0,0,2]=4 19058 B13R1.6 CC/C=C/CN[C@H]1CCC[C@H](C1)O 8f94589bfc76909154714d03970aaa21 [0,1,0,1,0,0|0,0,2]=4 19059 B13R1.6 CC/C=C\CCN1CCCC(C1)O 541488be574780435ad9cec89f782118 [0,1,0,1,0,0|0,0,2]=4 19060 B13R1.6 CC/C=C\CCN1CCC[C@@H](C1)O 567d1f12ae6fa842570256133a30e290 [0,1,0,1,0,0|0,0,2]=4 19061 B13R1.6 CC/C=C\CCN1CCC[C@H](C1)O d8844eab3ba73baa1a0dadd8a9c5e178 [0,1,0,1,0,0|0,0,2]=4 19062 B13R1.6 CC1CCCC(C1)CNCCCF 1ecde588222dad4c6955244d3604cff3 [0,1,0,1,0,0|2,0,0]=4 19063 B13R1.6 CC1CCCC(C1)CNCCCO 1c415779cf4b7806f55c7c1cb142234a [0,1,0,1,0,0|2,0,0]=4 19064 B13R1.6 CC1CCCC(C1)CNCCCS 10ebdd5a173623cb5a978d6fdca35858 [0,1,0,1,0,0|2,0,0]=4 19065 B13R1.6 CC1CCCC(C1)COCCCF b5f9afb6c03c32b84e4aaa49666236a7 [0,1,0,1,0,0|2,0,0]=4 19066 B13R1.6 CC1CCCC(C1)COCCCS a116758c49d60f22fc9a31d78cdc3cf4 [0,1,0,1,0,0|2,0,0]=4 19067 B13R1.6 CC1CCCC(C1)NCCCCF 5ce3962c8da67ed3ec7f0221a0ce0909 [0,1,0,1,0,0|2,0,0]=4 19068 B13R1.6 CC1CCCC(C1)NCCCCO 996cca800903b6425143c5530ff39b66 [0,1,0,1,0,0|2,0,0]=4 19069 B13R1.6 CC1CCCC(C1)OCCCCF 8e279eb1cb0d330db4e528a5f4d454b5 [0,1,0,1,0,0|2,0,0]=4 19070 B13R1.6 CC1CCCN(C1)CCCCCF 9e158f3a2863761f79a645ef8e064418 [0,1,0,1,0,0|2,0,0]=4 19071 B13R1.6 CC1CCCN(C1)CCCCCO 7f4b19cf7adfc4e421500b36a345b2c6 [0,1,0,1,0,0|2,0,0]=4 19072 B13R1.6 CCC/C=C/CN1CCCC(C1)O becd6933c084614a3bc26a8c5805d2c4 [0,1,0,1,0,0|0,0,2]=4 19073 B13R1.6 CCC/C=C/CN1CCC[C@@H](C1)O 5403ed888a7935f060b15a2422867dfb [0,1,0,1,0,0|0,0,2]=4 19074 B13R1.6 CCC/C=C/CN1CCC[C@H](C1)O b22f2f89941b88972806046b8d34d3fd [0,1,0,1,0,0|0,0,2]=4 19075 B13R1.6 CCC/C=C\CN1CCCC(C1)O 448c515969ab8e18c66c43ef353a9465 [0,1,0,1,0,0|0,0,2]=4 19076 B13R1.6 CCC/C=C\CN1CCC[C@@H](C1)O ea665c6105037fcfb84a4e69cb0c6674 [0,1,0,1,0,0|0,0,2]=4 19077 B13R1.6 CCC/C=C\CN1CCC[C@H](C1)O e0d2f8973d3e17e18519933082800c14 [0,1,0,1,0,0|0,0,2]=4 19078 B13R1.6 CCCCCCN1CC=CC(C1)O 939493cab697a0c2199de82f72e1ca4c [0,1,0,1,0,0|0,0,2]=4 19079 B13R1.6 CCCCCCN1CCCC(=O)C1 bb46bfa9e79877aff95a0f89ed3859de [0,1,0,1,0,0|0,0,2]=4 19080 B13R1.6 CCCCCCN1CCCC(C1)C cf158e58d98a22a486c0d2462f3dab98 [0,1,0,1,0,0|1,0,0]=3 19081 B13R1.6 CCCCCCN1CCCC(C1)F 1f10412e94a163a1701f68e774802c29 [0,1,0,1,0,0|1,0,0]=3 19082 B13R1.6 CCCCCCN1CCCC(C1)O 6edbc2fb3c2943aa61edeb1446d822c1 [0,1,0,1,0,0|0,0,0]=2 19083 B13R1.6 CCCCCCN1CCC[C@@H](C1)C a94576ec7feb574ff3c240bdb6096567 [0,1,0,1,0,0|1,0,0]=3 19084 B13R1.6 CCCCCCN1CCC[C@@H](C1)F 42f6fa005005d23dc7a7b670becb703b [0,1,0,1,0,0|1,0,0]=3 19085 B13R1.6 CCCCCCN1CCC[C@@H](C1)O 387fa201f7574f508a6f61a9ab4eee9d [0,1,0,1,0,0|0,0,0]=2 19086 B13R1.6 CCCCCCN1CCC[C@H](C1)C a5af9ab064b3c6552e476f1ff0af3e82 [0,1,0,1,0,0|1,0,0]=3 19087 B13R1.6 CCCCCCN1CCC[C@H](C1)F db48e3616ef9961d0b6eaeb4c10d84ae [0,1,0,1,0,0|1,0,0]=3 19088 B13R1.6 CCCCCCN1CCC[C@H](C1)O e4a999f7c458c1449a3cd1d67b88625d [0,1,0,1,0,0|0,0,0]=2 19089 B13R1.6 CCCCCCN1CCOC(C1)C 609f7b4b4aeab1c199263ead6935fb0b [0,1,0,1,0,0|2,0,0]=4 19090 B13R1.6 CCCCCCN1CCO[C@@H](C1)C 501a1ce0bb4399a5177472a40dd7488e [0,1,0,1,0,0|2,0,0]=4 19091 B13R1.6 CCCCCCN1CCO[C@H](C1)C a95f8ddb023c2fe2e7d332fcf9b44284 [0,1,0,1,0,0|2,0,0]=4 19092 B13R1.6 CCCCCNC1CCCC(=O)C1 f4adbee4bc7bf8035cf9711c7c626d81 [0,1,0,1,0,0|0,0,2]=4 19093 B13R1.6 CCCCCNC1CCCC(C1)C 5f09ca8ba7e1d082a2aca3af17bf6212 [0,1,0,1,0,0|1,0,0]=3 19094 B13R1.6 CCCCCNC1CCCC(C1)O c256f2daa23598bfce245448e4d37055 [0,1,0,1,0,0|0,0,0]=2 19095 B13R1.6 CCCCCNC1CCCN(C1)C 34bb81133f1b65adec1fcd7b0bcd5e9d [0,1,0,1,0,0|2,0,0]=4 19096 B13R1.6 CCCCCNC1CCOC(C1)C b8d58312d3fc7163b67f00bde774fd80 [0,1,0,1,0,0|2,0,0]=4 19097 B13R1.6 CCCCCNC1COCC(C1)O 798242789713bfa376571d590636e6b2 [0,1,0,1,0,0|1,0,0]=3 19098 B13R1.6 CCCCCN[C@@H]1CCCN(C1)C b0c3a50dc32cfc273df3f5508ea66aef [0,1,0,1,0,0|2,0,0]=4 19099 B13R1.6 CCCCCN[C@@H]1CCC[C@@H](C1)O 62dcbd4e8c566b1798de648e2e9ba915 [0,1,0,1,0,0|0,0,0]=2 19100 B13R1.6 CCCCCN[C@@H]1CCC[C@H](C1)C aa2285aa938a8c6c9aa86699f0ac93c3 [0,1,0,1,0,0|1,0,0]=3 19101 B13R1.6 CCCCCN[C@@H]1CCC[C@H](C1)O 0b86f92de0dcb6633ad3ba1dc7ff458d [0,1,0,1,0,0|0,0,0]=2 19102 B13R1.6 CCCCCN[C@@H]1CCO[C@@H](C1)C 6c24e60edbfb9a3d5b34e15ff8e87270 [0,1,0,1,0,0|2,0,0]=4 19103 B13R1.6 CCCCCN[C@@H]1CCO[C@H](C1)C 272a5937c44e91fc215ec8ca8f874bdd [0,1,0,1,0,0|2,0,0]=4 19104 B13R1.6 CCCCCN[C@@H]1COC[C@@H](C1)O bbc6a7c908df129b4a44641a5cb54293 [0,1,0,1,0,0|1,0,0]=3 19105 B13R1.6 CCCCCN[C@H]1CCCN(C1)C 86b9215cc3a73d57c3bda3673c890b82 [0,1,0,1,0,0|2,0,0]=4 19106 B13R1.6 CCCCCN[C@H]1CCC[C@@H](C1)O 00914c101cce0ebc50035f4b4044f89d [0,1,0,1,0,0|0,0,0]=2 19107 B13R1.6 CCCCCN[C@H]1CCC[C@H](C1)O 123de14985f892753d7785992b8bb61d [0,1,0,1,0,0|0,0,0]=2 19108 B13R1.6 CCCCCN[C@H]1CCO[C@@H](C1)C b53fc768f8a1aa8d0814f71652d1ba0b [0,1,0,1,0,0|2,0,0]=4 19109 B13R1.6 CCCCCN[C@H]1CCO[C@H](C1)C 65ef7ec92ae4c9fda88a18e6ec566ac4 [0,1,0,1,0,0|2,0,0]=4 19110 B13R1.6 CCCCCN[C@H]1COC[C@H](C1)O 2fafdf25dd9eee8214f015197a614836 [0,1,0,1,0,0|1,0,0]=3 19111 B13R1.6 CCCCCOC1C=C(CCC1)C 6687f86ea76eb81b9e5b003f88e2cf35 [0,1,0,1,0,0|1,0,1]=4 19112 B13R1.6 CCCCCOC1CCCC(=O)C1 4c0bf9a524c1874a0dd45767b0c699db [0,1,0,1,0,0|0,0,2]=4 19113 B13R1.6 CCCCCOC1CCCC(C1)C 5f11c920f1ee7ecb3fcf4600f9348fa6 [0,1,0,1,0,0|1,0,0]=3 19114 B13R1.6 CCCCCOC1CCCN(C1)C 85d1b2290001b459178007846c369500 [0,1,0,1,0,0|2,0,0]=4 19115 B13R1.6 CCCCCOC1CCOC(C1)C 661db22d168c687f5d9f2cb5afa2a994 [0,1,0,1,0,0|2,0,0]=4 19116 B13R1.6 CCCCCO[C@@H]1CCCN(C1)C 85fb40f513176d5557908a4a34d4ce8e [0,1,0,1,0,0|2,0,0]=4 19117 B13R1.6 CCCCCO[C@@H]1CCC[C@@H](C1)C 4353d301feae0393159af4f52f659d3d [0,1,0,1,0,0|1,0,0]=3 19118 B13R1.6 CCCCCO[C@@H]1CCO[C@@H](C1)C 2084eb5a5f93df39fc08712973d2c5fd [0,1,0,1,0,0|2,0,0]=4 19119 B13R1.6 CCCCCO[C@@H]1CCO[C@H](C1)C 4af97f306c11bd6d59e83d564233ed1b [0,1,0,1,0,0|2,0,0]=4 19120 B13R1.6 CCCCCO[C@H]1CCCN(C1)C 2a0f6e3fe1a15b56449990374cba9a28 [0,1,0,1,0,0|2,0,0]=4 19121 B13R1.6 CCCCCO[C@H]1CCC[C@@H](C1)C ae9a91418adb50e0a74430a262d0e538 [0,1,0,1,0,0|1,0,0]=3 19122 B13R1.6 CCCCCO[C@H]1CCC[C@H](C1)C 1c2da9b1bd4bf349e16a30e9ba58b3f1 [0,1,0,1,0,0|1,0,0]=3 19123 B13R1.6 CCCCCO[C@H]1CCO[C@@H](C1)C 68a58203927abd1751f8af72f9e38bd5 [0,1,0,1,0,0|2,0,0]=4 19124 B13R1.6 CCCCCO[C@H]1CCO[C@H](C1)C 9522fe2af11f832696b888f5e44ab895 [0,1,0,1,0,0|2,0,0]=4 19125 B13R1.6 CCCCNCC1CCCC(C1)C 6de18ec2052e76fb5efd804caeda9a76 [0,1,0,1,0,0|1,0,0]=3 19126 B13R1.6 CCCCNCC1CCCC(C1)O 9b1c81d7d049d0ca59933c053bc1222a [0,1,0,1,0,0|0,0,0]=2 19127 B13R1.6 CCCCNCC1CCCN(C1)C 9b475dcd98f29f793675f29d6911511f [0,1,0,1,0,0|2,0,0]=4 19128 B13R1.6 CCCCNC[C@@H]1CCCN(C1)C dd964eb2cba8f5586970bf1765c8340e [0,1,0,1,0,0|2,0,0]=4 19129 B13R1.6 CCCCNC[C@H]1CCCN(C1)C da10ea29fd52fcd7927ba01bdd84a4d0 [0,1,0,1,0,0|2,0,0]=4 19130 B13R1.6 CCCCNC[C@H]1CCC[C@H](C1)O 12f0d195958fbd949a9f5ec8234e0eea [0,1,0,1,0,0|0,0,0]=2 19131 B13R1.6 CCCCOCC1CCCC(=O)C1 4237d4e470698d994b85f6ae2b60d298 [0,1,0,1,0,0|0,0,2]=4 19132 B13R1.6 CCCCOCC1CCCC(C1)C bc10d5933cb8bdbe8211a8787aed21f5 [0,1,0,1,0,0|1,0,0]=3 19133 B13R1.6 CCCCOCC1CCCN(C1)C 43cd4b3a78577c9385e58e23ec678b5c [0,1,0,1,0,0|2,0,0]=4 19134 B13R1.6 CCCCOCN1CCCC(C1)C 7cfc984a0a6d7a81af7fa11b309ccadb [0,1,0,1,0,0|2,0,0]=4 19135 B13R1.6 CCCCOCN1CCCC(C1)F 476de76d2865e5a1ae84dbcabb46bce3 [0,1,0,1,0,0|2,0,0]=4 19136 B13R1.6 CCCCOCN1CCCC(C1)O e2cd145e1567a247e46ad01486771d6b [0,1,0,1,0,0|1,0,0]=3 19137 B13R1.6 CCCCOCN1CCC[C@@H](C1)C 96f8ea765a35965f78246d094d7599cc [0,1,0,1,0,0|2,0,0]=4 19138 B13R1.6 CCCCOCN1CCC[C@@H](C1)F f7828e931fca7c067a0d99155b04e96d [0,1,0,1,0,0|2,0,0]=4 19139 B13R1.6 CCCCOCN1CCC[C@@H](C1)O 05615a99ea52c0329cad4cc4c930f748 [0,1,0,1,0,0|1,0,0]=3 19140 B13R1.6 CCCCOCN1CCC[C@H](C1)C 32ec87bcce64d843d9bfe9f123a4beaa [0,1,0,1,0,0|2,0,0]=4 19141 B13R1.6 CCCCOCN1CCC[C@H](C1)F b9bba80a000637b688f5f84ec0a70b96 [0,1,0,1,0,0|2,0,0]=4 19142 B13R1.6 CCCCOCN1CCC[C@H](C1)O 937ad6b8c7e2e6e06ba9842b0be7e2cb [0,1,0,1,0,0|1,0,0]=3 19143 B13R1.6 CCCCOC[C@@H]1CCCN(C1)C b801adc0d554e945d61263cfe724da6f [0,1,0,1,0,0|2,0,0]=4 19144 B13R1.6 CCCCOC[C@H]1CCCN(C1)C aaf80bbbe0418ebb25d5964369bdf36b [0,1,0,1,0,0|2,0,0]=4 19145 B13R1.6 CCCNCCC1CCCN(C1)C 405e0dcde44418eba316c8f483f06c6a [0,1,0,1,0,0|2,0,0]=4 19146 B13R1.6 CCCNCCN1CCCC(C1)C 096c3a626767e778eed0174962eb6e57 [0,1,0,1,0,0|2,0,0]=4 19147 B13R1.6 CCCNCCN1CCCC(C1)O 6d1e395744fc63b3718b8dc5025ad345 [0,1,0,1,0,0|1,0,0]=3 19148 B13R1.6 CCCNCC[C@@H]1CCCN(C1)C f43442eaa2ade4e1fbf9ddc16637133f [0,1,0,1,0,0|2,0,0]=4 19149 B13R1.6 CCCNCC[C@H]1CCCN(C1)C 5d7654184835c0ed261c6954c3bdff70 [0,1,0,1,0,0|2,0,0]=4 19150 B13R1.6 CCCOCCC1CCCN(C1)C e7a997ddfbd7dc14a799f15e5173c5ea [0,1,0,1,0,0|2,0,0]=4 19151 B13R1.6 CCCOCCN1CCCC(C1)C 4fbc2f5129adf31bb6091fabfcac74b6 [0,1,0,1,0,0|2,0,0]=4 19152 B13R1.6 CCCOCCN1CCCC(C1)F 1dc2872eba9a87abe29c7496701c12b9 [0,1,0,1,0,0|2,0,0]=4 19153 B13R1.6 CCCOCCN1CCCC(C1)O 2eab1b4020310e38c68d4e5aa9ac3b12 [0,1,0,1,0,0|1,0,0]=3 19154 B13R1.6 CCCOCCN1CCC[C@@H](C1)C 8edf4313aeb6ec5121b59747cf4eeef5 [0,1,0,1,0,0|2,0,0]=4 19155 B13R1.6 CCCOCCN1CCC[C@@H](C1)F 733a0b2c52044da0a7fa9e9d871d0c16 [0,1,0,1,0,0|2,0,0]=4 19156 B13R1.6 CCCOCCN1CCC[C@@H](C1)O eb5d346d59e603aca938c59f485cd86f [0,1,0,1,0,0|1,0,0]=3 19157 B13R1.6 CCCOCCN1CCC[C@H](C1)C 94cede36bead97bc7ed7ab0916fb53e2 [0,1,0,1,0,0|2,0,0]=4 19158 B13R1.6 CCCOCCN1CCC[C@H](C1)F 7a62debd6c020ff1e34ed4185fc4c80a [0,1,0,1,0,0|2,0,0]=4 19159 B13R1.6 CCCOCCN1CCC[C@H](C1)O 9d5a142de3b933fd5ffdc5799b56ab02 [0,1,0,1,0,0|1,0,0]=3 19160 B13R1.6 CCNCCCN1CCCC(C1)C c796d7eca32bc22e25b68455bb29e698 [0,1,0,1,0,0|2,0,0]=4 19161 B13R1.6 CCNCCCN1CCCC(C1)O 8a0a7b343d187dda327a4bc2c6b764a1 [0,1,0,1,0,0|1,0,0]=3 19162 B13R1.6 CCOCCCN1CCCC(C1)C 88a97c3833b4ba4bdcb19e04b2d32113 [0,1,0,1,0,0|2,0,0]=4 19163 B13R1.6 CCOCCCN1CCCC(C1)F 98747a9b6389cbb57497d4fe1072767e [0,1,0,1,0,0|2,0,0]=4 19164 B13R1.6 CCOCCCN1CCCC(C1)O 9a1ac50c841f5fad71ddb22cea0372c1 [0,1,0,1,0,0|1,0,0]=3 19165 B13R1.6 CCOCCCN1CCC[C@@H](C1)C 4ea6c8696e7d17fadb626ead03b70863 [0,1,0,1,0,0|2,0,0]=4 19166 B13R1.6 CCOCCCN1CCC[C@@H](C1)F e47f2760820e80c6a7214fff537cb2e6 [0,1,0,1,0,0|2,0,0]=4 19167 B13R1.6 CCOCCCN1CCC[C@@H](C1)O dbea078861b9030acb0f3c47bddcc933 [0,1,0,1,0,0|1,0,0]=3 19168 B13R1.6 CCOCCCN1CCC[C@H](C1)C 646f9003b0c8a4896551bc73c327278a [0,1,0,1,0,0|2,0,0]=4 19169 B13R1.6 CCOCCCN1CCC[C@H](C1)F d2d5c24dc08db2142b79d5fff171010e [0,1,0,1,0,0|2,0,0]=4 19170 B13R1.6 CCOCCCN1CCC[C@H](C1)O 6401b2480ba0a91d568ded52e5b3be1a [0,1,0,1,0,0|1,0,0]=3 19171 B13R1.6 CCOCCNC1CCCC(C1)C 6b2509309e63ab776b23c5d977f540b0 [0,1,0,1,0,0|2,0,0]=4 19172 B13R1.6 CCOCCNC1CCCC(C1)O 2653925f1444b6750cfbd401040e3053 [0,1,0,1,0,0|1,0,0]=3 19173 B13R1.6 CCOCCNC1COCC(C1)O be8020e043547fcf4cf3e8617b8f7ed6 [0,1,0,1,0,0|2,0,0]=4 19174 B13R1.6 CCOCCN[C@@H]1CCC[C@@H](C1)O 05769de54d5a81d9ba429452090cc16f [0,1,0,1,0,0|1,0,0]=3 19175 B13R1.6 CCOCCN[C@@H]1CCC[C@H](C1)C 62431ec1b097b3162fad609ed4955b9b [0,1,0,1,0,0|2,0,0]=4 19176 B13R1.6 CCOCCN[C@@H]1CCC[C@H](C1)O b7ccbf3382ff212b0ee545a04ed6a7ae [0,1,0,1,0,0|1,0,0]=3 19177 B13R1.6 CCOCCN[C@@H]1COC[C@@H](C1)O ee48d323cc0c3c32a3ac6e70d1b844f8 [0,1,0,1,0,0|2,0,0]=4 19178 B13R1.6 CCOCCN[C@H]1CCC[C@@H](C1)O 9f97ec76c52596967e1904d1eb532c9b [0,1,0,1,0,0|1,0,0]=3 19179 B13R1.6 CCOCCN[C@H]1CCC[C@H](C1)O 3a324bdb8a7c3c5fda6be462efb7e913 [0,1,0,1,0,0|1,0,0]=3 19180 B13R1.6 CCOCCN[C@H]1COC[C@H](C1)O e79d8b09fd666c08e7ec80eeb5f1b44f [0,1,0,1,0,0|2,0,0]=4 19181 B13R1.6 CCOCCOC1CCCC(C1)C a6920f8f912b6e15bfd92c72bebe35e5 [0,1,0,1,0,0|2,0,0]=4 19182 B13R1.6 CCOCCO[C@@H]1CCC[C@@H](C1)C 3228f010d7d1b6a93a65cc3fe1af2109 [0,1,0,1,0,0|2,0,0]=4 19183 B13R1.6 CCOCCO[C@H]1CCC[C@@H](C1)C c2ca1c826301d6123aa76e5d9bcb6634 [0,1,0,1,0,0|2,0,0]=4 19184 B13R1.6 CCOCCO[C@H]1CCC[C@H](C1)C 4c4328ab86a0a9cc45aa41f243109bc5 [0,1,0,1,0,0|2,0,0]=4 19185 B13R1.6 CCOCNCC1CCCC(C1)C d2e9e5eeaa33dfe736d72e550559d2c8 [0,1,0,1,0,0|2,0,0]=4 19186 B13R1.6 CCOCNCC1CCCC(C1)O 1fc4281f3b3310d7b8acacc7e757c4bc [0,1,0,1,0,0|1,0,0]=3 19187 B13R1.6 CCOCNC[C@H]1CCC[C@H](C1)O 2f2f31da802e628e41446ce1d9fe9d9f [0,1,0,1,0,0|1,0,0]=3 19188 B13R1.6 CCOCOCC1CCCC(C1)C 1f295b697254c10063592fdeb7878fa1 [0,1,0,1,0,0|2,0,0]=4 19189 B13R1.6 CCSCCCN1CCCC(C1)C 3d6f97c8981394806b1510216b9875d9 [0,1,0,1,0,0|2,0,0]=4 19190 B13R1.6 CCSCCCN1CCCC(C1)F e0842d9946aae152542a2d1cccf9ca90 [0,1,0,1,0,0|2,0,0]=4 19191 B13R1.6 CCSCCCN1CCCC(C1)O dc7baff82a86e0a3bb7c8fd2aee02a2a [0,1,0,1,0,0|1,0,0]=3 19192 B13R1.6 CCSCCCN1CCC[C@@H](C1)C 664e7ff31748e555018ab1bb5f84b70f [0,1,0,1,0,0|2,0,0]=4 19193 B13R1.6 CCSCCCN1CCC[C@@H](C1)F a8c48e62178cd45f690e582afb7848b6 [0,1,0,1,0,0|2,0,0]=4 19194 B13R1.6 CCSCCCN1CCC[C@@H](C1)O 058a35ef021f4450fb40e5b2d83db3ee [0,1,0,1,0,0|1,0,0]=3 19195 B13R1.6 CCSCCCN1CCC[C@H](C1)C 3f99f42f13d3b818c3a35070d42b4a39 [0,1,0,1,0,0|2,0,0]=4 19196 B13R1.6 CCSCCCN1CCC[C@H](C1)F 48de3c89c177e7953f90c009c7b46c51 [0,1,0,1,0,0|2,0,0]=4 19197 B13R1.6 CCSCCCN1CCC[C@H](C1)O 7403eb77259ee898689dd1254743b58d [0,1,0,1,0,0|1,0,0]=3 19198 B13R1.6 CCSCCNC1CCCC(C1)C a320b31032e85a7e2aab5c5422834661 [0,1,0,1,0,0|2,0,0]=4 19199 B13R1.6 CCSCCNC1CCCC(C1)O b05376738632928b1b86e16c917f9745 [0,1,0,1,0,0|1,0,0]=3 19200 B13R1.6 CCSCCNC1COCC(C1)O 977f48e331fece21f3093886815ecec0 [0,1,0,1,0,0|2,0,0]=4 19201 B13R1.6 CCSCCN[C@@H]1CCC[C@@H](C1)O dee931724e47bd3760084aec33cba5c6 [0,1,0,1,0,0|1,0,0]=3 19202 B13R1.6 CCSCCN[C@@H]1CCC[C@H](C1)C 40791833970f056c3f66478cb379a205 [0,1,0,1,0,0|2,0,0]=4 19203 B13R1.6 CCSCCN[C@@H]1CCC[C@H](C1)O 033eb5f64db7c4fca1fed7da0ad8b408 [0,1,0,1,0,0|1,0,0]=3 19204 B13R1.6 CCSCCN[C@@H]1COC[C@@H](C1)O 85f40a4efa979d39f01a157f11794476 [0,1,0,1,0,0|2,0,0]=4 19205 B13R1.6 CCSCCN[C@H]1CCC[C@@H](C1)O c0a7c209a28e7003a7e450ff5532e094 [0,1,0,1,0,0|1,0,0]=3 19206 B13R1.6 CCSCCN[C@H]1CCC[C@H](C1)O 6f6f1f383a4edcad32efcacc38d4d502 [0,1,0,1,0,0|1,0,0]=3 19207 B13R1.6 CCSCCN[C@H]1COC[C@H](C1)O 8b1aed26622440bc65f0be4871a43312 [0,1,0,1,0,0|2,0,0]=4 19208 B13R1.6 CCSCCOC1CCCC(C1)C 9b968a7b77644920016528abff28a6e1 [0,1,0,1,0,0|2,0,0]=4 19209 B13R1.6 CCSCCO[C@@H]1CCC[C@@H](C1)C 3d2d17a587c51a9d442dcd399aa10043 [0,1,0,1,0,0|2,0,0]=4 19210 B13R1.6 CCSCCO[C@H]1CCC[C@@H](C1)C 29674a5fce35e5495cdf9c65f0b29ff1 [0,1,0,1,0,0|2,0,0]=4 19211 B13R1.6 CCSCCO[C@H]1CCC[C@H](C1)C a6f07af41df24ce2dbda8dfd16f29f6a [0,1,0,1,0,0|2,0,0]=4 19212 B13R1.6 COCCCCN1CCCC(C1)C 20e5c10451fb40a9b75edc674f44c7b0 [0,1,0,1,0,0|2,0,0]=4 19213 B13R1.6 COCCCCN1CCCC(C1)F aeed9492881d238e838b893f902095ba [0,1,0,1,0,0|2,0,0]=4 19214 B13R1.6 COCCCCN1CCCC(C1)O 564655e80ee1041260d27b1b97f2cc45 [0,1,0,1,0,0|1,0,0]=3 19215 B13R1.6 COCCCCN1CCC[C@@H](C1)C da60c4ec252cf4955a9d9e4f487c0454 [0,1,0,1,0,0|2,0,0]=4 19216 B13R1.6 COCCCCN1CCC[C@@H](C1)F 10e59b304368fbbeea2185b6bbfa195c [0,1,0,1,0,0|2,0,0]=4 19217 B13R1.6 COCCCCN1CCC[C@@H](C1)O e268c5e0f932eb5abe29fb28ba65fe2b [0,1,0,1,0,0|1,0,0]=3 19218 B13R1.6 COCCCCN1CCC[C@H](C1)C fa785e62e00907d7ad713674a723f7df [0,1,0,1,0,0|2,0,0]=4 19219 B13R1.6 COCCCCN1CCC[C@H](C1)F ddd3b8e50f6d386a5429c9cf912116f3 [0,1,0,1,0,0|2,0,0]=4 19220 B13R1.6 COCCCCN1CCC[C@H](C1)O 0ca11600e437dffd516d522aafed1d83 [0,1,0,1,0,0|1,0,0]=3 19221 B13R1.6 COCCCNC1CCCC(C1)C 93485ab8187604cdd0d5fa474e8c3758 [0,1,0,1,0,0|2,0,0]=4 19222 B13R1.6 COCCCNC1CCCC(C1)O cc383516ea0b9ffb3bff849f30e5de90 [0,1,0,1,0,0|1,0,0]=3 19223 B13R1.6 COCCCNC1COCC(C1)O 53b5033d5931e335b9dfa681c5745e15 [0,1,0,1,0,0|2,0,0]=4 19224 B13R1.6 COCCCN[C@@H]1CCC[C@@H](C1)O 7a8ffd5dc30fc94cf1a7e9c84f800211 [0,1,0,1,0,0|1,0,0]=3 19225 B13R1.6 COCCCN[C@@H]1CCC[C@H](C1)C d530d6f570074d8b04b120e67c332aa7 [0,1,0,1,0,0|2,0,0]=4 19226 B13R1.6 COCCCN[C@@H]1CCC[C@H](C1)O f1d23a7ede5a00a06eba9a90ce5dc229 [0,1,0,1,0,0|1,0,0]=3 19227 B13R1.6 COCCCN[C@@H]1COC[C@@H](C1)O 1a9d3b73f06499f48f15c9859902fc1d [0,1,0,1,0,0|2,0,0]=4 19228 B13R1.6 COCCCN[C@H]1CCC[C@@H](C1)O 126bd8db8bd9f19bb0ed4b780480ccbb [0,1,0,1,0,0|1,0,0]=3 19229 B13R1.6 COCCCN[C@H]1CCC[C@H](C1)O 1d214a0514cd349845fd1e2ce957f793 [0,1,0,1,0,0|1,0,0]=3 19230 B13R1.6 COCCCN[C@H]1COC[C@H](C1)O 4c8eeac156f3cae32ece9c39c425ea44 [0,1,0,1,0,0|2,0,0]=4 19231 B13R1.6 COCCCOC1CCCC(C1)C 5f0dcff8b384c2e1e680d3ae9c4cc802 [0,1,0,1,0,0|2,0,0]=4 19232 B13R1.6 COCCCO[C@@H]1CCC[C@@H](C1)C 5603e65026a715aabecd19a7544ef3d5 [0,1,0,1,0,0|2,0,0]=4 19233 B13R1.6 COCCCO[C@H]1CCC[C@@H](C1)C 1796e0fa454d8d30da8ae8de7d522313 [0,1,0,1,0,0|2,0,0]=4 19234 B13R1.6 COCCCO[C@H]1CCC[C@H](C1)C cc45e9456bff5e5736b5cc2fdcf6283d [0,1,0,1,0,0|2,0,0]=4 19235 B13R1.6 COCCNCC1CCCC(C1)C fe1c44a961358fb51e2614b245328798 [0,1,0,1,0,0|2,0,0]=4 19236 B13R1.6 COCCNCC1CCCC(C1)O 89a7a1c2e30d64ecfb04903e57630ede [0,1,0,1,0,0|1,0,0]=3 19237 B13R1.6 COCCNC[C@H]1CCC[C@H](C1)O dcb8e783116b5def0204cd92f4aa0d8c [0,1,0,1,0,0|1,0,0]=3 19238 B13R1.6 COCCOCC1CCCC(C1)C 1c88592105d72fb7cbaa7be1f77def15 [0,1,0,1,0,0|2,0,0]=4 19239 B13R1.6 COCCOCN1CCCC(C1)O 92d56fa50cc41c7a2e04cdfdb34135d4 [0,1,0,1,0,0|2,0,0]=4 19240 B13R1.6 COCCOCN1CCC[C@@H](C1)O fba90369818562b5ff712842ae41615e [0,1,0,1,0,0|2,0,0]=4 19241 B13R1.6 COCCOCN1CCC[C@H](C1)O 9191b74537be07404f96d6dcdc924d6b [0,1,0,1,0,0|2,0,0]=4 19242 B13R1.6 COCNCCN1CCCC(C1)O b29c75b66a074b56a32e5140255cc4a1 [0,1,0,1,0,0|2,0,0]=4 19243 B13R1.6 COCOCCN1CCCC(C1)O 7c77a3537b7851cdabe84a539c6b5152 [0,1,0,1,0,0|2,0,0]=4 19244 B13R1.6 COCOCCN1CCC[C@@H](C1)O 468ea5bee4dce71a36abb88bf0f9b885 [0,1,0,1,0,0|2,0,0]=4 19245 B13R1.6 COCOCCN1CCC[C@H](C1)O 07777b34ed661871a935d9d0fdaa54f2 [0,1,0,1,0,0|2,0,0]=4 19246 B13R1.6 CSCCCNC1CCCC(C1)C 6816fc4e7b4349cd2c537dd4c4fb96ca [0,1,0,1,0,0|2,0,0]=4 19247 B13R1.6 CSCCCNC1CCCC(C1)O f493115547be794aa8476b57083e859a [0,1,0,1,0,0|1,0,0]=3 19248 B13R1.6 CSCCCNC1COCC(C1)O d20be583b45ca48a74ebf0602a685eac [0,1,0,1,0,0|2,0,0]=4 19249 B13R1.6 CSCCCN[C@@H]1CCC[C@@H](C1)O b358654ac1f0b590a0552cab2d6a9aa0 [0,1,0,1,0,0|1,0,0]=3 19250 B13R1.6 CSCCCN[C@@H]1CCC[C@H](C1)C 330b0db522eef0b5aa4ece837aeba844 [0,1,0,1,0,0|2,0,0]=4 19251 B13R1.6 CSCCCN[C@@H]1CCC[C@H](C1)O 7579f36901fbd5657aa55266dcd3d99b [0,1,0,1,0,0|1,0,0]=3 19252 B13R1.6 CSCCCN[C@@H]1COC[C@@H](C1)O bb93764b7d6024adf4b7651ddbd3dbb9 [0,1,0,1,0,0|2,0,0]=4 19253 B13R1.6 CSCCCN[C@H]1CCC[C@@H](C1)O e8e7b66c57722573334c7c6cd7ef42ca [0,1,0,1,0,0|1,0,0]=3 19254 B13R1.6 CSCCCN[C@H]1CCC[C@H](C1)O b15700b73cd800badcc38cf8ebd392f5 [0,1,0,1,0,0|1,0,0]=3 19255 B13R1.6 CSCCCN[C@H]1COC[C@H](C1)O 53ad034a92584bfdd1151a45a3854815 [0,1,0,1,0,0|2,0,0]=4 19256 B13R1.6 CSCCCOC1CCCC(C1)C c84fdb890f0471751f1127e8f1655c12 [0,1,0,1,0,0|2,0,0]=4 19257 B13R1.6 CSCCCO[C@@H]1CCC[C@@H](C1)C 58f1b4bd8f1a6a5ac592ed7d3d3ad1d2 [0,1,0,1,0,0|2,0,0]=4 19258 B13R1.6 CSCCCO[C@H]1CCC[C@@H](C1)C a702e06dc29263b8506f10c1c2375af8 [0,1,0,1,0,0|2,0,0]=4 19259 B13R1.6 CSCCCO[C@H]1CCC[C@H](C1)C cab925b454328940ad3a2c7a43f250c7 [0,1,0,1,0,0|2,0,0]=4 19260 B13R1.6 CSCCNCC1CCCC(C1)C 00e7d3f34d6ff1d51fdd871ada745239 [0,1,0,1,0,0|2,0,0]=4 19261 B13R1.6 CSCCNCC1CCCC(C1)O 3feab05abd2266fa9cbc025fb12e04a9 [0,1,0,1,0,0|1,0,0]=3 19262 B13R1.6 CSCCNC[C@H]1CCC[C@H](C1)O a4f7268c7d1855a47ac0e06237ff8339 [0,1,0,1,0,0|1,0,0]=3 19263 B13R1.6 CSCCOCC1CCCC(C1)C 2aa98ab4257d4a3ddca97acefaeb1276 [0,1,0,1,0,0|2,0,0]=4 19264 B13R1.6 CSCNCCN1CCCC(C1)O c9f0fc97a9bf7889022637a91d96252d [0,1,0,1,0,0|2,0,0]=4 19265 B13R1.6 C[C@@H]1CCCN(C1)CCCCCF d872992dc3c8afeb985346912c7a5c6d [0,1,0,1,0,0|2,0,0]=4 19266 B13R1.6 C[C@@H]1CCCN(C1)CCCCCO a311ca0c93044d11855b221e00fe0334 [0,1,0,1,0,0|2,0,0]=4 19267 B13R1.6 C[C@@H]1CCC[C@@H](C1)OCCCCF d53dfbf4d14881021c9df95a7abf39f7 [0,1,0,1,0,0|2,0,0]=4 19268 B13R1.6 C[C@@H]1CCC[C@H](C1)NCCCCF bdb5686ba39d1eb1812902cb7a1e9d90 [0,1,0,1,0,0|2,0,0]=4 19269 B13R1.6 C[C@@H]1CCC[C@H](C1)NCCCCO 9a0ac2990e4879480b9320928f738d1f [0,1,0,1,0,0|2,0,0]=4 19270 B13R1.6 C[C@H]1CCCN(C1)CCCCCF cb10d1a1daa710fc80bdd1b35b7aec9e [0,1,0,1,0,0|2,0,0]=4 19271 B13R1.6 C[C@H]1CCCN(C1)CCCCCO 465be88ac8115492d53d75d53ac80fe3 [0,1,0,1,0,0|2,0,0]=4 19272 B13R1.6 C[C@H]1CCC[C@@H](C1)OCCCCF ec80d2a3c400fbd9a3850986aef4cc99 [0,1,0,1,0,0|2,0,0]=4 19273 B13R1.6 C[C@H]1CCC[C@H](C1)OCCCCF c97e35931d69033d19afa94e1c233349 [0,1,0,1,0,0|2,0,0]=4 19274 B13R1.6 FCCCCCN1CCCC(C1)F 2dcaaf3f0b89a04ec2d9c6b1437c826b [0,1,0,1,0,0|2,0,0]=4 19275 B13R1.6 FCCCCCN1CCC[C@@H](C1)F 00e1904cce14e38a2bf6cb912772c193 [0,1,0,1,0,0|2,0,0]=4 19276 B13R1.6 FCCCCCN1CCC[C@H](C1)F d180cf19cfb54a260098360f9c7a0b70 [0,1,0,1,0,0|2,0,0]=4 19277 B13R1.6 N#CCCCCN1CCCC(C1)O 6f46a8ad371b4c63f714c61a41c229d6 [0,1,0,1,0,0|1,0,1]=4 19278 B13R1.6 N#CCCCCN1CCC[C@@H](C1)O 1dabf7f73301d6d404a7736522685bf8 [0,1,0,1,0,0|1,0,1]=4 19279 B13R1.6 N#CCCCCN1CCC[C@H](C1)O ae5ea451f94ab9e682ed6c9bad8a5f7e [0,1,0,1,0,0|1,0,1]=4 19280 B13R1.6 N#CCCCNC1CCCC(C1)O a7ffadb207399f29081a34735c127f24 [0,1,0,1,0,0|1,0,1]=4 19281 B13R1.6 N#CCCCN[C@@H]1CCC[C@@H](C1)O 49829de5076131847e84c165b17d8260 [0,1,0,1,0,0|1,0,1]=4 19282 B13R1.6 N#CCCCN[C@@H]1CCC[C@H](C1)O ff582f9d5244efdc8a683e4caef9d39a [0,1,0,1,0,0|1,0,1]=4 19283 B13R1.6 N#CCCCN[C@H]1CCC[C@@H](C1)O 182fe7af70099af2b085cf1b58ac32b9 [0,1,0,1,0,0|1,0,1]=4 19284 B13R1.6 N#CCCCN[C@H]1CCC[C@H](C1)O e58f2fe4da02eaabdf7901c15480fc39 [0,1,0,1,0,0|1,0,1]=4 19285 B13R1.6 N#CCCNCC1CCCC(C1)O be02e73b6de63a6bf6d13a86b43774e9 [0,1,0,1,0,0|1,0,1]=4 19286 B13R1.6 N#CCCNC[C@H]1CCC[C@H](C1)O e7905e4195dd68625536e9044582baad [0,1,0,1,0,0|1,0,1]=4 19287 B13R1.6 NOCCCCN1CCCC(C1)O aafb4d90c4417af4f8e792d7fb18fbae [0,1,0,1,0,0|2,0,0]=4 19288 B13R1.6 NOCCCCN1CCC[C@@H](C1)O 438eb2ef7a6d98b9a19fb5914844444b [0,1,0,1,0,0|2,0,0]=4 19289 B13R1.6 NOCCCCN1CCC[C@H](C1)O 9fdf02f65aa7808bca2b0af97fb2ff22 [0,1,0,1,0,0|2,0,0]=4 19290 B13R1.6 O=CCCCCN1CCCC(C1)O 9781cabc0bf221ae209db6f64deb4f2e [0,1,0,1,0,0|1,0,1]=4 19291 B13R1.6 O=CCCCCN1CCC[C@@H](C1)O 8f3e11c0630e4edacd066bbc95e59d95 [0,1,0,1,0,0|1,0,1]=4 19292 B13R1.6 O=CCCCCN1CCC[C@H](C1)O 5b6c668aed139a5a838d5894e844a34e [0,1,0,1,0,0|1,0,1]=4 19293 B13R1.6 O=CCCCNC1CCCC(C1)O 50b1551734fbe6e6ba2b26cf7694311a [0,1,0,1,0,0|1,0,1]=4 19294 B13R1.6 O=CCCCN[C@@H]1CCC[C@@H](C1)O 42518b5434434ba9dc316776f9a89f71 [0,1,0,1,0,0|1,0,1]=4 19295 B13R1.6 O=CCCCN[C@@H]1CCC[C@H](C1)O b980056f54f82d27cb77889aca45fe56 [0,1,0,1,0,0|1,0,1]=4 19296 B13R1.6 O=CCCCN[C@H]1CCC[C@@H](C1)O b1c1e7366bdd528d80de580a4fdec0bc [0,1,0,1,0,0|1,0,1]=4 19297 B13R1.6 O=CCCCN[C@H]1CCC[C@H](C1)O d7cf66580ea25b7807adc8938e2a661c [0,1,0,1,0,0|1,0,1]=4 19298 B13R1.6 O=CCCNCC1CCCC(C1)O 7ff593dfc3ce12fcac6d125cd2fbb624 [0,1,0,1,0,0|1,0,1]=4 19299 B13R1.6 O=CCCNC[C@H]1CCC[C@H](C1)O 0ca7b9d87edf709f38bba752b45daa60 [0,1,0,1,0,0|1,0,1]=4 19300 B13R1.6 OC1CCCC(C1)CNCCCF d591179c2d154a67f507336d61384ed1 [0,1,0,1,0,0|1,0,0]=3 19301 B13R1.6 OC1CCCC(C1)CNCCCS b4a66981ddfdf32d8c474d252420ce34 [0,1,0,1,0,0|1,0,0]=3 19302 B13R1.6 OC1CCCC(C1)NCCCCF 42019dd239e94383ff9096dc0223d2a8 [0,1,0,1,0,0|1,0,0]=3 19303 B13R1.6 OC1CCCN(C1)CCCCCF 786948559c798ccdf4285313ab84df18 [0,1,0,1,0,0|1,0,0]=3 19304 B13R1.6 OC1CCCN(C1)CCCNCF d94e82c0de168261ef9051303f8b4e7c [0,1,0,1,0,0|2,0,0]=4 19305 B13R1.6 OC1CCCN(C1)CCNCCF 9e239a0727ae78b2dfa3cd7fef28ad84 [0,1,0,1,0,0|2,0,0]=4 19306 B13R1.6 OC1CCCN(C1)CCNCCS 01ae20b517b676553bf65537966919f6 [0,1,0,1,0,0|2,0,0]=4 19307 B13R1.6 OC1COCC(C1)NCCCCF fde4f774e9424619d63221cf8e440fb7 [0,1,0,1,0,0|2,0,0]=4 19308 B13R1.6 OCCCCCN1CCCC(C1)F 9d0b242816eed9dfe024eed9b41175f5 [0,1,0,1,0,0|2,0,0]=4 19309 B13R1.6 OCCCCCN1CCCC(C1)O 4b8d7c639775494bbe735dc170277cfd [0,1,0,1,0,0|1,0,0]=3 19310 B13R1.6 OCCCCCN1CCC[C@@H](C1)F dd314feee402d4340ac45bdc60f6179a [0,1,0,1,0,0|2,0,0]=4 19311 B13R1.6 OCCCCCN1CCC[C@@H](C1)O 5da537a341f5a44b3011866de65354cb [0,1,0,1,0,0|1,0,0]=3 19312 B13R1.6 OCCCCCN1CCC[C@H](C1)F 654d4f786c3180684b6da6f74ef5f8c5 [0,1,0,1,0,0|2,0,0]=4 19313 B13R1.6 OCCCCCN1CCC[C@H](C1)O 1a5b92e20cb24e6bb9514a223f67a277 [0,1,0,1,0,0|1,0,0]=3 19314 B13R1.6 OCCCCNC1CCCC(C1)O 6f55627873880487b4946a85ec559ed6 [0,1,0,1,0,0|1,0,0]=3 19315 B13R1.6 OCCCCNC1COCC(C1)O 935bd87916802f62d643f540b3bb7e25 [0,1,0,1,0,0|2,0,0]=4 19316 B13R1.6 OCCCCN[C@@H]1CCC[C@@H](C1)O 453acbafcbc1f3add89a2a829edf18d9 [0,1,0,1,0,0|1,0,0]=3 19317 B13R1.6 OCCCCN[C@@H]1CCC[C@H](C1)O faf687a7bc8095e5f603e9e2c0895d59 [0,1,0,1,0,0|1,0,0]=3 19318 B13R1.6 OCCCCN[C@@H]1COC[C@@H](C1)O 7688e2ca1a74cc1beee55b436c487116 [0,1,0,1,0,0|2,0,0]=4 19319 B13R1.6 OCCCCN[C@H]1CCC[C@@H](C1)O 90e501fbe53b12a4ddd01f7d3faf576f [0,1,0,1,0,0|1,0,0]=3 19320 B13R1.6 OCCCCN[C@H]1CCC[C@H](C1)O fa57dfb37b60d5826324479f22125b60 [0,1,0,1,0,0|1,0,0]=3 19321 B13R1.6 OCCCCN[C@H]1COC[C@H](C1)O 8678f2aad7c98237206e5ef9dbb01a97 [0,1,0,1,0,0|2,0,0]=4 19322 B13R1.6 OCCCNCC1CCCC(C1)O 21abf5ec060f4fb99f455ca4b8b5a6ec [0,1,0,1,0,0|1,0,0]=3 19323 B13R1.6 OCCCNC[C@H]1CCC[C@H](C1)O 6359b375936c3730e28c9cf4c8855a28 [0,1,0,1,0,0|1,0,0]=3 19324 B13R1.6 OCCNCCN1CCCC(C1)O 7a5a798be0f5d1cb79db2226949606d1 [0,1,0,1,0,0|2,0,0]=4 19325 B13R1.6 OCCOCCN1CCCC(C1)O 06dd635c16cb7062ae8b37afb2b104ae [0,1,0,1,0,0|2,0,0]=4 19326 B13R1.6 OCCOCCN1CCC[C@@H](C1)O 735b21be0a0a98fc19f17512c804a335 [0,1,0,1,0,0|2,0,0]=4 19327 B13R1.6 OCCOCCN1CCC[C@H](C1)O a23625933a3620095f53f1034aed55e8 [0,1,0,1,0,0|2,0,0]=4 19328 B13R1.6 OCNCCCN1CCCC(C1)O 44a1433370211a6a045116b75b03f765 [0,1,0,1,0,0|2,0,0]=4 19329 B13R1.6 O[C@@H]1CCCN(C1)CCCCCF 8e77526179d1f64b03d61992d64eaf01 [0,1,0,1,0,0|1,0,0]=3 19330 B13R1.6 O[C@@H]1CCC[C@@H](C1)CNCCCF 7518239a97d47e80751db9b0acb7fb6a [0,1,0,1,0,0|1,0,0]=3 19331 B13R1.6 O[C@@H]1CCC[C@@H](C1)CNCCCS c318cbd624de6ff777e34aa5f4b77a7d [0,1,0,1,0,0|1,0,0]=3 19332 B13R1.6 O[C@@H]1CCC[C@@H](C1)NCCCCF c7d8572a764d02e33ad88131ac8839c4 [0,1,0,1,0,0|1,0,0]=3 19333 B13R1.6 O[C@@H]1CCC[C@H](C1)NCCCCF 05ab8a22ca278f1c5dbc7b00db9dfd2e [0,1,0,1,0,0|1,0,0]=3 19334 B13R1.6 O[C@@H]1COC[C@@H](C1)NCCCCF 8c69c6278ef36af57912a59f85e58ae6 [0,1,0,1,0,0|2,0,0]=4 19335 B13R1.6 O[C@H]1CCCN(C1)CCCCCF 4c6f7e6fa188cdef8a5ab0dc2b18d7ca [0,1,0,1,0,0|1,0,0]=3 19336 B13R1.6 O[C@H]1CCC[C@@H](C1)NCCCCF bd5d793400df1744aef21a964095ae6d [0,1,0,1,0,0|1,0,0]=3 19337 B13R1.6 O[C@H]1CCC[C@H](C1)NCCCCF 12440ca6179508c07639bd33ed7006f0 [0,1,0,1,0,0|1,0,0]=3 19338 B13R1.6 O[C@H]1COC[C@H](C1)NCCCCF 4b146107da266e3ad82c54b824a43e7b [0,1,0,1,0,0|2,0,0]=4 19339 B13R1.90 C#CC1CCCCN1CCC(C)O e85554c0ba247aaa7fbc9456a24a1208 [0,1,0,1,0,0|0,0,2]=4 19340 B13R1.90 C=C(C)CCN1CCCCC1CC 12b8aefe5b77afe96c4340452b4f2e32 [0,1,0,1,0,0|1,0,1]=4 19341 B13R1.90 C=C(C)CCN1CCCC[C@@H]1CC b5361a384dabbf9de8b082a03962daae [0,1,0,1,0,0|1,0,1]=4 19342 B13R1.90 C=C(C)CCN1CCCC[C@H]1CC 25f7ec71a7e145011f1bcb3cf8f136ec [0,1,0,1,0,0|1,0,1]=4 19343 B13R1.90 C=C(C)COC1CCCCC1CC e2200fe96afb6be815c5aad2739cb0d7 [0,1,0,1,0,0|1,0,1]=4 19344 B13R1.90 CC(C)CCN1CCCCC1CO a047b6fe12fe3ae9057e484fc6428ca0 [0,1,0,1,0,0|2,0,0]=4 19345 B13R1.90 CC(C)CCN1CCCC[C@@H]1CO 1af8ff615e6e16cf106e2ae3882c3418 [0,1,0,1,0,0|2,0,0]=4 19346 B13R1.90 CC(C)CCN1CCCC[C@H]1CO 09c1d5a138655e0a0ac0d77394d5ea6b [0,1,0,1,0,0|2,0,0]=4 19347 B13R1.90 CC(C)CN[C@@H]1CCCC[C@@H]1CO 843d00fae723019c877a70aee9f2bb5a [0,1,0,1,0,0|2,0,0]=4 19348 B13R1.90 CC(C)CN[C@@H]1CCCC[C@H]1CO 7fef0284baf8517ecd7bce419faabae4 [0,1,0,1,0,0|2,0,0]=4 19349 B13R1.90 CC(C)CN[C@H]1CCCC[C@H]1CO b9ccea914a8bfa02fd5d525ec254afad [0,1,0,1,0,0|2,0,0]=4 19350 B13R1.90 CC(O)CCN1CCCCC1C#N 472528ec85fccb501073ce996be2932b [0,1,0,1,0,0|1,0,1]=4 19351 B13R1.90 CC(O)CCN1CCCCC1C=O e2c35c2efde4dd7e8b52e17e3542244a [0,1,0,1,0,0|1,0,1]=4 19352 B13R1.90 CC(O)CCN1CCCCC1CO 928d1d97151b36c4c5064a7ec499bd63 [0,1,0,1,0,0|1,0,0]=3 19353 B13R1.90 CC(O)CCN1CCCC[C@@H]1C#N 4074989da64bb8f9aaa08310bcb001ce [0,1,0,1,0,0|1,0,1]=4 19354 B13R1.90 CC(O)CCN1CCCC[C@@H]1CO 4a9151effa606264b0daf05ce6b6fe4d [0,1,0,1,0,0|1,0,0]=3 19355 B13R1.90 CC(O)CCN1CCCC[C@H]1C#N 532424c6b28af863727d499a29aac091 [0,1,0,1,0,0|1,0,1]=4 19356 B13R1.90 CC(O)CCN1CCCC[C@H]1CO e25f0b5850e71039c349ac26166d721b [0,1,0,1,0,0|1,0,0]=3 19357 B13R1.90 CC(O)CCN1CCOCC1CO 5d724ffb2edb83ba059fb9042f4c7b89 [0,1,0,1,0,0|2,0,0]=4 19358 B13R1.90 CC(O)CCN1CCOC[C@@H]1CO 62f1e10070d30ced0a9d1e84fac8ee96 [0,1,0,1,0,0|2,0,0]=4 19359 B13R1.90 CC(O)CCN1CCOC[C@H]1CO 60af372dcddffa65983df7193ced1f94 [0,1,0,1,0,0|2,0,0]=4 19360 B13R1.90 CC(O)CNC1CCCCC1C#N 606f326d911e366449bcc62fa20e0308 [0,1,0,1,0,0|1,0,1]=4 19361 B13R1.90 CC(O)CNC1CCOCC1CO 69c28569f3e5cd368ad18ecbe45ba996 [0,1,0,1,0,0|2,0,0]=4 19362 B13R1.90 CC(O)CN[C@@H]1CCCC[C@@H]1CO a1915a4aff12db2e285b2f6123b0f26f [0,1,0,1,0,0|1,0,0]=3 19363 B13R1.90 CC(O)CN[C@@H]1CCCC[C@H]1CO 17e9ab5ad842480111280581630b6e8e [0,1,0,1,0,0|1,0,0]=3 19364 B13R1.90 CC(O)CN[C@@H]1CCOC[C@@H]1CO 226bb097443a02b7be2fb1e1e2bcc784 [0,1,0,1,0,0|2,0,0]=4 19365 B13R1.90 CC(O)CN[C@H]1CCCC[C@H]1C#N 3023b96080727c014e29666c3ef98108 [0,1,0,1,0,0|1,0,1]=4 19366 B13R1.90 CC(O)CN[C@H]1CCCC[C@H]1CO 9a8681efd0bc6d1f8bf88e1687ce1e5f [0,1,0,1,0,0|1,0,0]=3 19367 B13R1.90 CCC1CCCCC1OCC(=O)O ce3d996ac59c6f08029f858e9d1a8404 [0,1,0,1,0,0|1,0,1]=4 19368 B13R1.90 CCC1CCCCC1OCC(C)C 40247528ddf992fbbccee342dfd047bb [0,1,0,1,0,0|1,0,0]=3 19369 B13R1.90 CCC1CCCCC1OCC(F)F 86909e29a308597aea65fa759f3675a3 [0,1,0,1,0,0|2,0,0]=4 19370 B13R1.90 CCC1CCCCC1OCN(C)C 7fd3a26c59858485d02c3d2292834111 [0,1,0,1,0,0|2,0,0]=4 19371 B13R1.90 CCC1CCCCN1CCC(=O)C 147b2741092151476d1cac4d5c38ca55 [0,1,0,1,0,0|0,0,2]=4 19372 B13R1.90 CCC1CCCCN1CCC(=O)O 3df5945447bed85da38232ce3e0085fc [0,1,0,1,0,0|1,0,1]=4 19373 B13R1.90 CCC1CCCCN1CCC(C)C 7a1e7595fef41f5140afd74dea6d1db0 [0,1,0,1,0,0|1,0,0]=3 19374 B13R1.90 CCC1CCCCN1CCC(C)O 2c97d14dd28397759e35318c05868775 [0,1,0,1,0,0|0,0,0]=2 19375 B13R1.90 CCC1CCCCN1CCN(C)C b5e8be2ccf4258376ad3870115029787 [0,1,0,1,0,0|2,0,0]=4 19376 B13R1.90 CCC1CCCCN1CCS(=O)C b149660be2ddfc582568f3ca05483455 [0,1,0,1,0,0|1,0,1]=4 19377 B13R1.90 CCC1CCCCN1COC(C)C 338ddccb171de82013376487332075d2 [0,1,0,1,0,0|2,0,0]=4 19378 B13R1.90 CCC1COCCC1NCC(C)C 841fcbdaf09331f46eb356044491d6b7 [0,1,0,1,0,0|2,0,0]=4 19379 B13R1.90 CCC1COCCC1NCC(C)O a392c804bf94fac3789be314a8f9ea36 [0,1,0,1,0,0|1,0,0]=3 19380 B13R1.90 CCC1COCCC1NC[C@@H](C)O 55850c020da071d587747c26e2de78a8 [0,1,0,1,0,0|1,0,0]=3 19381 B13R1.90 CCC1COCCC1NC[C@H](C)O 13515d0ab62bd4c8daa2f9cda5ce41a3 [0,1,0,1,0,0|1,0,0]=3 19382 B13R1.90 CCC1COCCN1CCC(C)C b981295ab279e473c9350557c7c43102 [0,1,0,1,0,0|2,0,0]=4 19383 B13R1.90 CCC1COCCN1CCC(C)O 5e6390ee633b6a8b80c5767a5dcb023f [0,1,0,1,0,0|1,0,0]=3 19384 B13R1.90 CCN1CCCCC1CCC(=O)O de8ff0f6f7079068957556051851ed66 [0,1,0,1,0,0|1,0,1]=4 19385 B13R1.90 CCN1CCCCC1CCN(C)C 529ca7aca103daf2cddbc91a891fdba2 [0,1,0,1,0,0|2,0,0]=4 19386 B13R1.90 CCN1CCCCC1CNC(C)C 9ec53fcc0e26d4ce4b13f27250619b5b [0,1,0,1,0,0|2,0,0]=4 19387 B13R1.90 CCN1CCCCC1COC(C)C 24d95674f6cb0b963813e5417ed311a7 [0,1,0,1,0,0|2,0,0]=4 19388 B13R1.90 CC[C@@H]1CCCCN1CCC(=O)C 4eb76a8a4f3c283d23bfe26541ce0820 [0,1,0,1,0,0|0,0,2]=4 19389 B13R1.90 CC[C@@H]1CCCCN1CCC(=O)O 00b39f00d9025efaf3d4d10a299f9de4 [0,1,0,1,0,0|1,0,1]=4 19390 B13R1.90 CC[C@@H]1CCCCN1CCC(C)C a04e5f920239750c40f035d4b872a228 [0,1,0,1,0,0|1,0,0]=3 19391 B13R1.90 CC[C@@H]1CCCCN1CCC(C)O 9ab6122cc380bbb0769cfef2c7eab274 [0,1,0,1,0,0|0,0,0]=2 19392 B13R1.90 CC[C@@H]1CCCCN1CCN(C)C b0f7e7a3ff26fbbba72659401492363a [0,1,0,1,0,0|2,0,0]=4 19393 B13R1.90 CC[C@@H]1CCCCN1CCS(=O)C 380e15ac15a1623d79df8603a35cccbd [0,1,0,1,0,0|1,0,1]=4 19394 B13R1.90 CC[C@@H]1CCCCN1COC(C)C bb6814ba315cd00672091f4fd96f9508 [0,1,0,1,0,0|2,0,0]=4 19395 B13R1.90 CC[C@@H]1COCCN1CCC(C)C 6c58a187ad61eefdecdfaca5da6ffd15 [0,1,0,1,0,0|2,0,0]=4 19396 B13R1.90 CC[C@@H]1COCCN1CCC(C)O 385748ba40942809ff4f6b9bf7657bbc [0,1,0,1,0,0|1,0,0]=3 19397 B13R1.90 CC[C@H]1CCCCN1CCC(=O)C 4c0ea5176765a20895b06cf0f8dfd019 [0,1,0,1,0,0|0,0,2]=4 19398 B13R1.90 CC[C@H]1CCCCN1CCC(=O)O 1b19729a0f93fe01bf71930961118d59 [0,1,0,1,0,0|1,0,1]=4 19399 B13R1.90 CC[C@H]1CCCCN1CCC(C)C 19dddb3c2a269ed0b4128b170cd69a46 [0,1,0,1,0,0|1,0,0]=3 19400 B13R1.90 CC[C@H]1CCCCN1CCC(C)O 5c59a577e79b95f5f440d64eabc2d7c1 [0,1,0,1,0,0|0,0,0]=2 19401 B13R1.90 CC[C@H]1CCCCN1CCN(C)C 4ede570ad754d08701d0f456cce51dd4 [0,1,0,1,0,0|2,0,0]=4 19402 B13R1.90 CC[C@H]1CCCCN1CCS(=O)C afd70ed5b6e0cee24956c30470a412d9 [0,1,0,1,0,0|1,0,1]=4 19403 B13R1.90 CC[C@H]1CCCCN1COC(C)C 426c66595be46e580345f11f9ee0eb63 [0,1,0,1,0,0|2,0,0]=4 19404 B13R1.90 CC[C@H]1COCCN1CCC(C)C f76eaf6c5de51cae598f3671553cd8ac [0,1,0,1,0,0|2,0,0]=4 19405 B13R1.90 CC[C@H]1COCCN1CCC(C)O e69da24adde02736e4ebb227c3385fa1 [0,1,0,1,0,0|1,0,0]=3 19406 B13R1.90 COC1CCCCC1COC(C)C a2d416278de5b8c478fadfeda3f143d6 [0,1,0,1,0,0|2,0,0]=4 19407 B13R1.90 COC1CCCCC1NCC(C)C ea281b6d3625721a7c5158d043f865d1 [0,1,0,1,0,0|2,0,0]=4 19408 B13R1.90 COC1CCCCC1NCC(C)O c15528b374dbea1296956c99bf463611 [0,1,0,1,0,0|1,0,0]=3 19409 B13R1.90 COC1CCCCC1NC[C@@H](C)O da7255e72e9d4228db7814535b77fa13 [0,1,0,1,0,0|1,0,0]=3 19410 B13R1.90 COC1CCCCC1NC[C@H](C)O 51a9b2e287f2b40e4ee7afac9481ec23 [0,1,0,1,0,0|1,0,0]=3 19411 B13R1.90 COC1CCCCC1OCC(C)C 192bf8ab6fe2a3c890fd528746980937 [0,1,0,1,0,0|2,0,0]=4 19412 B13R1.90 CO[C@@H]1COCC[C@@H]1NCC(C)O 406a97aef07112132d8fd4162214f222 [0,1,0,1,0,0|2,0,0]=4 19413 B13R1.90 CO[C@@H]1COCC[C@@H]1NC[C@@H](C)O b0ef39e16b7bb1e55e7d457139bc9297 [0,1,0,1,0,0|2,0,0]=4 19414 B13R1.90 CO[C@@H]1COCC[C@@H]1NC[C@H](C)O d107fe0d8f04feea21aad7670340df67 [0,1,0,1,0,0|2,0,0]=4 19415 B13R1.90 CO[C@@H]1COCC[C@H]1NCC(C)O 01bb6afe06cd4a5cf675ac75c58fcae7 [0,1,0,1,0,0|2,0,0]=4 19416 B13R1.90 CO[C@@H]1COCC[C@H]1NC[C@@H](C)O 732c3f4a67782daf15ca9b6e884e8685 [0,1,0,1,0,0|2,0,0]=4 19417 B13R1.90 CO[C@@H]1COCC[C@H]1NC[C@H](C)O 2469bffcd0270669f46962beb7330428 [0,1,0,1,0,0|2,0,0]=4 19418 B13R1.90 CO[C@H]1CCCC[C@@H]1NCC(C)C cab14ab48618112b2edf5ff00ca3d695 [0,1,0,1,0,0|2,0,0]=4 19419 B13R1.90 CO[C@H]1CCCC[C@@H]1NCC(C)O 480cc8eab28a827cf5437835ef7c2d57 [0,1,0,1,0,0|1,0,0]=3 19420 B13R1.90 CO[C@H]1CCCC[C@@H]1NC[C@@H](C)O 51c3fd60d20eeec16ea1ea6e34dc0d40 [0,1,0,1,0,0|1,0,0]=3 19421 B13R1.90 CO[C@H]1CCCC[C@@H]1NC[C@H](C)O 33577448fc988c31ca522e0ccdcc6546 [0,1,0,1,0,0|1,0,0]=3 19422 B13R1.90 CO[C@H]1COCC[C@@H]1NCC(C)O d84e2a458cb93a59ff809dcfa586aa86 [0,1,0,1,0,0|2,0,0]=4 19423 B13R1.90 CO[C@H]1COCC[C@@H]1NC[C@@H](C)O 5dcc99681209481414afcf339ad6d3ef [0,1,0,1,0,0|2,0,0]=4 19424 B13R1.90 CO[C@H]1COCC[C@@H]1NC[C@H](C)O 392a23f0631543ab731f72eb4f3ff33e [0,1,0,1,0,0|2,0,0]=4 19425 B13R1.90 CO[C@H]1COCC[C@H]1NCC(C)O aea77a381f98dfdf50c849fe760e8d41 [0,1,0,1,0,0|2,0,0]=4 19426 B13R1.90 CO[C@H]1COCC[C@H]1NC[C@@H](C)O 070dae81b6c090359ee97dc0546141de [0,1,0,1,0,0|2,0,0]=4 19427 B13R1.90 CO[C@H]1COCC[C@H]1NC[C@H](C)O 7cba97de94d190cb0dfc4062fe45ea8b [0,1,0,1,0,0|2,0,0]=4 19428 B13R1.90 CS[C@@H]1CCCC[C@H]1OCC(C)C ac863ead3d7c812e6dbb0e4b67868d6e [0,1,0,1,0,0|2,0,0]=4 19429 B13R1.90 C[C@@H](O)CNC1CCCCC1C#N 78856116f4e041fa6d852ca4ed8b4d1a [0,1,0,1,0,0|1,0,1]=4 19430 B13R1.90 C[C@@H](O)CNC1CCOCC1CO 3ea4ac9f2924f1255fbdcf294a2a9673 [0,1,0,1,0,0|2,0,0]=4 19431 B13R1.90 C[C@@H](O)CN[C@@H]1CCCC[C@@H]1CO e54bb78cda71f4ea8396bb9edb59e59d [0,1,0,1,0,0|1,0,0]=3 19432 B13R1.90 C[C@@H](O)CN[C@@H]1CCCC[C@H]1CO 67bee1ac5a3b927ab51542aaebfca9a8 [0,1,0,1,0,0|1,0,0]=3 19433 B13R1.90 C[C@@H](O)CN[C@@H]1CCOC[C@@H]1CO b86dbe2557075c90605bc56a48c0dbf4 [0,1,0,1,0,0|2,0,0]=4 19434 B13R1.90 C[C@@H](O)CN[C@H]1CCCC[C@H]1C#N 5c82c592b2cdeac045580439e1a2adea [0,1,0,1,0,0|1,0,1]=4 19435 B13R1.90 C[C@@H](O)CN[C@H]1CCCC[C@H]1CO b50e9dce898dfb38fec0f7cb243503b0 [0,1,0,1,0,0|1,0,0]=3 19436 B13R1.90 C[C@H](O)CNC1CCCCC1C#N b2742d502514c35767a5bb3b344afd7a [0,1,0,1,0,0|1,0,1]=4 19437 B13R1.90 C[C@H](O)CNC1CCOCC1CO 2071eda228870955d2fc4d389b55e37a [0,1,0,1,0,0|2,0,0]=4 19438 B13R1.90 C[C@H](O)CN[C@@H]1CCCC[C@@H]1CO 63beef9a83e04a0152fcafb425f0a956 [0,1,0,1,0,0|1,0,0]=3 19439 B13R1.90 C[C@H](O)CN[C@@H]1CCCC[C@H]1CO b1f4d42767db982f5bdeb112628b7dfb [0,1,0,1,0,0|1,0,0]=3 19440 B13R1.90 C[C@H](O)CN[C@@H]1CCOC[C@@H]1CO 89bd680658a4b81c702af98e237fb504 [0,1,0,1,0,0|2,0,0]=4 19441 B13R1.90 C[C@H](O)CN[C@H]1CCCC[C@H]1C#N e47a1ab47904777f713cf7325e3b2fde [0,1,0,1,0,0|1,0,1]=4 19442 B13R1.90 C[C@H](O)CN[C@H]1CCCC[C@H]1CO 79bdc267578554af54019eff940be7c7 [0,1,0,1,0,0|1,0,0]=3 19443 B13R1.103 C#CC1CCCN1CCCC(C)O 5a277010bb3c95b1df8ba6c612bf996b [0,1,0,1,0,0|0,0,2]=4 19444 B13R1.103 C=C(C)CCCN1CCCC1CC 6f426808a7d54ca8a258c29f231e3eb4 [0,1,0,1,0,0|1,0,1]=4 19445 B13R1.103 C=C(C)CCCN1CCC[C@H]1CC 211ef29d918f974833974ff11968d4e1 [0,1,0,1,0,0|1,0,1]=4 19446 B13R1.103 C=C(C)CCN[C@@H]1CCC[C@H]1CC 0d83bf2674d9434c4c33777770010a23 [0,1,0,1,0,0|1,0,1]=4 19447 B13R1.103 CC(C)CCCN1CCCC1CO e6c2598e58b290ab08f94130694b9b78 [0,1,0,1,0,0|2,0,0]=4 19448 B13R1.103 CC(C)CCCN1CCC[C@@H]1CF da47816bd404c2021bfcdd9166049d42 [0,1,0,1,0,0|2,0,0]=4 19449 B13R1.103 CC(C)CCCN1CCC[C@@H]1CO adee1bcdb1de33848c892502134c4dec [0,1,0,1,0,0|2,0,0]=4 19450 B13R1.103 CC(C)CCCN1CCC[C@H]1CF 9ff0398b32c6f4795658c4c056e11383 [0,1,0,1,0,0|2,0,0]=4 19451 B13R1.103 CC(C)CCCN1CCC[C@H]1CO 6eb38aad37d0981f54b588d53b3b5b94 [0,1,0,1,0,0|2,0,0]=4 19452 B13R1.103 CC(C)CCN[C@H]1CCC[C@H]1CO e39a01ac344506914050690e3dcc8424 [0,1,0,1,0,0|2,0,0]=4 19453 B13R1.103 CC(O)CCCN1CCCC1C#N 96b6ac4690c752adf37d32b549c3e21f [0,1,0,1,0,0|1,0,1]=4 19454 B13R1.103 CC(O)CCCN1CCCC1CO cad266890215f80732b95e3e9c135930 [0,1,0,1,0,0|1,0,0]=3 19455 B13R1.103 CC(O)CCCN1CCC[C@@H]1CF 5d9275af2e7396c6784a41dc3e6833d7 [0,1,0,1,0,0|1,0,0]=3 19456 B13R1.103 CC(O)CCCN1CCC[C@@H]1CO c7f6b21005f2219094891161b965db1f [0,1,0,1,0,0|1,0,0]=3 19457 B13R1.103 CC(O)CCCN1CCC[C@H]1C#N 35b07256158e7ca5e35a3b7030b31560 [0,1,0,1,0,0|1,0,1]=4 19458 B13R1.103 CC(O)CCCN1CCC[C@H]1CF b90ededa4e954e0af92d6028e639e451 [0,1,0,1,0,0|1,0,0]=3 19459 B13R1.103 CC(O)CCCN1CCC[C@H]1CO 8c76a16336649caa69498b3fad48bcbb [0,1,0,1,0,0|1,0,0]=3 19460 B13R1.103 CC(O)CCNC1COCC1CO c714c7d84950d1a2068c850cbeb8cf80 [0,1,0,1,0,0|2,0,0]=4 19461 B13R1.103 CC(O)CCN[C@@H]1COC[C@H]1CO 1c872b92e7de505cfe6e7275fc1af75e [0,1,0,1,0,0|2,0,0]=4 19462 B13R1.103 CC(O)CCN[C@H]1CCC[C@H]1C#N 988e9af4e71abaef472961fd14445375 [0,1,0,1,0,0|1,0,1]=4 19463 B13R1.103 CC(O)CCN[C@H]1CCC[C@H]1CO 8d621d1d4caa30abbaa2e874a3129b32 [0,1,0,1,0,0|1,0,0]=3 19464 B13R1.103 CC(O)CCN[C@H]1CSC[C@@H]1CO 75b0f2aa686e36ebd50e751aab552a7f [0,1,0,1,0,0|2,0,0]=4 19465 B13R1.103 CCC1CCCN1CCCC(=O)C ec74cb265bcd430146ecd6ca75dd4a38 [0,1,0,1,0,0|0,0,2]=4 19466 B13R1.103 CCC1CCCN1CCCC(=O)O 2e731b2842537942a412306a55bd08f4 [0,1,0,1,0,0|1,0,1]=4 19467 B13R1.103 CCC1CCCN1CCCC(C)C 15fb6cbea1380175443d8802cfe6af1e [0,1,0,1,0,0|1,0,0]=3 19468 B13R1.103 CCC1CCCN1CCCC(C)O abad244eec5f7216063c776948127433 [0,1,0,1,0,0|0,0,0]=2 19469 B13R1.103 CCC1CCCN1CCCN(C)C fc5a7bec360b4a3387c0e8776cca3411 [0,1,0,1,0,0|2,0,0]=4 19470 B13R1.103 CCC1CCCN1CCOC(C)C 2dd3439127bb1395718a6b3df3aef102 [0,1,0,1,0,0|2,0,0]=4 19471 B13R1.103 CCC1CCCN1CCSC(C)C 51eafc0d5a9f2637f1efb31ec48c2b4b [0,1,0,1,0,0|2,0,0]=4 19472 B13R1.103 CCN1CCCC1CNCC(C)C c72bc2bd879f74e985f4957a15c8392d [0,1,0,1,0,0|2,0,0]=4 19473 B13R1.103 CCN1CCCC1CNCC(C)O 3a96f68ff732c761d1a1c2c37e6525f8 [0,1,0,1,0,0|1,0,0]=3 19474 B13R1.103 CCN1CCCC1CNC[C@@H](C)O d6dadf00bd86647818089d75e3edd0a3 [0,1,0,1,0,0|1,0,0]=3 19475 B13R1.103 CCN1CCCC1CNC[C@H](C)O 74a86672f2fcb93d89fba12ad4d6d099 [0,1,0,1,0,0|1,0,0]=3 19476 B13R1.103 CCN1CCCC1COCC(C)C 53966235d36f4bc1007c90aa0624a4b0 [0,1,0,1,0,0|2,0,0]=4 19477 B13R1.103 CCN1CCC[C@@H]1CNCC(C)C c800e0826083d2462e7a9319fe1915ab [0,1,0,1,0,0|2,0,0]=4 19478 B13R1.103 CCN1CCC[C@@H]1CNCC(C)O a65b24bc9725462205960b473e62a3aa [0,1,0,1,0,0|1,0,0]=3 19479 B13R1.103 CCN1CCC[C@@H]1CNC[C@@H](C)O f42fe810809d75ba2fcc92104697339d [0,1,0,1,0,0|1,0,0]=3 19480 B13R1.103 CCN1CCC[C@@H]1CNC[C@H](C)O 1b21afac622cf22ec7336332bd6495ba [0,1,0,1,0,0|1,0,0]=3 19481 B13R1.103 CCN1CCC[C@@H]1COCC(C)C 9c50bd7465aae97e43183e1c717555ec [0,1,0,1,0,0|2,0,0]=4 19482 B13R1.103 CCN1CCC[C@H]1CNCC(C)C 661fb992794028ef7bad8ef7f098e719 [0,1,0,1,0,0|2,0,0]=4 19483 B13R1.103 CCN1CCC[C@H]1CNCC(C)O c5158d098f0715a5eac2084673b2985a [0,1,0,1,0,0|1,0,0]=3 19484 B13R1.103 CCN1CCC[C@H]1CNC[C@@H](C)O 4ded1370b737bd5431d406f15f124303 [0,1,0,1,0,0|1,0,0]=3 19485 B13R1.103 CCN1CCC[C@H]1CNC[C@H](C)O 2dba97d5c15fc0afac6138e5b96da940 [0,1,0,1,0,0|1,0,0]=3 19486 B13R1.103 CCN1CCC[C@H]1COCC(C)C 1ce54fd269a6235125162b3d255c79d1 [0,1,0,1,0,0|2,0,0]=4 19487 B13R1.103 CC[C@@H]1CCCN1CCCC(=O)C cc8002dd18fea3c99d49da47e3e04c89 [0,1,0,1,0,0|0,0,2]=4 19488 B13R1.103 CC[C@@H]1CCCN1CCCC(=O)O 31070978689590b47e6162baf8a70b50 [0,1,0,1,0,0|1,0,1]=4 19489 B13R1.103 CC[C@@H]1CCCN1CCCC(C)C 88c745434eaed20b89cf37f961ac8d75 [0,1,0,1,0,0|1,0,0]=3 19490 B13R1.103 CC[C@@H]1CCCN1CCCC(C)O cc0e88f12382262a21c7b7f2bfd8c2ff [0,1,0,1,0,0|0,0,0]=2 19491 B13R1.103 CC[C@@H]1CCCN1CCCN(C)C 0a0466b960f1fbe0635acde4576ae743 [0,1,0,1,0,0|2,0,0]=4 19492 B13R1.103 CC[C@@H]1CCCN1CCOC(C)C 2f46f9244c8aecec31795a8c64e88956 [0,1,0,1,0,0|2,0,0]=4 19493 B13R1.103 CC[C@@H]1CCCN1CCSC(C)C 492e693c403e1a0e7d89f653387910eb [0,1,0,1,0,0|2,0,0]=4 19494 B13R1.103 CC[C@@H]1CCC[C@H]1NCCC(=O)C ced24469fed273db17f54f81ca7c089e [0,1,0,1,0,0|0,0,2]=4 19495 B13R1.103 CC[C@@H]1CCC[C@H]1NCCC(=O)O a5b226c516fcd1b9859584a70f60a8c2 [0,1,0,1,0,0|1,0,1]=4 19496 B13R1.103 CC[C@@H]1CCC[C@H]1NCCC(C)C 532788e67cfeccba80046ccc41afe7fd [0,1,0,1,0,0|1,0,0]=3 19497 B13R1.103 CC[C@@H]1CCC[C@H]1NCCC(C)O 6b882f8eee34046c51a483721e5487c6 [0,1,0,1,0,0|0,0,0]=2 19498 B13R1.103 CC[C@@H]1CCC[C@H]1NCCN(C)C bde7cfbb9a853be3add1e9fd54cee50a [0,1,0,1,0,0|2,0,0]=4 19499 B13R1.103 CC[C@@H]1CCC[C@H]1NCCS(=O)C 425c1256f49fccc04e77327dd343dba7 [0,1,0,1,0,0|1,0,1]=4 19500 B13R1.103 CC[C@@H]1CCC[C@H]1NCOC(C)C 53d69dc0be32eba9c2320e7e38bf69ea [0,1,0,1,0,0|2,0,0]=4 19501 B13R1.103 COC1CCCC1NCCC(C)C 7b9fb7c1501a2f2cdf0147df13dccb35 [0,1,0,1,0,0|2,0,0]=4 19502 B13R1.103 COC1CCCC1NCCC(C)O 959bef08b27bd209bca613331184ca9c [0,1,0,1,0,0|1,0,0]=3 19503 B13R1.103 COC1CCCN1CCCC(C)C 0ef15e4fd89797d33106482f0bfe21da [0,1,0,1,0,0|2,0,0]=4 19504 B13R1.103 COC1CCCN1CCCC(C)O 406aec6add1e587bf97cfec0887f7bed [0,1,0,1,0,0|1,0,0]=3 19505 B13R1.103 COC1COCC1NCCC(C)O 9170ea50cdcad705173334839ab8161c [0,1,0,1,0,0|2,0,0]=4 19506 B13R1.103 CO[C@@H]1CCC[C@@H]1NCCC(C)C bd7e2502aa7a1bb8b0835c88aa8b5c77 [0,1,0,1,0,0|2,0,0]=4 19507 B13R1.103 CO[C@@H]1CCC[C@@H]1NCCC(C)O 4533b9ee2bf0e7bf971235dbc8b0a962 [0,1,0,1,0,0|1,0,0]=3 19508 B13R1.103 CO[C@@H]1CCC[C@H]1NCCC(C)C 3dbbbfe4b9d81b7ab1a05d135a85c470 [0,1,0,1,0,0|2,0,0]=4 19509 B13R1.103 CO[C@@H]1CCC[C@H]1NCCC(C)O 74567f59f8043f8670c8477b61b88ac8 [0,1,0,1,0,0|1,0,0]=3 19510 B13R1.103 CO[C@@H]1COC[C@@H]1NCCC(C)O b6f219f8c03ba5002e75c2ce3e63f9ee [0,1,0,1,0,0|2,0,0]=4 19511 B13R1.103 CO[C@@H]1COC[C@H]1NCCC(C)O 3fbf622774630d2c1d16e5809af2bbd1 [0,1,0,1,0,0|2,0,0]=4 19512 B13R1.103 CO[C@H]1CCC[C@@H]1NCCC(C)C 5d20d315d633079e66d5373f071efe6e [0,1,0,1,0,0|2,0,0]=4 19513 B13R1.103 CO[C@H]1CCC[C@@H]1NCCC(C)O 90afc2cac9ce08bdb4e7608b1afd05be [0,1,0,1,0,0|1,0,0]=3 19514 B13R1.103 CO[C@H]1COC[C@@H]1NCCC(C)O 4a49fcb12af0e92a26899a39720f6683 [0,1,0,1,0,0|2,0,0]=4 19515 B13R1.103 CO[C@H]1COC[C@H]1NCCC(C)O d1ff1b0b60d1ff0441fa1ec5fa16d7c8 [0,1,0,1,0,0|2,0,0]=4 19516 B13R1.167 C=C(C)CCCOC1CCCC1C 6dbc8ab41472e7665e7a17f083b696a1 [0,1,0,1,0,0|1,0,1]=4 19517 B13R1.167 C=C(C)CCCO[C@@H]1CCC[C@@H]1C e152804bfc39e5ad02971d03cf28ec1e [0,1,0,1,0,0|1,0,1]=4 19518 B13R1.167 C=C(C)CCCO[C@@H]1CCC[C@H]1C 29324aab67c9106dad1fd56beeb3b15b [0,1,0,1,0,0|1,0,1]=4 19519 B13R1.167 C=C(C)CCCO[C@H]1CCC[C@@H]1C ea739a64cf1cb6682293f19fbee11c6f [0,1,0,1,0,0|1,0,1]=4 19520 B13R1.167 C=C(C)CCCO[C@H]1CCC[C@H]1C 31a30e8d296117f31230ca43f4bbb412 [0,1,0,1,0,0|1,0,1]=4 19521 B13R1.167 C=C(C)CCOCC1CCCC1C 8b75ba48263d550ff004116ed3cd522d [0,1,0,1,0,0|1,0,1]=4 19522 B13R1.167 CC(=O)CCCCN1CCCC1C 648d3dd20406f7df6c2a7cfaf839fb7c [0,1,0,1,0,0|0,0,2]=4 19523 B13R1.167 CC(=O)CCCCN1CCC[C@@H]1C be6d78acceccf264a405be7a2817c1ae [0,1,0,1,0,0|0,0,2]=4 19524 B13R1.167 CC(=O)CCCCN1CCC[C@H]1C 9a33702c17fc8eec4cd2d11130b753dc [0,1,0,1,0,0|0,0,2]=4 19525 B13R1.167 CC(=O)CCCOC1CCCC1C dcd0d26976b0320036a3edff448866c2 [0,1,0,1,0,0|0,0,2]=4 19526 B13R1.167 CC(=O)CCCO[C@@H]1CCC[C@@H]1C 151b60511b1ebf7c7c539e99a50716a1 [0,1,0,1,0,0|0,0,2]=4 19527 B13R1.167 CC(=O)CCCO[C@@H]1CCC[C@H]1C dd46b00fb934ff1225675cc3ac37b8fd [0,1,0,1,0,0|0,0,2]=4 19528 B13R1.167 CC(=O)CCCO[C@H]1CCC[C@@H]1C 0227e824ef70a337608920a5c1bd3121 [0,1,0,1,0,0|0,0,2]=4 19529 B13R1.167 CC(=O)CCCO[C@H]1CCC[C@H]1C bdd72ac45dc52b8c72ddc32d903782b8 [0,1,0,1,0,0|0,0,2]=4 19530 B13R1.167 CC(=O)CCOCC1CCCC1C a8e75b98ed6d293f620d967fcad51bb3 [0,1,0,1,0,0|0,0,2]=4 19531 B13R1.167 CC(C)CCCCN1CCCC1C cd2f5b7782ced4c8cbf5e0fc2339040a [0,1,0,1,0,0|1,0,0]=3 19532 B13R1.167 CC(C)CCCCN1CCCC1O 462d0f10fc2a0a3e4b5312ff49c974bf [0,1,0,1,0,0|2,0,0]=4 19533 B13R1.167 CC(C)CCCCN1CCC[C@@H]1C bd0d7dd0d992e93af7a53e488c3cc706 [0,1,0,1,0,0|1,0,0]=3 19534 B13R1.167 CC(C)CCCCN1CCC[C@H]1C 9d20ca0552bdbe7bc16f4da8ed052f38 [0,1,0,1,0,0|1,0,0]=3 19535 B13R1.167 CC(C)CCCCN1CCSC1C 0562eecfe5ff8150c112deda6b1e29a0 [0,1,0,1,0,0|2,0,0]=4 19536 B13R1.167 CC(C)CCCNC1CCCC1O 83bd025ecd6d51b92a14a037d86ed92e [0,1,0,1,0,0|2,0,0]=4 19537 B13R1.167 CC(C)CCCN[C@@H]1CCC[C@@H]1O 9716d52d0dca9a78c6ef88254f1dab23 [0,1,0,1,0,0|2,0,0]=4 19538 B13R1.167 CC(C)CCCN[C@@H]1CCC[C@H]1O 95de4bd6deb35f0f009cc74f21d40d44 [0,1,0,1,0,0|2,0,0]=4 19539 B13R1.167 CC(C)CCCN[C@H]1CCC[C@@H]1O b57f835b4b26fecd41f18c77a176d92b [0,1,0,1,0,0|2,0,0]=4 19540 B13R1.167 CC(C)CCCN[C@H]1CCC[C@H]1O 7b70cac5709d867fedcc45d8fa6189ed [0,1,0,1,0,0|2,0,0]=4 19541 B13R1.167 CC(C)CCCOC1CCCC1C 7a2bc0d5e147feb5177b8e742403b24d [0,1,0,1,0,0|1,0,0]=3 19542 B13R1.167 CC(C)CCCOC1COCC1C 1a8c4a141eeba8e66247e043b87fb6f9 [0,1,0,1,0,0|2,0,0]=4 19543 B13R1.167 CC(C)CCCO[C@@H]1CCC[C@@H]1C b0c7982558209979b4c8d175b71bc4ad [0,1,0,1,0,0|1,0,0]=3 19544 B13R1.167 CC(C)CCCO[C@@H]1CCC[C@H]1C 348ecf300362b8ef9699129783258f84 [0,1,0,1,0,0|1,0,0]=3 19545 B13R1.167 CC(C)CCCO[C@@H]1CCC[C@H]1F 045b1f029919a65bda0086e114152326 [0,1,0,1,0,0|2,0,0]=4 19546 B13R1.167 CC(C)CCCO[C@@H]1COC[C@@H]1C dd2ce87f65f31c5b62dbc49c26797eda [0,1,0,1,0,0|2,0,0]=4 19547 B13R1.167 CC(C)CCCO[C@H]1CCC[C@@H]1C 9cffc79f18008b12d2376ceea8c6b657 [0,1,0,1,0,0|1,0,0]=3 19548 B13R1.167 CC(C)CCCO[C@H]1CCC[C@H]1C 41f60fc81fad079a1ddebaa2b3e08f91 [0,1,0,1,0,0|1,0,0]=3 19549 B13R1.167 CC(C)CCCO[C@H]1COC[C@@H]1C d5a2c427c83c40983d616d0a2f67ab7b [0,1,0,1,0,0|2,0,0]=4 19550 B13R1.167 CC(C)CCCO[C@H]1COC[C@H]1C 028d71d5508def9ad7931ef1a30e4087 [0,1,0,1,0,0|2,0,0]=4 19551 B13R1.167 CC(C)CCNCC1CCCC1O 498a72f4cceae7c31bcb4d89f1f7e293 [0,1,0,1,0,0|2,0,0]=4 19552 B13R1.167 CC(C)CCNCC1CCCN1C e0c3291e1b8c266f03ffdbf8c239aa8c [0,1,0,1,0,0|2,0,0]=4 19553 B13R1.167 CC(C)CCNCC1COCC1C 577f3fe6e113c016d265fa76ec35fab0 [0,1,0,1,0,0|2,0,0]=4 19554 B13R1.167 CC(C)CCNC[C@@H]1CCCN1C 1425751911a62016d80200661879065c [0,1,0,1,0,0|2,0,0]=4 19555 B13R1.167 CC(C)CCNC[C@H]1CCCN1C b9812e8c76736ff878a6ecaf769344b2 [0,1,0,1,0,0|2,0,0]=4 19556 B13R1.167 CC(C)CCOCC1CCCC1C d4545c773a677ee9a09e1733e0043252 [0,1,0,1,0,0|1,0,0]=3 19557 B13R1.167 CC(C)CCOCC1CCCN1C 726b4492f2b989ecf0d4e6db983c336d [0,1,0,1,0,0|2,0,0]=4 19558 B13R1.167 CC(C)CCOCC1COCC1C 5f519e4bb04e0e0a26dea38a4adfad06 [0,1,0,1,0,0|2,0,0]=4 19559 B13R1.167 CC(C)CCOCC1OCCC1C 1a270a66c16f2a7ac5f21b19b270be25 [0,1,0,1,0,0|2,0,0]=4 19560 B13R1.167 CC(C)CCOC[C@@H]1CCCN1C 597d9a1287e505d72fc9e88dd4cf968a [0,1,0,1,0,0|2,0,0]=4 19561 B13R1.167 CC(C)CCOC[C@@H]1CCC[C@H]1F 49b33beb2d3e16d98dc1e2ceea212dc9 [0,1,0,1,0,0|2,0,0]=4 19562 B13R1.167 CC(C)CCOC[C@@H]1CCO[C@@H]1C 492c10007a3628ff0980a713d5c9ed99 [0,1,0,1,0,0|2,0,0]=4 19563 B13R1.167 CC(C)CCOC[C@H]1CCCN1C 7983e132980bab0f0fea8c880fea014e [0,1,0,1,0,0|2,0,0]=4 19564 B13R1.167 CC(C)CNCCC1CCCN1C 2b6678094e54bed6885ce2cf53ccb255 [0,1,0,1,0,0|2,0,0]=4 19565 B13R1.167 CC(C)CNCC[C@@H]1CCCN1C 7c84993b7c818932bdbb156cc8a4f13f [0,1,0,1,0,0|2,0,0]=4 19566 B13R1.167 CC(C)CNCC[C@H]1CCCN1C 8ba482921802e5a3a70c3285baaaa6d3 [0,1,0,1,0,0|2,0,0]=4 19567 B13R1.167 CC(C)COCCC1CCCN1C bd4622cf1378eb2ea0039854501c9cd2 [0,1,0,1,0,0|2,0,0]=4 19568 B13R1.167 CC(C)COCCN1CCCC1C 5ef62507b1117a3be2ae4df3b9cb8fe6 [0,1,0,1,0,0|2,0,0]=4 19569 B13R1.167 CC(C)COCCN1CCC[C@@H]1C e7706197bac9ef83b7ade81e08093585 [0,1,0,1,0,0|2,0,0]=4 19570 B13R1.167 CC(C)COCCN1CCC[C@H]1C 1a7af4710e89972b3771c405cd9cd730 [0,1,0,1,0,0|2,0,0]=4 19571 B13R1.167 CC(C)COCC[C@@H]1CCCN1C 7e8bfd9616cce4de3ab01b7658b9c7c4 [0,1,0,1,0,0|2,0,0]=4 19572 B13R1.167 CC(C)COCC[C@H]1CCCN1C 9999e79ae728fce2a03424dc4f372b43 [0,1,0,1,0,0|2,0,0]=4 19573 B13R1.167 CC(C)OCCOC1CCCC1C b03e8e5fe918d7790e1b0a6707168a54 [0,1,0,1,0,0|2,0,0]=4 19574 B13R1.167 CC(C)OCCO[C@@H]1CCC[C@@H]1C c087f81e59883c4bbb07475639b2c5cf [0,1,0,1,0,0|2,0,0]=4 19575 B13R1.167 CC(C)OCCO[C@@H]1CCC[C@H]1C 3f279ec8c5d82dc0ab0c917192ce4bbf [0,1,0,1,0,0|2,0,0]=4 19576 B13R1.167 CC(C)OCCO[C@H]1CCC[C@@H]1C e313e3cd8346b3306f98f59f99882f58 [0,1,0,1,0,0|2,0,0]=4 19577 B13R1.167 CC(C)OCCO[C@H]1CCC[C@H]1C c7473909078c7063f5ade2059edcd3cc [0,1,0,1,0,0|2,0,0]=4 19578 B13R1.167 CC(C)OCOCC1CCCC1C cfb8cc53d1ef5dcd5dc5b693dbbbca9b [0,1,0,1,0,0|2,0,0]=4 19579 B13R1.167 CC(C)SCCOC1CCCC1C bd0beeaefd4fb55bd0262a65d3dbfab4 [0,1,0,1,0,0|2,0,0]=4 19580 B13R1.167 CC(C)SCCO[C@@H]1CCC[C@@H]1C e56eab2b73bc0794f0ab0f4245a06d88 [0,1,0,1,0,0|2,0,0]=4 19581 B13R1.167 CC(C)SCCO[C@@H]1CCC[C@H]1C 62d56ea9569133e2a04a9c63cdbcf7d3 [0,1,0,1,0,0|2,0,0]=4 19582 B13R1.167 CC(C)SCCO[C@H]1CCC[C@@H]1C 8835d09dfdfc00705b8de836a3315401 [0,1,0,1,0,0|2,0,0]=4 19583 B13R1.167 CC(C)SCCO[C@H]1CCC[C@H]1C e46c012c95e95db7a38c7924aacaa4bd [0,1,0,1,0,0|2,0,0]=4 19584 B13R1.167 CC(F)COCCC1CCCN1C 2a78d8cf011862e6eb53c49c332faf2e [0,1,0,1,0,0|2,0,0]=4 19585 B13R1.167 CC(O)CCCCN1CCCC1C f9c4d2a5f6eb40edec97b797af2eaaa3 [0,1,0,1,0,0|0,0,0]=2 19586 B13R1.167 CC(O)CCCCN1CCCC1O 5ae5a1d735ffe7f935d4256e8fdb20f1 [0,1,0,1,0,0|1,0,0]=3 19587 B13R1.167 CC(O)CCCCN1CCC[C@@H]1C 952efbe63be71fa8fb051de1381f9c60 [0,1,0,1,0,0|0,0,0]=2 19588 B13R1.167 CC(O)CCCCN1CCC[C@H]1C 0168233fbf7c013ef21d87823f6ff19e [0,1,0,1,0,0|0,0,0]=2 19589 B13R1.167 CC(O)CCCCN1CCSC1C e1ca4aceea22c505ce8047bbd4fed746 [0,1,0,1,0,0|1,0,0]=3 19590 B13R1.167 CC(O)CCCNC1CCCC1O 4cc95eb2b3d047a783a62f37f9f549d8 [0,1,0,1,0,0|1,0,0]=3 19591 B13R1.167 CC(O)CCCNC1COCC1O e2df905f75e24ac5605d0db78a02655b [0,1,0,1,0,0|2,0,0]=4 19592 B13R1.167 CC(O)CCCN[C@@H]1CCC[C@@H]1O d1ce36263b4e41285d04a386ccf30bbb [0,1,0,1,0,0|1,0,0]=3 19593 B13R1.167 CC(O)CCCN[C@@H]1CCC[C@H]1O 886e8a23fbc641feb0557eaed01bcdbb [0,1,0,1,0,0|1,0,0]=3 19594 B13R1.167 CC(O)CCCN[C@@H]1COC[C@@H]1O de3b647bf290bc7a6b4c2b79d6811e50 [0,1,0,1,0,0|2,0,0]=4 19595 B13R1.167 CC(O)CCCN[C@@H]1COC[C@H]1O d746755d1dba777a359c988196ca080c [0,1,0,1,0,0|2,0,0]=4 19596 B13R1.167 CC(O)CCCN[C@H]1CCC[C@@H]1O df1dcd1977952337f31ca952fae670b9 [0,1,0,1,0,0|1,0,0]=3 19597 B13R1.167 CC(O)CCCN[C@H]1CCC[C@H]1O da17ce993de0a7fed244102839c899a2 [0,1,0,1,0,0|1,0,0]=3 19598 B13R1.167 CC(O)CCCN[C@H]1COC[C@@H]1O f183bff7b8a2075e734c4db6ceaf59ec [0,1,0,1,0,0|2,0,0]=4 19599 B13R1.167 CC(O)CCCN[C@H]1COC[C@H]1F dbadcf3362bc28dccbaaaa0c0b3ec5c7 [0,1,0,1,0,0|2,0,0]=4 19600 B13R1.167 CC(O)CCCN[C@H]1COC[C@H]1O db2cd425e5ae1f35db1859b73df34579 [0,1,0,1,0,0|2,0,0]=4 19601 B13R1.167 CC(O)CCNCC1CCCC1O 2799511a7d526fc01cdf81f74a9dd0ad [0,1,0,1,0,0|1,0,0]=3 19602 B13R1.167 CC(O)CCNCC1CCCN1C b61b8c6caffd321d619664e998c58232 [0,1,0,1,0,0|1,0,0]=3 19603 B13R1.167 CC(O)CCNCC1COCC1C e1140240b44cfe0816657190f4db5f57 [0,1,0,1,0,0|1,0,0]=3 19604 B13R1.167 CC(O)CCNC[C@@H]1CCCN1C 183eceaf2a2303ba7e181fd57e267088 [0,1,0,1,0,0|1,0,0]=3 19605 B13R1.167 CC(O)CCNC[C@@H]1COC[C@@H]1O d67d87360b16353990c2b2f2ad16a80a [0,1,0,1,0,0|2,0,0]=4 19606 B13R1.167 CC(O)CCNC[C@H]1CCCN1C 7b4f8715faf7d57c113ca217e1267233 [0,1,0,1,0,0|1,0,0]=3 19607 B13R1.167 CC(O)CNCCC1CCCN1C affcdb4e337c103eab9c3b1c94dd1cdf [0,1,0,1,0,0|1,0,0]=3 19608 B13R1.167 CC(O)CNCC[C@@H]1CCCN1C a3d308ba98e0621816f54611ee04f36c [0,1,0,1,0,0|1,0,0]=3 19609 B13R1.167 CC(O)CNCC[C@H]1CCCN1C c81878dddcd054102362e37c8e13edb1 [0,1,0,1,0,0|1,0,0]=3 19610 B13R1.167 CC(S)COCCC1CCCN1C e710a2e31c67ad3502dc465d08d68aea [0,1,0,1,0,0|1,1,0]=4 19611 B13R1.167 CC1CCCC1COCCC(=O)O 16b9f2779489c7c7e8a713b6f75b0ed4 [0,1,0,1,0,0|1,0,1]=4 19612 B13R1.167 CC1CCCC1COCCN(C)C 7d07bd236f2d69899adfdd211e119e7c [0,1,0,1,0,0|2,0,0]=4 19613 B13R1.167 CC1CCCC1COCCS(=O)C bfd9fbf6c17fc886a9ec7649ece6d4f1 [0,1,0,1,0,0|1,0,1]=4 19614 B13R1.167 CC1CCCC1OCCCC(=O)O 5e40d7cde00a6b7e108959d03a33d7d6 [0,1,0,1,0,0|1,0,1]=4 19615 B13R1.167 CC1CCCC1OCCCN(C)C 4ec3cf5bf482402cb154f5ef0a81c519 [0,1,0,1,0,0|2,0,0]=4 19616 B13R1.167 CC1CCCN1CCCCC(=O)O 3fcfa4e118495a817317095903fc69d3 [0,1,0,1,0,0|1,0,1]=4 19617 B13R1.167 CC1CCCN1CCCCN(C)C 6d65bd7205889aadb7450c85733b6a9b [0,1,0,1,0,0|2,0,0]=4 19618 B13R1.167 CC1CCCN1CCCC[C@@H](C)O 2a629ce64d47c6befecbfce52cb23f13 [0,1,0,1,0,0|0,0,0]=2 19619 B13R1.167 CC1COCC1CNCC[C@@H](C)O 282e78e3cea6b3e8f4a50b02e3301b24 [0,1,0,1,0,0|1,0,0]=3 19620 B13R1.167 CC1COCC1CNCC[C@H](C)O 1b5aacc4740517b56659c6e7601344b6 [0,1,0,1,0,0|1,0,0]=3 19621 B13R1.167 CC1SCCN1CCCC[C@@H](C)O ad3bf24104d534fd66e3e89304668990 [0,1,0,1,0,0|1,0,0]=3 19622 B13R1.167 C[C@@H](F)COCCC1CCCN1C 0a2041430d2e0f457dbbccd1727dc29e [0,1,0,1,0,0|2,0,0]=4 19623 B13R1.167 C[C@@H](O)CCCCN1CCCC1O 9e772151efa4fd5cddd1ae8812735f8a [0,1,0,1,0,0|1,0,0]=3 19624 B13R1.167 C[C@@H](O)CCCCN1CCC[C@@H]1C 0d04dc4b30a01d9289683bc93968d710 [0,1,0,1,0,0|0,0,0]=2 19625 B13R1.167 C[C@@H](O)CNCCC1CCCN1C e881ab01b92bbce86c6af70bc641e7a2 [0,1,0,1,0,0|1,0,0]=3 19626 B13R1.167 C[C@@H](O)CNCC[C@@H]1CCCN1C 5335774d6d61efe71b728e7f55a9fcd7 [0,1,0,1,0,0|1,0,0]=3 19627 B13R1.167 C[C@@H](O)CNCC[C@H]1CCCN1C 7e00d0eaf9f08fd2f1a6dfc2340eecf6 [0,1,0,1,0,0|1,0,0]=3 19628 B13R1.167 C[C@@H]1CCCN1CCCCC(=O)O 4b12038ffaaaa827e8182706427ec881 [0,1,0,1,0,0|1,0,1]=4 19629 B13R1.167 C[C@@H]1CCCN1CCCCN(C)C 4dcaeb59a27192ed28fd32efeb804655 [0,1,0,1,0,0|2,0,0]=4 19630 B13R1.167 C[C@@H]1CCCN1CCCC[C@@H](C)O 7f3e4d2dc2961050b3e34cd2e58c8aca [0,1,0,1,0,0|0,0,0]=2 19631 B13R1.167 C[C@@H]1CCC[C@@H]1OCCCC(=O)O 78e1eee664bb45b0b1472584adc5d5e3 [0,1,0,1,0,0|1,0,1]=4 19632 B13R1.167 C[C@@H]1CCC[C@@H]1OCCCN(C)C e6e3396241a579d0b4e9721d0ee264a4 [0,1,0,1,0,0|2,0,0]=4 19633 B13R1.167 C[C@@H]1CCC[C@H]1OCCCC(=O)O c650039148aaf5e09f6294a091823911 [0,1,0,1,0,0|1,0,1]=4 19634 B13R1.167 C[C@@H]1CCC[C@H]1OCCCN(C)C 7968a616e86808ccb4714dfa5b9f9acd [0,1,0,1,0,0|2,0,0]=4 19635 B13R1.167 C[C@H](F)COCCC1CCCN1C 1c9a9625ce29d462f1403b06257212ed [0,1,0,1,0,0|2,0,0]=4 19636 B13R1.167 C[C@H](O)CNCCC1CCCN1C fad732369a1f18a6d2462952d4e56059 [0,1,0,1,0,0|1,0,0]=3 19637 B13R1.167 C[C@H](O)CNCC[C@@H]1CCCN1C 9c90723d218d25a1953b723d3f39c923 [0,1,0,1,0,0|1,0,0]=3 19638 B13R1.167 C[C@H](O)CNCC[C@H]1CCCN1C a671120a8557c06a32a070f954e00edd [0,1,0,1,0,0|1,0,0]=3 19639 B13R1.167 C[C@H]1CCCN1CCCCC(=O)O 4a13c5df6c02724fe25bf0750f0a2ab1 [0,1,0,1,0,0|1,0,1]=4 19640 B13R1.167 C[C@H]1CCCN1CCCCN(C)C 24d6e0b184ae8804838203e6ca6bce28 [0,1,0,1,0,0|2,0,0]=4 19641 B13R1.167 C[C@H]1CCC[C@@H]1OCCCC(=O)O ff2677dc9b7f6ac8127375747b8a2c14 [0,1,0,1,0,0|1,0,1]=4 19642 B13R1.167 C[C@H]1CCC[C@@H]1OCCCN(C)C 357dc69a3d0e48339121a10b6a42456d [0,1,0,1,0,0|2,0,0]=4 19643 B13R1.167 C[C@H]1CCC[C@H]1OCCCC(=O)O d174c1108a7d1608f5f07c5ec0e3faa4 [0,1,0,1,0,0|1,0,1]=4 19644 B13R1.167 C[C@H]1CCC[C@H]1OCCCN(C)C 3ebb60edb6c4b6721579f425fdc1919e [0,1,0,1,0,0|2,0,0]=4 19645 B13R1.193 C#CCCCNC1CCCC1(C)O de7c8827491510a2ded4b8a70a43a095 [0,1,0,1,0,0|0,0,2]=4 19646 B13R1.193 C#CCCCN[C@@H]1CCC[C@@]1(C)O 604c640b25b2713d061f63c1f769491f [0,1,0,1,0,0|0,0,2]=4 19647 B13R1.193 C#CCCCN[C@H]1CCC[C@]1(C)O 534a9995d0ea9c4ea7eb5b5099e88cc6 [0,1,0,1,0,0|0,0,2]=4 19648 B13R1.193 C=CCCCNC1CCCC1(C)O aeef40b5baf44486a7df52053520e349 [0,1,0,1,0,0|0,0,2]=4 19649 B13R1.193 C=CCCCN[C@@H]1CCC[C@@]1(C)O 11406cc05f1a35655d3747cacd0e6a0f [0,1,0,1,0,0|0,0,2]=4 19650 B13R1.193 C=CCCCN[C@H]1CCC[C@]1(C)O 703815bf5138a29eac1f93f32d3eb56d [0,1,0,1,0,0|0,0,2]=4 19651 B13R1.193 CC/C=C/CNC1CCCC1(C)O d85c956a1d93d375a64513593bb46e72 [0,1,0,1,0,0|0,0,2]=4 19652 B13R1.193 CC/C=C/CN[C@@H]1CCC[C@@]1(C)O cec34645221f2ed06db79d5057ecada1 [0,1,0,1,0,0|0,0,2]=4 19653 B13R1.193 CC/C=C/CN[C@H]1CCC[C@]1(C)O 9cc902ec94cf4e8c8eb0498fb880296c [0,1,0,1,0,0|0,0,2]=4 19654 B13R1.193 CC1(CCCC1NCCCC#N)O ff527dc5f174e3903b28604c95a878e6 [0,1,0,1,0,0|1,0,1]=4 19655 B13R1.193 CC1(CCCC1NCCCC=O)O 55d2c3be3108e4c938c43129ca9c6bb7 [0,1,0,1,0,0|1,0,1]=4 19656 B13R1.193 CC1(CCCC1NCCCCF)C 521a874f168e8dd79d03e1f5490348f9 [0,1,0,1,0,0|2,0,0]=4 19657 B13R1.193 CC1(CCCC1NCCCCF)O 85f3a48182564782be48d03303ceebdf [0,1,0,1,0,0|1,0,0]=3 19658 B13R1.193 CC1(CCCC1NCCCCO)C 73954e786d17b078a4d1badaa2fea500 [0,1,0,1,0,0|2,0,0]=4 19659 B13R1.193 CC1(CCCC1NCCCCO)O 9f789cc8124ff45ec8b99041433a1886 [0,1,0,1,0,0|1,0,0]=3 19660 B13R1.193 CC1(CCCC1OCCCCF)C 580722110c434d6e11cf96b90e2f9580 [0,1,0,1,0,0|2,0,0]=4 19661 B13R1.193 CC1(CCCN1CCCCCF)C 3f046700fbd70f39c7938b74b021fd5b [0,1,0,1,0,0|2,0,0]=4 19662 B13R1.193 CC1(CCCN1CCCCCO)C 76c874e17bab616b917002a3532cc1e4 [0,1,0,1,0,0|2,0,0]=4 19663 B13R1.193 CC1(CCC[C@@H]1OCCCCF)C 6263aa32dcfa3ac2b756c9ccd24f3a97 [0,1,0,1,0,0|2,0,0]=4 19664 B13R1.193 CC1(CCC[C@H]1OCCCCF)C a6c42a4c81d2ba74181837b31cf56c54 [0,1,0,1,0,0|2,0,0]=4 19665 B13R1.193 CCCCCCN1CCCC1(C)C c4abb62f813403079f1298655b8b3af4 [0,1,0,1,0,0|1,0,0]=3 19666 B13R1.193 CCCCCCN1CCOC1(C)C 6834dbbb2ee5c705a77ac23777dcb1e8 [0,1,0,1,0,0|2,0,0]=4 19667 B13R1.193 CCCCCCN1CCSC1(C)C f481ee80249026dec4b0c66ca7c754b4 [0,1,0,1,0,0|2,0,0]=4 19668 B13R1.193 CCCCCCN1COCC1(C)C ffcf044cef2ece3b5a0a6c373f644b8b [0,1,0,1,0,0|2,0,0]=4 19669 B13R1.193 CCCCCNC1CCCC1(C)C a8972e67bb58357a40d5e443d7e9b02e [0,1,0,1,0,0|1,0,0]=3 19670 B13R1.193 CCCCCNC1CCCC1(C)O 37ea65ba40126dfcdbcde1ca58daddb1 [0,1,0,1,0,0|0,0,0]=2 19671 B13R1.193 CCCCCNC1CCCC1(F)F 4b577372ed8ce3d752acdc2048955d3a [0,1,0,1,0,0|2,0,0]=4 19672 B13R1.193 CCCCCNC1CCOC1(C)C 5d8439f21734df6cbb579dfdd8d6355a [0,1,0,1,0,0|2,0,0]=4 19673 B13R1.193 CCCCCN[C@@H]1CCC[C@@]1(C)O 07b0d5830e18b16e911fdc8ef20667ee [0,1,0,1,0,0|0,0,0]=2 19674 B13R1.193 CCCCCN[C@H]1CCC[C@]1(C)O 7a67d4620475c3b21ad2672b6291ffbb [0,1,0,1,0,0|0,0,0]=2 19675 B13R1.193 CCCCCOC1CCCC1(C)C bc58fc71525dcca30d57ab54a3390768 [0,1,0,1,0,0|1,0,0]=3 19676 B13R1.193 CCCCCOC1CCCC1(F)F aef00695a73ba69b1ff5d68a9997ff6b [0,1,0,1,0,0|2,0,0]=4 19677 B13R1.193 CCCCCO[C@@H]1CCCC1(C)C 83a48bf664d2dc10d5a0c77efdf3a5d3 [0,1,0,1,0,0|1,0,0]=3 19678 B13R1.193 CCCCCO[C@H]1CCCC1(C)C 359112b178d1833070a008bc9579a494 [0,1,0,1,0,0|1,0,0]=3 19679 B13R1.193 CCCCNCC1CCOC1(C)C f30b42725fdd5dd8dbbf78601e7bd886 [0,1,0,1,0,0|2,0,0]=4 19680 B13R1.193 CCCCOCC1CCOC1(C)C 23f91752947a399517a4cee06076dffc [0,1,0,1,0,0|2,0,0]=4 19681 B13R1.193 CCCCOCN1CCCC1(C)C 8c2c4b4b2ed8805b77dfadf42076f03f [0,1,0,1,0,0|2,0,0]=4 19682 B13R1.193 CCCNCCN1CCCC1(C)C b9ed1f4c5e8ac9dc5e62ce545cdb81b5 [0,1,0,1,0,0|2,0,0]=4 19683 B13R1.193 CCCOCCC1CCCC1(F)F 0544b927cafe9040ed07194cca069d8c [0,1,0,1,0,0|2,0,0]=4 19684 B13R1.193 CCCOCCN1CCCC1(C)C f784da79bd58e6adba1e0084bee1e5c8 [0,1,0,1,0,0|2,0,0]=4 19685 B13R1.193 CCOCCCN1CCCC1(C)C cb1e5a733266d9fef9d815ed8575664d [0,1,0,1,0,0|2,0,0]=4 19686 B13R1.193 CCOCCNC1CCCC1(C)C b94edbd43f3330f8e0d3c277897d13c8 [0,1,0,1,0,0|2,0,0]=4 19687 B13R1.193 CCOCCNC1CCCC1(C)O 9c14d6121034ef315acc7781e61ce05e [0,1,0,1,0,0|1,0,0]=3 19688 B13R1.193 CCOCCN[C@@H]1CCC[C@@]1(C)O e016f4def8f14b8423b64319d277985a [0,1,0,1,0,0|1,0,0]=3 19689 B13R1.193 CCOCCN[C@H]1CCC[C@]1(C)O 920958fe51e2e71b2529e23435627b05 [0,1,0,1,0,0|1,0,0]=3 19690 B13R1.193 CCOCCOC1CCCC1(C)C a3ec85bbea639284505b11ce2e4deaaa [0,1,0,1,0,0|2,0,0]=4 19691 B13R1.193 CCOCCO[C@@H]1CCCC1(C)C 594117ad215b2080c5ef21c4212329c0 [0,1,0,1,0,0|2,0,0]=4 19692 B13R1.193 CCOCCO[C@H]1CCCC1(C)C 1a053ed9e9e2ab0e548c73441b95148e [0,1,0,1,0,0|2,0,0]=4 19693 B13R1.193 CCSCCCN1CCCC1(C)C 215d16cc011c1d77ed0af0f08fb33666 [0,1,0,1,0,0|2,0,0]=4 19694 B13R1.193 CCSCCNC1CCCC1(C)C 1c46091600d121996b8578fe6fffcf7a [0,1,0,1,0,0|2,0,0]=4 19695 B13R1.193 CCSCCNC1CCCC1(C)O 3acb9d5be32addb9b08abd4711a1939f [0,1,0,1,0,0|1,0,0]=3 19696 B13R1.193 CCSCCN[C@@H]1CCC[C@@]1(C)O 4bfa783cfba2a9e3cf6339de816bcb90 [0,1,0,1,0,0|1,0,0]=3 19697 B13R1.193 CCSCCN[C@H]1CCC[C@]1(C)O efcfd313343c49e0f58a4178a71b9d7b [0,1,0,1,0,0|1,0,0]=3 19698 B13R1.193 CCSCCOC1CCCC1(C)C e9737711c386cd0b15c67fb849f775c6 [0,1,0,1,0,0|2,0,0]=4 19699 B13R1.193 CCSCCO[C@@H]1CCCC1(C)C 87f80cc488cee303ab5cfbeb8ade3bd1 [0,1,0,1,0,0|2,0,0]=4 19700 B13R1.193 CCSCCO[C@H]1CCCC1(C)C 759e1f4fa5a0d8409a9a010bb0923929 [0,1,0,1,0,0|2,0,0]=4 19701 B13R1.193 COCCCCN1CCCC1(C)C 692775a483fd6a38030f528b33d0bd86 [0,1,0,1,0,0|2,0,0]=4 19702 B13R1.193 COCCCNC1CCCC1(C)C d1182554c98836c47ff69cd80b1bfe32 [0,1,0,1,0,0|2,0,0]=4 19703 B13R1.193 COCCCNC1CCCC1(C)O 4f11d32ccfeb28b4751c822d9be359c2 [0,1,0,1,0,0|1,0,0]=3 19704 B13R1.193 COCCCN[C@@H]1CCC[C@@]1(C)O 72e1f35329e5db5aba1185b0f51587d8 [0,1,0,1,0,0|1,0,0]=3 19705 B13R1.193 COCCCN[C@H]1CCC[C@]1(C)O d68b3d6c06f2b45a6af6aaed11a02a0a [0,1,0,1,0,0|1,0,0]=3 19706 B13R1.193 COCCCOC1CCCC1(C)C 280e2c305f430af7af87c47212c3d6dc [0,1,0,1,0,0|2,0,0]=4 19707 B13R1.193 COCCCO[C@@H]1CCCC1(C)C b65a009b3e57592135456aa184abc52a [0,1,0,1,0,0|2,0,0]=4 19708 B13R1.193 COCCCO[C@H]1CCCC1(C)C 1c6ec645fb673fe002d5537e911bf8ed [0,1,0,1,0,0|2,0,0]=4 19709 B13R1.193 CSCCCNC1CCCC1(C)C 9a33f3813d18f89466d634ca24a4758f [0,1,0,1,0,0|2,0,0]=4 19710 B13R1.193 CSCCCNC1CCCC1(C)O 822e651767fcd8326b57fd0bde2ade92 [0,1,0,1,0,0|1,0,0]=3 19711 B13R1.193 CSCCCN[C@@H]1CCC[C@@]1(C)O 2ace387abbeceefe88b5b6dc5a7b515d [0,1,0,1,0,0|1,0,0]=3 19712 B13R1.193 CSCCCN[C@H]1CCC[C@]1(C)O e6a1f6fdc52da0128552d9c7af34a52f [0,1,0,1,0,0|1,0,0]=3 19713 B13R1.193 CSCCCOC1CCCC1(C)C cdec4a09f5af4819e471151fe834f24e [0,1,0,1,0,0|2,0,0]=4 19714 B13R1.193 CSCCCO[C@@H]1CCCC1(C)C e18567284f7933b95d69947e3497acb3 [0,1,0,1,0,0|2,0,0]=4 19715 B13R1.193 CSCCCO[C@H]1CCCC1(C)C fdb460b4f77b1aee777dc4916e31a802 [0,1,0,1,0,0|2,0,0]=4 19716 B13R1.193 C[C@@]1(CCC[C@@H]1NCCCC#N)O f6a40bc1d7f258f8f00af25ca8a2efc5 [0,1,0,1,0,0|1,0,1]=4 19717 B13R1.193 C[C@@]1(CCC[C@@H]1NCCCC=O)O a97b3512af932ddda234e74db3c85be5 [0,1,0,1,0,0|1,0,1]=4 19718 B13R1.193 C[C@@]1(CCC[C@@H]1NCCCCF)O b2ac2154e9e0ecedc8160d081c573e95 [0,1,0,1,0,0|1,0,0]=3 19719 B13R1.193 C[C@@]1(CCC[C@@H]1NCCCCO)O 6e86175887b3fbece59323ee7965b80d [0,1,0,1,0,0|1,0,0]=3 19720 B13R1.193 C[C@]1(CCC[C@H]1NCCCC#N)O cb18cdb0f457c28ac7e74b506d0c6779 [0,1,0,1,0,0|1,0,1]=4 19721 B13R1.193 C[C@]1(CCC[C@H]1NCCCC=O)O 6af03e59a1efe43392bad37392db172d [0,1,0,1,0,0|1,0,1]=4 19722 B13R1.193 C[C@]1(CCC[C@H]1NCCCCF)O 680e1d7e3b6c537a6690880537e531f1 [0,1,0,1,0,0|1,0,0]=3 19723 B13R1.193 C[C@]1(CCC[C@H]1NCCCCO)O 0c85dbc1f0b718f5a9cfaff228aa00c0 [0,1,0,1,0,0|1,0,0]=3 19724 B13R1.218 CC(C)CCCN1CCC1CCO 338432c4f9ae92c577ad2f40b37820cd [0,1,0,1,0,0|2,0,0]=4 19725 B13R1.218 CC(O)CCCN1CCC1CCO 681a542b35bb3a2544b647b9764a4510 [0,1,0,1,0,0|1,0,0]=3 19726 B13R1.218 COCC1CCN1CCCC(C)C f066cb24eb5c64e586ba5435d6613fdc [0,1,0,1,0,0|2,0,0]=4 19727 B13R1.218 COCC1CCN1CCCC(C)O 7b260c35c70d927fca46d44a8af50bd2 [0,1,0,1,0,0|1,0,0]=3 19728 B13R1.218 COC[C@@H]1CCN1CCCC(C)C 1e71f4f45aed1d0dfbc0975d55cfd8ea [0,1,0,1,0,0|2,0,0]=4 19729 B13R1.218 COC[C@@H]1CCN1CCCC(C)O 6a53c012bc83af5b2a4f91da6c3991ef [0,1,0,1,0,0|1,0,0]=3 19730 B13R1.218 COC[C@H]1CCN1CCCC(C)C b88c5b30e05506283021a785a0b8f83b [0,1,0,1,0,0|2,0,0]=4 19731 B13R1.218 COC[C@H]1CCN1CCCC(C)O 183dc396a9d4c54771a71700a2cc9003 [0,1,0,1,0,0|1,0,0]=3 19732 B13R1.224 CCCN1CCCCCC1C(=O)O 9cde5800c737fb793388021fe86bffeb [0,1,0,1,0,0|1,0,1]=4 19733 B13R1.224 CCCN1CCCCC[C@@H]1C(=O)O 20d4334221962889fe3c3201c63574e4 [0,1,0,1,0,0|1,0,1]=4 19734 B13R1.224 CCCN1CCCCC[C@H]1C(=O)O 506d9c2aecf971b754b046056f7f351a [0,1,0,1,0,0|1,0,1]=4 19735 B13R1.283 CC(C)N[C@H]1CCCCCC[C@@H]1O 6abfc6c3df8f964ad06f9d01b190e91e [0,1,0,1,0,0|2,0,0]=4 19736 B13R1.343 C=C(C)CCCNCC1CCCC1 046ba43f8864a1f9808f9acf05dc5d30 [0,1,0,1,0,0|1,0,1]=4 19737 B13R1.343 C=C(C)CCCOCC1CCCC1 792af48af2849b4375b8f19b8355fee7 [0,1,0,1,0,0|1,0,1]=4 19738 B13R1.343 C=C(C)CCNCCC1CCCC1 0120562ae5927b08d87db002e023864e [0,1,0,1,0,0|1,0,1]=4 19739 B13R1.343 C=C(C)CCOCCC1CCCC1 c983835172f7b36fbe6bf534583bf087 [0,1,0,1,0,0|1,0,1]=4 19740 B13R1.343 C=C(C)CNCCCC1CCCC1 b43480782694c567481f1de06d543aed [0,1,0,1,0,0|1,0,1]=4 19741 B13R1.343 C=C(C)COCCCC1CCCC1 e4ef05fb28356e0d1967ae84a8f59454 [0,1,0,1,0,0|1,0,1]=4 19742 B13R1.343 CC(=O)CCCCNC1CCCC1 392bba383052bd4b3d66273d0e722720 [0,1,0,1,0,0|0,0,2]=4 19743 B13R1.343 CC(=O)CCCCOC1CCCC1 194b85d175bc543191765c87280b8851 [0,1,0,1,0,0|0,0,2]=4 19744 B13R1.343 CC(=O)CCCNCC1CCCC1 f65740728a7303c1c975d363e7594a12 [0,1,0,1,0,0|0,0,2]=4 19745 B13R1.343 CC(=O)CCCOCC1CCCC1 9e0c089dc8a49988e939cf79a513dd73 [0,1,0,1,0,0|0,0,2]=4 19746 B13R1.343 CC(=O)CCNCCC1CCCC1 87605c2692ad09e825d6c424eabc2e11 [0,1,0,1,0,0|0,0,2]=4 19747 B13R1.343 CC(=O)CCOCCC1CCCC1 6d43d6ad7ac5926e250564fa0235232d [0,1,0,1,0,0|0,0,2]=4 19748 B13R1.343 CC(=O)CNCCCC1CCCC1 197ff7bb541a6a8aba5884f0f2cc65fe [0,1,0,1,0,0|0,0,2]=4 19749 B13R1.343 CC(=O)COCCCC1CCCC1 894b5f6e4b458910fa55ed057f111702 [0,1,0,1,0,0|0,0,2]=4 19750 B13R1.343 CC(=O)NCCCCC1CCCC1 4615f363af1d532d90633104468f35f7 [0,1,0,1,0,0|0,0,2]=4 19751 B13R1.343 CC(C)CCCCCN1CCSC1 73cecd624ae74b61878e99b92d17cf14 [0,1,0,1,0,0|2,0,0]=4 19752 B13R1.343 CC(C)CCCCNC1CCCC1 b6d29f2e4fe0a9feb71f54b3581b3a52 [0,1,0,1,0,0|1,0,0]=3 19753 B13R1.343 CC(C)CCCCNC1CCOC1 6bbd004b1c8e3da6c29bf3b155c4f826 [0,1,0,1,0,0|2,0,0]=4 19754 B13R1.343 CC(C)CCCCNC1CCSC1 1dd67a031f1aeb796c1eee26f3c0fb92 [0,1,0,1,0,0|2,0,0]=4 19755 B13R1.343 CC(C)CCCCN[C@@H]1CCOC1 bb91de26e59da063829dd078c591fd5d [0,1,0,1,0,0|2,0,0]=4 19756 B13R1.343 CC(C)CCCCN[C@H]1CCOC1 01dec3e08424ebd4d7a874201a2e6ad6 [0,1,0,1,0,0|2,0,0]=4 19757 B13R1.343 CC(C)CCCCOC1CCCC1 ffac4c16d7b30d92cc4354860caf80a5 [0,1,0,1,0,0|1,0,0]=3 19758 B13R1.343 CC(C)CCCCOC1CCCO1 3180dbd579ff467b8a6cac68a49aaf19 [0,1,0,1,0,0|2,0,0]=4 19759 B13R1.343 CC(C)CCCCOC1CCOC1 3ec96fae4e0fd31064fb761889d55fba [0,1,0,1,0,0|2,0,0]=4 19760 B13R1.343 CC(C)CCCCOC1CCSC1 defd4c2fc4703abec77d93f86d9b235a [0,1,0,1,0,0|2,0,0]=4 19761 B13R1.343 CC(C)CCCCO[C@@H]1CCOC1 312391ff6ae9915eff911b3b4b33641c [0,1,0,1,0,0|2,0,0]=4 19762 B13R1.343 CC(C)CCCCO[C@@H]1CCSC1 08c7339b43ba0e15271420af1a50b33f [0,1,0,1,0,0|2,0,0]=4 19763 B13R1.343 CC(C)CCCCO[C@H]1CCOC1 b7b631fa7c4df6a0f525e183d58d0da1 [0,1,0,1,0,0|2,0,0]=4 19764 B13R1.343 CC(C)CCCCO[C@H]1CCSC1 3a31fe301d7b482037c2a70b5e722672 [0,1,0,1,0,0|2,0,0]=4 19765 B13R1.343 CC(C)CCCNCC1CCCC1 4d4a5db53842134076637388c75b9501 [0,1,0,1,0,0|1,0,0]=3 19766 B13R1.343 CC(C)CCCNCC1CCCO1 432833c522fb60d534606331e7eb46b4 [0,1,0,1,0,0|2,0,0]=4 19767 B13R1.343 CC(C)CCCNCC1CCOC1 5625934ab2bffcdfc4aa0df2a694a7ef [0,1,0,1,0,0|2,0,0]=4 19768 B13R1.343 CC(C)CCCNC[C@@H]1CCCO1 95e0b3ae6c46266d70ecec8792ee4a76 [0,1,0,1,0,0|2,0,0]=4 19769 B13R1.343 CC(C)CCCNC[C@@H]1CCOC1 8fba0d31ce6f2c14cb56e6ab11f7e527 [0,1,0,1,0,0|2,0,0]=4 19770 B13R1.343 CC(C)CCCNC[C@H]1CCCO1 e0d3de336cb4f602a609284cb0bd23c7 [0,1,0,1,0,0|2,0,0]=4 19771 B13R1.343 CC(C)CCCNC[C@H]1CCOC1 91174c52557de3652d50689f729103a6 [0,1,0,1,0,0|2,0,0]=4 19772 B13R1.343 CC(C)CCCOCC1CCCC1 3c3dbfdfb32e1a15408a077f6df52812 [0,1,0,1,0,0|1,0,0]=3 19773 B13R1.343 CC(C)CCCOCC1CCCO1 c1d21523460f7d2c68a1e81d3ff67026 [0,1,0,1,0,0|2,0,0]=4 19774 B13R1.343 CC(C)CCCOCC1CCCS1 697ad64ecc577cca3263dea4ccc4838e [0,1,0,1,0,0|2,0,0]=4 19775 B13R1.343 CC(C)CCCOCC1CCOC1 dc029b24ff83b052e6ce72f027bf7d39 [0,1,0,1,0,0|2,0,0]=4 19776 B13R1.343 CC(C)CCCOCN1CCCC1 39e1508a599f3f90bf07b9c1be77ef2c [0,1,0,1,0,0|2,0,0]=4 19777 B13R1.343 CC(C)CCCOC[C@@H]1CCCO1 d0496d09d08efd83baffe5541c061d7b [0,1,0,1,0,0|2,0,0]=4 19778 B13R1.343 CC(C)CCCOC[C@@H]1CCOC1 ed3b06359f98255375cf626952cc9208 [0,1,0,1,0,0|2,0,0]=4 19779 B13R1.343 CC(C)CCCOC[C@H]1CCCO1 527fee25e27dbff2fe7509ca04e0a508 [0,1,0,1,0,0|2,0,0]=4 19780 B13R1.343 CC(C)CCCOC[C@H]1CCOC1 341b3e0347b728a95574da893495f18e [0,1,0,1,0,0|2,0,0]=4 19781 B13R1.343 CC(C)CCNCCC1CCCC1 797a208af003b1a277664d0fe1158158 [0,1,0,1,0,0|1,0,0]=3 19782 B13R1.343 CC(C)CCNCCC1CCCO1 279e3acea10f5c24427491ada19a8e03 [0,1,0,1,0,0|2,0,0]=4 19783 B13R1.343 CC(C)CCNCCC1CCOC1 6b85f9c0e37c53bc89ec7150dcc0c80b [0,1,0,1,0,0|2,0,0]=4 19784 B13R1.343 CC(C)CCNCCN1CCCC1 85c166d6333ef49e0fa63fcabb19db65 [0,1,0,1,0,0|2,0,0]=4 19785 B13R1.343 CC(C)CCOCCC1CCCC1 cf61003238ecf5aba14961b3fced0a49 [0,1,0,1,0,0|1,0,0]=3 19786 B13R1.343 CC(C)CCOCCC1CCCO1 9b78a4cfc1423e40234eae670438ba52 [0,1,0,1,0,0|2,0,0]=4 19787 B13R1.343 CC(C)CCOCCC1CCOC1 4429b31484614e49c28dc323d535533f [0,1,0,1,0,0|2,0,0]=4 19788 B13R1.343 CC(C)CCOCCN1CCCC1 a25a2be398282b0195b0d91f69a1f222 [0,1,0,1,0,0|2,0,0]=4 19789 B13R1.343 CC(C)CNCCCC1CCCC1 0265b3710cdd2fafb11c573bdf20ab69 [0,1,0,1,0,0|1,0,0]=3 19790 B13R1.343 CC(C)CNCCCC1CCOC1 e7ba56ee1b9649cb44998685198b99c3 [0,1,0,1,0,0|2,0,0]=4 19791 B13R1.343 CC(C)CNCCCN1CCCC1 74412fe6b7ab0f7527f542327bb0110f [0,1,0,1,0,0|2,0,0]=4 19792 B13R1.343 CC(C)CNCCOC1CCCC1 4cbc7b85ffbc7e0352e45a435c133821 [0,1,0,1,0,0|2,0,0]=4 19793 B13R1.343 CC(C)CNCCSC1CCCC1 58a38e4c76b5a1b1945acb60a5832e9d [0,1,0,1,0,0|2,0,0]=4 19794 B13R1.343 CC(C)COCCCC1CCCC1 fea67d32c9a3c65724f44a4ea5cf2ab6 [0,1,0,1,0,0|1,0,0]=3 19795 B13R1.343 CC(C)COCCCN1CCCC1 4d7b9a1b61569ffa8bdc5ce50c485519 [0,1,0,1,0,0|2,0,0]=4 19796 B13R1.343 CC(C)COCCNC1CCCC1 6e360c879a3dfff566231a3ea558e279 [0,1,0,1,0,0|2,0,0]=4 19797 B13R1.343 CC(C)COCCOC1CCCC1 25d17b133294f25460f79ee0c1c4fa52 [0,1,0,1,0,0|2,0,0]=4 19798 B13R1.343 CC(C)CSCCOC1CCCC1 8b36e7e100599cc9a67e20993a5620f8 [0,1,0,1,0,0|2,0,0]=4 19799 B13R1.343 CC(C)NCCCCC1CCCC1 dcfc74b379e49ffaf77796ccbcacc325 [0,1,0,1,0,0|1,0,0]=3 19800 B13R1.343 CC(C)NCCCCN1CCCC1 74f4d65e7d904a66b187a8e68a74b4df [0,1,0,1,0,0|2,0,0]=4 19801 B13R1.343 CC(C)NCCCOC1CCCC1 5afe2f09329efe888631ca764851e8c7 [0,1,0,1,0,0|2,0,0]=4 19802 B13R1.343 CC(C)OCCCCN1CCCC1 1d3e28f89010eddf317acd28a7913f0c [0,1,0,1,0,0|2,0,0]=4 19803 B13R1.343 CC(C)OCCCNC1CCCC1 1cfc191faa01d19d0657f663223a3a1b [0,1,0,1,0,0|2,0,0]=4 19804 B13R1.343 CC(C)OCCCOC1CCCC1 844263f1b2107488243a034cf3c7df44 [0,1,0,1,0,0|2,0,0]=4 19805 B13R1.343 CC(C)OCCNCC1CCCC1 829557f7c4516469a786907d147831ab [0,1,0,1,0,0|2,0,0]=4 19806 B13R1.343 CC(C)OCCOCC1CCCC1 5bfa1cf26e9271d454e2c185e0b4cb15 [0,1,0,1,0,0|2,0,0]=4 19807 B13R1.343 CC(C)OCNCCC1CCCC1 1bb7e320495ac19564024da6e02acd51 [0,1,0,1,0,0|2,0,0]=4 19808 B13R1.343 CC(C)OCOCCC1CCCC1 9d23dd8877bc28838f17a16c43693181 [0,1,0,1,0,0|2,0,0]=4 19809 B13R1.343 CC(C)SCCCNC1CCCC1 18061ddd16048e1ec6fe8917b908529f [0,1,0,1,0,0|2,0,0]=4 19810 B13R1.343 CC(C)SCCCOC1CCCC1 fc0c22978982462eeb689ee830f146aa [0,1,0,1,0,0|2,0,0]=4 19811 B13R1.343 CC(C)SCCNCC1CCCC1 7fee40ad1240b4b8d83b805a2c217494 [0,1,0,1,0,0|2,0,0]=4 19812 B13R1.343 CC(C)SCCOCC1CCCC1 3e07b2941ef08387288464e45431da27 [0,1,0,1,0,0|2,0,0]=4 19813 B13R1.343 CC(F)COCCCC1CCCC1 a5c5d4173e87e00f55169f8322d21658 [0,1,0,1,0,0|1,0,0]=3 19814 B13R1.343 CC(F)COCCCN1CCCC1 c6236bff1bcb8aa7ba68617618d5ef4e [0,1,0,1,0,0|2,0,0]=4 19815 B13R1.343 CC(O)CCCCNC1CC=CC1 01f12718aac80b14a25f4184ea0dc549 [0,1,0,1,0,0|0,0,2]=4 19816 B13R1.343 CC(O)CCCCNC1CCCC1 29e2b069fcbdd37d28b70af6eaf93976 [0,1,0,1,0,0|0,0,0]=2 19817 B13R1.343 CC(O)CCCCNC1CCOC1 c312f068abdb2b948ef7971a82ca16e5 [0,1,0,1,0,0|1,0,0]=3 19818 B13R1.343 CC(O)CCCCNC1CCSC1 cfabca7d39cdc9d2f4a90ba103760830 [0,1,0,1,0,0|1,0,0]=3 19819 B13R1.343 CC(O)CCCCN[C@@H]1CCOC1 fb85c995258129c26ca60d2138fd6fd2 [0,1,0,1,0,0|1,0,0]=3 19820 B13R1.343 CC(O)CCCCN[C@H]1CCOC1 37aa7b18094e19a6efcc011003ffce0d [0,1,0,1,0,0|1,0,0]=3 19821 B13R1.343 CC(O)CCCNCC1CC=CC1 6e8f549629f136c931a044a223fc3849 [0,1,0,1,0,0|0,0,2]=4 19822 B13R1.343 CC(O)CCCNCC1CCCC1 9fea8e4a1d54e5fede0ab1d3ace3be9f [0,1,0,1,0,0|0,0,0]=2 19823 B13R1.343 CC(O)CCCNCC1CCCO1 014e78921e68afc00ac807430376b458 [0,1,0,1,0,0|1,0,0]=3 19824 B13R1.343 CC(O)CCCNCC1CCOC1 415445e0014d4cbb7f4d9e23a9ff560c [0,1,0,1,0,0|1,0,0]=3 19825 B13R1.343 CC(O)CCCNC[C@@H]1CCCO1 158d223791d8de1734efc8160c02e2e7 [0,1,0,1,0,0|1,0,0]=3 19826 B13R1.343 CC(O)CCCNC[C@@H]1CCOC1 82f641787f1d7b160bae274148bad322 [0,1,0,1,0,0|1,0,0]=3 19827 B13R1.343 CC(O)CCCNC[C@H]1CCCO1 e66e321fd630a11bb47909c4c8e03801 [0,1,0,1,0,0|1,0,0]=3 19828 B13R1.343 CC(O)CCCNC[C@H]1CCOC1 ec0a240ffb59d399e3619bb44d1daeff [0,1,0,1,0,0|1,0,0]=3 19829 B13R1.343 CC(O)CCNCCC1CCCC1 939980fa387f75a165cf81bf8134da9c [0,1,0,1,0,0|0,0,0]=2 19830 B13R1.343 CC(O)CCNCCC1CCCO1 3b1ec947a38719e007687f16feba6a56 [0,1,0,1,0,0|1,0,0]=3 19831 B13R1.343 CC(O)CCNCCC1CCOC1 e7d28edc9d2998bec49a3b97f8742ef9 [0,1,0,1,0,0|1,0,0]=3 19832 B13R1.343 CC(O)CCNCCN1CCCC1 b3f4ca0893feebc6318746c83e4ae1ac [0,1,0,1,0,0|1,0,0]=3 19833 B13R1.343 CC(O)CNCCCC1CCCC1 46fbfd1478c9195a2aa522fc8da81b59 [0,1,0,1,0,0|0,0,0]=2 19834 B13R1.343 CC(O)CNCCCC1CCOC1 9b4dfc52617b28a0e2f175c54d3e0399 [0,1,0,1,0,0|1,0,0]=3 19835 B13R1.343 CC(O)CNCCCN1CCCC1 da5635fa45c1abd33c6dbe1c7e5f1acb [0,1,0,1,0,0|1,0,0]=3 19836 B13R1.343 CC(O)CNCCOC1CCCC1 2d9a23b32a504d317ad4e63224038f6f [0,1,0,1,0,0|1,0,0]=3 19837 B13R1.343 CC(O)CNCCOC1CCOC1 0d2d8717097162a104d80cc4efd52f00 [0,1,0,1,0,0|2,0,0]=4 19838 B13R1.343 CC(O)CNCCSC1CCCC1 800f86328b31f879284ec10c18eb0ecc [0,1,0,1,0,0|1,0,0]=3 19839 B13R1.343 CC(S)COCCCC1CCCC1 18beb3949a4f41a1bf92470cd96c840c [0,1,0,1,0,0|0,1,0]=3 19840 B13R1.343 CC(S)COCCCN1CCCC1 425acadc15bf6382f221aa07d9366882 [0,1,0,1,0,0|1,1,0]=4 19841 B13R1.343 CN(C)CCCCNC1CCCC1 ea54fb78d3cadba02ebf67521e148b28 [0,1,0,1,0,0|2,0,0]=4 19842 B13R1.343 CN(C)CCCCOC1CCCC1 04466e89615591e3e7de76a0c067e90f [0,1,0,1,0,0|2,0,0]=4 19843 B13R1.343 CN(C)CCCNCC1CCCC1 13032bed35a97957be5c7c7e5d2e9846 [0,1,0,1,0,0|2,0,0]=4 19844 B13R1.343 CN(C)CCCOCC1CCCC1 6c54ee801f506dbc55101b3398350c88 [0,1,0,1,0,0|2,0,0]=4 19845 B13R1.343 CN(C)CCNCCC1CCCC1 f00fa81cb2a654b5283ed34ad6b2f8fa [0,1,0,1,0,0|2,0,0]=4 19846 B13R1.343 CN(C)CCOCCC1CCCC1 defb79a5968ac48b1ddc8f63d16ec11a [0,1,0,1,0,0|2,0,0]=4 19847 B13R1.343 CN(C)CNCCCC1CCCC1 267b910a0ac6513e95b37ecaefee178d [0,1,0,1,0,0|2,0,0]=4 19848 B13R1.343 CN(C)COCCCC1CCCC1 d893bb599578329c1846ad220653aa14 [0,1,0,1,0,0|2,0,0]=4 19849 B13R1.343 CS(=O)CCCNCC1CCCC1 54013542e002688caa5aee6895843d2f [0,1,0,1,0,0|1,0,1]=4 19850 B13R1.343 CS(=O)CCNCCC1CCCC1 a602966cb4e94060bdaeb3f2f210ceb7 [0,1,0,1,0,0|1,0,1]=4 19851 B13R1.343 CS(=O)CCOCCC1CCCC1 bcc901b9b4771187f5900e722f254bfc [0,1,0,1,0,0|1,0,1]=4 19852 B13R1.343 C[C@@H](F)COCCCC1CCCC1 4d956dd833db4d1e3ce67451be0bc868 [0,1,0,1,0,0|1,0,0]=3 19853 B13R1.343 C[C@@H](F)COCCCN1CCCC1 8d6862796cc130dda6832bf6b7f6c31a [0,1,0,1,0,0|2,0,0]=4 19854 B13R1.343 C[C@@H](O)CCCCNC1CC=CC1 957a4a6fb45ca77e14f4be99efbcea41 [0,1,0,1,0,0|0,0,2]=4 19855 B13R1.343 C[C@@H](O)CCCCNC1CCCC1 7da12ec1b8ca0f410da1671ed6454034 [0,1,0,1,0,0|0,0,0]=2 19856 B13R1.343 C[C@@H](O)CCCCNC1CCOC1 d656e130634346c6bf41ff1351d4eed2 [0,1,0,1,0,0|1,0,0]=3 19857 B13R1.343 C[C@@H](O)CCCCNC1CCSC1 cc7b4bf667d173da97a0967b3e28c0ed [0,1,0,1,0,0|1,0,0]=3 19858 B13R1.343 C[C@@H](O)CCCCN[C@@H]1CCOC1 aaf2135510317e7a5c674f475f5f605f [0,1,0,1,0,0|1,0,0]=3 19859 B13R1.343 C[C@@H](O)CCCCN[C@H]1CCOC1 e227d1b9cc766c415146b79356aef1c3 [0,1,0,1,0,0|1,0,0]=3 19860 B13R1.343 C[C@@H](O)CCNCCC1CCCC1 4732b2e05e965dbc23c43954f7271c7f [0,1,0,1,0,0|0,0,0]=2 19861 B13R1.343 C[C@@H](O)CCNCCC1CCCO1 50b424276bdcd73dd53d322dac40e149 [0,1,0,1,0,0|1,0,0]=3 19862 B13R1.343 C[C@@H](O)CCNCCC1CCOC1 d4b9abd972e9dc7f969f614e6238ffee [0,1,0,1,0,0|1,0,0]=3 19863 B13R1.343 C[C@@H](O)CCNCCN1CCCC1 15080629cc45379f97d8100ba7a5235c [0,1,0,1,0,0|1,0,0]=3 19864 B13R1.343 C[C@@H](O)CNCCCC1CCCC1 27b23b27315df7d078c422a3e77aef84 [0,1,0,1,0,0|0,0,0]=2 19865 B13R1.343 C[C@@H](O)CNCCCC1CCOC1 a6795d769778bcd3959e4b864ed3d348 [0,1,0,1,0,0|1,0,0]=3 19866 B13R1.343 C[C@@H](O)CNCCCN1CCCC1 3f15587170f0a84f9ae0ee8c7bdd1013 [0,1,0,1,0,0|1,0,0]=3 19867 B13R1.343 C[C@@H](O)CNCCOC1CCCC1 3b60080d9e71043413396daeb8076cc6 [0,1,0,1,0,0|1,0,0]=3 19868 B13R1.343 C[C@@H](O)CNCCOC1CCOC1 371fc52360d8e9284e19cf48b4f2f776 [0,1,0,1,0,0|2,0,0]=4 19869 B13R1.343 C[C@@H](O)CNCCSC1CCCC1 4da7de3d1ad2182758cb1bd232104dcd [0,1,0,1,0,0|1,0,0]=3 19870 B13R1.343 C[C@H](F)COCCCC1CCCC1 7e7e22a60df8d57b0143efe1a4e26abc [0,1,0,1,0,0|1,0,0]=3 19871 B13R1.343 C[C@H](F)COCCCN1CCCC1 e8af9ce09dac2bb70ee12e018806917e [0,1,0,1,0,0|2,0,0]=4 19872 B13R1.343 C[C@H](O)CCNCCC1CCCC1 1b6fb8ccd7b8f577517e39aff939dc04 [0,1,0,1,0,0|0,0,0]=2 19873 B13R1.343 C[C@H](O)CCNCCC1CCCO1 a7905f2bb5925fd593e934733c0efb10 [0,1,0,1,0,0|1,0,0]=3 19874 B13R1.343 C[C@H](O)CCNCCC1CCOC1 1c6b219d184fac33135789b6463bbd24 [0,1,0,1,0,0|1,0,0]=3 19875 B13R1.343 C[C@H](O)CCNCCN1CCCC1 29acd2733afdd1e2b086aa5c7fa9e420 [0,1,0,1,0,0|1,0,0]=3 19876 B13R1.343 C[C@H](O)CNCCCC1CCCC1 6f4d8fb06effe2387ffc181b7b58ae91 [0,1,0,1,0,0|0,0,0]=2 19877 B13R1.343 C[C@H](O)CNCCCC1CCOC1 bd5089d7972fba4749f76ae9b46d40e3 [0,1,0,1,0,0|1,0,0]=3 19878 B13R1.343 C[C@H](O)CNCCCN1CCCC1 c53fc93b456494d9a40e52a58bd5dbba [0,1,0,1,0,0|1,0,0]=3 19879 B13R1.343 C[C@H](O)CNCCOC1CCCC1 e8717c23d04f3cc95aa276be3ccb7cb5 [0,1,0,1,0,0|1,0,0]=3 19880 B13R1.343 C[C@H](O)CNCCOC1CCOC1 da28d44fb337d3ac3bd10153278067e8 [0,1,0,1,0,0|2,0,0]=4 19881 B13R1.343 C[C@H](O)CNCCSC1CCCC1 04a9af52323fb48e71a112cd897bb3fe [0,1,0,1,0,0|1,0,0]=3 19882 B13R1.343 FC(F)CCCCNC1CCCC1 bf6b7ec1b12fd2417cc8a95b017ec9ae [0,1,0,1,0,0|2,0,0]=4 19883 B13R1.343 FC(F)CCNCCC1CCCC1 2aaabe3c841842344120ad60ef9ee1e1 [0,1,0,1,0,0|2,0,0]=4 19884 B13R1.343 FC(F)CCOCCC1CCCC1 72be568e875b9c91eb6f4de2af81c66f [0,1,0,1,0,0|2,0,0]=4 19885 B13R1.343 FC(F)CNCCCC1CCCC1 a69b7216f752ddf07c0773bd0ddae67f [0,1,0,1,0,0|2,0,0]=4 19886 B13R1.343 FC(F)COCCCC1CCCC1 354eff1baf584d3ee0dfa0e11843a755 [0,1,0,1,0,0|2,0,0]=4 19887 B13R1.343 O=C(O)CCCCNC1CCCC1 735469e0242df960af5be4dfc3a741a9 [0,1,0,1,0,0|1,0,1]=4 19888 B13R1.343 O=C(O)CCCCOC1CCCC1 1b330a71d363df41265fa673af9c1dd6 [0,1,0,1,0,0|1,0,1]=4 19889 B13R1.343 O=C(O)CCCNCC1CCCC1 ada08880c6e87950d27981a3d654282a [0,1,0,1,0,0|1,0,1]=4 19890 B13R1.343 O=C(O)CCCOCC1CCCC1 389779b85e65edeac6411413c4e1dca2 [0,1,0,1,0,0|1,0,1]=4 19891 B13R1.343 O=C(O)CCNCCC1CCCC1 b0f35ead0a958a777deb6d6737eedc10 [0,1,0,1,0,0|1,0,1]=4 19892 B13R1.343 O=C(O)CCOCCC1CCCC1 5cd1f12c4f5011b29ae61261df59757e [0,1,0,1,0,0|1,0,1]=4 19893 B13R1.343 O=C(O)CNCCCC1CCCC1 d05960260f3a30c09ba8835387922d86 [0,1,0,1,0,0|1,0,1]=4 19894 B13R1.343 O=C(O)COCCCC1CCCC1 80be45ce70b57c2dcfe5873dba5fb429 [0,1,0,1,0,0|1,0,1]=4 19895 B13R1.343 O=S(O)CCNCCC1CCCC1 1ebf777a0571c46c336d40b5d7ffc223 [0,1,0,1,0,0|2,0,0]=4 19896 B13R1.343 O=S(O)COCCCC1CCCC1 8f9548038fd604534856a8e829305b1a [0,1,0,1,0,0|2,0,0]=4 19897 B13R1.362 C#CCCCCCCN1CC(C1)O 08c4528e228d2f36cefaf895a6ebf56f [0,1,0,1,0,0|0,0,2]=4 19898 B13R1.362 C#CCCCCCNC1CC(C1)O 3f20ceb7320807556ce3bdd499c32eec [0,1,0,1,0,0|0,0,2]=4 19899 B13R1.362 C#CCCCCCN[C@H]1C[C@@H](C1)O f2f8d4551fbc96417aafe89918446c58 [0,1,0,1,0,0|0,0,2]=4 19900 B13R1.362 C#CCCCCCN[C@H]1C[C@H](C1)O 7af3ad68a0533acbc6924f304fbdecf4 [0,1,0,1,0,0|0,0,2]=4 19901 B13R1.362 C#CCCCCNCC1CC(C1)O e242f1e1f13c43972f5f0d9cf22be674 [0,1,0,1,0,0|0,0,2]=4 19902 B13R1.362 C#CCCCCNC[C@H]1C[C@@H](C1)O 080b356d2496efa05a3c75653f9a77e4 [0,1,0,1,0,0|0,0,2]=4 19903 B13R1.362 C#CCCCCNC[C@H]1C[C@H](C1)O 7abb5b781368df0577e8c6501893f3ec [0,1,0,1,0,0|0,0,2]=4 19904 B13R1.362 C/C=C\CCCNCC1CC(C1)O 55432bee8b1aa50c806a4174cf6de698 [0,1,0,1,0,0|0,0,2]=4 19905 B13R1.362 C/C=C\CCCNC[C@H]1C[C@@H](C1)O 13bb4de254021597f5de8211b33d1969 [0,1,0,1,0,0|0,0,2]=4 19906 B13R1.362 C/C=C\CCCNC[C@H]1C[C@H](C1)O 4cc45152d94f99d040f4a6ef32e067bf [0,1,0,1,0,0|0,0,2]=4 19907 B13R1.362 C=C1CC(C1)CNCCCCCC 27b55b8f66d0409c9f7a380d4fd96518 [0,1,0,1,0,0|1,0,1]=4 19908 B13R1.362 C=C1CC(C1)COCCCCCC 2cb798cae68f07743294304aa2d24367 [0,1,0,1,0,0|1,0,1]=4 19909 B13R1.362 C=CCCCCCCN1CC(C1)O 558f8abeb89e27f54c72b23d9c271d57 [0,1,0,1,0,0|0,0,2]=4 19910 B13R1.362 C=CCCCCCNC1CC(C1)O a009e12286bce9f0327c4d50300e3fe4 [0,1,0,1,0,0|0,0,2]=4 19911 B13R1.362 C=CCCCCCN[C@H]1C[C@@H](C1)O a72b5fa844291d342b1e13c264f0e2f1 [0,1,0,1,0,0|0,0,2]=4 19912 B13R1.362 C=CCCCCCN[C@H]1C[C@H](C1)O d5fdccd640831890e19e6c7cb9392bbb [0,1,0,1,0,0|0,0,2]=4 19913 B13R1.362 C=CCCCCNCC1CC(C1)O 6f8e46830dfc55d61512934f95a3d5be [0,1,0,1,0,0|0,0,2]=4 19914 B13R1.362 C=CCCCCNC[C@H]1C[C@@H](C1)O 0f22ff65fc099a0423b37b3fdf47b5d0 [0,1,0,1,0,0|0,0,2]=4 19915 B13R1.362 C=CCCCCNC[C@H]1C[C@H](C1)O 022cf8fc3408d9e0ba77faf362df51ce [0,1,0,1,0,0|0,0,2]=4 19916 B13R1.362 CC#CCCCNCC1CC(C1)O 127814de0d3f2de55c9383d8ba57ed2a [0,1,0,1,0,0|0,0,2]=4 19917 B13R1.362 CC#CCCCNC[C@H]1C[C@@H](C1)O 4c10701b60e614d7a0295e26c355b5f3 [0,1,0,1,0,0|0,0,2]=4 19918 B13R1.362 CC#CCCCNC[C@H]1C[C@H](C1)O ec1c3ef1d181ec97861651ca30a9173c [0,1,0,1,0,0|0,0,2]=4 19919 B13R1.362 CC/C=C\CCNCC1CC(C1)O e0c2c1f87aba3fde966475a3eea4700d [0,1,0,1,0,0|0,0,2]=4 19920 B13R1.362 CC/C=C\CCNC[C@H]1C[C@@H](C1)O c84a72cce4bc7d8b9a4868c283334347 [0,1,0,1,0,0|0,0,2]=4 19921 B13R1.362 CC/C=C\CCNC[C@H]1C[C@H](C1)O defd7a107c0180e94b4b82bbb7076661 [0,1,0,1,0,0|0,0,2]=4 19922 B13R1.362 CC1CC(C1)CNCCCCCCl 96e895894a99278a0e092e0038b1480e [0,1,0,1,0,0|2,0,0]=4 19923 B13R1.362 CC1CC(C1)CNCCCCCO bd8923664bb9382eda377b8522f5e119 [0,1,0,1,0,0|2,0,0]=4 19924 B13R1.362 CC1CC(C1)COCCCCCF 08e151451250cccfd27f330b53197319 [0,1,0,1,0,0|2,0,0]=4 19925 B13R1.362 CC1CC(C1)OCCCCCCF 778a9ad049791b3011b85d8d56b3ca0c [0,1,0,1,0,0|2,0,0]=4 19926 B13R1.362 CCC/C=C/CNCC1CC(C1)O 05cdce3b58d248e30b951e48d3ec149f [0,1,0,1,0,0|0,0,2]=4 19927 B13R1.362 CCC/C=C/CNC[C@H]1C[C@@H](C1)O bc86cf0556b8d4258dd6fba7cd328179 [0,1,0,1,0,0|0,0,2]=4 19928 B13R1.362 CCC/C=C/CNC[C@H]1C[C@H](C1)O 42a3212225e7d7cff8322c3518d2e56d [0,1,0,1,0,0|0,0,2]=4 19929 B13R1.362 CCC/C=C\CNCC1CC(C1)O 540de04bfca89dff42fbf4f1e29a2ded [0,1,0,1,0,0|0,0,2]=4 19930 B13R1.362 CCC/C=C\CNC[C@H]1C[C@@H](C1)O 9cf4b4e268cea6f4489b7fcbbfb79df4 [0,1,0,1,0,0|0,0,2]=4 19931 B13R1.362 CCC/C=C\CNC[C@H]1C[C@H](C1)O 580c7c607ff8680e65d75243595b3d84 [0,1,0,1,0,0|0,0,2]=4 19932 B13R1.362 CCCC/C=C/CNC1CC(C1)O 1bf56197b75f49a1795e01c3fba5a4f3 [0,1,0,1,0,0|0,0,2]=4 19933 B13R1.362 CCCC/C=C/CN[C@H]1C[C@@H](C1)O bf7308018f1b7386d1fce1a74efebfcb [0,1,0,1,0,0|0,0,2]=4 19934 B13R1.362 CCCC/C=C/CN[C@H]1C[C@H](C1)O d7c23cf3d22a9685b700c3e009cbc373 [0,1,0,1,0,0|0,0,2]=4 19935 B13R1.362 CCCC/C=C\CNC1CC(C1)O 76b4b39e4bfe5a117740518fa90efcd2 [0,1,0,1,0,0|0,0,2]=4 19936 B13R1.362 CCCC/C=C\CN[C@H]1C[C@@H](C1)O 2ecc953e5ee384dd0011343796891969 [0,1,0,1,0,0|0,0,2]=4 19937 B13R1.362 CCCC/C=C\CN[C@H]1C[C@H](C1)O 1ee6ee3cdec6fd75465e187fdedd861c [0,1,0,1,0,0|0,0,2]=4 19938 B13R1.362 CCCCCCCCN1CC(C1)F ee05a1aa39de1a5a2add059c00ca38cf [0,1,0,1,0,0|1,0,0]=3 19939 B13R1.362 CCCCCCCCN1CC(C1)O 299d311f3f092e82d77f84f108bc2aad [0,1,0,1,0,0|0,0,0]=2 19940 B13R1.362 CCCCCCCNC1CC(=O)C1 badf837d614ad7aa53a9c14566c69393 [0,1,0,1,0,0|0,0,2]=4 19941 B13R1.362 CCCCCCCNC1CC(C1)F 723b480283fc01cb285bad4d08c64b2d [0,1,0,1,0,0|1,0,0]=3 19942 B13R1.362 CCCCCCCNC1CC(C1)O 4187dc4603f81c3db53c0443f652cefc [0,1,0,1,0,0|0,0,0]=2 19943 B13R1.362 CCCCCCCNC1CN(C1)C 41f0e7fcecfc51b8154f1b412c87e5d0 [0,1,0,1,0,0|2,0,0]=4 19944 B13R1.362 CCCCCCCN[C@H]1C[C@@H](C1)F 2a614b39a9c0edfa35a0297ec38787dd [0,1,0,1,0,0|1,0,0]=3 19945 B13R1.362 CCCCCCCN[C@H]1C[C@@H](C1)O 9eceb308792a0fecb6ba057cd0915f3b [0,1,0,1,0,0|0,0,0]=2 19946 B13R1.362 CCCCCCCN[C@H]1C[C@H](C1)F af91ce8b0f14ac4f977fe15076aa37f5 [0,1,0,1,0,0|1,0,0]=3 19947 B13R1.362 CCCCCCCN[C@H]1C[C@H](C1)O 30c651cba061fc49bdbc0e4bb0f71c02 [0,1,0,1,0,0|0,0,0]=2 19948 B13R1.362 CCCCCCCOC1CC(=O)C1 e7d2adb4ec638035c896f942943293c3 [0,1,0,1,0,0|0,0,2]=4 19949 B13R1.362 CCCCCCCOC1CC(C1)C 5ab86c290162d42f73a1f5e80955b334 [0,1,0,1,0,0|1,0,0]=3 19950 B13R1.362 CCCCCCCOC1CC(C1)F a72c701e86d72b7c2b6030bd13bd1259 [0,1,0,1,0,0|1,0,0]=3 19951 B13R1.362 CCCCCCCOC1CN(C1)C f7fc12b1c01b3843f804cf15a7b28121 [0,1,0,1,0,0|2,0,0]=4 19952 B13R1.362 CCCCCCCO[C@H]1C[C@@H](C1)F 59ebbaab756169ba651ea2df581c6702 [0,1,0,1,0,0|1,0,0]=3 19953 B13R1.362 CCCCCCCO[C@H]1C[C@H](C1)F 15ec475878f806e1985a63e0315d989c [0,1,0,1,0,0|1,0,0]=3 19954 B13R1.362 CCCCCCNCC1CC(=O)C1 806cedabb061ac1712dc0d2cbc26f816 [0,1,0,1,0,0|0,0,2]=4 19955 B13R1.362 CCCCCCNCC1CC(=O)O1 510e1e89603d1aea7a4403c60683e259 [0,1,0,1,0,0|1,0,1]=4 19956 B13R1.362 CCCCCCNCC1CC(C1)C b204c3b0245b582ceb261980cd78725f [0,1,0,1,0,0|1,0,0]=3 19957 B13R1.362 CCCCCCNCC1CC(C1)O 66a6322c69bffca91ca638dd9d79148e [0,1,0,1,0,0|0,0,0]=2 19958 B13R1.362 CCCCCCNCC1CN(C1)C 674328b09616853fbffe8abe4f16a062 [0,1,0,1,0,0|2,0,0]=4 19959 B13R1.362 CCCCCCNC[C@H]1C[C@@H](C1)O 39ee9c456ee87fdb329c4850033393c1 [0,1,0,1,0,0|0,0,0]=2 19960 B13R1.362 CCCCCCNC[C@H]1C[C@H](C1)F 127041b7daa0dab672a8dd79f3763377 [0,1,0,1,0,0|1,0,0]=3 19961 B13R1.362 CCCCCCNC[C@H]1C[C@H](C1)O b973b2df692d97d4ea67384ae3c508e7 [0,1,0,1,0,0|0,0,0]=2 19962 B13R1.362 CCCCCCOCC1CC(=O)C1 457ac90e2e070097c1fde8e16216df3d [0,1,0,1,0,0|0,0,2]=4 19963 B13R1.362 CCCCCCOCC1CC(=O)O1 3b0794138c390a4fb98b9451ce4ba1f6 [0,1,0,1,0,0|1,0,1]=4 19964 B13R1.362 CCCCCCOCC1CC(C1)C c0dba57fb9e3a4de50d805843ffafd85 [0,1,0,1,0,0|1,0,0]=3 19965 B13R1.362 CCCCCCOCC1CC(C1)F b373a6e857a9e4fcd96967ebb0800b9c [0,1,0,1,0,0|1,0,0]=3 19966 B13R1.362 CCCCCCOCC1CN(C1)C b776fe87a20db063b0e8d06de6a3a80d [0,1,0,1,0,0|2,0,0]=4 19967 B13R1.362 CCCCCCOC[C@H]1C[C@@H](C1)C 0d109a45781b6a5e62bb5492c8044f67 [0,1,0,1,0,0|1,0,0]=3 19968 B13R1.362 CCCCCCOC[C@H]1C[C@H](C1)F cb70c5e4d125ce92b31fcda87f1d5d1b [0,1,0,1,0,0|1,0,0]=3 19969 B13R1.362 CCCCCNCCC1CN(C1)C 2c05aa3050651b3a4dfce162565bca4c [0,1,0,1,0,0|2,0,0]=4 19970 B13R1.362 CCCCCNCCN1CC(C1)F c44563b12c357e924f465ad30e8bec0e [0,1,0,1,0,0|2,0,0]=4 19971 B13R1.362 CCCCCNCCN1CC(C1)O 9dea76670623ef439c1e3817df62498b [0,1,0,1,0,0|1,0,0]=3 19972 B13R1.362 CCCCCOCCC1CN(C1)C 96a85289a01280eae49535fe04d4e324 [0,1,0,1,0,0|2,0,0]=4 19973 B13R1.362 CCCCCOCCN1CC(C1)F a3780c1926608f74de7da3c72aaebbb8 [0,1,0,1,0,0|2,0,0]=4 19974 B13R1.362 CCCCNCCCN1CC(C1)O 9571ec6805579a80175d0511d11ae5aa [0,1,0,1,0,0|1,0,0]=3 19975 B13R1.362 CCCCOCCNC1CC(C1)F 2f1ca95bf6dee1839d329756cb1bc516 [0,1,0,1,0,0|2,0,0]=4 19976 B13R1.362 CCCCOCCNC1CC(C1)O 5a3ee9d1e4651d0cc0d85289b4a5fee9 [0,1,0,1,0,0|1,0,0]=3 19977 B13R1.362 CCCCOCCN[C@H]1C[C@@H](C1)F edd38020d46233e95101a8d3d591a7a6 [0,1,0,1,0,0|2,0,0]=4 19978 B13R1.362 CCCCOCCN[C@H]1C[C@@H](C1)O 3d610a9f593213a122935ddea4839706 [0,1,0,1,0,0|1,0,0]=3 19979 B13R1.362 CCCCOCCN[C@H]1C[C@H](C1)F 8d03e30f2adb7e70d47f1503152b68b3 [0,1,0,1,0,0|2,0,0]=4 19980 B13R1.362 CCCCOCCN[C@H]1C[C@H](C1)O efd15531b9efa433ca7a914af0b85bd7 [0,1,0,1,0,0|1,0,0]=3 19981 B13R1.362 CCCCOCCOC1CC(C1)C 876cb8823291903a2b2ab52d32d5071a [0,1,0,1,0,0|2,0,0]=4 19982 B13R1.362 CCCCOCCOC1CC(C1)F 5ce660d519b1189f9e780511a727d414 [0,1,0,1,0,0|2,0,0]=4 19983 B13R1.362 CCCCOCCO[C@H]1C[C@@H](C1)F 0342733573064373b45db4284fa8b6a6 [0,1,0,1,0,0|2,0,0]=4 19984 B13R1.362 CCCCOCCO[C@H]1C[C@H](C1)F b721fb0052550df5c2ce410d7c30dd8e [0,1,0,1,0,0|2,0,0]=4 19985 B13R1.362 CCCCOCNCC1CC(C1)O 22e15a39fcd1e4c084a5bee581313865 [0,1,0,1,0,0|1,0,0]=3 19986 B13R1.362 CCCCOCNC[C@H]1C[C@@H](C1)O 9039f9d5b8c6cdbfb0f7961d7a128f8c [0,1,0,1,0,0|1,0,0]=3 19987 B13R1.362 CCCCOCNC[C@H]1C[C@H](C1)O ae9c14d28e922cfaed8da48aff43faaf [0,1,0,1,0,0|1,0,0]=3 19988 B13R1.362 CCCCOCOCC1CC(C1)C a028e22335c6e63e3e5c7c443ce62fe0 [0,1,0,1,0,0|2,0,0]=4 19989 B13R1.362 CCCCOCOCC1CC(C1)F 3b2ab33e16894091dd7517b4ffe455b7 [0,1,0,1,0,0|2,0,0]=4 19990 B13R1.362 CCCCOCOC[C@H]1C[C@@H](C1)C e71a6ab51fc2168e59700476130293ed [0,1,0,1,0,0|2,0,0]=4 19991 B13R1.362 CCCOCCCNC1CC(C1)F bb3ec41f2470edbb2af95abe43a9ccfc [0,1,0,1,0,0|2,0,0]=4 19992 B13R1.362 CCCOCCCNC1CC(C1)O c8d09ab1e2cf238073de700f9267dbf5 [0,1,0,1,0,0|1,0,0]=3 19993 B13R1.362 CCCOCCCN[C@H]1C[C@@H](C1)F 99c3247300eb7b5b584be2cf85156380 [0,1,0,1,0,0|2,0,0]=4 19994 B13R1.362 CCCOCCCN[C@H]1C[C@@H](C1)O 874dbe9957026bfe243b6f908602700d [0,1,0,1,0,0|1,0,0]=3 19995 B13R1.362 CCCOCCCN[C@H]1C[C@H](C1)F f5849a5df3778ed792925c0a08551a92 [0,1,0,1,0,0|2,0,0]=4 19996 B13R1.362 CCCOCCCN[C@H]1C[C@H](C1)O dbe39bce808b817e91c69d29888cb437 [0,1,0,1,0,0|1,0,0]=3 19997 B13R1.362 CCCOCCCOC1CC(C1)C 14764b8d54f4ff616c1d0ed707eec2ba [0,1,0,1,0,0|2,0,0]=4 19998 B13R1.362 CCCOCCCOC1CC(C1)F 4cc81fff392d5a7e2cb1b5d53366c4d1 [0,1,0,1,0,0|2,0,0]=4 19999 B13R1.362 CCCOCCCO[C@H]1C[C@@H](C1)F a1baccc70660aaad2569ed1bf3765974 [0,1,0,1,0,0|2,0,0]=4 20000 B13R1.362 CCCOCCCO[C@H]1C[C@H](C1)F 2d1c5904d0497836743b8169d27981be [0,1,0,1,0,0|2,0,0]=4 20001 B13R1.362 CCCOCCNCC1CC(C1)C 5aa26c6f47134253f11491ede5ca976c [0,1,0,1,0,0|2,0,0]=4 20002 B13R1.362 CCCOCCNCC1CC(C1)O 0087826d57996a5872fddd0bfa553a23 [0,1,0,1,0,0|1,0,0]=3 20003 B13R1.362 CCCOCCNC[C@H]1C[C@@H](C1)O 54826952f4241b5a8809bb713e942b09 [0,1,0,1,0,0|1,0,0]=3 20004 B13R1.362 CCCOCCNC[C@H]1C[C@H](C1)F 20eee86b82df48ed9b95aaf03403305e [0,1,0,1,0,0|2,0,0]=4 20005 B13R1.362 CCCOCCNC[C@H]1C[C@H](C1)O d22d780629a85529584d1c79acfea989 [0,1,0,1,0,0|1,0,0]=3 20006 B13R1.362 CCCOCCOCC1CC(C1)C 06b7e8064009b31519166a151ae18cb0 [0,1,0,1,0,0|2,0,0]=4 20007 B13R1.362 CCCOCCOCC1CC(C1)F dd55370b3030cc391a9ab5e674f31a24 [0,1,0,1,0,0|2,0,0]=4 20008 B13R1.362 CCCOCCOC[C@H]1C[C@@H](C1)C e3c93c53dce01fbe8b7840ba16197ef9 [0,1,0,1,0,0|2,0,0]=4 20009 B13R1.362 CCCOCCOC[C@H]1C[C@H](C1)F 81c58d53a364475d22c76522ae129c2a [0,1,0,1,0,0|2,0,0]=4 20010 B13R1.362 CCCSCCOCC1CC(C1)C 5a3aee4d9f0897eeebf802eaf74ec26f [0,1,0,1,0,0|2,0,0]=4 20011 B13R1.362 CCCSCCOC[C@H]1C[C@H](C1)F e5514bbfb9e03e843d7b25fabea98935 [0,1,0,1,0,0|2,0,0]=4 20012 B13R1.362 CCOCCCNCC1CC(C1)C 28d9592b09f4dc924abc3ff60acc09ec [0,1,0,1,0,0|2,0,0]=4 20013 B13R1.362 CCOCCCNCC1CC(C1)O fb2765f5fab8fb7165eb5a2839196420 [0,1,0,1,0,0|1,0,0]=3 20014 B13R1.362 CCOCCCNC[C@H]1C[C@@H](C1)O cb832df67bbfde8893e9ec72a1b62180 [0,1,0,1,0,0|1,0,0]=3 20015 B13R1.362 CCOCCCNC[C@H]1C[C@H](C1)F bbd07334852da3ac8c2a214e102779cd [0,1,0,1,0,0|2,0,0]=4 20016 B13R1.362 CCOCCCNC[C@H]1C[C@H](C1)O cd945a63c77ed9638470b509f1347451 [0,1,0,1,0,0|1,0,0]=3 20017 B13R1.362 CCOCCCOCC1CC(C1)C 75fed5f4bb52b085677be2ce065f0a42 [0,1,0,1,0,0|2,0,0]=4 20018 B13R1.362 CCOCCCOCC1CC(C1)F 54014ba33496e210ad1eddc263aabbae [0,1,0,1,0,0|2,0,0]=4 20019 B13R1.362 CCOCCCOC[C@H]1C[C@@H](C1)C ab9e0a686cec7bff2bdc0642c7c9d2c2 [0,1,0,1,0,0|2,0,0]=4 20020 B13R1.362 CCOCCCOC[C@H]1C[C@H](C1)F 8738988d637ab13caea50a866c508d6a [0,1,0,1,0,0|2,0,0]=4 20021 B13R1.362 CCOCCNCCN1CC(C1)O ce3a6a910c52c572b3ffb0f0014b0c9c [0,1,0,1,0,0|2,0,0]=4 20022 B13R1.362 CCOCCOCCN1CC(C1)O b6ba781ae70bb2c682c33452c0f79f9c [0,1,0,1,0,0|2,0,0]=4 20023 B13R1.362 CCOCNCCCN1CC(C1)O bdee145916fd84aa55367e4aa0ca4145 [0,1,0,1,0,0|2,0,0]=4 20024 B13R1.362 CCSCCCCNC1CC(C1)O fc2952ae70317896ea70311dcc23f11d [0,1,0,1,0,0|1,0,0]=3 20025 B13R1.362 CCSCCCNCC1CC(C1)O 3f1e428b2f29e615efecfaca967be731 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20047 B13R1.362 COCCCCNC[C@H]1C[C@@H](C1)O 0493a78f1254735a4fb32a15d08426fc [0,1,0,1,0,0|1,0,0]=3 20048 B13R1.362 COCCCCNC[C@H]1C[C@H](C1)F c3cef77ff73f11a8139f50f544f92e2d [0,1,0,1,0,0|2,0,0]=4 20049 B13R1.362 COCCCCNC[C@H]1C[C@H](C1)O 861b713ebdabf38e6711639b062d472c [0,1,0,1,0,0|1,0,0]=3 20050 B13R1.362 COCCCCOCC1CC(C1)C 49c03a70915c0147950bc0fa2dd86ad2 [0,1,0,1,0,0|2,0,0]=4 20051 B13R1.362 COCCCCOCC1CC(C1)F 47a9b1467a150cce1543778bccb75d37 [0,1,0,1,0,0|2,0,0]=4 20052 B13R1.362 COCCCCOC[C@H]1C[C@@H](C1)C 19872bb2de4af8fb8b568ab5ad4e93c7 [0,1,0,1,0,0|2,0,0]=4 20053 B13R1.362 COCCCCOC[C@H]1C[C@H](C1)F 349c4c17d8618619ac39a6f96b9fc476 [0,1,0,1,0,0|2,0,0]=4 20054 B13R1.362 COCCCNCCN1CC(C1)O e1f5946bfa62747bbc9081185be355e5 [0,1,0,1,0,0|2,0,0]=4 20055 B13R1.362 COCCNCCCN1CC(C1)O 3851fff6b294160511a89776099fe546 [0,1,0,1,0,0|2,0,0]=4 20056 B13R1.362 COCCOCCCN1CC(C1)O 98636a801440357b7add3e3db0218a82 [0,1,0,1,0,0|2,0,0]=4 20057 B13R1.362 COCCOCCNC1CC(C1)O a51c21aaec23fa460314c6b5d4c82719 [0,1,0,1,0,0|2,0,0]=4 20058 B13R1.362 COCCOCCN[C@H]1C[C@@H](C1)O 0c64d2eec8030d813b200b210bf170ff [0,1,0,1,0,0|2,0,0]=4 20059 B13R1.362 COCCOCCN[C@H]1C[C@H](C1)O 6e0b8465ef555a5c5be3f37f541e5a5e [0,1,0,1,0,0|2,0,0]=4 20060 B13R1.362 COCCOCNCC1CC(C1)O f15ec5b8f8e5cf2c976e76d2ccb70d7e [0,1,0,1,0,0|2,0,0]=4 20061 B13R1.362 COCCOCNC[C@H]1C[C@@H](C1)O 8d646c3f8e8db0c15435538bb07c576f [0,1,0,1,0,0|2,0,0]=4 20062 B13R1.362 COCCOCNC[C@H]1C[C@H](C1)O b68e84f5738a2c2bc50d1c2be9996371 [0,1,0,1,0,0|2,0,0]=4 20063 B13R1.362 COCOCCNCC1CC(C1)O 67de41afd3f8b77d8af6cc7d9e8dcab8 [0,1,0,1,0,0|2,0,0]=4 20064 B13R1.362 COCOCCNC[C@H]1C[C@@H](C1)O 6584af13ec4d2166a1f6e195e780e7a2 [0,1,0,1,0,0|2,0,0]=4 20065 B13R1.362 COCOCCNC[C@H]1C[C@H](C1)O 733438377aa44d2e19f94476c5f413fb [0,1,0,1,0,0|2,0,0]=4 20066 B13R1.362 CSCCCCNCC1CC(C1)C 87e71b9646491c25ffffb70a1944acbf [0,1,0,1,0,0|2,0,0]=4 20067 B13R1.362 CSCCCCNCC1CC(C1)O f32c751a6466772e3fb30b49b52c8951 [0,1,0,1,0,0|1,0,0]=3 20068 B13R1.362 CSCCCCNC[C@H]1C[C@H](C1)F b42f43e6650ecb7c1141bf363db88324 [0,1,0,1,0,0|2,0,0]=4 20069 B13R1.362 CSCCCCOCC1CC(C1)C 5f0769d0d43f86e07f11166c7af24651 [0,1,0,1,0,0|2,0,0]=4 20070 B13R1.362 CSCCCCOC[C@H]1C[C@H](C1)F b019c43f85ebe00792c5bc58b8997ea9 [0,1,0,1,0,0|2,0,0]=4 20071 B13R1.362 CSCCCNCCN1CC(C1)O df1352e766c5cb8fd74c5027c35e9ed0 [0,1,0,1,0,0|2,0,0]=4 20072 B13R1.362 CSCCNCCCN1CC(C1)O 40c997f3334d3667ce0ad8466db9c6cf [0,1,0,1,0,0|2,0,0]=4 20073 B13R1.362 C[C@H]1C[C@@H](C1)COCCCCCF a4399393641ceebcd0e549d4e44bc51c [0,1,0,1,0,0|2,0,0]=4 20074 B13R1.362 FCCCCCCNC1CC(C1)F 9cdf262a6046eb88c991a471c938ef90 [0,1,0,1,0,0|2,0,0]=4 20075 B13R1.362 FCCCCCCN[C@H]1C[C@@H](C1)F 4cb18b236260d00292a16cb316f4be76 [0,1,0,1,0,0|2,0,0]=4 20076 B13R1.362 FCCCCCCN[C@H]1C[C@H](C1)F 2a007395dc3c7282e2eb8b0ec3614db8 [0,1,0,1,0,0|2,0,0]=4 20077 B13R1.362 FCCCCCCOC1CC(C1)F e44aaf8acdc87b1460b3d30455b06907 [0,1,0,1,0,0|2,0,0]=4 20078 B13R1.362 FCCCCCCO[C@H]1C[C@@H](C1)F 0512ee270e9b046bf83e01c664df3247 [0,1,0,1,0,0|2,0,0]=4 20079 B13R1.362 FCCCCCCO[C@H]1C[C@H](C1)F 3c80ea9febdf4c1cc3055497daca6cbe [0,1,0,1,0,0|2,0,0]=4 20080 B13R1.362 FCCCCCOCC1CC(C1)F 7d36308a8f0e8f64d963b8bf0b56b954 [0,1,0,1,0,0|2,0,0]=4 20081 B13R1.362 F[C@H]1C[C@H](C1)CNCCCCCCl 833dbb1273b67b42be6e53eb8af9e84c [0,1,0,1,0,0|2,0,0]=4 20082 B13R1.362 N#CCCCCCCN1CC(C1)O 9c953b4a85bbe83520f876bbf6209285 [0,1,0,1,0,0|1,0,1]=4 20083 B13R1.362 N#CCCCCCNC1CC(C1)O e939c94b8ff2fd3c2d194615361abeb5 [0,1,0,1,0,0|1,0,1]=4 20084 B13R1.362 N#CCCCCCN[C@H]1C[C@@H](C1)O 716c52aabc9ec5846597765a033d0851 [0,1,0,1,0,0|1,0,1]=4 20085 B13R1.362 N#CCCCCCN[C@H]1C[C@H](C1)O 32d856a54236fb13abbfeed66ac6fc1b [0,1,0,1,0,0|1,0,1]=4 20086 B13R1.362 N#CCCCCNCC1CC(C1)O 9004f95eeec2622a09ef9d52dada7f0a [0,1,0,1,0,0|1,0,1]=4 20087 B13R1.362 N#CCCCCNC[C@H]1C[C@@H](C1)O dd52066dec564b76f81e1c7f955d621f [0,1,0,1,0,0|1,0,1]=4 20088 B13R1.362 N#CCCCCNC[C@H]1C[C@H](C1)O f4d6987deb9f68d41a76d726273daf71 [0,1,0,1,0,0|1,0,1]=4 20089 B13R1.362 NOCCCCNCC1CC(C1)O a2859b2d589d920048a5ecd6719274a8 [0,1,0,1,0,0|2,0,0]=4 20090 B13R1.362 NOCCCCNC[C@H]1C[C@@H](C1)O a25f9500b61fa5b7fe8094482a0adcfe [0,1,0,1,0,0|2,0,0]=4 20091 B13R1.362 NOCCCCNC[C@H]1C[C@H](C1)O 0d9f383675741cab6bebe815ea6f5518 [0,1,0,1,0,0|2,0,0]=4 20092 B13R1.362 O=CCCCCCCN1CC(C1)O a0494df6f1df5f624c6ea9b24afc5af8 [0,1,0,1,0,0|1,0,1]=4 20093 B13R1.362 O=CCCCCCNC1CC(C1)O 04c1db54e725ef572363c162c99e8c50 [0,1,0,1,0,0|1,0,1]=4 20094 B13R1.362 O=CCCCCCN[C@H]1C[C@@H](C1)O c34ebd4b7caa76817d4e18311e90cf5d [0,1,0,1,0,0|1,0,1]=4 20095 B13R1.362 O=CCCCCCN[C@H]1C[C@H](C1)O 292ed62b5f70da3b0c10573bb48f8c72 [0,1,0,1,0,0|1,0,1]=4 20096 B13R1.362 O=CCCCCNCC1CC(C1)O 6802ed7b9fc14d419996855cb7fe6554 [0,1,0,1,0,0|1,0,1]=4 20097 B13R1.362 O=CCCCCNC[C@H]1C[C@@H](C1)O 2258f21051de054c0973b9008b605dd9 [0,1,0,1,0,0|1,0,1]=4 20098 B13R1.362 O=CCCCCNC[C@H]1C[C@H](C1)O 44b7bb80c33c0be191b95c18e8c70e13 [0,1,0,1,0,0|1,0,1]=4 20099 B13R1.362 OC1CC(C1)CNCCCCCCl 2f9f61fb21fc4f658d3cf42d154830af [0,1,0,1,0,0|1,0,0]=3 20100 B13R1.362 OC1CC(C1)CNCCCCCF 6ae5851d359e3eba1955ae912769d389 [0,1,0,1,0,0|1,0,0]=3 20101 B13R1.362 OC1CC(C1)CNCCOCCS 0b3d31bb51c85809ebdde8d13ac51d37 [0,1,0,1,0,0|2,0,0]=4 20102 B13R1.362 OC1CC(C1)NCCCCCCCl ae3b82379bee7971fa8ca40503cc2508 [0,1,0,1,0,0|1,0,0]=3 20103 B13R1.362 OC1CC(C1)NCCCCCCF 08d0aeffaf4e57a4764fc2fa6bc20d91 [0,1,0,1,0,0|1,0,0]=3 20104 B13R1.362 OC1CN(C1)CCCNCCCF 96cb682a862f0de5e721ef2c0b572e68 [0,1,0,1,0,0|2,0,0]=4 20105 B13R1.362 OC1CN(C1)CCCNCCCS 154c7c69092b1307bdad35cd4b1f10a5 [0,1,0,1,0,0|2,0,0]=4 20106 B13R1.362 OC1CN(C1)CCNCCCCF e4a63d668501c4ac1e7566a542e6f967 [0,1,0,1,0,0|2,0,0]=4 20107 B13R1.362 OCCCCCCCN1CC(C1)F fcaaeb8623a155f44ee7c55ab239be1c [0,1,0,1,0,0|2,0,0]=4 20108 B13R1.362 OCCCCCCCN1CC(C1)O b5af28f2e484c90997465e9438cc95a3 [0,1,0,1,0,0|1,0,0]=3 20109 B13R1.362 OCCCCCCNC1CC(C1)F 18f39ce0d0ec6a3cb037bc185ce33838 [0,1,0,1,0,0|2,0,0]=4 20110 B13R1.362 OCCCCCCNC1CC(C1)O 9ff995281b5d3b147af92022197add24 [0,1,0,1,0,0|1,0,0]=3 20111 B13R1.362 OCCCCCCN[C@H]1C[C@@H](C1)F 9e3b40e7dd669ea6e17bfd5a48fa94ff [0,1,0,1,0,0|2,0,0]=4 20112 B13R1.362 OCCCCCCN[C@H]1C[C@@H](C1)O 5a9185a2ad1c457b8e321773b5529d7b [0,1,0,1,0,0|1,0,0]=3 20113 B13R1.362 OCCCCCCN[C@H]1C[C@H](C1)F fbdd2287780bac1d314ab996c2b94793 [0,1,0,1,0,0|2,0,0]=4 20114 B13R1.362 OCCCCCCN[C@H]1C[C@H](C1)O c2bfae292fd22a04278431f8c33e3cdf [0,1,0,1,0,0|1,0,0]=3 20115 B13R1.362 OCCCCCNCC1CC(C1)O ac48d7187272a140f3f425523ec6345c [0,1,0,1,0,0|1,0,0]=3 20116 B13R1.362 OCCCCCNC[C@H]1C[C@@H](C1)O c395efeb28e24f0c890d813dea6be9a0 [0,1,0,1,0,0|1,0,0]=3 20117 B13R1.362 OCCCCCNC[C@H]1C[C@H](C1)F 272265c697ed014d3e4a8f17b5ae5d6e [0,1,0,1,0,0|2,0,0]=4 20118 B13R1.362 OCCCCCNC[C@H]1C[C@H](C1)O 3e82955abba6cef8d5e6a1738089a2cd [0,1,0,1,0,0|1,0,0]=3 20119 B13R1.362 OCCCCNCCN1CC(C1)O 73fa27e0b0066598a172c4cbd53a43c2 [0,1,0,1,0,0|2,0,0]=4 20120 B13R1.362 OCCCNCCCN1CC(C1)O a9e025e9d696478388f4162897692284 [0,1,0,1,0,0|2,0,0]=4 20121 B13R1.362 OCCCOCCCN1CC(C1)O c20a6a208923b262ddb9ef30f9caf1a4 [0,1,0,1,0,0|2,0,0]=4 20122 B13R1.362 OCCOCCCNC1CC(C1)O 24cc875a6d5d0614fce5c8948325bccb [0,1,0,1,0,0|2,0,0]=4 20123 B13R1.362 OCCOCCNCC1CC(C1)O a762871742428ba5449b2ca00d85df89 [0,1,0,1,0,0|2,0,0]=4 20124 B13R1.362 OCCOCCNC[C@H]1C[C@@H](C1)O d35a72f64b6ff9b504b70bf358f62ed9 [0,1,0,1,0,0|2,0,0]=4 20125 B13R1.362 OCCOCCNC[C@H]1C[C@H](C1)O c8a946e940f14f26c8f71f52c89da5d5 [0,1,0,1,0,0|2,0,0]=4 20126 B13R1.362 OCCSCCNCC1CC(C1)O 3d8aced9dd9fb0cca85bcbd8aa46de15 [0,1,0,1,0,0|2,0,0]=4 20127 B13R1.362 O[C@H]1C[C@@H](C1)CNCCCCCF f09e912920103b61a59f4847ce482a4d [0,1,0,1,0,0|1,0,0]=3 20128 B13R1.362 O[C@H]1C[C@@H](C1)NCCCCCCF 7b9c044299defd69c2a59662a6cd2314 [0,1,0,1,0,0|1,0,0]=3 20129 B13R1.362 O[C@H]1C[C@H](C1)CNCCCCCF 8ddca86706811fa6a53bece79940afec [0,1,0,1,0,0|1,0,0]=3 20130 B13R1.362 O[C@H]1C[C@H](C1)NCCCCCCF 3c422c1843be08d1f47d37ad93ffd856 [0,1,0,1,0,0|1,0,0]=3 20131 B13R1.380 CC(C)CN1CCCCC1CCCl 21c8477aafa05756ad489afce3cd0f1a [0,1,0,1,0,0|2,0,0]=4 20132 B13R1.380 CC(C)CN1CCCCC1CCO 0529cb30adb8b361e6f5c83babde0cb0 [0,1,0,1,0,0|2,0,0]=4 20133 B13R1.380 CC(C)CN1CCCC[C@@H]1CCO f1e2658f17885f844c9623ec9a5e63bf [0,1,0,1,0,0|2,0,0]=4 20134 B13R1.380 CC(C)CN1CCCC[C@H]1CCO 3b6b4587f3752f2ee9e693a86127e3c1 [0,1,0,1,0,0|2,0,0]=4 20135 B13R1.380 CC(O)CN1CCCCC1CC#N 684eb9d11c83d0e940498fee1826b851 [0,1,0,1,0,0|1,0,1]=4 20136 B13R1.380 CC(O)CN1CCCCC1CCCl 74147e0a1748d034bf7999d090e47ebe [0,1,0,1,0,0|1,0,0]=3 20137 B13R1.380 CC(O)CN1CCCCC1CCO b8289ed2a65eb924c50462ca6675f458 [0,1,0,1,0,0|1,0,0]=3 20138 B13R1.380 CC(O)CN1CCCC[C@@H]1CCO c918b2e5392acf856352fd68c8003151 [0,1,0,1,0,0|1,0,0]=3 20139 B13R1.380 CC(O)CN1CCCC[C@H]1CCO 9a52b7d934b8e94314e58f6a7cbfc6ce [0,1,0,1,0,0|1,0,0]=3 20140 B13R1.380 CCCC1CCCCC1OC(C)C ac04ca3fb0c38308ad5fee5ba764d623 [0,1,0,1,0,0|1,0,0]=3 20141 B13R1.380 CCCC1COCCN1CC(C)C 218312c548ddbd590504fdf9c2b015c5 [0,1,0,1,0,0|2,0,0]=4 20142 B13R1.380 CCCC1COCCN1CC(C)O d4bd71e565e8c5f3af14bbc86dd66d1c [0,1,0,1,0,0|1,0,0]=3 20143 B13R1.380 CCCC1COCCN1C[C@@H](C)O 5c98144d93d0d4aaa119a5406219d467 [0,1,0,1,0,0|1,0,0]=3 20144 B13R1.380 CCCC1COCCN1C[C@H](C)O fc97ba1ce4b93443a0cd03a5886047d0 [0,1,0,1,0,0|1,0,0]=3 20145 B13R1.380 CCCN1CCCCC1CC(=O)O a2af3532eea15f8fcb0d76a12e2664f9 [0,1,0,1,0,0|1,0,1]=4 20146 B13R1.380 CCCN1CCCCC1CN(C)C b426bafde64682175f7ab4d3ec3b1604 [0,1,0,1,0,0|2,0,0]=4 20147 B13R1.380 CCCN1CCCC[C@H]1CC(=O)O 5d778f9ac6c8ecb4df13a7fcba65d3fc [0,1,0,1,0,0|1,0,1]=4 20148 B13R1.380 CCCN1CCOCC1CC(C)C 3b69e9eed928862ff2ef2ce6db7748d0 [0,1,0,1,0,0|2,0,0]=4 20149 B13R1.380 CCCN1CCOC[C@@H]1CC(C)C 421d3b3deed7959b39011db1d2dd53b8 [0,1,0,1,0,0|2,0,0]=4 20150 B13R1.380 CCCN1CCOC[C@H]1CC(C)C d0ae6716540b999dfda1b6fac548a099 [0,1,0,1,0,0|2,0,0]=4 20151 B13R1.380 COCC1CCCCN1CC(C)C 6a5f7d6b6a9a258e8f6b4f6e360e1b5f [0,1,0,1,0,0|2,0,0]=4 20152 B13R1.380 COCC1CCCCN1CC(C)O 7409557410f5ea5fc4fc95746d88c52c [0,1,0,1,0,0|1,0,0]=3 20153 B13R1.380 COCC1CCCCN1C[C@@H](C)O c388dec6e866518212ea32c33768027f [0,1,0,1,0,0|1,0,0]=3 20154 B13R1.380 COCC1CCCCN1C[C@H](C)O 2c0118d367ecec7cb54bcca8e1550dc1 [0,1,0,1,0,0|1,0,0]=3 20155 B13R1.380 COC[C@@H]1COCCN1CC(C)O 5e81e32a5e30deb43fd76c44a268d77b [0,1,0,1,0,0|2,0,0]=4 20156 B13R1.380 COC[C@@H]1COCCN1C[C@@H](C)O 146c31e467fdcc0971d527c4b04e8c23 [0,1,0,1,0,0|2,0,0]=4 20157 B13R1.380 COC[C@@H]1COCCN1C[C@H](C)O 3022fd81e0aae8847f59e8317fd369ab [0,1,0,1,0,0|2,0,0]=4 20158 B13R1.380 COC[C@H]1COCCN1CC(C)O ef7da79343c67a9b637bdc828eb60596 [0,1,0,1,0,0|2,0,0]=4 20159 B13R1.380 COC[C@H]1COCCN1C[C@@H](C)O 8c29f797057aa4bb8188181fbbb6cd4f [0,1,0,1,0,0|2,0,0]=4 20160 B13R1.380 COC[C@H]1COCCN1C[C@H](C)O 89d2ab0942f20cc861fc7cca5a22cb4c [0,1,0,1,0,0|2,0,0]=4 20161 B13R1.380 C[C@@H](O)CN1CCCCC1CC#N 98971a9ac4681500806e5161ac10604f [0,1,0,1,0,0|1,0,1]=4 20162 B13R1.380 C[C@@H](O)CN1CCCCC1CCCl 4cf4e2b81f3e1b75f1500a6ecb5d4029 [0,1,0,1,0,0|1,0,0]=3 20163 B13R1.380 C[C@@H](O)CN1CCCCC1CCO b2b532e4f6ac836301f06acbdd66b95f [0,1,0,1,0,0|1,0,0]=3 20164 B13R1.380 C[C@@H](O)CN1CCCC[C@@H]1CCO 9d9fb31c84d4dc2393e50fc75e03ff3b [0,1,0,1,0,0|1,0,0]=3 20165 B13R1.380 C[C@@H](O)CN1CCCC[C@H]1CCO 624475ed0e7522a6b3f0d299b02090e1 [0,1,0,1,0,0|1,0,0]=3 20166 B13R1.380 C[C@H](O)CN1CCCCC1CC#N f0827bcda2af9964e3c23ef3c858a111 [0,1,0,1,0,0|1,0,1]=4 20167 B13R1.380 C[C@H](O)CN1CCCCC1CCCl 56fd5e10496472ff8b4ed718afd354a9 [0,1,0,1,0,0|1,0,0]=3 20168 B13R1.380 C[C@H](O)CN1CCCCC1CCO 209e5502e40a822033a57cc22ce8e50c [0,1,0,1,0,0|1,0,0]=3 20169 B13R1.380 C[C@H](O)CN1CCCC[C@@H]1CCO 010a0dd01a8b32353b70c973f15fd7b0 [0,1,0,1,0,0|1,0,0]=3 20170 B13R1.380 C[C@H](O)CN1CCCC[C@H]1CCO 9b7fb88bad9214d9c5c05bc3ee55dfcf [0,1,0,1,0,0|1,0,0]=3 20171 B13R1.392 CC(C)CCN1CCCC1CCO cc12907d7c22cef6d48ea44881cb494e [0,1,0,1,0,0|2,0,0]=4 20172 B13R1.392 CC(C)CCN1CCC[C@@H]1CCO 89865e8c0f8ddab3793c0549e12f91ed [0,1,0,1,0,0|2,0,0]=4 20173 B13R1.392 CC(O)CCN1CCCC1CCO dd3809663e9fbda1a2727c3380cea691 [0,1,0,1,0,0|1,0,0]=3 20174 B13R1.392 CC(O)CCN1CCC[C@@H]1CCO 272b17d2a58869ffa4a7dee812624cd7 [0,1,0,1,0,0|1,0,0]=3 20175 B13R1.392 CCCC1C=CCN1CCC(C)O f82579c6bb3610018bfe67c819691abd [0,1,0,1,0,0|0,0,2]=4 20176 B13R1.392 CCCC1SCCN1CCC(C)C ccee60770708a726289d75b0d9533711 [0,1,0,1,0,0|2,0,0]=4 20177 B13R1.392 CCCC1SCCN1CCC(C)O 6ee2a9513eda3b43fe25af6b102ed134 [0,1,0,1,0,0|1,0,0]=3 20178 B13R1.392 COCC1CCCN1CCC(C)C 7f5727b5572734ad30b1e23e68caee6f [0,1,0,1,0,0|2,0,0]=4 20179 B13R1.392 COCC1CCCN1CCC(C)O 7466d1193c4bf4bc9e1cd23ae931b4e8 [0,1,0,1,0,0|1,0,0]=3 20180 B13R1.392 COC[C@@H]1CCCN1CCC(C)C cefe0187b3a4807411872b1b901d5370 [0,1,0,1,0,0|2,0,0]=4 20181 B13R1.392 COC[C@@H]1CCCN1CCC(C)O 0713d7c7ccbbb2902577d8023254e485 [0,1,0,1,0,0|1,0,0]=3 20182 B13R1.392 COC[C@@H]1CCC[C@@H]1NCC(C)C 21b8bbd531decdd7874d67b04519d8be [0,1,0,1,0,0|2,0,0]=4 20183 B13R1.392 COC[C@@H]1CCC[C@@H]1NCC(C)O bfa9020529d8c06683384df154874294 [0,1,0,1,0,0|1,0,0]=3 20184 B13R1.392 COC[C@@H]1CCC[C@@H]1NC[C@@H](C)O d4a037fe256cb135623eb3d6ea91d14a [0,1,0,1,0,0|1,0,0]=3 20185 B13R1.392 COC[C@@H]1CCC[C@@H]1NC[C@H](C)O 02988a90b21faa95671c0d4c549a86d7 [0,1,0,1,0,0|1,0,0]=3 20186 B13R1.392 COC[C@H]1CCCN1CCC(C)C 6b08d9fcd5b9023126f3d0508844b31d [0,1,0,1,0,0|2,0,0]=4 20187 B13R1.392 COC[C@H]1CCCN1CCC(C)O 388b34ea93e60c453ea6f17e2037384d [0,1,0,1,0,0|1,0,0]=3 20188 B13R1.392 COC[C@H]1CCC[C@H]1NCC(C)C b0e4f6e46f96e4e89a8e2bf0ed71140d [0,1,0,1,0,0|2,0,0]=4 20189 B13R1.392 COC[C@H]1CCC[C@H]1NCC(C)O 481e58015e2b7e1fc5398dfc13af0628 [0,1,0,1,0,0|1,0,0]=3 20190 B13R1.392 COC[C@H]1CCC[C@H]1NC[C@@H](C)O 111fa5ce53f146a33e2eada6ba045997 [0,1,0,1,0,0|1,0,0]=3 20191 B13R1.392 COC[C@H]1CCC[C@H]1NC[C@H](C)O 97be7239cf52b616c186f16d4c5fddab [0,1,0,1,0,0|1,0,0]=3 20192 B13R1.392 CSCC1CCCN1CCC(C)C 7bb6e5f1f8a78d74f549ab38bffe4bf3 [0,1,0,1,0,0|2,0,0]=4 20193 B13R1.392 CSCC1CCCN1CCC(C)O cf59e6c9d192588fdc136dc1eb4db9fc [0,1,0,1,0,0|1,0,0]=3 20194 B13R1.559 C=C1CC1COCCCCCCC 575d35b69df0b21ab06fd1bb8688ece9 [0,1,0,1,0,0|1,0,1]=4 20195 B13R1.559 CC1CC1COCCCCCCF cd8e2618638713a71767a02a3dbbd6af [0,1,0,1,0,0|2,0,0]=4 20196 B13R1.559 CC1CC1NCCCCCCCO 8aa3ae35662187ae00f2d2d88bee4c91 [0,1,0,1,0,0|2,0,0]=4 20197 B13R1.559 CCCCCCCCNC1CC1C 545d61cb22c06d77bdbd8a29c53c43e3 [0,1,0,1,0,0|1,0,0]=3 20198 B13R1.559 CCCCCCCCN[C@@H]1C[C@H]1F 9725614a4284b260794be4fda177f164 [0,1,0,1,0,0|1,0,0]=3 20199 B13R1.559 CCCCCCCCN[C@H]1C[C@@H]1F f18f330e3c0111eb5de189d12e0c12e0 [0,1,0,1,0,0|1,0,0]=3 20200 B13R1.559 CCCCCCCCN[C@H]1C[C@H]1F 946ba80845cd1cc60a85b8dfffb59338 [0,1,0,1,0,0|1,0,0]=3 20201 B13R1.559 CCCCCCCOCC1CC1C e875e93837d38c35f4207a79e24571b4 [0,1,0,1,0,0|1,0,0]=3 20202 B13R1.559 CCCCCCCOC[C@@H]1C[C@@H]1C 910cbf0ec10a2010351dcd2e98a276ef [0,1,0,1,0,0|1,0,0]=3 20203 B13R1.559 CCCCCCCOC[C@@H]1C[C@@H]1F d8b52e421d60b6316d52bde1601605b0 [0,1,0,1,0,0|1,0,0]=3 20204 B13R1.559 CCCCCCCOC[C@@H]1C[C@H]1C b2601180c166317e298d3d5e57e48086 [0,1,0,1,0,0|1,0,0]=3 20205 B13R1.559 CCCCCCCOC[C@@H]1C[C@H]1F 31b854895e93356747e12c770a681d9d [0,1,0,1,0,0|1,0,0]=3 20206 B13R1.559 CCCCCCCOC[C@H]1C[C@@H]1C c5e89fdb78cdcdf6096e4d5a74c71776 [0,1,0,1,0,0|1,0,0]=3 20207 B13R1.559 CCCCCCCOC[C@H]1C[C@@H]1F 2336c5e09c11846c55898e7a4f815c75 [0,1,0,1,0,0|1,0,0]=3 20208 B13R1.559 CCCCCCCOC[C@H]1C[C@H]1F 96882d6a584bde67724f99cb86fa24e0 [0,1,0,1,0,0|1,0,0]=3 20209 B13R1.559 CCCCOCCOCC1CC1C 33b656aa4cb13fcbeb8aa4d5d8bad371 [0,1,0,1,0,0|2,0,0]=4 20210 B13R1.559 CCCCOCCOC[C@@H]1C[C@@H]1C e4852f172f6edad27dbc7616da08f98a [0,1,0,1,0,0|2,0,0]=4 20211 B13R1.559 CCCCOCCOC[C@@H]1C[C@@H]1F e0e18087aed20bef7e3dea08c7832b1e [0,1,0,1,0,0|2,0,0]=4 20212 B13R1.559 CCCCOCCOC[C@@H]1C[C@H]1C f65cfa166dc34860aa1efd935a61d81f [0,1,0,1,0,0|2,0,0]=4 20213 B13R1.559 CCCCOCCOC[C@@H]1C[C@H]1F 99306347c9e538c139d34511d4187239 [0,1,0,1,0,0|2,0,0]=4 20214 B13R1.559 CCCCOCCOC[C@H]1C[C@@H]1C 8147f25e1bc51650e154e348a6f43252 [0,1,0,1,0,0|2,0,0]=4 20215 B13R1.559 CCCCOCCOC[C@H]1C[C@@H]1F 482db4a359f80d1c98c454f34f858a71 [0,1,0,1,0,0|2,0,0]=4 20216 B13R1.559 CCCCOCCOC[C@H]1C[C@H]1F b26987fe08537daddce22b602d74a1d0 [0,1,0,1,0,0|2,0,0]=4 20217 B13R1.559 CCCOCCCOCC1CC1C ffad29f01df897d8d9da14b027667389 [0,1,0,1,0,0|2,0,0]=4 20218 B13R1.559 CCCOCCCOC[C@@H]1C[C@@H]1C 2a6adcbd0be0335207bf4d8ca4faef98 [0,1,0,1,0,0|2,0,0]=4 20219 B13R1.559 CCCOCCCOC[C@@H]1C[C@@H]1F 97843c7635dcb96eefa91e98b206676f [0,1,0,1,0,0|2,0,0]=4 20220 B13R1.559 CCCOCCCOC[C@@H]1C[C@H]1C 4924a509f4355b45df2d0a7568feedb6 [0,1,0,1,0,0|2,0,0]=4 20221 B13R1.559 CCCOCCCOC[C@@H]1C[C@H]1F 878533f3382b56a5342f800b9015e6bf [0,1,0,1,0,0|2,0,0]=4 20222 B13R1.559 CCCOCCCOC[C@H]1C[C@@H]1C 004e5d6792fdee1ae96f1a678808ea23 [0,1,0,1,0,0|2,0,0]=4 20223 B13R1.559 CCCOCCCOC[C@H]1C[C@@H]1F 3de7a925c35724cddfa36e1edd011387 [0,1,0,1,0,0|2,0,0]=4 20224 B13R1.559 CCCOCCCOC[C@H]1C[C@H]1F 630610a82e4598c8876807486262c51b [0,1,0,1,0,0|2,0,0]=4 20225 B13R1.559 COCCCCCCNC1CC1C 041c9142c0c0e413505f5102fc8b659a [0,1,0,1,0,0|2,0,0]=4 20226 B13R1.559 COCCCCCCN[C@@H]1C[C@H]1F 0bedf74ce4a5c2dcd4120d59e61f4d80 [0,1,0,1,0,0|2,0,0]=4 20227 B13R1.559 COCCCCCCN[C@H]1C[C@@H]1F 1d37ad262cdfd065a5f7137740f8022f [0,1,0,1,0,0|2,0,0]=4 20228 B13R1.559 COCCCCCCN[C@H]1C[C@H]1F e21bfc75ed95b90fd28f4351620bca97 [0,1,0,1,0,0|2,0,0]=4 20229 B13R1.559 COCCCCCOCC1CC1C 151706357501d21f4cf4a93329622f5e [0,1,0,1,0,0|2,0,0]=4 20230 B13R1.559 COCCCCCOC[C@@H]1C[C@@H]1C 710de92a5d0192d5937a8f89ac040fe0 [0,1,0,1,0,0|2,0,0]=4 20231 B13R1.559 COCCCCCOC[C@@H]1C[C@@H]1F df60dbf5ec8b6ba853b284b9d770cd70 [0,1,0,1,0,0|2,0,0]=4 20232 B13R1.559 COCCCCCOC[C@@H]1C[C@H]1C ffabcc7a79e7c0ffb6ebcf0270dbf2fa [0,1,0,1,0,0|2,0,0]=4 20233 B13R1.559 COCCCCCOC[C@@H]1C[C@H]1F 2f769a3c02b3b26633c02dbb56da0ab8 [0,1,0,1,0,0|2,0,0]=4 20234 B13R1.559 COCCCCCOC[C@H]1C[C@@H]1C 9ebb91b89d3fe000e48e76be999dd963 [0,1,0,1,0,0|2,0,0]=4 20235 B13R1.559 COCCCCCOC[C@H]1C[C@@H]1F 3c8b6449715f8fef2a9aabb92ca53f55 [0,1,0,1,0,0|2,0,0]=4 20236 B13R1.559 COCCCCCOC[C@H]1C[C@H]1F 07f4bbb4f954523025cc0901882a7963 [0,1,0,1,0,0|2,0,0]=4 20237 B13R1.559 C[C@@H]1C[C@H]1COCCCCCCF 050f5f87b8755b9fb4beb9fe47b26515 [0,1,0,1,0,0|2,0,0]=4 20238 B13R1.559 C[C@H]1C[C@@H]1COCCCCCCF d5b0a790cfed33ce1afddc32ca16cb60 [0,1,0,1,0,0|2,0,0]=4 20239 B13R1.559 C[C@H]1C[C@H]1COCCCCCCF b14aac5636f7e2e15252b3911c31fe4f [0,1,0,1,0,0|2,0,0]=4 20240 B13R1.559 FCCCCCCOC[C@@H]1C[C@@H]1F c73fd9851a269712b6187f82aa36d18b [0,1,0,1,0,0|2,0,0]=4 20241 B13R1.559 FCCCCCCOC[C@@H]1C[C@H]1F c18cb83ca5561afbd34f89ad3e0c0e4a [0,1,0,1,0,0|2,0,0]=4 20242 B13R1.559 FCCCCCCOC[C@H]1C[C@@H]1F 0ebc8be6728b97082d27ca0ece6b5cc2 [0,1,0,1,0,0|2,0,0]=4 20243 B13R1.559 FCCCCCCOC[C@H]1C[C@H]1F 30b74de17b16f4e44aeafdf1d6a23ecd [0,1,0,1,0,0|2,0,0]=4 20244 B13R1.559 OCCCCCCCN[C@@H]1C[C@H]1F 1d34ae647cc7fde2589d25db68562672 [0,1,0,1,0,0|2,0,0]=4 20245 B13R1.559 OCCCCCCCN[C@H]1C[C@@H]1F 56435dc91fff89c0c176c39df77e8696 [0,1,0,1,0,0|2,0,0]=4 20246 B13R1.559 OCCCCCCCN[C@H]1C[C@H]1F d96bcee2ad568285a76f17abc8043461 [0,1,0,1,0,0|2,0,0]=4 20247 B13R1.572 CC(C)C1CCCCC1OCCF 62b5256802eb65e66a3accf37070af66 [0,1,0,1,0,0|2,0,0]=4 20248 B13R1.572 CC(C)C1CCCCC1OCCS f02686316d8b2a191123466c143984fe [0,1,0,1,0,0|2,0,0]=4 20249 B13R1.572 CC(C)N1CCCCC1CCCO 5065de2dfa26154d2a97a0f1cb76bc86 [0,1,0,1,0,0|2,0,0]=4 20250 B13R1.572 CCCCN1CCCCC1C(=O)C bd97ea84bc34f779ce7f4323fe652561 [0,1,0,1,0,0|0,0,2]=4 20251 B13R1.572 CCCCN1CCCCC1C(=O)O 1f52fecf3aa8b78dd1ffff90bc902c33 [0,1,0,1,0,0|1,0,1]=4 20252 B13R1.572 CCCCN1CCCCC1C(F)F fa5e111e4a7c2e6af8f92a8218835730 [0,1,0,1,0,0|2,0,0]=4 20253 B13R1.572 CCCCN1CCCC[C@@H]1C(=O)O 47e06aac6667d4e81d956a86c9e7163a [0,1,0,1,0,0|1,0,1]=4 20254 B13R1.572 CCCCN1CCCC[C@@H]1C(F)F 6caca6c4b45e74e573f43a902748fbc3 [0,1,0,1,0,0|2,0,0]=4 20255 B13R1.572 CCCCN1CCCC[C@H]1C(=O)O 63d1cdb85cf96247585912b18ebc86a0 [0,1,0,1,0,0|1,0,1]=4 20256 B13R1.572 CCCCN1CCCC[C@H]1C(F)F 2b9c0aec8683d93e87e6fbfe42a86f91 [0,1,0,1,0,0|2,0,0]=4 20257 B13R1.572 CCCCN1CCOCC1C(C)C a71e16310439b69d254c211d0ea03840 [0,1,0,1,0,0|2,0,0]=4 20258 B13R1.572 CCCCN1CCOC[C@@H]1C(C)C 934e976c49b70b42711df01ec26967c0 [0,1,0,1,0,0|2,0,0]=4 20259 B13R1.572 CCCCN1CCOC[C@H]1C(C)C 633aa3c8f9608550d01a6916662c1fe5 [0,1,0,1,0,0|2,0,0]=4 20260 B13R1.572 CCCNC1CCCCC1C(=O)O 244aca53fd6340b8174b276176c41540 [0,1,0,1,0,0|1,0,1]=4 20261 B13R1.572 CCCNC1CCCCC1N(C)C d52f78cc80701196ed6bb99f6b72f740 [0,1,0,1,0,0|2,0,0]=4 20262 B13R1.572 CCCN[C@@H]1CCCC[C@H]1N(C)C 5247e601e82531ebc13c490bb985b322 [0,1,0,1,0,0|2,0,0]=4 20263 B13R1.572 CCCN[C@H]1CCCC[C@@H]1C(=O)O a86ad4a5f368603e91898d71d916ca97 [0,1,0,1,0,0|1,0,1]=4 20264 B13R1.572 CCCN[C@H]1CCCC[C@@H]1N(C)C 5f08febffe399a4e44ae91ab8ccb0d03 [0,1,0,1,0,0|2,0,0]=4 20265 B13R1.572 CCCN[C@H]1CCCC[C@H]1C(=O)O 625d5fb1f6708ed369ee1b91e2f0726d [0,1,0,1,0,0|1,0,1]=4 20266 B13R1.572 CCCOC1CCCCC1C(=O)O cb6c5c99f1c3b565c53509328478ddb8 [0,1,0,1,0,0|1,0,1]=4 20267 B13R1.572 CCCOC1CCCCC1C(C)C a30137c8c78e6f9f45e2b6b69eb0ac12 [0,1,0,1,0,0|1,0,0]=3 20268 B13R1.572 CCCOC1CCCCC1N(C)C e2708f1ab0a84009a35cf0e74ece4c5a [0,1,0,1,0,0|2,0,0]=4 20269 B13R1.572 CCCO[C@@H]1CCCC[C@@H]1N(C)C 5eee8c757e1ae158a2ed7fcfe4c299d8 [0,1,0,1,0,0|2,0,0]=4 20270 B13R1.572 CCCO[C@@H]1CCCC[C@H]1N(C)C 345294e5cbb7e4ed14003905d154efc7 [0,1,0,1,0,0|2,0,0]=4 20271 B13R1.572 CCCO[C@H]1CCCC[C@H]1N(C)C d2a163432516520e77138cc9c47ab4f8 [0,1,0,1,0,0|2,0,0]=4 20272 B13R1.572 COCCC1CCCCN1C(C)C ba0a6f83c0687f155df805fe2a61bb4b [0,1,0,1,0,0|2,0,0]=4 20273 B13R1.572 COCOC1CCCCC1C(C)C 499a1d637c2ceb07ac3801c1e63a10bf [0,1,0,1,0,0|2,0,0]=4 20274 B13R1.572 CSCOC1CCCCC1C(C)C b658449e5b65f3360af4bbd134b84c30 [0,1,0,1,0,0|2,0,0]=4 20275 B13R1.578 C=C(C)CN1CCCC1CCCC 78f2ce91864946febed7c2ae60d3da0d [0,1,0,1,0,0|1,0,1]=4 20276 B13R1.578 CC(C)CC1CCCN1CCCF 1b283da331783eda4fb616cf4d39aa26 [0,1,0,1,0,0|2,0,0]=4 20277 B13R1.578 CC(C)CC1CCCN1CCCO c3baa097c296ce0d16b36e943818a320 [0,1,0,1,0,0|2,0,0]=4 20278 B13R1.578 CC(C)CC1CCCN1CCCS d2a9bffc107ab045f75921ddcc5604d6 [0,1,0,1,0,0|2,0,0]=4 20279 B13R1.578 CCCCC1CCCC1NC(=O)C b32b6b28ac5bf3bde6691d76e88a2c42 [0,1,0,1,0,0|0,0,2]=4 20280 B13R1.578 CCCCC1CCCC1NC(C)C 18485276aae7f09f6439dfe7a41856f7 [0,1,0,1,0,0|1,0,0]=3 20281 B13R1.578 CCCCC1CCCN1CC(=O)O 6c88ac149e87c36e2a38e6bb4e678b8a [0,1,0,1,0,0|1,0,1]=4 20282 B13R1.578 CCCCC1CCCN1CC(C)C 3e39403a67a3db36ce0f802ef622c454 [0,1,0,1,0,0|1,0,0]=3 20283 B13R1.578 CCCCC1CCCN1CC(C)O d40615023bf406cb9ae25d40f0969a5e [0,1,0,1,0,0|0,0,0]=2 20284 B13R1.578 CCCCC1CCCN1CC(F)F 194b234eaa6423e256d2fe99bfb6bb34 [0,1,0,1,0,0|2,0,0]=4 20285 B13R1.578 CCCCC1CCCN1CN(C)C ac8756c39ee7b726d7e5e5a8e630eed1 [0,1,0,1,0,0|2,0,0]=4 20286 B13R1.578 CCCCC1CCCN1C[C@@H](C)O 51c10d405454efb93acbe8ff37d03382 [0,1,0,1,0,0|0,0,0]=2 20287 B13R1.578 CCCCC1CCCN1C[C@H](C)O 26b1ba7877b11739c7309e8b952ffc9a [0,1,0,1,0,0|0,0,0]=2 20288 B13R1.578 CCCCN1CCCC1CC(=O)O ab0c4deef01f0fb7afdc84e7f02da33c [0,1,0,1,0,0|1,0,1]=4 20289 B13R1.578 CCCCN1CCCC1CC(C)C ebce8ddf96191ad38d5721f1cf38bb7c [0,1,0,1,0,0|1,0,0]=3 20290 B13R1.578 CCCCN1CCC[C@@H]1CC(=O)O dc1cb37fbff76df38748739b605b4cd4 [0,1,0,1,0,0|1,0,1]=4 20291 B13R1.578 CCCCN1CCC[C@@H]1CN(C)C 9d5922d4b52125c76fe5b43dd9940c29 [0,1,0,1,0,0|2,0,0]=4 20292 B13R1.578 CCCCN1CCC[C@H]1CC(=O)O c6eefcd251955ab05d3ba672eaeda9c2 [0,1,0,1,0,0|1,0,1]=4 20293 B13R1.578 CCCCN1CCC[C@H]1CN(C)C b9b0868b9161ccc6a3a97a7305ff4e46 [0,1,0,1,0,0|2,0,0]=4 20294 B13R1.578 CCOCC1CCCN1CC(C)C 5ac833c1a97e6ca34539111b5d82b0e7 [0,1,0,1,0,0|2,0,0]=4 20295 B13R1.578 CCOCC1CCCN1CC(C)O 04fa885c12f65da6476bfae89ece80a9 [0,1,0,1,0,0|1,0,0]=3 20296 B13R1.578 CCOCC1CCCN1C[C@@H](C)O 29e242e324eaa77253bf5fa8026f4fc9 [0,1,0,1,0,0|1,0,0]=3 20297 B13R1.578 CCOCC1CCCN1C[C@H](C)O 2e037e4b061c6c444d6d8475a4d778ff [0,1,0,1,0,0|1,0,0]=3 20298 B13R1.578 CCOCN1CCCC1CC(C)C b2af199c3e10a09679d9c20bbdde39b1 [0,1,0,1,0,0|2,0,0]=4 20299 B13R1.578 CCOC[C@@H]1CCCN1CC(C)C f8c29cb9bffad3aa0e4465f7fd7df195 [0,1,0,1,0,0|2,0,0]=4 20300 B13R1.578 CCOC[C@@H]1CCCN1CC(C)O 7fae77a7cd8610c79b48037a26ce63f6 [0,1,0,1,0,0|1,0,0]=3 20301 B13R1.578 CCOC[C@@H]1CCCN1C[C@@H](C)O aa0fdc0f7a3260b70ac48769928f277f [0,1,0,1,0,0|1,0,0]=3 20302 B13R1.578 CCOC[C@@H]1CCCN1C[C@H](C)O 37c7a70c954bc76f09f6483d920fc2be [0,1,0,1,0,0|1,0,0]=3 20303 B13R1.578 COCCC1CCCN1CC(C)C 0abcc32c8ea60f838409fbea63f8fe30 [0,1,0,1,0,0|2,0,0]=4 20304 B13R1.578 COCCC1CCCN1CC(C)O eb4e2888a7deef5acba9a8125067705c [0,1,0,1,0,0|1,0,0]=3 20305 B13R1.578 COCCC1CCCN1C[C@@H](C)O 168cebfde229404484d2c9787d11dbff [0,1,0,1,0,0|1,0,0]=3 20306 B13R1.578 COCCC1CCCN1C[C@H](C)O 03f4641bf98e68635ef3b24c42b8d8f7 [0,1,0,1,0,0|1,0,0]=3 20307 B13R1.578 COCCN1CCCC1CC(C)C 17fa417f6ba1c5fb260454d58e4e3943 [0,1,0,1,0,0|2,0,0]=4 20308 B13R1.578 CSCCN1CCCC1CC(C)C 302c7366569e882c46148d1ff1d3d81f [0,1,0,1,0,0|2,0,0]=4 20309 B13R1.610 CC(C)CC1CCCCCN1CF 45b4054a61675f7139a7fbba5782485f [0,1,0,1,0,0|2,0,0]=4 20310 B13R1.610 CC(C)CC1CCCCCN1CO 5eed387245f50abb259e79d9414f5925 [0,1,0,1,0,0|2,0,0]=4 20311 B13R1.610 CC(C)CN1CCCCCC1CO a9482742dd70f49d9058c5f93e9eccb3 [0,1,0,1,0,0|2,0,0]=4 20312 B13R1.610 CC(O)CN1CCCCCC1CO 84baa2dbabf3f526ed46d5977bdebbd8 [0,1,0,1,0,0|1,0,0]=3 20313 B13R1.610 CC(O)CN1CCCOCC1CO 9f920aa3632517c519f69eb121c74453 [0,1,0,1,0,0|2,0,0]=4 20314 B13R1.610 CC(O)CN1CCCOC[C@@H]1CO 0057ab391d1daf830de9dae505242eda [0,1,0,1,0,0|2,0,0]=4 20315 B13R1.610 CC(O)CN1CCCOC[C@H]1CO d9a490fb176076029a1c8e0356eafae3 [0,1,0,1,0,0|2,0,0]=4 20316 B13R1.610 CCN1CCCCCC1CC(C)C fa6e567485ccac9facea097afd03c264 [0,1,0,1,0,0|1,0,0]=3 20317 B13R1.610 C[C@@H](O)CN1CCCCCC1CO 6daafb55fbd4995759ea72ee67fa1d14 [0,1,0,1,0,0|1,0,0]=3 20318 B13R1.610 C[C@@H](O)CN1CCCOCC1CO e8881e58b4bde214607348cd658277a9 [0,1,0,1,0,0|2,0,0]=4 20319 B13R1.610 C[C@@H](O)CN1CCCOC[C@@H]1CO 590b7985dfd3e9ee53455e0adb94777f [0,1,0,1,0,0|2,0,0]=4 20320 B13R1.610 C[C@@H](O)CN1CCCOC[C@H]1CO 36fa33d75155f102c7486bc66e3815bc [0,1,0,1,0,0|2,0,0]=4 20321 B13R1.610 C[C@H](O)CN1CCCCCC1CO 008f1079e69a8aab6003c2fd3af84fe3 [0,1,0,1,0,0|1,0,0]=3 20322 B13R1.610 C[C@H](O)CN1CCCOCC1CO 3085235095f4568e5e9dbdf49e3baccc [0,1,0,1,0,0|2,0,0]=4 20323 B13R1.610 C[C@H](O)CN1CCCOC[C@@H]1CO de10c7ffe85a2be77efb249a30a9e8e4 [0,1,0,1,0,0|2,0,0]=4 20324 B13R1.610 C[C@H](O)CN1CCCOC[C@H]1CO 624a24c309b3a5bb2b4bbee3b90dfc0b [0,1,0,1,0,0|2,0,0]=4 20325 B13R1.647 CC(C)CCCCN1CCC1CO 0fb86603f3953f85bc0dc0d2544c7f66 [0,1,0,1,0,0|2,0,0]=4 20326 B13R1.647 CC(C)CCCCN1CC[C@@H]1CO b7f01471c51747b5bf058418f1efbf09 [0,1,0,1,0,0|2,0,0]=4 20327 B13R1.647 CC(C)CCCCN1CC[C@H]1CO e054cf18f86cff091aaf6904c0a5b9c3 [0,1,0,1,0,0|2,0,0]=4 20328 B13R1.647 CC(O)CCCCN1CCC1CO ce90b23cf4642d545ff332727fcb0b3d [0,1,0,1,0,0|1,0,0]=3 20329 B13R1.647 CC(O)CCCCN1CC[C@@H]1CO 9c29d7e205f67c58f80ac58711a49b4b [0,1,0,1,0,0|1,0,0]=3 20330 B13R1.647 CC(O)CCCCN1CC[C@H]1CO 877440144656d9bc7d44eec356122092 [0,1,0,1,0,0|1,0,0]=3 20331 B13R1.647 CCC1CCN1CCCCC(=O)C 921cdcd238dcb50a08f07c61fafbbc25 [0,1,0,1,0,0|0,0,2]=4 20332 B13R1.647 CCC1CCN1CCCCC(=O)O f972cd33665993d437e62e4a8a73ca65 [0,1,0,1,0,0|1,0,1]=4 20333 B13R1.647 CCC1CCN1CCCCC(C)C 0effa9c1a6c1fd1ff27f377910d889b0 [0,1,0,1,0,0|1,0,0]=3 20334 B13R1.647 CCC1CCN1CCCCC(C)O aaadcab0b4f22869bf05c2fea4bea65f [0,1,0,1,0,0|0,0,0]=2 20335 B13R1.647 CCC1CCN1CCCCN(C)C 06bb9bb787140f0e67d5546b6ee93f7c [0,1,0,1,0,0|2,0,0]=4 20336 B13R1.647 CCC1CCN1CCCC[C@@H](C)O 4793def507d5d69f366deda033a19e40 [0,1,0,1,0,0|0,0,0]=2 20337 B13R1.647 CCC1CCN1CCOCC(C)C b695f3b3186f976a6ff533539da1bd84 [0,1,0,1,0,0|2,0,0]=4 20338 B13R1.647 COC1CCC1COCCC(C)C 3f40a1b330c43d2db4af0ff49e59f69e [0,1,0,1,0,0|2,0,0]=4 20339 B13R1.647 COC1CCC1NCCCC(C)C e6d0d832fcd03e81005c87a2a2dd1055 [0,1,0,1,0,0|2,0,0]=4 20340 B13R1.647 COC1CCC1NCCCC(C)O a302c87ba20a53f039c2272a32a5ef38 [0,1,0,1,0,0|1,0,0]=3 20341 B13R1.647 CO[C@@H]1CC[C@@H]1COCCC(C)C 7de8134a93acc2cdaa4c4e84ffe4fe1f [0,1,0,1,0,0|2,0,0]=4 20342 B13R1.647 CO[C@@H]1CC[C@@H]1NCCCC(C)C 1035bc73347b209edebfb5e8f59727f3 [0,1,0,1,0,0|2,0,0]=4 20343 B13R1.647 CO[C@@H]1CC[C@@H]1NCCCC(C)O 1cb36fcaf9db0365487c23e4795078f6 [0,1,0,1,0,0|1,0,0]=3 20344 B13R1.647 CO[C@@H]1CC[C@H]1COCCC(C)C 01d740dae3a5b092a05191071f4ebb73 [0,1,0,1,0,0|2,0,0]=4 20345 B13R1.647 CO[C@@H]1CC[C@H]1NCCCC(C)C 6471103af2d1e819008bdb1712d792e1 [0,1,0,1,0,0|2,0,0]=4 20346 B13R1.647 CO[C@@H]1CC[C@H]1NCCCC(C)O 21b68a84869e9a3b79fdcdafa49c1bfb [0,1,0,1,0,0|1,0,0]=3 20347 B13R1.647 CO[C@H]1CC[C@@H]1NCCCC(C)C 44cd7af4c61356b50c3ca86e52da4198 [0,1,0,1,0,0|2,0,0]=4 20348 B13R1.647 CO[C@H]1CC[C@@H]1NCCCC(C)O eadef7544c18943962603a8368e6cc00 [0,1,0,1,0,0|1,0,0]=3 20349 B13R1.647 CO[C@H]1CC[C@H]1NCCCC(C)C 71a259cdfb62d2d23ac22e40201dfb42 [0,1,0,1,0,0|2,0,0]=4 20350 B13R1.647 CO[C@H]1CC[C@H]1NCCCC(C)O 7b686cdcb5476ff7e95e6c56ecc5c9f6 [0,1,0,1,0,0|1,0,0]=3 20351 B13R1.647 C[C@@H](O)CCCCN1CCC1CO 8a4b66f1b2dd306bce4312acc358601c [0,1,0,1,0,0|1,0,0]=3 20352 B13R1.647 C[C@@H](O)CCCCN1CC[C@@H]1CO c9e8eb2bcdf3fad96dba0b2e8ccc6f46 [0,1,0,1,0,0|1,0,0]=3 20353 B13R1.647 C[C@@H](O)CCCCN1CC[C@H]1CO ac50fea4b01890d8712025676fe4b994 [0,1,0,1,0,0|1,0,0]=3 20354 B13R1.659 CCCCCCCCCNC1CC1 cb6df207ea07d7bea3dd827b746e1ae0 [0,1,0,1,0,0|1,0,0]=3 20355 B13R1.659 CCCCCCCCCOC1CC1 cf2e3b4307a40588e75ae6a6306b6db1 [0,1,0,1,0,0|1,0,0]=3 20356 B13R1.659 CCCCCCCCNCC1CC1 433d69cf6d11096d31d958ec4112ea0d [0,1,0,1,0,0|1,0,0]=3 20357 B13R1.659 CCCCCCCCOCC1CC1 856823677aa4d6ddc632adede7cf8716 [0,1,0,1,0,0|1,0,0]=3 20358 B13R1.659 CCCCCCCNCCC1CC1 b2abeaa064b44778daf1128a4d839a68 [0,1,0,1,0,0|1,0,0]=3 20359 B13R1.659 CCCCCCCNCCN1CC1 66f634c7c4c8e884047d373a9a3987b3 [0,1,0,1,0,0|2,0,0]=4 20360 B13R1.659 CCCCCCCOCCC1CC1 e5ab760c2b43f99b9cf531d0d40ea4e4 [0,1,0,1,0,0|1,0,0]=3 20361 B13R1.659 CCCCCCCOCCN1CC1 04cf66e2685626dad0c68e546909aea9 [0,1,0,1,0,0|2,0,0]=4 20362 B13R1.659 CCCCCCNCCOC1CC1 c0ab9f7458309742624838e24830b671 [0,1,0,1,0,0|2,0,0]=4 20363 B13R1.659 CCCCCCOCCCC1CC1 50457ce8fbe0a686319462b44c6762bb [0,1,0,1,0,0|1,0,0]=3 20364 B13R1.659 CCCCCCOCCOC1CC1 a11f5c35928dc91b63c51a4d858250c3 [0,1,0,1,0,0|2,0,0]=4 20365 B13R1.659 CCCCCNCCSCC1CC1 c84300b3c9a41a8c25314399e2eb8cdb [0,1,0,1,0,0|2,0,0]=4 20366 B13R1.659 CCCCCOCCCOC1CC1 dc2f00f3b4875c106459b7df7bd8ac71 [0,1,0,1,0,0|2,0,0]=4 20367 B13R1.659 CCCCCOCCCSC1CC1 446b3c142092173ed61be188579294ae [0,1,0,1,0,0|2,0,0]=4 20368 B13R1.659 CCCCCOCCOCC1CC1 14d175e9acc9b9a1c18caeb5dc94317c [0,1,0,1,0,0|2,0,0]=4 20369 B13R1.659 CCCCNCCCOCC1CC1 6461eb54152bfb716a06dbdd99443f01 [0,1,0,1,0,0|2,0,0]=4 20370 B13R1.659 CCCCOCCCNCC1CC1 2af03e03382b64b9ff3b67face429f58 [0,1,0,1,0,0|2,0,0]=4 20371 B13R1.659 CCCCOCCCOCC1CC1 d23f3b3a1fc2df42edeaf19130ef106b [0,1,0,1,0,0|2,0,0]=4 20372 B13R1.659 CCCCOCCNCCC1CC1 7d445472985b84b230f1525eb203a032 [0,1,0,1,0,0|2,0,0]=4 20373 B13R1.659 CCCCOCCOCCC1CC1 fb5510f497ad750020dcb4279ba11226 [0,1,0,1,0,0|2,0,0]=4 20374 B13R1.659 CCCCOCOCCCC1CC1 78b82b0b5f44f91bb48ff8875604cf67 [0,1,0,1,0,0|2,0,0]=4 20375 B13R1.659 CCCCSCCOCCC1CC1 7f099eb1e9bfb649e23d7c61edae0dc4 [0,1,0,1,0,0|2,0,0]=4 20376 B13R1.659 CCCOCCCNCCC1CC1 8f5fb38f019e6aa5b7ca8eacc53261ff [0,1,0,1,0,0|2,0,0]=4 20377 B13R1.659 CCCOCCCOCCC1CC1 c1f9037e1a6dcc8ce635fb6d265e503b [0,1,0,1,0,0|2,0,0]=4 20378 B13R1.659 CCCOCCOCCCC1CC1 7fc3008001a84d842a5ef4e6f9528028 [0,1,0,1,0,0|2,0,0]=4 20379 B13R1.659 CCCSCCCCNCC1CC1 83b267a4feab0aff82f015e92bb9f31e [0,1,0,1,0,0|2,0,0]=4 20380 B13R1.659 CCOCCCOCCCC1CC1 0db15d5e6737fc937d378cadcd4c5745 [0,1,0,1,0,0|2,0,0]=4 20381 B13R1.659 CCSCCCCNCCC1CC1 f3c82bcf67324ffad1c72cb3b0f6b6a4 [0,1,0,1,0,0|2,0,0]=4 20382 B13R1.659 CCSCCCOCCCC1CC1 d393e3d4a9faee1fce59b800d1a1f61d [0,1,0,1,0,0|2,0,0]=4 20383 B13R1.659 COCCCCCCNCC1CC1 577a38a3e68f47d5d2761a68f48fe387 [0,1,0,1,0,0|2,0,0]=4 20384 B13R1.659 COCCCCCCOCC1CC1 753864028fb6b988c56f6b3e242fbd53 [0,1,0,1,0,0|2,0,0]=4 20385 B13R1.659 COCCCCCNCCC1CC1 184e65c180d0d6b322607560e37c08d1 [0,1,0,1,0,0|2,0,0]=4 20386 B13R1.659 COCCCCCOCCC1CC1 8ff6f45f2c9fade5ee1e4093e85807ca [0,1,0,1,0,0|2,0,0]=4 20387 B13R1.659 COCCCCOCCCC1CC1 f399ad68417873611ba9d0547f169afd [0,1,0,1,0,0|2,0,0]=4 20388 B13R1.659 ClCCCCCCNCCC1CC1 7783c73810e0205acc3d72ac23679dbc [0,1,0,1,0,0|2,0,0]=4 20389 B13R1.659 FCCCCCCNCCC1CC1 0f8d16ecc555837cdcb69d4a91b30e76 [0,1,0,1,0,0|2,0,0]=4 20390 B13R1.659 FCCCCCCOCCC1CC1 9ef94780a58b1ebdcd1fdbb5cc45e570 [0,1,0,1,0,0|2,0,0]=4 20391 B13R1.659 FCCCCCOCCCC1CC1 afe14ed2d18d2776bdaeb12819cc4af5 [0,1,0,1,0,0|2,0,0]=4 20392 B13R1.659 OCCCCCCCCNC1CC1 b6dcba2321730a5203b388c0daff4d90 [0,1,0,1,0,0|2,0,0]=4 20393 B13R1.659 OCCCCCCCNCC1CC1 f0cafebdda1243cf53ffd450587365cc [0,1,0,1,0,0|2,0,0]=4 20394 B13R1.659 OCCCCCCNCCC1CC1 7a811e568850038a2c682b73493833f3 [0,1,0,1,0,0|2,0,0]=4 20395 B13R1.659 SCCCCCCOCCC1CC1 b3129f843437b6e6ed574f9b1a62bc1e [0,1,0,1,0,0|2,0,0]=4 20396 B13R1.668 C#CCCNC1CCCCC1(C)O 2f82af3dc6c19a45c45327c207ee21c7 [0,1,0,1,0,0|0,0,2]=4 20397 B13R1.668 C/C=C/CNC1CCCCC1(C)O ede78b3fa9abf33ee0f05095e951635e [0,1,0,1,0,0|0,0,2]=4 20398 B13R1.668 C/C=C\CNC1CCCCC1(C)O 957557850a28ba3ca968100fce9ac50b [0,1,0,1,0,0|0,0,2]=4 20399 B13R1.668 C=CCCNC1CCCCC1(C)O f7d59adf5229515157b34d40b9723691 [0,1,0,1,0,0|0,0,2]=4 20400 B13R1.668 CC1(CCCCC1NCCC#N)O 2d64d680077fdda2e056b96c36db34c2 [0,1,0,1,0,0|1,0,1]=4 20401 B13R1.668 CC1(CCCCC1NCCC=O)O a7902db87ab8d7eb92f3e9ccd0643c6f [0,1,0,1,0,0|1,0,1]=4 20402 B13R1.668 CC1(CCCCC1NCCCF)C 5ac72559cf929408b1b7c64cf32ce55d [0,1,0,1,0,0|2,0,0]=4 20403 B13R1.668 CC1(CCCCC1NCCCF)O 1f9b91032d4d93223681dbf8d25424b9 [0,1,0,1,0,0|1,0,0]=3 20404 B13R1.668 CC1(CCCCC1NCCCO)C 3de5ebacfc2906d8a7b30f3514b95b9c [0,1,0,1,0,0|2,0,0]=4 20405 B13R1.668 CC1(CCCCC1NCCCO)O 17dd1bd3e8697f4a0934951331f579f2 [0,1,0,1,0,0|1,0,0]=3 20406 B13R1.668 CC1(CCCCC1NCCCS)C 12574fd594d84c48e1e4d041ba80177e [0,1,0,1,0,0|2,0,0]=4 20407 B13R1.668 CC1(CCCCC1NCCCS)O 118a89503feb1b8d45daaa360c1d9e4c [0,1,0,1,0,0|1,0,0]=3 20408 B13R1.668 CC1(CCCCC1OCCCF)C 0381fade95d07dfbfc1249a01e5829f7 [0,1,0,1,0,0|2,0,0]=4 20409 B13R1.668 CC1(CCCCC1OCCCS)C 477072b68c41fbcaae79aca0059ed447 [0,1,0,1,0,0|2,0,0]=4 20410 B13R1.668 CC1(CCCCN1CCCCF)C a005ed3241e11c9f0adc138dbb69f161 [0,1,0,1,0,0|2,0,0]=4 20411 B13R1.668 CC1(CCCCN1CCCCO)C deec3668a870fef1dc78fb95001536a4 [0,1,0,1,0,0|2,0,0]=4 20412 B13R1.668 CCCCCN1CCCCC1(C)C bb3ffe53093207145a3a8516b30bc7d4 [0,1,0,1,0,0|1,0,0]=3 20413 B13R1.668 CCCCCN1CCOCC1(C)C a285941077cb4b3ac77bd01fa0059f8c [0,1,0,1,0,0|2,0,0]=4 20414 B13R1.668 CCCCNC1CCCCC1(C)C aceac0473f99227795387693d4dde483 [0,1,0,1,0,0|1,0,0]=3 20415 B13R1.668 CCCCNC1CCCCC1(C)O 73a849f49f8338657e196df5330c24ba [0,1,0,1,0,0|0,0,0]=2 20416 B13R1.668 CCCCNC1CCCCC1(F)F 1c97a430545ea731ea57858f46e178b8 [0,1,0,1,0,0|2,0,0]=4 20417 B13R1.668 CCCCNC1CCOCC1(C)C db59ff5f388b4c061fd97bf4d9355d9a [0,1,0,1,0,0|2,0,0]=4 20418 B13R1.668 CCCCOC1CCCCC1(C)C dc14ac19a27972d40349faacb6585fae [0,1,0,1,0,0|1,0,0]=3 20419 B13R1.668 CCCCOC1CCCCC1(F)F 371b550e0b235e455c10609db5cdfeaa [0,1,0,1,0,0|2,0,0]=4 20420 B13R1.668 CCCCOC1CCOCC1(C)C 95c3de44203e97776e8e849a3eaf4a96 [0,1,0,1,0,0|2,0,0]=4 20421 B13R1.668 CCOCCN1CCCCC1(C)C d134ccb16b7261e6d029ea43005ef6c0 [0,1,0,1,0,0|2,0,0]=4 20422 B13R1.668 CCOCNC1CCCCC1(C)C 0f0d81622c1fdac08060aa6774c14fa9 [0,1,0,1,0,0|2,0,0]=4 20423 B13R1.668 CCOCOC1CCCCC1(C)C afc99e496b206f7afb6c24b13971cc45 [0,1,0,1,0,0|2,0,0]=4 20424 B13R1.668 CCSCCN1CCCCC1(C)C 2ca497b75adf56c5c5b212853f54f98d [0,1,0,1,0,0|2,0,0]=4 20425 B13R1.668 COCCCN1CCCCC1(C)C 333791f67120f8bbc979fcb900a21b72 [0,1,0,1,0,0|2,0,0]=4 20426 B13R1.668 COCCNC1CCCCC1(C)C 8fe5c2c0e98f95e804d81492cd964138 [0,1,0,1,0,0|2,0,0]=4 20427 B13R1.668 COCCNC1CCCCC1(C)O d31901a992a001ed97b1f543cf01f9b5 [0,1,0,1,0,0|1,0,0]=3 20428 B13R1.668 COCCOC1CCCCC1(C)C f262ec741fbe4613635383b267bee61b [0,1,0,1,0,0|2,0,0]=4 20429 B13R1.668 CSCCCN1CCCCC1(C)C b7085efd5b5ca0e7fda3d866fd4cb2c4 [0,1,0,1,0,0|2,0,0]=4 20430 B13R1.668 CSCCNC1CCCCC1(C)C 6c542224d35ce96d34b183d9e153a389 [0,1,0,1,0,0|2,0,0]=4 20431 B13R1.668 CSCCNC1CCCCC1(C)O 4cfa574610c81e6e4d126c68fe3cc16e [0,1,0,1,0,0|1,0,0]=3 20432 B13R1.668 CSCCOC1CCCCC1(C)C e12bf86ac22a0bb49d04e594541cec87 [0,1,0,1,0,0|2,0,0]=4 20433 B13R1.670 C#CCCCN1CCCC1C(C)O 5b2f91c083e6857b1e4b1119528058fe [0,1,0,1,0,0|0,0,2]=4 20434 B13R1.670 C#CCCCN1CCC[C@@H]1C(C)O f47a583255035f6c0c85b46ca0142d68 [0,1,0,1,0,0|0,0,2]=4 20435 B13R1.670 C#CCCCN1CCC[C@H]1[C@H](C)O c0e84110ce76f181eb18bf4ed51b6353 [0,1,0,1,0,0|0,0,2]=4 20436 B13R1.670 C=CCCCN1CCCC1C(C)O 939923f22ad70c34e7482efa34e680d3 [0,1,0,1,0,0|0,0,2]=4 20437 B13R1.670 C=CCCCN1CCC[C@@H]1C(C)O ab799e160733ece73d0c343dd2003b6b [0,1,0,1,0,0|0,0,2]=4 20438 B13R1.670 C=CCCCN1CCC[C@H]1[C@H](C)O 8e7eec69c466c7350e78a32d1802dc34 [0,1,0,1,0,0|0,0,2]=4 20439 B13R1.670 CC(C)C1CCCC1OCCCF 1cde23652009898b716a996a71414cdf [0,1,0,1,0,0|2,0,0]=4 20440 B13R1.670 CC(C)C1CCCC1OCCCS 4e68773c662734a4b80207cfde36043d [0,1,0,1,0,0|2,0,0]=4 20441 B13R1.670 CC(C)C1CCCN1CCCCF 2e4f8578618ff172343563425106685f [0,1,0,1,0,0|2,0,0]=4 20442 B13R1.670 CC(C)C1CCCN1CCCCO 59883d0b8e2a305c61b4ecaee233335e [0,1,0,1,0,0|2,0,0]=4 20443 B13R1.670 CC(C)[C@@H]1CCCN1CCCCF 94d979bb218c3cd802d36ecef47e2301 [0,1,0,1,0,0|2,0,0]=4 20444 B13R1.670 CC(C)[C@@H]1CCCN1CCCCO 9d3a86e750edf677f02694d10cee4027 [0,1,0,1,0,0|2,0,0]=4 20445 B13R1.670 CC(O)C1CCCN1CCCC#N 766252c09ad6174dd72a17ed8ec40db0 [0,1,0,1,0,0|1,0,1]=4 20446 B13R1.670 CC(O)C1CCCN1CCCC=O 528362a77a0bb1e50277f64bbc2c569c [0,1,0,1,0,0|1,0,1]=4 20447 B13R1.670 CC(O)C1CCCN1CCCCF 507719ccbc6bf91b1e3b47b2c92a76fb [0,1,0,1,0,0|1,0,0]=3 20448 B13R1.670 CC(O)C1CCCN1CCCCO eed1f84282cf8d31ba87d7d96daa1803 [0,1,0,1,0,0|1,0,0]=3 20449 B13R1.670 CC(O)[C@H]1CCCN1CCCC#N bd0d99937428aad4896148935ffcac8d [0,1,0,1,0,0|1,0,1]=4 20450 B13R1.670 CC(O)[C@H]1CCCN1CCCC=O 3448b18892a457eb2670e4979db4fcc0 [0,1,0,1,0,0|1,0,1]=4 20451 B13R1.670 CC(O)[C@H]1CCCN1CCCCF 6b1f861eea30733340d648f69c3c16af [0,1,0,1,0,0|1,0,0]=3 20452 B13R1.670 CC(O)[C@H]1CCCN1CCCCO 2316a84c7ebe5129867e10ea92fe890c [0,1,0,1,0,0|1,0,0]=3 20453 B13R1.670 CC/C=C/CN1CCCC1C(C)O 77aa5c2f9803675a0dcf80366d078064 [0,1,0,1,0,0|0,0,2]=4 20454 B13R1.670 CC/C=C/CN1CCC[C@@H]1C(C)O 01b24db0b708a363c85266241ca14a3d [0,1,0,1,0,0|0,0,2]=4 20455 B13R1.670 CC/C=C/CN1CCC[C@H]1[C@H](C)O f1af3e60fde82bfde4acc47b1b3817c4 [0,1,0,1,0,0|0,0,2]=4 20456 B13R1.670 CCC#CCN1CCCC1C(C)O e1ebdae3f3d62eed60c3750abe0a207b [0,1,0,1,0,0|0,0,2]=4 20457 B13R1.670 CCC#CCN1CCC[C@@H]1C(C)O 855db85726152890e669e65129d206e3 [0,1,0,1,0,0|0,0,2]=4 20458 B13R1.670 CCC#CCN1CCC[C@H]1[C@H](C)O fba800ae07111ec338751bfaaa44c2a6 [0,1,0,1,0,0|0,0,2]=4 20459 B13R1.670 CCCCCN1CCCC1C(=O)O 7501bb5f170e75df87f34da9c060f3cf [0,1,0,1,0,0|1,0,1]=4 20460 B13R1.670 CCCCCN1CCCC1C(C)C 2c59e1e2da894a1824f0d9fe2b186b4e [0,1,0,1,0,0|1,0,0]=3 20461 B13R1.670 CCCCCN1CCCC1C(C)O 5ecd18674d92dade2a6d0bab0e052997 [0,1,0,1,0,0|0,0,0]=2 20462 B13R1.670 CCCCCN1CCCC1C(F)F 207ed6e8fa0d3bf0d9e99d755ebb9d77 [0,1,0,1,0,0|2,0,0]=4 20463 B13R1.670 CCCCCN1CCC[C@@H]1C(=O)O 696eb4646a5aedeb4c01baee88c3a84d [0,1,0,1,0,0|1,0,1]=4 20464 B13R1.670 CCCCCN1CCC[C@@H]1C(C)O d26f1dcc6bf27fba2e1be1658941a630 [0,1,0,1,0,0|0,0,0]=2 20465 B13R1.670 CCCCCN1CCC[C@@H]1C(F)F fcc680d7b021aaad90902ad08ad3d837 [0,1,0,1,0,0|2,0,0]=4 20466 B13R1.670 CCCCCN1CCC[C@H]1C(=O)O 53f578dd29c93526b25a57c0a032c757 [0,1,0,1,0,0|1,0,1]=4 20467 B13R1.670 CCCCCN1CCC[C@H]1C(C)C dd3b92fa53ef9a4361bb41e0207f253d [0,1,0,1,0,0|1,0,0]=3 20468 B13R1.670 CCCCCN1CCC[C@H]1C(F)F bfb343d19434be423efd9f18cace346b [0,1,0,1,0,0|2,0,0]=4 20469 B13R1.670 CCCCCN1CCC[C@H]1[C@H](C)O 1d75cbc09b70dda4f3e89d234e5380e2 [0,1,0,1,0,0|0,0,0]=2 20470 B13R1.670 CCCCN[C@@H]1CCC[C@@H]1C(=O)O 1ae0b8569cf9a9add47ec52e1dbee0a7 [0,1,0,1,0,0|1,0,1]=4 20471 B13R1.670 CCCCN[C@@H]1CCC[C@H]1N(C)C 165297009d9ced88389ffd7ee123717b [0,1,0,1,0,0|2,0,0]=4 20472 B13R1.670 CCCCN[C@H]1CCC[C@@H]1C(=O)O 83dabc2287cbf509873a8a4f6782598b [0,1,0,1,0,0|1,0,1]=4 20473 B13R1.670 CCCCN[C@H]1CCC[C@@H]1N(C)C 32447993422d91a3410e002c18ce164f [0,1,0,1,0,0|2,0,0]=4 20474 B13R1.670 CCCCN[C@H]1CCC[C@H]1C(=O)O 99a7cd8afcbeec1cb6c4bac2d0533f8d [0,1,0,1,0,0|1,0,1]=4 20475 B13R1.670 CCCCOC1CCCC1C(=O)O d9c4e0f12fb20cd1c7a8309ac1081e86 [0,1,0,1,0,0|1,0,1]=4 20476 B13R1.670 CCCCOC1CCCC1C(C)C 27e76cda03a40ba02bf17a789bc05e7c [0,1,0,1,0,0|1,0,0]=3 20477 B13R1.670 CCCCOC1CCCC1N(C)C 15c9c9cac91a34cfdaa5dafef6c6837d [0,1,0,1,0,0|2,0,0]=4 20478 B13R1.670 CCCCO[C@@H]1CCC[C@@H]1C(=O)O 276bdcfe96692f65c82bb54a5125e7b6 [0,1,0,1,0,0|1,0,1]=4 20479 B13R1.670 CCCCO[C@@H]1CCC[C@H]1C(=O)O 71b7999169ca81625689d875852522a9 [0,1,0,1,0,0|1,0,1]=4 20480 B13R1.670 CCCCO[C@@H]1CCC[C@H]1N(C)C 9ee8cac49a31c4e6fee47caa03d797f6 [0,1,0,1,0,0|2,0,0]=4 20481 B13R1.670 CCCCO[C@H]1CCC[C@H]1C(=O)O 3de144c897b72cb1030f8177c0317506 [0,1,0,1,0,0|1,0,1]=4 20482 B13R1.670 CCCNCC1CCCN1C(C)C dc899385512f5ee50c03c4fdbe40e864 [0,1,0,1,0,0|2,0,0]=4 20483 B13R1.670 CCCOCC1CCCN1C(C)C b0c94d1e6a12da3572baedfb5f5425d7 [0,1,0,1,0,0|2,0,0]=4 20484 B13R1.670 CCCOC[C@@H]1CCCN1C(C)C 21da10251c5ee94b62eb2c1d11177861 [0,1,0,1,0,0|2,0,0]=4 20485 B13R1.670 CCCOC[C@H]1CCCN1C(C)C c40042f807aea681bdf9e3a724e46b36 [0,1,0,1,0,0|2,0,0]=4 20486 B13R1.670 CCOCCN1CCCC1C(C)C 965a0fc82445fd2c41284e6998cd66f0 [0,1,0,1,0,0|2,0,0]=4 20487 B13R1.670 CCOCCN1CCCC1C(C)O 2190440489b9138b11d615af1829178a [0,1,0,1,0,0|1,0,0]=3 20488 B13R1.670 CCOCCN1CCC[C@@H]1C(C)O b81b52a734e296c14b52787d463ed726 [0,1,0,1,0,0|1,0,0]=3 20489 B13R1.670 CCOCCN1CCC[C@H]1C(C)C d2752ac4752a389ba38ce17b43d4b1cf [0,1,0,1,0,0|2,0,0]=4 20490 B13R1.670 CCOCCN1CCC[C@H]1[C@H](C)O c62afb4a20dc5afc94f2930c5bd01091 [0,1,0,1,0,0|1,0,0]=3 20491 B13R1.670 CCOCOC1CCCC1C(C)C 91707c5389e1196029f34b3080f915b0 [0,1,0,1,0,0|2,0,0]=4 20492 B13R1.670 CCSCCN1CCCC1C(C)C 4bb448baa6139fb20c28567984c839a6 [0,1,0,1,0,0|2,0,0]=4 20493 B13R1.670 CCSCCN1CCCC1C(C)O badb8f8cf68b205bd0d67c7987f859c5 [0,1,0,1,0,0|1,0,0]=3 20494 B13R1.670 CCSCCN1CCC[C@@H]1C(C)O c138233a49c21d4a583d2898b225c737 [0,1,0,1,0,0|1,0,0]=3 20495 B13R1.670 CCSCCN1CCC[C@H]1C(C)C cde8985ec2ed6751b187a1a4c0878d15 [0,1,0,1,0,0|2,0,0]=4 20496 B13R1.670 CCSCCN1CCC[C@H]1[C@H](C)O 07e331166065a010e5a43bbdd6debe6e [0,1,0,1,0,0|1,0,0]=3 20497 B13R1.670 COCCCN1CCCC1C(C)C 9303b31425ee8b90a4e438a2fdd68ea9 [0,1,0,1,0,0|2,0,0]=4 20498 B13R1.670 COCCCN1CCCC1C(C)O 7e71580be01f64c3d9d83df04d5b5841 [0,1,0,1,0,0|1,0,0]=3 20499 B13R1.670 COCCCN1CCC[C@@H]1C(C)O ce2d524adb934d22ace54b93def6c20e [0,1,0,1,0,0|1,0,0]=3 20500 B13R1.670 COCCCN1CCC[C@H]1C(C)C 3b22837ff74caa4b723a289795b2c256 [0,1,0,1,0,0|2,0,0]=4 20501 B13R1.670 COCCCN1CCC[C@H]1[C@H](C)O adaad642841c961323e57ea3b1c8c8a3 [0,1,0,1,0,0|1,0,0]=3 20502 B13R1.670 COCCOC1CCCC1C(C)C 7e41f6df33a3c35a5daffa693bf3813e [0,1,0,1,0,0|2,0,0]=4 20503 B13R1.670 CSCCCN1CCCC1C(C)C d9bd43dcfb372464b4e9d4a3baf28682 [0,1,0,1,0,0|2,0,0]=4 20504 B13R1.670 CSCCCN1CCCC1C(C)O 30b860ef8c03b33a488dfd40ed01a352 [0,1,0,1,0,0|1,0,0]=3 20505 B13R1.670 CSCCCN1CCC[C@@H]1C(C)O 7a459fa7466302f2320542013ae7448f [0,1,0,1,0,0|1,0,0]=3 20506 B13R1.670 CSCCCN1CCC[C@H]1C(C)C b6b22a1738a8fae5f27ed384ad06bd0d [0,1,0,1,0,0|2,0,0]=4 20507 B13R1.670 CSCCCN1CCC[C@H]1[C@H](C)O 695488275b45683fe3669184c2ae3aec [0,1,0,1,0,0|1,0,0]=3 20508 B13R1.670 CSCCOC1CCCC1C(C)C ecbd0499b3f1013a67eace7255006901 [0,1,0,1,0,0|2,0,0]=4 20509 B13R1.670 C[C@H](O)[C@@H]1CCCN1CCCC#N e402a5e251c59cd85bf895c1fc3e4287 [0,1,0,1,0,0|1,0,1]=4 20510 B13R1.670 C[C@H](O)[C@@H]1CCCN1CCCC=O f29991f6539d760056db794e96145189 [0,1,0,1,0,0|1,0,1]=4 20511 B13R1.670 C[C@H](O)[C@@H]1CCCN1CCCCF 5a45f84df7696a85701c843025d0c325 [0,1,0,1,0,0|1,0,0]=3 20512 B13R1.670 C[C@H](O)[C@@H]1CCCN1CCCCO f3e39b396fbd38fdcea9e17ac940f1f3 [0,1,0,1,0,0|1,0,0]=3 20513 B13R1.1022 C=C(C)CCN1CCCCCCC1 66cabb7d82deac5bfb135f20f0492e08 [0,1,0,1,0,0|1,0,1]=4 20514 B13R1.1022 C=C(C)CNC1CCCCCCC1 879cf9bcacafd09e497b718019162988 [0,1,0,1,0,0|1,0,1]=4 20515 B13R1.1022 C=C(C)COC1CCCCCCC1 023f65b8fb6106217895f73fbb082a00 [0,1,0,1,0,0|1,0,1]=4 20516 B13R1.1022 CC(=O)CCN1CCCCCCC1 3b00eac956e0075df78ffa0c88023f76 [0,1,0,1,0,0|0,0,2]=4 20517 B13R1.1022 CC(C)CCN1CCCCCCC1 eb8b9d8314cbefd2e3c9ee99f3804f55 [0,1,0,1,0,0|1,0,0]=3 20518 B13R1.1022 CC(C)CNC1CCCCCCC1 c4fb0ea33ccaa9f29ce6d2791a1d095e [0,1,0,1,0,0|1,0,0]=3 20519 B13R1.1022 CC(C)COC1CCCCCCC1 5345d23995ce7df26aadf8bf21ae0754 [0,1,0,1,0,0|1,0,0]=3 20520 B13R1.1022 CC(C)OCC1CCCCCCC1 df7fa6a5d1fb55a8a6af45e7f34975c0 [0,1,0,1,0,0|1,0,0]=3 20521 B13R1.1022 CC(C)OCN1CCCCCCC1 bf1eeedbb56688b94a57914fb76d5add [0,1,0,1,0,0|2,0,0]=4 20522 B13R1.1022 CC(O)CCN1CCCCCCC1 2ea9425b66e660f656adefe15a7bd09b [0,1,0,1,0,0|0,0,0]=2 20523 B13R1.1022 CC(O)CNC1/C=C\CCCCC1 64a99fbec1a2782d1051a9956eeba821 [0,1,0,1,0,0|0,0,2]=4 20524 B13R1.1022 CC(O)CNC1CC/C=C\CCC1 e8f16f9d8915f4e3b3e7801c9681ca8d [0,1,0,1,0,0|0,0,2]=4 20525 B13R1.1022 CC(O)CNC1CCCCCCC1 17ecc1eb0d03a2b5130a9ccf5d117efb [0,1,0,1,0,0|0,0,0]=2 20526 B13R1.1022 CN(C)CCN1CCCCCCC1 c8ef288323d0338a3391d7fe4c05e01a [0,1,0,1,0,0|2,0,0]=4 20527 B13R1.1022 CN(C)CNC1CCCCCCC1 474e3f173b8ff30bb2d1eac9064ff703 [0,1,0,1,0,0|2,0,0]=4 20528 B13R1.1022 CN(C)COC1CCCCCCC1 f76dc52819ac25381fc0a1af23f193a5 [0,1,0,1,0,0|2,0,0]=4 20529 B13R1.1022 CS(=O)CCN1CCCCCCC1 c2e23091688f8f65cf8e012bb419afd2 [0,1,0,1,0,0|1,0,1]=4 20530 B13R1.1022 C[C@@H](O)CNC1/C=C\CCCCC1 c5cc8cf9dc18aa4b07dbd3598872e541 [0,1,0,1,0,0|0,0,2]=4 20531 B13R1.1022 C[C@@H](O)CNC1CC/C=C\CCC1 c4b1ea3268d4ba308874d20ea5f85168 [0,1,0,1,0,0|0,0,2]=4 20532 B13R1.1022 C[C@@H](O)CNC1CCCCCCC1 640fbb2fe694d32be7b4b8512cb17ae1 [0,1,0,1,0,0|0,0,0]=2 20533 B13R1.1022 C[C@H](O)CNC1/C=C\CCCCC1 79f99a3b3ff7f5738118e10062e67634 [0,1,0,1,0,0|0,0,2]=4 20534 B13R1.1022 C[C@H](O)CNC1CC/C=C\CCC1 3ce5d73ef60a238ce95b0d2f9646aa9f [0,1,0,1,0,0|0,0,2]=4 20535 B13R1.1022 C[C@H](O)CNC1CCCCCCC1 f9b71f245c21c2aeaf68e1aa25358244 [0,1,0,1,0,0|0,0,0]=2 20536 B13R1.1022 FC(F)CNC1CCCCCCC1 6c3f10fcb0f8b778444474331fc5afab [0,1,0,1,0,0|2,0,0]=4 20537 B13R1.1022 FC(F)COC1CCCCCCC1 216ebcfb9100dfe304f05cac2f5c861d [0,1,0,1,0,0|2,0,0]=4 20538 B13R1.1022 O=C(O)CCN1CCCCCCC1 a14b82353515aefd377f547bac034059 [0,1,0,1,0,0|1,0,1]=4 20539 B13R1.1022 O=C(O)CNC1CCCCCCC1 c2c73feb3b8b9bcc610ad9a77cda9a1d [0,1,0,1,0,0|1,0,1]=4 20540 B13R1.1022 O=C(O)COC1CCCCCCC1 330e5c3b40bed0a56476ad6153361f77 [0,1,0,1,0,0|1,0,1]=4 20541 B13R1.1052 C=C(C)CCCOCCCC1CC1 29e9551518ed384e7c26c8fe9796d9ec [0,1,0,1,0,0|1,0,1]=4 20542 B13R1.1052 CC(=O)CCCCCNCC1CC1 b8afe6ca277b4ce587a1af36b241a936 [0,1,0,1,0,0|0,0,2]=4 20543 B13R1.1052 CC(=O)CCCCCOCC1CC1 3ecc6372d09dcf8c2706e75f73fe85dd [0,1,0,1,0,0|0,0,2]=4 20544 B13R1.1052 CC(=O)CCCCNCCC1CC1 7ea69b78b481bbce531be3892cd59d23 [0,1,0,1,0,0|0,0,2]=4 20545 B13R1.1052 CC(=O)CCCCOCCC1CC1 363000089f573aada249e90c8a970405 [0,1,0,1,0,0|0,0,2]=4 20546 B13R1.1052 CC(=O)CCCOCCCC1CC1 6f012c7d1afbb05d6a5c7c5ad0bf89a8 [0,1,0,1,0,0|0,0,2]=4 20547 B13R1.1052 CC(C)CCCCCCNC1CC1 ec9067fd506f5430a61d9ac737ba37a6 [0,1,0,1,0,0|1,0,0]=3 20548 B13R1.1052 CC(C)CCCCCCOC1CC1 66340b5fe74ac0f03e477d829569c7a8 [0,1,0,1,0,0|1,0,0]=3 20549 B13R1.1052 CC(C)CCCCCNCC1CC1 1963566b5cd413a18ccdfa97582d2e6e [0,1,0,1,0,0|1,0,0]=3 20550 B13R1.1052 CC(C)CCCCCOCC1CC1 8897543772bfbcb70e06a73286eebf01 [0,1,0,1,0,0|1,0,0]=3 20551 B13R1.1052 CC(C)CCCCNCCC1CC1 db345dc8204cca5f35b836f9dec66cae [0,1,0,1,0,0|1,0,0]=3 20552 B13R1.1052 CC(C)CCCCNCCN1CC1 bb375c7906fc2aa9f8eef963f2ffc7f5 [0,1,0,1,0,0|2,0,0]=4 20553 B13R1.1052 CC(C)CCCCOCCC1CC1 e7d2e1105caabc198ecee048b31505f0 [0,1,0,1,0,0|1,0,0]=3 20554 B13R1.1052 CC(C)CCCCOCCN1CC1 e4b16e7f2237aa926aa8cf4a0d6792c5 [0,1,0,1,0,0|2,0,0]=4 20555 B13R1.1052 CC(C)CCCNCCOC1CC1 69ff7b2e18b57ae7dd2d095966c6bc0c [0,1,0,1,0,0|2,0,0]=4 20556 B13R1.1052 CC(C)CCCOCCCC1CC1 0daed52a628d528dedbb73c5f463d867 [0,1,0,1,0,0|1,0,0]=3 20557 B13R1.1052 CC(C)CCCOCCOC1CC1 e9644cf7fcfed382b93e256df0eb7a63 [0,1,0,1,0,0|2,0,0]=4 20558 B13R1.1052 CC(C)CCNCCSCC1CC1 0edae0d7701e49ffb70c52f8f5182a35 [0,1,0,1,0,0|2,0,0]=4 20559 B13R1.1052 CC(C)CCOCCCSC1CC1 564377b3ac280c826eae169e7c84de29 [0,1,0,1,0,0|2,0,0]=4 20560 B13R1.1052 CC(C)CCOCCOCC1CC1 de4eb03c5a9ed3950fc5f7d54ab3a599 [0,1,0,1,0,0|2,0,0]=4 20561 B13R1.1052 CC(C)CNCCCOCC1CC1 a1162aa90d202a96e32734f79022b7ed [0,1,0,1,0,0|2,0,0]=4 20562 B13R1.1052 CC(C)COCCCNCC1CC1 2e788ccfd32bde5ed5600545f90b9efa [0,1,0,1,0,0|2,0,0]=4 20563 B13R1.1052 CC(C)COCCCOCC1CC1 8df2078c0619edbe2bbcafcc912633f2 [0,1,0,1,0,0|2,0,0]=4 20564 B13R1.1052 CC(C)COCCNCCC1CC1 1da9b6f343a20c9312787a2ad78ad2d0 [0,1,0,1,0,0|2,0,0]=4 20565 B13R1.1052 CC(C)COCCOCCC1CC1 34bad3c2c7fc8f1b453a5a6122a76735 [0,1,0,1,0,0|2,0,0]=4 20566 B13R1.1052 CC(C)CSCCCCNC1CC1 567b5d0edae4d8c20c81201fb2dfd994 [0,1,0,1,0,0|2,0,0]=4 20567 B13R1.1052 CC(C)CSCCCOCC1CC1 3133a994d506c2d05f77ae51597b0d36 [0,1,0,1,0,0|2,0,0]=4 20568 B13R1.1052 CC(C)CSCCOCCC1CC1 6b73a53283c402c30070ca6c64707cab [0,1,0,1,0,0|2,0,0]=4 20569 B13R1.1052 CC(C)OCCCNCCC1CC1 0826f185ad238d1bf6ec105b3e6a9c54 [0,1,0,1,0,0|2,0,0]=4 20570 B13R1.1052 CC(C)OCCCOCCC1CC1 04ce0ebf8417d1db205331beb910952d [0,1,0,1,0,0|2,0,0]=4 20571 B13R1.1052 CC(C)OCCOCCCC1CC1 a4b84e890258147420ed5a5ec2042f03 [0,1,0,1,0,0|2,0,0]=4 20572 B13R1.1052 CC(C)SCCCNCCC1CC1 cd8d8de74efa59ed6242cfe9a48fa716 [0,1,0,1,0,0|2,0,0]=4 20573 B13R1.1052 CC(C)SCCCOCCC1CC1 27c233fc70243d6b4428470361797ea5 [0,1,0,1,0,0|2,0,0]=4 20574 B13R1.1052 CC(C)SCCOCCCC1CC1 12171bfc15edca94a933cc5870898c9b [0,1,0,1,0,0|2,0,0]=4 20575 B13R1.1052 CC(O)CCCCNCCC1CC1 50a4b04deeaeeefd6da040c218a80137 [0,1,0,1,0,0|0,0,0]=2 20576 B13R1.1052 CC(O)CCCCNCCN1CC1 b06820c6a5068ebbd4ddb0fdcbb70f20 [0,1,0,1,0,0|1,0,0]=3 20577 B13R1.1052 CC(O)CCCNCCOC1CC1 4d7fa7f4a96b979b9cc4ed67b5a8ab77 [0,1,0,1,0,0|1,0,0]=3 20578 B13R1.1052 CC(O)CCNCCCC=C1CC1 0359440c0b846ecd357f7e8778463ef1 [0,1,0,1,0,0|0,0,2]=4 20579 B13R1.1052 CC(O)CCNCCSCC1CC1 325a9b09777dbe7d1177ba5ec646fc30 [0,1,0,1,0,0|1,0,0]=3 20580 B13R1.1052 CC(O)CNCCCOCC1CC1 09e80f8083bb4703476559b1b2fa0803 [0,1,0,1,0,0|1,0,0]=3 20581 B13R1.1052 CN(C)CCCCCCNC1CC1 b4ee32d96ecd35936b9bc5675c9b177a [0,1,0,1,0,0|2,0,0]=4 20582 B13R1.1052 CN(C)CCCCCCOC1CC1 34c44fdf32a735017b9550d88c1624a7 [0,1,0,1,0,0|2,0,0]=4 20583 B13R1.1052 CN(C)CCCCCNCC1CC1 a5cf8f3e686e51d05939d6a466144118 [0,1,0,1,0,0|2,0,0]=4 20584 B13R1.1052 CN(C)CCCCCOCC1CC1 e8703a79b5f0f1a9ce0e397937427d5d [0,1,0,1,0,0|2,0,0]=4 20585 B13R1.1052 CN(C)CCCCNCCC1CC1 41536bd2707cd34f21baa0dc29cf9aaa [0,1,0,1,0,0|2,0,0]=4 20586 B13R1.1052 CN(C)CCCCOCCC1CC1 e1e5cd1d4d8a4edbfca46a8500dc3d0d [0,1,0,1,0,0|2,0,0]=4 20587 B13R1.1052 CN(C)CCCOCCCC1CC1 f9e944486da4441f8e360fcfd79d5020 [0,1,0,1,0,0|2,0,0]=4 20588 B13R1.1052 C[C@@H](O)CCCCNCCC1CC1 04def9a853f86bbdb10a705b829ec296 [0,1,0,1,0,0|0,0,0]=2 20589 B13R1.1052 C[C@@H](O)CCCCNCCN1CC1 192d0fc004adc59c34f1dda930bfc884 [0,1,0,1,0,0|1,0,0]=3 20590 B13R1.1052 C[C@@H](O)CCNCCCC=C1CC1 53c1e46048554c9513fbee93acec7588 [0,1,0,1,0,0|0,0,2]=4 20591 B13R1.1052 C[C@@H](O)CNCCCOCC1CC1 b75ae7d398945212aeb5daef0bdb6cc7 [0,1,0,1,0,0|1,0,0]=3 20592 B13R1.1052 C[C@H](O)CCNCCCC=C1CC1 1ed569c8884ee1052937a31b88e3d021 [0,1,0,1,0,0|0,0,2]=4 20593 B13R1.1052 C[C@H](O)CNCCCOCC1CC1 3bc19944c7502ff5d70a4baa98387424 [0,1,0,1,0,0|1,0,0]=3 20594 B13R1.1052 FC(F)CCCCCNCC1CC1 9ffa0d8752ad1722e57c45a79dadc30f [0,1,0,1,0,0|2,0,0]=4 20595 B13R1.1052 FC(F)CCCCCOCC1CC1 d43f52c288d17c114d23074ab4328aa3 [0,1,0,1,0,0|2,0,0]=4 20596 B13R1.1052 FC(F)CCCCNCCC1CC1 0c2ef6d2e3a3a59b2604c2af1d5ebb64 [0,1,0,1,0,0|2,0,0]=4 20597 B13R1.1052 O=C(O)CCCCCCNC1CC1 ce789a676804ab8cac3c43c3e501071c [0,1,0,1,0,0|1,0,1]=4 20598 B13R1.1052 O=C(O)CCCCCCOC1CC1 d87c2a6a9e2308464cdf91a36a070058 [0,1,0,1,0,0|1,0,1]=4 20599 B13R1.1052 O=C(O)CCCCCNCC1CC1 55e40ed106c7f27256369d017570ffcd [0,1,0,1,0,0|1,0,1]=4 20600 B13R1.1052 O=C(O)CCCCCOCC1CC1 9411dba4e574c9b284a00a5f647dd4f3 [0,1,0,1,0,0|1,0,1]=4 20601 B13R1.1052 O=C(O)CCCCNCCC1CC1 01b51213ef7ea33759dfb3293e8a7982 [0,1,0,1,0,0|1,0,1]=4 20602 B13R1.1052 O=C(O)CCCCOCCC1CC1 eab4f83b8c0e44bdd764694a9d4b057f [0,1,0,1,0,0|1,0,1]=4 20603 B13R1.1148 C#CCCCN1CCCCC(C1)O 64e7829a2dd6d2cad3a2a67746c5ce65 [0,1,0,1,0,0|0,0,2]=4 20604 B13R1.1148 C#CCCCN1CCCC[C@H](C1)O 58963aab4de17eafa6f99797324b57c0 [0,1,0,1,0,0|0,0,2]=4 20605 B13R1.1148 C=CCCCN1CCCCC(C1)O df15ce90e2e721ffdf7489fe61413342 [0,1,0,1,0,0|0,0,2]=4 20606 B13R1.1148 C=CCCCN1CCCC[C@H](C1)O 01958485b012cfcd37274d180ec357e4 [0,1,0,1,0,0|0,0,2]=4 20607 B13R1.1148 CC/C=C/CN1CCCCC(C1)O 1c687eb6049c018cc489026ad7987774 [0,1,0,1,0,0|0,0,2]=4 20608 B13R1.1148 CC/C=C/CN1CCCC[C@H](C1)O 3981fbf144ed3efd5d7346ce548b8a53 [0,1,0,1,0,0|0,0,2]=4 20609 B13R1.1148 CCC#CCN1CCCCC(C1)O 2c221c36a4342532ebf17984d45d8226 [0,1,0,1,0,0|0,0,2]=4 20610 B13R1.1148 CCC#CCN1CCCC[C@H](C1)O 1e4ccaa260bec42906a77e516271e165 [0,1,0,1,0,0|0,0,2]=4 20611 B13R1.1148 CCCCCN1CCCCC(C1)O 1d354b762b6901b51988e4d94a79fb19 [0,1,0,1,0,0|0,0,0]=2 20612 B13R1.1148 CCCCCN1CCCC[C@H](C1)O f01d551c3bfcea7abcde16f1b3642d89 [0,1,0,1,0,0|0,0,0]=2 20613 B13R1.1148 CCCCCN1CCCOC(C1)C cbf2682ad040fd2dfc9756b5d5683daa [0,1,0,1,0,0|2,0,0]=4 20614 B13R1.1148 CCCCCN1CCOCC(C1)F d4f811d9f4377bd910dcc232bd967707 [0,1,0,1,0,0|2,0,0]=4 20615 B13R1.1148 CCCCCN1CCOCC(C1)O ad79ea7779f8fbca3e77279dd48b2224 [0,1,0,1,0,0|1,0,0]=3 20616 B13R1.1148 CCCCCN1CCOC[C@@H](C1)F 590aae06a5d77d7edc6c8d0274af34c9 [0,1,0,1,0,0|2,0,0]=4 20617 B13R1.1148 CCCCCN1CCOC[C@@H](C1)O a9651e3f669c6e18c0cec9da0e5ea889 [0,1,0,1,0,0|1,0,0]=3 20618 B13R1.1148 CCCCCN1CCOC[C@H](C1)F 7cc2b5aab147ba28f55e53edf97a35d4 [0,1,0,1,0,0|2,0,0]=4 20619 B13R1.1148 CCCCCN1CCOC[C@H](C1)O a05a0b4fe86aef6b7f132149b2efe0fa [0,1,0,1,0,0|1,0,0]=3 20620 B13R1.1148 CCCCNC1CCCCN(C1)C 0ff19441e70a8bf892554d193b4ad2e9 [0,1,0,1,0,0|2,0,0]=4 20621 B13R1.1148 CCCCN[C@@H]1CCCCN(C1)C d1602f81765d037556418182a8a14d80 [0,1,0,1,0,0|2,0,0]=4 20622 B13R1.1148 CCCCN[C@H]1CCCCN(C1)C b74d5c242d073f8404f607c7ef84233d [0,1,0,1,0,0|2,0,0]=4 20623 B13R1.1148 CCOCCN1CCCCC(C1)O 8807f34e0a62a22c9d9166e68287ebfd [0,1,0,1,0,0|1,0,0]=3 20624 B13R1.1148 CCOCCN1CCCC[C@H](C1)O 02dc4cd21caf955cad81a256db48f51d [0,1,0,1,0,0|1,0,0]=3 20625 B13R1.1148 CCOCCN1CCOCC(C1)O 190f1aabdbe13a3f1d62cc22bbc970a0 [0,1,0,1,0,0|2,0,0]=4 20626 B13R1.1148 CCOCCN1CCOC[C@@H](C1)O 1eaea392f59a4840bacdbf9375cb9955 [0,1,0,1,0,0|2,0,0]=4 20627 B13R1.1148 CCOCCN1CCOC[C@H](C1)O 16b8b4a8d6bb21f5b9d6aa81c342f038 [0,1,0,1,0,0|2,0,0]=4 20628 B13R1.1148 CCSCCN1CCCCC(C1)O f83b154635e2cd0697a91d8b9c1da333 [0,1,0,1,0,0|1,0,0]=3 20629 B13R1.1148 CCSCCN1CCCC[C@H](C1)O f109b6d2754c8590a0e5d187bf7084c9 [0,1,0,1,0,0|1,0,0]=3 20630 B13R1.1148 CCSCCN1CCOCC(C1)O 3de79bc7f0365692570029582abc62fb [0,1,0,1,0,0|2,0,0]=4 20631 B13R1.1148 CCSCCN1CCOC[C@@H](C1)O f3ccc268835e84edb1c88d7a27b649f9 [0,1,0,1,0,0|2,0,0]=4 20632 B13R1.1148 CCSCCN1CCOC[C@H](C1)O 904e22feef8c56617e8c880d7ab8dfd0 [0,1,0,1,0,0|2,0,0]=4 20633 B13R1.1148 COCCCN1CCCCC(C1)O 0f41b3ee4dbf4c6ddc23dc603b3e75ec [0,1,0,1,0,0|1,0,0]=3 20634 B13R1.1148 COCCCN1CCCC[C@H](C1)O 69738890cf5efcecfcb7a82857fb79c9 [0,1,0,1,0,0|1,0,0]=3 20635 B13R1.1148 COCCCN1CCOCC(C1)O 34a030f74c3d1e106f1ca1d58f979c8b [0,1,0,1,0,0|2,0,0]=4 20636 B13R1.1148 COCCCN1CCOC[C@@H](C1)O 5a2dbd520cd1dfa54f78660180c73527 [0,1,0,1,0,0|2,0,0]=4 20637 B13R1.1148 COCCCN1CCOC[C@H](C1)O d10452840c23f6d3dd1008c598c20c0b [0,1,0,1,0,0|2,0,0]=4 20638 B13R1.1148 CSCCCN1CCCCC(C1)O 9dd9b5ae553ea963e22c5cd7441d8751 [0,1,0,1,0,0|1,0,0]=3 20639 B13R1.1148 CSCCCN1CCCC[C@H](C1)O 9c178dc6739eb5cf974667c88620dafd [0,1,0,1,0,0|1,0,0]=3 20640 B13R1.1148 CSCCCN1CCOCC(C1)O 765c30d20bd729d0b7744d33636a3448 [0,1,0,1,0,0|2,0,0]=4 20641 B13R1.1148 CSCCCN1CCOC[C@@H](C1)O 2a152bad0feaf044291e86c3ee0138fc [0,1,0,1,0,0|2,0,0]=4 20642 B13R1.1148 CSCCCN1CCOC[C@H](C1)O 638b5a267ffd60d03e9bb1ced3dbcb77 [0,1,0,1,0,0|2,0,0]=4 20643 B13R1.1148 N#CCCCN1CCCCC(C1)O 82ddd69266ba8c702aecad3ead5acbc1 [0,1,0,1,0,0|1,0,1]=4 20644 B13R1.1148 N#CCCCN1CCCC[C@H](C1)O 3917683cfaecc93d82b0f483674b32bc [0,1,0,1,0,0|1,0,1]=4 20645 B13R1.1148 O=CCCCN1CCCCC(C1)O 0058dab1a66b652b2032f6594d176ed4 [0,1,0,1,0,0|1,0,1]=4 20646 B13R1.1148 O=CCCCN1CCCC[C@H](C1)O d62b676c978ed2cbf50c174295299a86 [0,1,0,1,0,0|1,0,1]=4 20647 B13R1.1148 OC1CCCCN(C1)CCCCF 7f5a7b1c10666548ea25b467f4a16ddd [0,1,0,1,0,0|1,0,0]=3 20648 B13R1.1148 OC1COCCN(C1)CCCCF 339ad633254d1395d4ab1572c43681a4 [0,1,0,1,0,0|2,0,0]=4 20649 B13R1.1148 OCCCCN1CCCCC(C1)O 036ca639e69e5d4138f29c0c0e7b499c [0,1,0,1,0,0|1,0,0]=3 20650 B13R1.1148 OCCCCN1CCCC[C@H](C1)O a3092f2aacdf7cbbc317af7eb80c6c87 [0,1,0,1,0,0|1,0,0]=3 20651 B13R1.1148 OCCCCN1CCOCC(C1)O 2438085113153fc96e5c5c20bcbf9248 [0,1,0,1,0,0|2,0,0]=4 20652 B13R1.1148 OCCCCN1CCOC[C@@H](C1)O 477671f36ffafb9a8e70f032ec305dba [0,1,0,1,0,0|2,0,0]=4 20653 B13R1.1148 OCCCCN1CCOC[C@H](C1)O a2c21f38c4f8bc29698dd0809f29ee9d [0,1,0,1,0,0|2,0,0]=4 20654 B13R1.1148 O[C@@H]1CCCCN(C1)CCCCF 5a1ca3c4065b624d194b2341e3944d70 [0,1,0,1,0,0|1,0,0]=3 20655 B13R1.1148 O[C@@H]1COCCN(C1)CCCCF 7210c2d231e5da8800d4c739e42acc26 [0,1,0,1,0,0|2,0,0]=4 20656 B13R1.1148 O[C@H]1COCCN(C1)CCCCF 582e6b847f5bfd2791669594d99ac5d8 [0,1,0,1,0,0|2,0,0]=4 20657 B13R1.2852 CCCCCN1CCC1CC(=O)O 3463dfe593752106103b4c86e544596c [0,1,0,1,0,0|1,0,1]=4 20658 B13R1.2970 CC1(CCC1OCCCCCF)C b36f63a7a3320b7820d209ec44c0bcbf [0,1,0,1,0,0|2,0,0]=4 20659 B13R1.2970 CCCCCCNC1CCC1(F)F cdfa38fb71315a762dc8132f329ddb96 [0,1,0,1,0,0|2,0,0]=4 20660 B13R1.2970 CCCCCCNC1COC1(C)C 628a4ce412f39e3b6bca755bc1d2028d [0,1,0,1,0,0|2,0,0]=4 20661 B13R1.2970 CCCCCCOC1CCC1(C)C 4bf4e0635933d802c59a070f7f3ff6fd [0,1,0,1,0,0|1,0,0]=3 20662 B13R1.2970 CCCCCCOC1CCC1(F)F 64147db2f9d7094bcf5ef0ea9f7763d3 [0,1,0,1,0,0|2,0,0]=4 20663 B13R1.2970 CCCCCCOC1COC1(C)C 9f461e3a5a086e84e2b0d56a20b85afe [0,1,0,1,0,0|2,0,0]=4 20664 B13R1.2970 CCCCCNCC1CCC1(F)F 0af72b03e92b6057ab2cae35e440d900 [0,1,0,1,0,0|2,0,0]=4 20665 B13R1.2970 CCCCCNCC1OCC1(C)C 16df258a2091c678f71ac95362b6c4ce [0,1,0,1,0,0|2,0,0]=4 20666 B13R1.2970 CCCCCOCC1CCC1(F)F c467278bb7439582d9e7143cc387e92c [0,1,0,1,0,0|2,0,0]=4 20667 B13R1.2970 CCCCCOCC1COC1(C)C 95529e1b9c500a96a272feec2e26c9ca [0,1,0,1,0,0|2,0,0]=4 20668 B13R1.2970 CCCCOCOC1CCC1(C)C 8f23360971b871800a61ede13955a705 [0,1,0,1,0,0|2,0,0]=4 20669 B13R1.2970 CCCOCCOC1CCC1(C)C 6e0ff54bd114d40ca6b1e60145f7483a [0,1,0,1,0,0|2,0,0]=4 20670 B13R1.2970 CCOCCCOC1CCC1(C)C 3b5a45f9a9ba0e0302b45137faadf70c [0,1,0,1,0,0|2,0,0]=4 20671 B13R1.2970 CCSCCCOC1CCC1(C)C 6f035ea8e620c1e7b013b85c523ef03f [0,1,0,1,0,0|2,0,0]=4 20672 B13R1.2970 COCCCCOC1CCC1(C)C 748f70de6dae34606ff632caf47f4f93 [0,1,0,1,0,0|2,0,0]=4 20673 B13R1.3435 CCCCCCN1CCC1C(=O)O 9b2a45857490d7256797958957cb43ad [0,1,0,1,0,0|1,0,1]=4 20674 B13R1.3435 CCCCCCN1CC[C@@H]1C(=O)O 9eba1e4962a11225f662a6f2f378e551 [0,1,0,1,0,0|1,0,1]=4 20675 B13R1.3435 CCCCCCN1CC[C@H]1C(=O)O d6ecb35f933e8ef86da4853dda1d83a4 [0,1,0,1,0,0|1,0,1]=4 20676 B13R1.3435 CCCCCNC1COC1C(C)C 2a4a52532c78133436b4537f2dd41af2 [0,1,0,1,0,0|2,0,0]=4 20677 B13R1.3435 CCCCCN[C@@H]1CO[C@@H]1C(C)C 4b94cb2b50a3ec8babb9d2828291bcfb [0,1,0,1,0,0|2,0,0]=4 20678 B13R1.3435 CCCCCN[C@H]1CC[C@H]1C(=O)O 0cfc92e9df4a02a6b6d33e6db773698c [0,1,0,1,0,0|1,0,1]=4 20679 B13R1.3435 CCCCCOC1CCC1C(=O)O a826e933fa68f75a26e631284bdb6dc8 [0,1,0,1,0,0|1,0,1]=4 20680 B13R1.3435 CCCCCO[C@H]1CC[C@@H]1C(=O)O 164787dd678abec822897a4edb816662 [0,1,0,1,0,0|1,0,1]=4 20681 B13R1.3435 CCCCOC[C@@H]1CC[C@@H]1N(C)C cd2e6fc77ef9d8c5a844dd927a3a7a4e [0,1,0,1,0,0|2,0,0]=4 20682 B13R1.9 CCCCCCN1CCC(CC1)C 4f2bca952c04d0787258a26bcf783562 [0,1,0,1,0,0|2,0,0]=4 20683 B13R1.9 CCCCCCN1CCC(CC1)Cl 845656aea1b4fc0b7f0b59a65bbc9164 [0,1,0,1,0,0|2,0,0]=4 20684 B13R1.9 CCCCCCN1CCC(CC1)F b5a7fb4daec52e5ba7805dd4ed11ba84 [0,1,0,1,0,0|2,0,0]=4 20685 B13R1.9 CCCCCCN1CCC(CC1)I 73edd5fbffb31adabf8b7c5d457d2f07 [0,1,0,1,0,0|2,0,0]=4 20686 B13R1.9 CCCCCCN1CCC(CC1)O 7b8413675fa02c9ddb663882911e2031 [0,1,0,1,0,0|1,0,0]=3 20687 B13R1.9 CCCCCNC1CCC(CC1)C 8a3f2820c3ad515579b4b51d204dae2a [0,1,0,1,0,0|2,0,0]=4 20688 B13R1.9 CCCCCNC1CCC(CC1)Cl 08e59f01d5d595cc8a33d4a597724eca [0,1,0,1,0,0|2,0,0]=4 20689 B13R1.9 CCCCCNC1CCC(CC1)O c8870f09b2bd2d34083901ff18960d9d [0,1,0,1,0,0|1,0,0]=3 20690 B13R1.9 CCCCCN[C@H]1CC[C@@H](CC1)C 2290ccb29d2e1dfe5d94dd052ffedae1 [0,1,0,1,0,0|2,0,0]=4 20691 B13R1.9 CCCCCN[C@H]1CC[C@@H](CC1)Cl 83a0c40b5815859e8f00a4fdd2ed47a6 [0,1,0,1,0,0|2,0,0]=4 20692 B13R1.9 CCCCCN[C@H]1CC[C@@H](CC1)O a8f917c19fbee64fd7a68f982d2472a7 [0,1,0,1,0,0|1,0,0]=3 20693 B13R1.9 CCCCCN[C@H]1CC[C@H](CC1)C d4069ee30f436c8028850b5932caef2c [0,1,0,1,0,0|2,0,0]=4 20694 B13R1.9 CCCCCN[C@H]1CC[C@H](CC1)Cl d26eea82b89bbf67c2958fc7a80ad294 [0,1,0,1,0,0|2,0,0]=4 20695 B13R1.9 CCCCCN[C@H]1CC[C@H](CC1)O 659dc01cb5c580194f5dc9a1eda5f94e [0,1,0,1,0,0|1,0,0]=3 20696 B13R1.9 CCCCCOC1CCC(CC1)C 1c7cc44a73dce6aaf32f1fa6897cf5c0 [0,1,0,1,0,0|2,0,0]=4 20697 B13R1.9 CCCCCOC1CCC(CC1)F 94f88a409150b42072d217a52dba9cda [0,1,0,1,0,0|2,0,0]=4 20698 B13R1.9 CCCCCO[C@H]1CC[C@@H](CC1)C 9f92bca9b78a5f6557dbb820064e32bf [0,1,0,1,0,0|2,0,0]=4 20699 B13R1.9 CCCCCO[C@H]1CC[C@H](CC1)C 0bb281a29a3141465448b31c49e64eee [0,1,0,1,0,0|2,0,0]=4 20700 B13R1.9 CCCCNCC1CCC(CC1)C 78bb87b77d7b19dfd34d743a3daa65a1 [0,1,0,1,0,0|2,0,0]=4 20701 B13R1.9 CCCCNCC1CCC(CC1)Cl f24bed751489bdacaf048d945c13e3e2 [0,1,0,1,0,0|2,0,0]=4 20702 B13R1.9 CCCCNCC1CCC(CC1)O 2e81a39f94e05203b6c7374f326003b5 [0,1,0,1,0,0|1,0,0]=3 20703 B13R1.9 CCCCNC[C@H]1CC[C@@H](CC1)F 9a0372e62815b17251926823184855ee [0,1,0,1,0,0|2,0,0]=4 20704 B13R1.9 CCCCNC[C@H]1CC[C@@H](CC1)O 7a58223c6dc154486f212a566ca1c4cc [0,1,0,1,0,0|1,0,0]=3 20705 B13R1.9 CCCCNC[C@H]1CC[C@H](CC1)F cecac294b457f20bdaa1360d212b076e [0,1,0,1,0,0|2,0,0]=4 20706 B13R1.9 CCCCOCC1CCC(CC1)C 0109a8688d9a061bfa27e1a6da7017b5 [0,1,0,1,0,0|2,0,0]=4 20707 B13R1.9 CCCCOCN1CCC(CC1)O 53ac0ca4b0c54f1a43df3c8105b56fa5 [0,1,0,1,0,0|2,0,0]=4 20708 B13R1.9 CCCCOC[C@H]1CC[C@@H](CC1)C d59c7fcebf17c8b1af4e75047241b9cd [0,1,0,1,0,0|2,0,0]=4 20709 B13R1.9 CCCCOC[C@H]1CC[C@H](CC1)C f9a1edcec2625f9bc7535ce13c5bb296 [0,1,0,1,0,0|2,0,0]=4 20710 B13R1.9 CCCNCCC1CCC(CC1)O 810a3cc19d8a821f5aa78eec73e1b068 [0,1,0,1,0,0|1,0,0]=3 20711 B13R1.9 CCCNCCN1CCC(CC1)O 2bec65f8d77da29e8573af9d6ef8ebdc [0,1,0,1,0,0|2,0,0]=4 20712 B13R1.9 CCCOCCN1CCC(CC1)O 8e370794e09291ab3a2270a611a6ad82 [0,1,0,1,0,0|2,0,0]=4 20713 B13R1.9 CCCOCC[C@H]1CC[C@@H](CC1)C 68342a7fdfa6d24480fb38f5f830876c [0,1,0,1,0,0|2,0,0]=4 20714 B13R1.9 CCNCCCN1CCC(CC1)O 0af574b9a02a80cafa0b9566c28900cd [0,1,0,1,0,0|2,0,0]=4 20715 B13R1.9 CCOCCCN1CCC(CC1)O 60ec5dae18976236ba2c9d4b6bc63725 [0,1,0,1,0,0|2,0,0]=4 20716 B13R1.9 CCOCCNC1CCC(CC1)O e9e415917430001fa3a850d2629cd79a [0,1,0,1,0,0|2,0,0]=4 20717 B13R1.9 CCOCCN[C@H]1CC[C@@H](CC1)O 4efc84c32fc135c1996fb87457ebe10b [0,1,0,1,0,0|2,0,0]=4 20718 B13R1.9 CCOCCN[C@H]1CC[C@H](CC1)O e916cce207949525aa165462f3d61c24 [0,1,0,1,0,0|2,0,0]=4 20719 B13R1.9 CCOCNCC1CCC(CC1)O 2aa9ea9370dcc4ba63be802783140586 [0,1,0,1,0,0|2,0,0]=4 20720 B13R1.9 CCOCNC[C@H]1CC[C@@H](CC1)O cb167a51852ea86576fcf40ead817fe7 [0,1,0,1,0,0|2,0,0]=4 20721 B13R1.9 CCSCCCN1CCC(CC1)O 18441a4bcc5d67c3cc1cc5228a23a622 [0,1,0,1,0,0|2,0,0]=4 20722 B13R1.9 CCSCCNC1CCC(CC1)O 2c09f133caf183efd26fb15e231f7c02 [0,1,0,1,0,0|2,0,0]=4 20723 B13R1.9 CCSCCN[C@H]1CC[C@@H](CC1)O 8e25a18e3f4bdfc6df3aa937855e9101 [0,1,0,1,0,0|2,0,0]=4 20724 B13R1.9 CCSCCN[C@H]1CC[C@H](CC1)O 075b9771ca778ee6f64c46b2e95d37a0 [0,1,0,1,0,0|2,0,0]=4 20725 B13R1.9 COCCCCN1CCC(CC1)O 5117cf953e3ed2f773b6c2a5686e7cb5 [0,1,0,1,0,0|2,0,0]=4 20726 B13R1.9 COCCCNC1CCC(CC1)O ea9f1a463674aaa8c79d39b7d79913b2 [0,1,0,1,0,0|2,0,0]=4 20727 B13R1.9 COCCCN[C@H]1CC[C@@H](CC1)O 87559d6be053c4099c025670c20fd7f5 [0,1,0,1,0,0|2,0,0]=4 20728 B13R1.9 COCCCN[C@H]1CC[C@H](CC1)O 8b40934719f3adf0f42402d796a0da18 [0,1,0,1,0,0|2,0,0]=4 20729 B13R1.9 COCCNCC1CCC(CC1)O 5aaf9f03315cba15112dbad954293380 [0,1,0,1,0,0|2,0,0]=4 20730 B13R1.9 COCCNC[C@H]1CC[C@@H](CC1)O 61ba4b7bcd5738a2f946f0b7dd7ab381 [0,1,0,1,0,0|2,0,0]=4 20731 B13R1.9 COCNCCC1CCC(CC1)O 4322f7d430e600f8c12283023fab9841 [0,1,0,1,0,0|2,0,0]=4 20732 B13R1.9 CSCCCNC1CCC(CC1)O 6ec6ec3c17f7d30ca200bc958f92045f [0,1,0,1,0,0|2,0,0]=4 20733 B13R1.9 CSCCCN[C@H]1CC[C@@H](CC1)O 290e0b0c4d1c2819e992e106b6365b15 [0,1,0,1,0,0|2,0,0]=4 20734 B13R1.9 CSCCCN[C@H]1CC[C@H](CC1)O 1a4b0cbad0ce74310ff618a2bb42397f [0,1,0,1,0,0|2,0,0]=4 20735 B13R1.9 CSCCNCC1CCC(CC1)O 722e12d0a77b1ae034b1749c65ae5d02 [0,1,0,1,0,0|2,0,0]=4 20736 B13R1.9 CSCCNC[C@H]1CC[C@@H](CC1)O 077a955f2b15748bb2bcdf4e8cf352e1 [0,1,0,1,0,0|2,0,0]=4 20737 B13R1.9 CSCNCCC1CCC(CC1)O d4a34b82da141b950a7e0d754c16e6e0 [0,1,0,1,0,0|2,0,0]=4 20738 B13R1.9 OC1CCC(CC1)CCNCCF aa6dbeb56b36b08be02a9cc93a27c865 [0,1,0,1,0,0|2,0,0]=4 20739 B13R1.9 OC1CCC(CC1)CCNCCS c65247644925315643ddeb9203255d0a [0,1,0,1,0,0|2,0,0]=4 20740 B13R1.9 OC1CCC(CC1)CNCCCF a32989c3acfb704e49b40a84e4d40bcc [0,1,0,1,0,0|2,0,0]=4 20741 B13R1.9 OC1CCC(CC1)CNCCCS 8f9ad69a31fc2a6a88428844eca14681 [0,1,0,1,0,0|2,0,0]=4 20742 B13R1.9 OC1CCC(CC1)NCCCCCl 45fcec9093cd1f95937f129761c6e745 [0,1,0,1,0,0|2,0,0]=4 20743 B13R1.9 OC1CCC(CC1)NCCCCF 4984f486e64e7c8dc7a525c9429045b1 [0,1,0,1,0,0|2,0,0]=4 20744 B13R1.9 OC1CCC(CC1)NCCCCS 097c08a13e7a202126981037c19062b0 [0,1,0,1,0,0|2,0,0]=4 20745 B13R1.9 OC1CCN(CC1)CCCCCF 6668b144c0579d8bffb6a5a5563b9e7d [0,1,0,1,0,0|2,0,0]=4 20746 B13R1.9 OCCCCCN1CCC(CC1)O 6b6403a91aa6e3261b91c68b65dfd4c3 [0,1,0,1,0,0|2,0,0]=4 20747 B13R1.9 OCCCCNC1CCC(CC1)O 2afa1f1e7c74d3c499ddcbfd3c176516 [0,1,0,1,0,0|2,0,0]=4 20748 B13R1.9 OCCCCN[C@H]1CC[C@@H](CC1)O 1f88cc8c7043401426ee6b3e25d6e4dc [0,1,0,1,0,0|2,0,0]=4 20749 B13R1.9 OCCCCN[C@H]1CC[C@H](CC1)O 86d9185e6775c9a01c2854b8331565be [0,1,0,1,0,0|2,0,0]=4 20750 B13R1.9 OCCCNCC1CCC(CC1)O 81b1a88cb62da67321cc960a63f15460 [0,1,0,1,0,0|2,0,0]=4 20751 B13R1.9 OCCCNC[C@H]1CC[C@@H](CC1)O 4bd60044229abf8edc7bbd856cbbad77 [0,1,0,1,0,0|2,0,0]=4 20752 B13R1.9 OCCNCCC1CCC(CC1)O f75f26680c56f4760648d7e89c919d9c [0,1,0,1,0,0|2,0,0]=4 20753 B13R1.9 O[C@H]1CC[C@@H](CC1)CNCCCF 2c8a29059c94a0edbb8c0eb257226d80 [0,1,0,1,0,0|2,0,0]=4 20754 B13R1.9 O[C@H]1CC[C@@H](CC1)CNCCCS 3906678f0384c9818f1e6e5753ee4bab [0,1,0,1,0,0|2,0,0]=4 20755 B13R1.9 O[C@H]1CC[C@@H](CC1)NCCCCF 087833d4326a35643c991b63521f7372 [0,1,0,1,0,0|2,0,0]=4 20756 B13R1.9 O[C@H]1CC[C@H](CC1)NCCCCF 9b783c213f55bb4d755df37d7c48d87d [0,1,0,1,0,0|2,0,0]=4 20757 B13R1.16 CC1C(CCCN1CCCCF)O 143aa92566d3e26e84c56784bff8798c [0,1,0,1,0,0|2,0,0]=4 20758 B13R1.16 CC1C(CCCN1CCCCO)O bbf81009d812107391a87f17cb3eeece [0,1,0,1,0,0|2,0,0]=4 20759 B13R1.16 CCCCCN1CCCC(C1C)O c81ba36774d5ae9ea49591125bd96a1e [0,1,0,1,0,0|1,0,0]=3 20760 B13R1.16 CCCCCN1CCC[C@@H]([C@H]1C)O 3061262ec92046fb491bd8dd9738c4a6 [0,1,0,1,0,0|1,0,0]=3 20761 B13R1.16 CCCCCN1CCC[C@H]([C@@H]1C)O 3433b345d2bcc949e1b3c1018138f700 [0,1,0,1,0,0|1,0,0]=3 20762 B13R1.16 CCCCNC1CCCC(C1C)C 64c1ef19ccbf950ae32cda908a19d470 [0,1,0,1,0,0|2,0,0]=4 20763 B13R1.16 CCCCOC1CCCC(C1C)C 637fa9cd44206b1c9a9fa50f7679e46c [0,1,0,1,0,0|2,0,0]=4 20764 B13R1.16 CCOCCN1CCCC(C1C)O f249a1c469ec6e99b1f6b7476e8e8bea [0,1,0,1,0,0|2,0,0]=4 20765 B13R1.16 CCOCCN1CCC[C@@H]([C@H]1C)O 87c090599de4a424c378778e2c787b4c [0,1,0,1,0,0|2,0,0]=4 20766 B13R1.16 CCOCCN1CCC[C@H]([C@@H]1C)O a78726eb54a1d4de1f7e7cf0138fb273 [0,1,0,1,0,0|2,0,0]=4 20767 B13R1.16 CCSCCN1CCCC(C1C)O c9bbd70fe4d7148926dc1382d2623bd0 [0,1,0,1,0,0|2,0,0]=4 20768 B13R1.16 CCSCCN1CCC[C@@H]([C@H]1C)O 689e13982e4b9ea7d708f0bee540f062 [0,1,0,1,0,0|2,0,0]=4 20769 B13R1.16 CCSCCN1CCC[C@H]([C@@H]1C)O 55aba540ea2a4fdcb9e878535f28bc0b [0,1,0,1,0,0|2,0,0]=4 20770 B13R1.16 COCCCN1CCCC(C1C)O b204565e811b1e5fd8a835db708e0b90 [0,1,0,1,0,0|2,0,0]=4 20771 B13R1.16 COCCCN1CCC[C@@H]([C@H]1C)O ebf9ab948a75fd082b3613be16d3cf42 [0,1,0,1,0,0|2,0,0]=4 20772 B13R1.16 COCCCN1CCC[C@H]([C@@H]1C)O cdb73bc4a0963ff0e2bfff18f87985b9 [0,1,0,1,0,0|2,0,0]=4 20773 B13R1.16 CSCCCN1CCCC(C1C)O 6521da4fdc2a5441ad9a605bf19e87be [0,1,0,1,0,0|2,0,0]=4 20774 B13R1.16 CSCCCN1CCC[C@@H]([C@H]1C)O 09fec33b5f1976fdc5885801ded555d5 [0,1,0,1,0,0|2,0,0]=4 20775 B13R1.16 CSCCCN1CCC[C@H]([C@@H]1C)O 03566a42eab6c5a44920be25e0a48ab8 [0,1,0,1,0,0|2,0,0]=4 20776 B13R1.16 C[C@@H]1[C@H](CCCN1CCCCF)O 9ea4bed001b2f029d119852456ef48bd [0,1,0,1,0,0|2,0,0]=4 20777 B13R1.16 C[C@@H]1[C@H](CCCN1CCCCO)O 5a0565645727560e45f9202801c4c98f [0,1,0,1,0,0|2,0,0]=4 20778 B13R1.16 C[C@H]1[C@@H](CCCN1CCCCF)O ee29a8e4076aabe8858fc02332e94825 [0,1,0,1,0,0|2,0,0]=4 20779 B13R1.16 C[C@H]1[C@@H](CCCN1CCCCO)O 261c1f435d3bf1195f787e9dd00aca57 [0,1,0,1,0,0|2,0,0]=4 20780 B13R1.91 C#CC(C)OC1CCCCC1CC 402a74256e80a11dfd7a0271b731533f [0,1,0,1,0,0|2,0,0]=4 20781 B13R1.91 C=CC(C)OC1CCCCC1CC fd6e9c75d73c8cf8a2ba03e30b52248a [0,1,0,1,0,0|2,0,0]=4 20782 B13R1.91 CC(CO)CN1CCCCC1CO bd5f169b3e57b932dbc6c4218b635ba8 [0,1,0,1,0,0|2,0,0]=4 20783 B13R1.91 CC(CO)CN1CCCC[C@@H]1CO b410e80f0a5358d6761c33c50eb0066d [0,1,0,1,0,0|2,0,0]=4 20784 B13R1.91 CC(CO)CN1CCCC[C@H]1CO a12595407d1e58348da8bee4e9bda977 [0,1,0,1,0,0|2,0,0]=4 20785 B13R1.91 CC(CO)N[C@@H]1CCCC[C@@H]1CO 99525198336be35a4d6201e486f9eecc [0,1,0,1,0,0|2,0,0]=4 20786 B13R1.91 CC(CO)N[C@@H]1CCCC[C@H]1CO 0968e71bc779d4f60a51610229dfb832 [0,1,0,1,0,0|2,0,0]=4 20787 B13R1.91 CC(CO)N[C@H]1CCCC[C@H]1CO e5538c3b7a589ec8b8993bb69d10993b [0,1,0,1,0,0|2,0,0]=4 20788 B13R1.91 CCC(C)CN1CCCCC1CC e418242abe0557b8242068a7e305137f [0,1,0,1,0,0|2,0,0]=4 20789 B13R1.91 CCC(C)CN1CCCC[C@@H]1CC d01c5cc1df86175cb0a91aac151a2dd1 [0,1,0,1,0,0|2,0,0]=4 20790 B13R1.91 CCC(C)CN1CCCC[C@H]1CC 397c9cf0ea16c5be904a71b07890c7f2 [0,1,0,1,0,0|2,0,0]=4 20791 B13R1.91 CCC(C)OC1CCCCC1CC 57fe63397820a1331040a0dd40245436 [0,1,0,1,0,0|2,0,0]=4 20792 B13R1.91 CCC(O)CN1CCCCC1CC 06a680b75c7f939cf47bf647ed2b396a [0,1,0,1,0,0|1,0,0]=3 20793 B13R1.91 CCC(O)CN1CCCCC1CO da618d089fd2ad2c8ccbe75381e29f3a [0,1,0,1,0,0|2,0,0]=4 20794 B13R1.91 CCC(O)CN1CCCC[C@@H]1CC b0e4d395ff7cea350812dd909c9b0ee2 [0,1,0,1,0,0|1,0,0]=3 20795 B13R1.91 CCC(O)CN1CCCC[C@@H]1CO 477485e264ec4cfe90f2c49f8d6c26e1 [0,1,0,1,0,0|2,0,0]=4 20796 B13R1.91 CCC(O)CN1CCCC[C@H]1CC 5cbf61ca59e3b5e41e840de94c4ed18e [0,1,0,1,0,0|1,0,0]=3 20797 B13R1.91 CCC(O)CN1CCCC[C@H]1CO 77aef7af8ff872925c37acd43ff00472 [0,1,0,1,0,0|2,0,0]=4 20798 B13R1.91 CCC(O)CN1CCOCC1CC bcff6ffb39ef49c1e68a564fa29aece9 [0,1,0,1,0,0|2,0,0]=4 20799 B13R1.91 CCC(O)CN1CCOC[C@@H]1CC 1ebb6e9a29513326b30b2e305ec9603b [0,1,0,1,0,0|2,0,0]=4 20800 B13R1.91 CCC(O)CN1CCOC[C@H]1CC bb7451647b77d0380756a7b5b0426505 [0,1,0,1,0,0|2,0,0]=4 20801 B13R1.91 CCC1CCCCC1OC(C)C#N cfe5757cf22399ecbed0fe8fc73fd3cd [0,1,0,1,0,0|2,0,0]=4 20802 B13R1.91 CCC1CCCCC1OC(C)C=O 1fab3f36cd4660dbe8ca8766b0e64f80 [0,1,0,1,0,0|1,0,1]=4 20803 B13R1.91 CCC1CCCCC1O[C@H](C)C=O 09edcad1f8d08a5a729abf407949850c [0,1,0,1,0,0|1,0,1]=4 20804 B13R1.91 CCC1CCCCN1CC(C)C#N 1dc0a49b921a3dd6d8b143575d07504b [0,1,0,1,0,0|2,0,0]=4 20805 B13R1.91 CCC1CCCCN1CC(C)CO 33bc0e47b672c918b17934db33b1a203 [0,1,0,1,0,0|1,0,0]=3 20806 B13R1.91 CCC1CCCCN1CC(C)OC 783fe88e3f09b26d7898b1006546c384 [0,1,0,1,0,0|1,0,0]=3 20807 B13R1.91 CCC1CCCCN1CC(O)CF 7261f5e4cca51f3a14f4e2afead4c00d [0,1,0,1,0,0|1,0,0]=3 20808 B13R1.91 CCC1CCCCN1CC(O)CO 4c54936493f2007af1b3fdf9d06f5098 [0,1,0,1,0,0|1,0,0]=3 20809 B13R1.91 CCC1CCCCN1C[C@@H](C)CC 1bf28df72f43d32c73a4e1486d950916 [0,1,0,1,0,0|2,0,0]=4 20810 B13R1.91 CCC1CCCCN1C[C@@H](C)CO 7c6d50657d1898a072b881febfb456bf [0,1,0,1,0,0|1,0,0]=3 20811 B13R1.91 CCC1CCCCN1C[C@@H](C)OC f316d36cce85b47b3fe033a40cbe9f9e [0,1,0,1,0,0|1,0,0]=3 20812 B13R1.91 CCC1CCCCN1C[C@@H](O)CO 9e70a98af0b350ff51f1b25d4cd57f32 [0,1,0,1,0,0|1,0,0]=3 20813 B13R1.91 CCC1CCCCN1C[C@H](C)CC c4663b101cdd3db9f49a82132bfeadf8 [0,1,0,1,0,0|2,0,0]=4 20814 B13R1.91 CCC1CCCCN1C[C@H](C)CO 5b81337cb36a60b8e0d52c3a4c679535 [0,1,0,1,0,0|1,0,0]=3 20815 B13R1.91 CCC1CCCCN1C[C@H](C)OC c32c72df60a7471f7a735122bd90f666 [0,1,0,1,0,0|1,0,0]=3 20816 B13R1.91 CCC1CCCCN1C[C@H](O)CO 378d6610e07a5082640faefa5a4ed9d0 [0,1,0,1,0,0|1,0,0]=3 20817 B13R1.91 CCC1COCCC1NC(C)CO bf91a5f9c2a9e87c1b459937b4d9b641 [0,1,0,1,0,0|2,0,0]=4 20818 B13R1.91 CCC1COCCC1N[C@@H](C)CO 2a3e2c733d7b7cb2096a090b89872ffa [0,1,0,1,0,0|2,0,0]=4 20819 B13R1.91 CCC1COCCC1N[C@H](C)CO 0048bb86ef3f4b814b28524dfd09c86b [0,1,0,1,0,0|2,0,0]=4 20820 B13R1.91 CCC1COCCN1CC(C)CO e6ba9e8cdb1bca840c7c7791bd4b6684 [0,1,0,1,0,0|2,0,0]=4 20821 B13R1.91 CCC1COCCN1CC(C)OC 59c8cc328d1d0c9dc5b547e337e41785 [0,1,0,1,0,0|2,0,0]=4 20822 B13R1.91 CCC1COCCN1CC(O)CF 2ee9db21d0bd0723b5c559257b0e4bd6 [0,1,0,1,0,0|2,0,0]=4 20823 B13R1.91 CCC1COCCN1CC(O)CO 99b16e501361773a1df2371863905b5b [0,1,0,1,0,0|2,0,0]=4 20824 B13R1.91 CCC1COCCN1C[C@@H](C)CO 2a6662a28f9f4566f7796b998d85a534 [0,1,0,1,0,0|2,0,0]=4 20825 B13R1.91 CCC1COCCN1C[C@@H](C)OC 4d879f02740ebf00f120a2a42d9876fa [0,1,0,1,0,0|2,0,0]=4 20826 B13R1.91 CCC1COCCN1C[C@@H](O)CO ee1014b87b6997b833e9a25c7e445a1d [0,1,0,1,0,0|2,0,0]=4 20827 B13R1.91 CCC1COCCN1C[C@H](C)CO 281d8248661716db8d1681804a70c905 [0,1,0,1,0,0|2,0,0]=4 20828 B13R1.91 CCC1COCCN1C[C@H](C)OC 1e6a32f7b84f157f299efc6c7d9229ba [0,1,0,1,0,0|2,0,0]=4 20829 B13R1.91 CCC1COCCN1C[C@H](O)CO 393e81976a57291359673fb58a8ee390 [0,1,0,1,0,0|2,0,0]=4 20830 B13R1.91 CC[C@@H](C)CN1CCCC[C@@H]1CC 4a0e8e2c60ada7c69a75985a92532f37 [0,1,0,1,0,0|2,0,0]=4 20831 B13R1.91 CC[C@@H](C)CN1CCCC[C@H]1CC e26a2a601fbe3ed8c6e3662e48316ae0 [0,1,0,1,0,0|2,0,0]=4 20832 B13R1.91 CC[C@@H]1CCCCN1CC(C)C#N e01eb53ff4484e93cd303ded31aa604f [0,1,0,1,0,0|2,0,0]=4 20833 B13R1.91 CC[C@@H]1CCCCN1CC(C)CO a95c34e6e571755c27c55aae467f2249 [0,1,0,1,0,0|1,0,0]=3 20834 B13R1.91 CC[C@@H]1CCCCN1CC(C)OC 3f96d4961b1601a31ab584857b1920e7 [0,1,0,1,0,0|1,0,0]=3 20835 B13R1.91 CC[C@@H]1CCCCN1CC(O)CF 7bfa33d5d1d11f3a46c1f14159b43c9a [0,1,0,1,0,0|1,0,0]=3 20836 B13R1.91 CC[C@@H]1CCCCN1CC(O)CO 97563ab6e3049699dc04c852f91546e1 [0,1,0,1,0,0|1,0,0]=3 20837 B13R1.91 CC[C@@H]1CCCCN1C[C@@H](C)CO 504f1c6011d97f37b6dc88f38b72ef68 [0,1,0,1,0,0|1,0,0]=3 20838 B13R1.91 CC[C@@H]1CCCCN1C[C@@H](C)OC 817e22f1361206fbd77f0eb9d82ca64d [0,1,0,1,0,0|1,0,0]=3 20839 B13R1.91 CC[C@@H]1CCCCN1C[C@@H](O)CO f2988a6cc020cd26415f73ac875b0ba4 [0,1,0,1,0,0|1,0,0]=3 20840 B13R1.91 CC[C@@H]1CCCCN1C[C@H](C)CO 8ef5416a9fccff25fb7c9139bd75903d [0,1,0,1,0,0|1,0,0]=3 20841 B13R1.91 CC[C@@H]1CCCCN1C[C@H](C)OC 2d3ed2a7eed194dc6d6beba28622ed3b [0,1,0,1,0,0|1,0,0]=3 20842 B13R1.91 CC[C@@H]1CCCCN1C[C@H](O)CO 198b72c6e9f4351bd1704afd95b250e0 [0,1,0,1,0,0|1,0,0]=3 20843 B13R1.91 CC[C@@H]1COCCN1CC(C)CO 64361c8d45fce56d1cdf7c2b94581d4e [0,1,0,1,0,0|2,0,0]=4 20844 B13R1.91 CC[C@@H]1COCCN1CC(C)OC 0464c9069b5a30e766c4ec9c56e4915b [0,1,0,1,0,0|2,0,0]=4 20845 B13R1.91 CC[C@@H]1COCCN1CC(O)CF 5a9123c9c0216dbbcc323e0c06274cbf [0,1,0,1,0,0|2,0,0]=4 20846 B13R1.91 CC[C@@H]1COCCN1CC(O)CO e012e73c6ae635c34c849b96b46c007a [0,1,0,1,0,0|2,0,0]=4 20847 B13R1.91 CC[C@@H]1COCCN1C[C@@H](C)CO 08dc82ee490cc1469d2f0829e212309d [0,1,0,1,0,0|2,0,0]=4 20848 B13R1.91 CC[C@@H]1COCCN1C[C@@H](C)OC 432d91727550c90ea0e9ba73f1f311ec [0,1,0,1,0,0|2,0,0]=4 20849 B13R1.91 CC[C@@H]1COCCN1C[C@@H](O)CO 382650168205ae7d92b5781627b6618b [0,1,0,1,0,0|2,0,0]=4 20850 B13R1.91 CC[C@@H]1COCCN1C[C@H](C)CO 7ca4564d96b49c9efa75c9716e7de733 [0,1,0,1,0,0|2,0,0]=4 20851 B13R1.91 CC[C@@H]1COCCN1C[C@H](C)OC a1248e8163c70c1f9eab8a357d3fd037 [0,1,0,1,0,0|2,0,0]=4 20852 B13R1.91 CC[C@@H]1COCCN1C[C@H](O)CO 2709d279861083fa37465dd81b2e1ee9 [0,1,0,1,0,0|2,0,0]=4 20853 B13R1.91 CC[C@H](C)CN1CCCC[C@@H]1CC 865eff4586dfde49224c9c18215779cb [0,1,0,1,0,0|2,0,0]=4 20854 B13R1.91 CC[C@H](C)CN1CCCC[C@H]1CC 3a1ab313b969ba46b82617e129a75750 [0,1,0,1,0,0|2,0,0]=4 20855 B13R1.91 CC[C@H]1CCCCN1CC(C)C#N 41f38ca7299d065c5101400b941e28ab [0,1,0,1,0,0|2,0,0]=4 20856 B13R1.91 CC[C@H]1CCCCN1CC(C)CO f94032e1cab23684e2d05ef18829386d [0,1,0,1,0,0|1,0,0]=3 20857 B13R1.91 CC[C@H]1CCCCN1CC(C)OC d10edd46aea6f2030aac3ef42b38a0b2 [0,1,0,1,0,0|1,0,0]=3 20858 B13R1.91 CC[C@H]1CCCCN1CC(O)CF 143eedf2cf135489210fc70a39efa0b6 [0,1,0,1,0,0|1,0,0]=3 20859 B13R1.91 CC[C@H]1CCCCN1CC(O)CO 3236bb06d490f00ffb9f3687bee25f18 [0,1,0,1,0,0|1,0,0]=3 20860 B13R1.91 CC[C@H]1CCCCN1C[C@@H](C)CO 1309595b34ce9dee7db6111a70935efd [0,1,0,1,0,0|1,0,0]=3 20861 B13R1.91 CC[C@H]1CCCCN1C[C@@H](C)OC 4114b8f433e90b06a5c59bc5667b5fd0 [0,1,0,1,0,0|1,0,0]=3 20862 B13R1.91 CC[C@H]1CCCCN1C[C@@H](O)CO a4beb73cadd5c1523c152a34cf4d97d5 [0,1,0,1,0,0|1,0,0]=3 20863 B13R1.91 CC[C@H]1CCCCN1C[C@H](C)CO 21e12e7e595483c65f135d0037467962 [0,1,0,1,0,0|1,0,0]=3 20864 B13R1.91 CC[C@H]1CCCCN1C[C@H](C)OC 6814cab051959e20c4dec4b04341d8f1 [0,1,0,1,0,0|1,0,0]=3 20865 B13R1.91 CC[C@H]1CCCCN1C[C@H](O)CO 22adb7173f03067a32a6deefe18d0c74 [0,1,0,1,0,0|1,0,0]=3 20866 B13R1.91 CC[C@H]1COCCN1CC(C)CO 3630f8b7ddc5d829f5c70a4a91a870ee [0,1,0,1,0,0|2,0,0]=4 20867 B13R1.91 CC[C@H]1COCCN1CC(C)OC 3d92eb5caf479f1e5dc05927ea905f33 [0,1,0,1,0,0|2,0,0]=4 20868 B13R1.91 CC[C@H]1COCCN1CC(O)CF d3579d113ea296d4dac5dc48dfa053e5 [0,1,0,1,0,0|2,0,0]=4 20869 B13R1.91 CC[C@H]1COCCN1CC(O)CO fbf4549bdf64c2a62e0c297cb6904d81 [0,1,0,1,0,0|2,0,0]=4 20870 B13R1.91 CC[C@H]1COCCN1C[C@@H](C)CO 6f9496482f8d11fadd58c033b84643e6 [0,1,0,1,0,0|2,0,0]=4 20871 B13R1.91 CC[C@H]1COCCN1C[C@@H](C)OC f57a5db9934c0be2dd4c6283476a6669 [0,1,0,1,0,0|2,0,0]=4 20872 B13R1.91 CC[C@H]1COCCN1C[C@@H](O)CO 80f22c50a4cf07f3be99f164c9bee63c [0,1,0,1,0,0|2,0,0]=4 20873 B13R1.91 CC[C@H]1COCCN1C[C@H](C)CO 270690f820beb220ba5c90ec7a8e8bff [0,1,0,1,0,0|2,0,0]=4 20874 B13R1.91 CC[C@H]1COCCN1C[C@H](C)OC 2fcea4041ae1bfc7115414d080acbdd1 [0,1,0,1,0,0|2,0,0]=4 20875 B13R1.91 CC[C@H]1COCCN1C[C@H](O)CO 68a2e529ba429d81597f98dc4c06d4f3 [0,1,0,1,0,0|2,0,0]=4 20876 B13R1.91 COC(C)CN1CCCCC1CO 45ac4a00fdfbe1621f5b4efe10d4b312 [0,1,0,1,0,0|2,0,0]=4 20877 B13R1.91 COC(C)CN1CCCC[C@@H]1CO 9a40a7c611f1e2eb465dc4e8da237a32 [0,1,0,1,0,0|2,0,0]=4 20878 B13R1.91 COC(C)CN1CCCC[C@H]1CO afe6e5d37ec7fb0c19f47e256f54031e [0,1,0,1,0,0|2,0,0]=4 20879 B13R1.91 COC1CCCCC1NC(C)CO 41ed257a09aa18c36da67e751f2ab1ae [0,1,0,1,0,0|2,0,0]=4 20880 B13R1.91 COC1CCCCC1N[C@@H](C)CO 3a1f44fa7b795ec02c8e3916f6070e29 [0,1,0,1,0,0|2,0,0]=4 20881 B13R1.91 COC1CCCCC1N[C@H](C)CO 9435a468afb41259d4293c7d359b3022 [0,1,0,1,0,0|2,0,0]=4 20882 B13R1.91 CO[C@@H](C)CN1CCCCC1CO 13ecaddbbc9b769622b5282240e7c48b [0,1,0,1,0,0|2,0,0]=4 20883 B13R1.91 CO[C@@H](C)CN1CCCC[C@@H]1CO b601cb08a64d0ddc62d522744f8cf676 [0,1,0,1,0,0|2,0,0]=4 20884 B13R1.91 CO[C@@H](C)CN1CCCC[C@H]1CO e938d496f293d0730b8886fe411d6d3a [0,1,0,1,0,0|2,0,0]=4 20885 B13R1.91 CO[C@H](C)CN1CCCCC1CO d7c78f52b5efebe079a6f7a7eed9bfcb [0,1,0,1,0,0|2,0,0]=4 20886 B13R1.91 CO[C@H](C)CN1CCCC[C@@H]1CO 57616dd9815301c535736a1b805736ad [0,1,0,1,0,0|2,0,0]=4 20887 B13R1.91 CO[C@H](C)CN1CCCC[C@H]1CO 58c8ecf39fe1f1b274794773eff2c072 [0,1,0,1,0,0|2,0,0]=4 20888 B13R1.91 CO[C@H]1CCCC[C@@H]1NC(C)CO 007228eb0e35d96bb086e9c497de289f [0,1,0,1,0,0|2,0,0]=4 20889 B13R1.91 CO[C@H]1CCCC[C@@H]1N[C@@H](C)CO cd6a374d04d6057e2d5ebb7d21da3c08 [0,1,0,1,0,0|2,0,0]=4 20890 B13R1.91 CO[C@H]1CCCC[C@@H]1N[C@H](C)CO 2d7f9da6e4fc504203b29b4732af983a [0,1,0,1,0,0|2,0,0]=4 20891 B13R1.91 C[C@@H](CO)CN1CCCCC1CO 7326deb76afcf1a476c977e3646d12c8 [0,1,0,1,0,0|2,0,0]=4 20892 B13R1.91 C[C@@H](CO)CN1CCCC[C@@H]1CO 72afe4cc34dc2a2b79106fa79276bded [0,1,0,1,0,0|2,0,0]=4 20893 B13R1.91 C[C@@H](CO)CN1CCCC[C@H]1CO 61dbd03dc5ef290aaabe28da9bfe9058 [0,1,0,1,0,0|2,0,0]=4 20894 B13R1.91 C[C@@H](CO)N[C@@H]1CCCC[C@@H]1CO 0cef7564657afa6c95c1aad558612e7a [0,1,0,1,0,0|2,0,0]=4 20895 B13R1.91 C[C@@H](CO)N[C@@H]1CCCC[C@H]1CO 72901a53d1933d42f6093acf60be1a00 [0,1,0,1,0,0|2,0,0]=4 20896 B13R1.91 C[C@@H](CO)N[C@H]1CCCC[C@H]1CO f66c494539e06a31e674ad915f09f21b [0,1,0,1,0,0|2,0,0]=4 20897 B13R1.91 C[C@H](CO)CN1CCCCC1CO 4f54a857789b94c2bf9684b9e3603d50 [0,1,0,1,0,0|2,0,0]=4 20898 B13R1.91 C[C@H](CO)CN1CCCC[C@@H]1CO 7102ef0eaf5caa710bc19a456005071e [0,1,0,1,0,0|2,0,0]=4 20899 B13R1.91 C[C@H](CO)CN1CCCC[C@H]1CO 54a6bbed85e0b00d4bb79523626ae42d [0,1,0,1,0,0|2,0,0]=4 20900 B13R1.91 C[C@H](CO)N[C@@H]1CCCC[C@@H]1CO 24088446ecb2e6d2621a4905d1dae15f [0,1,0,1,0,0|2,0,0]=4 20901 B13R1.91 C[C@H](CO)N[C@@H]1CCCC[C@H]1CO e6a05ecb23903d131509ade0a41b1fc7 [0,1,0,1,0,0|2,0,0]=4 20902 B13R1.91 C[C@H](CO)N[C@H]1CCCC[C@H]1CO 0b96e4c28d54df3fc06e61c24f9ec716 [0,1,0,1,0,0|2,0,0]=4 20903 B13R1.91 OCC(O)CN1CCCCC1CO 9aa45591eea3ac5448424ac939cc3566 [0,1,0,1,0,0|2,0,0]=4 20904 B13R1.91 OCC(O)CN1CCCC[C@@H]1CO 3de57cda59bc8734cae3c6dd78d81b86 [0,1,0,1,0,0|2,0,0]=4 20905 B13R1.91 OCC(O)CN1CCCC[C@H]1CO 888cf4ea25ad721cf71fb37e2e36ccce [0,1,0,1,0,0|2,0,0]=4 20906 B13R1.91 OCC1CCCCN1CC(O)CF 27a2411fbe0780bfd5bcc4b45e24bbff [0,1,0,1,0,0|2,0,0]=4 20907 B13R1.91 OCC1CCCCN1C[C@@H](O)CO 6be80ad03b6f164de5b418b1275bd1de [0,1,0,1,0,0|2,0,0]=4 20908 B13R1.91 OCC1CCCCN1C[C@H](O)CO a3dc3bdf1fc75862f52812808d8aa175 [0,1,0,1,0,0|2,0,0]=4 20909 B13R1.91 OC[C@@H](O)CN1CCCC[C@@H]1CO 4acc4a786fedd833a08457d1d838b3ad [0,1,0,1,0,0|2,0,0]=4 20910 B13R1.91 OC[C@@H](O)CN1CCCC[C@H]1CO 2386ecf32ff33843bc883bdded3a8928 [0,1,0,1,0,0|2,0,0]=4 20911 B13R1.91 OC[C@@H]1CCCCN1CC(O)CF 8d4e51c6fa19a8e8f146b8ac96d9e824 [0,1,0,1,0,0|2,0,0]=4 20912 B13R1.91 OC[C@H](O)CN1CCCC[C@@H]1CO db7e325c10d4dcf0916a23b724f84ce0 [0,1,0,1,0,0|2,0,0]=4 20913 B13R1.91 OC[C@H](O)CN1CCCC[C@H]1CO 5de3d4dbe5d67fec26c75e1f8491dee7 [0,1,0,1,0,0|2,0,0]=4 20914 B13R1.91 OC[C@H]1CCCCN1CC(O)CF acd614787ae413ef2aabefd9f90ed54b [0,1,0,1,0,0|2,0,0]=4 20915 B13R1.188 C#C[C@H]1C[C@H]1COCCCCCC 3a65abf830b7a6379efe81eb4b9fd2f3 [0,1,0,1,0,0|2,0,0]=4 20916 B13R1.188 CCCCCCCNC1CC1C=O ab031577a3c1a0ba53a305c8c1b16638 [0,1,0,1,0,0|1,0,1]=4 20917 B13R1.188 CCCCCCCN[C@@H]1C[C@@H]1OC d539589543a3356bf53ba1d55782f561 [0,1,0,1,0,0|1,0,0]=3 20918 B13R1.188 CCCCCCCN[C@@H]1C[C@H]1CO 633ac9cdebcea7ec4d73888579cf9ccf [0,1,0,1,0,0|1,0,0]=3 20919 B13R1.188 CCCCCCCN[C@H]1C[C@@H]1CO 1a3217beba87b0ef4e4ebbc55230fcf5 [0,1,0,1,0,0|1,0,0]=3 20920 B13R1.188 CCCCCCCN[C@H]1C[C@H]1CO 56076ba00d6a8cc6b884d10c73e28ae4 [0,1,0,1,0,0|1,0,0]=3 20921 B13R1.188 CCCCCCCOC1CC1C=O 7e321ca70f13dd0ecc65734eeb70e0e2 [0,1,0,1,0,0|1,0,1]=4 20922 B13R1.188 CCCCCCNCC1CC1CO 483d5754e4006d0abb2875161410508b [0,1,0,1,0,0|1,0,0]=3 20923 B13R1.188 CCCCCCOCC1CC1C#N 5b19fd8371fd2c83a72050e885a1258f [0,1,0,1,0,0|2,0,0]=4 20924 B13R1.188 CCCCOCCN[C@@H]1C[C@@H]1OC 19abda691a115a149d7f70b89f68bd5b [0,1,0,1,0,0|2,0,0]=4 20925 B13R1.188 CCCCOCCN[C@@H]1C[C@H]1CO 08369ddaeb21fa7bf4955b61e6ca0584 [0,1,0,1,0,0|2,0,0]=4 20926 B13R1.188 CCCCOCCN[C@H]1C[C@@H]1CO 27e16fb9736c9b5670b376d741bb518a [0,1,0,1,0,0|2,0,0]=4 20927 B13R1.188 CCCCOCCN[C@H]1C[C@H]1CO 58163e765307e0122c1c12a37f64a3a5 [0,1,0,1,0,0|2,0,0]=4 20928 B13R1.188 CCCCOCNCC1CC1CO 26a93ffc75259894371e8bc56466fb69 [0,1,0,1,0,0|2,0,0]=4 20929 B13R1.188 CCCOCCCN[C@@H]1C[C@@H]1OC 1ac9f8b1b8748e8df0b4b880a4d1ada4 [0,1,0,1,0,0|2,0,0]=4 20930 B13R1.188 CCCOCCCN[C@@H]1C[C@H]1CO a32b76197a1910900fd30e9e27e335e3 [0,1,0,1,0,0|2,0,0]=4 20931 B13R1.188 CCCOCCCN[C@H]1C[C@@H]1CO 698d59f544b047fcdb1173f5316d8695 [0,1,0,1,0,0|2,0,0]=4 20932 B13R1.188 CCCOCCCN[C@H]1C[C@H]1CO 69efd0765f6a6ce244365e6381412ddc [0,1,0,1,0,0|2,0,0]=4 20933 B13R1.188 CCCOCCNCC1CC1CO b89a708a597b831b605351eb9ac68658 [0,1,0,1,0,0|2,0,0]=4 20934 B13R1.188 CCOCCCNCC1CC1CO e8fbf21d26a8e136422d07645a493726 [0,1,0,1,0,0|2,0,0]=4 20935 B13R1.188 CCSCCCNCC1CC1CO a6fb009ffe20e1d4f1cd6b4547c28c54 [0,1,0,1,0,0|2,0,0]=4 20936 B13R1.188 COCCCCCN[C@@H]1C[C@@H]1OC a8a72fafd3fb05f6820e68b787e436c3 [0,1,0,1,0,0|2,0,0]=4 20937 B13R1.188 COCCCCCN[C@@H]1C[C@H]1CO dd6207bd80350ac3cba3466d88593d3d [0,1,0,1,0,0|2,0,0]=4 20938 B13R1.188 COCCCCCN[C@H]1C[C@@H]1CO 7fdd00c1b429e542beb78e293b632972 [0,1,0,1,0,0|2,0,0]=4 20939 B13R1.188 COCCCCCN[C@H]1C[C@H]1CO 676f4339e2775a17d45057ea8840a6db [0,1,0,1,0,0|2,0,0]=4 20940 B13R1.188 COCCCCNCC1CC1CO 897f666f50aeea16195d3eead7568adc [0,1,0,1,0,0|2,0,0]=4 20941 B13R1.188 CO[C@H]1C[C@H]1NCCCCCCF 4a3d86c27ce5e9824b702ae403b77524 [0,1,0,1,0,0|2,0,0]=4 20942 B13R1.188 CO[C@H]1C[C@H]1NCCCCCCO eecce7df0d9906c0646628aa2eecd797 [0,1,0,1,0,0|2,0,0]=4 20943 B13R1.188 OCC1CC1CNCCCCCF dcf28f9282cb43f34b94b740ba66f871 [0,1,0,1,0,0|2,0,0]=4 20944 B13R1.188 OCCCCCCN[C@@H]1C[C@H]1CO 6664544ab832250b137986c6c32bcc7c [0,1,0,1,0,0|2,0,0]=4 20945 B13R1.188 OCCCCCCN[C@H]1C[C@@H]1CO cf3d48a783e1b5c048d27829c3fe6cc8 [0,1,0,1,0,0|2,0,0]=4 20946 B13R1.188 OCCCCCCN[C@H]1C[C@H]1CO bb7db986bf97b6a456aebb7a73da661f [0,1,0,1,0,0|2,0,0]=4 20947 B13R1.188 OCCCCCNCC1CC1CO 1fcb19b412e2af1430bba64da482e68e [0,1,0,1,0,0|2,0,0]=4 20948 B13R1.188 OC[C@@H]1C[C@@H]1NCCCCCCF 3ec3f9147482ae47f0128b2fbcfa473c [0,1,0,1,0,0|2,0,0]=4 20949 B13R1.188 OC[C@@H]1C[C@H]1NCCCCCCF de40403cbf79787e2c16aebc2ea6f24f [0,1,0,1,0,0|2,0,0]=4 20950 B13R1.188 OC[C@H]1C[C@@H]1NCCCCCCF 226fb4287d16d6d752a6e43772635916 [0,1,0,1,0,0|2,0,0]=4 20951 B13R1.189 C#CC1CCC(C1)COCCCC 76f4f73ef7d9cd3320fa23acff2a66ed [0,1,0,1,0,0|2,0,0]=4 20952 B13R1.189 C#CC1CCN(C1)CCCCCC 220c98490126260d354e352dc60803e0 [0,1,0,1,0,0|2,0,0]=4 20953 B13R1.189 C=CC1CCN(C1)CCCCCC bb8109790820f6e7606c3e4613d7fb54 [0,1,0,1,0,0|2,0,0]=4 20954 B13R1.189 CCCCCCN1CCC(C1)C#N a85d65c39281ac924c7640a56a2db35e [0,1,0,1,0,0|2,0,0]=4 20955 B13R1.189 CCCCCCN1CCC(C1)CC 2427f1ceb5666319044bafcdda62bbfe [0,1,0,1,0,0|2,0,0]=4 20956 B13R1.189 CCCCCCN1CCC(C1)CO e0192be21b734c69e5448fb19af0cb4e [0,1,0,1,0,0|1,0,0]=3 20957 B13R1.189 CCCCCCN1CCC(C1)OC 078c19f8f1ae1e68309fceaccbb7b1dc [0,1,0,1,0,0|1,0,0]=3 20958 B13R1.189 CCCCCCN1CC[C@@H](C1)C#N 8a461b2ddb02604ddf523a3511265164 [0,1,0,1,0,0|2,0,0]=4 20959 B13R1.189 CCCCCCN1CC[C@@H](C1)CO 98e6a8ab5cc8afa3773fafc174f41399 [0,1,0,1,0,0|1,0,0]=3 20960 B13R1.189 CCCCCCN1CC[C@@H](C1)OC 0e3cc017099debf9e49da31ef8a389f3 [0,1,0,1,0,0|1,0,0]=3 20961 B13R1.189 CCCCCCN1CC[C@H](C1)C#N 1a85d0b242a1c0599bd2ed4edc81bdf7 [0,1,0,1,0,0|2,0,0]=4 20962 B13R1.189 CCCCCCN1CC[C@H](C1)CO 35f1b1cbf8b54de0650bf0fcb73a03ba [0,1,0,1,0,0|1,0,0]=3 20963 B13R1.189 CCCCCCN1CC[C@H](C1)OC 040e5e0397d00e9959f7a3d2a719edc9 [0,1,0,1,0,0|1,0,0]=3 20964 B13R1.189 CCCCCNC1CCC(C1)C#N da84a52036227d1bb1c1b3d8e3fd2707 [0,1,0,1,0,0|2,0,0]=4 20965 B13R1.189 CCCCCNC1CCC(C1)CO 1a9bfef9e80123dc326ef285cae461c5 [0,1,0,1,0,0|1,0,0]=3 20966 B13R1.189 CCCCCNC1CCC(C1)OC f76d4a080cfcfa91e4ca48347e379bf8 [0,1,0,1,0,0|1,0,0]=3 20967 B13R1.189 CCCCCN[C@@H]1CC[C@@H](C1)CO f4a1b96c2b1201005051ad33e157579f [0,1,0,1,0,0|1,0,0]=3 20968 B13R1.189 CCCCCN[C@@H]1CC[C@@H](C1)OC cc930f0a2c615ad3d6f1023c22189ac0 [0,1,0,1,0,0|1,0,0]=3 20969 B13R1.189 CCCCCN[C@@H]1CC[C@H](C1)CO 623fa1be670f90a5c6ef4e3d62cc6e80 [0,1,0,1,0,0|1,0,0]=3 20970 B13R1.189 CCCCCN[C@H]1CC[C@@H](C1)CO 7f2d5d92ad69fda69b95b7d6bc41255d [0,1,0,1,0,0|1,0,0]=3 20971 B13R1.189 CCCCCN[C@H]1CC[C@H](C1)CO 27a0278bdab78a0ff0692f383ca6175c [0,1,0,1,0,0|1,0,0]=3 20972 B13R1.189 CCCCCOC1CCC(C1)C#N 7742b9d919153154903ffe82d9097199 [0,1,0,1,0,0|2,0,0]=4 20973 B13R1.189 CCCCCOC1CCC(C1)OC 600fcb34ad675d202509310cc909b476 [0,1,0,1,0,0|1,0,0]=3 20974 B13R1.189 CCCCCO[C@@H]1CC[C@H](C1)C#N 25c84f1a0a432486165a257ccd9fe383 [0,1,0,1,0,0|2,0,0]=4 20975 B13R1.189 CCCCCO[C@@H]1CC[C@H](C1)OC b3c01bae42eed20f85c4da9688b09932 [0,1,0,1,0,0|1,0,0]=3 20976 B13R1.189 CCCCCO[C@H]1CC[C@H](C1)OC 9fc8c99ff3571cf2855423dfd78143db [0,1,0,1,0,0|1,0,0]=3 20977 B13R1.189 CCCCOCN1CCC(C1)CO 4bbd01c2fd4f289534e524404d25ed51 [0,1,0,1,0,0|2,0,0]=4 20978 B13R1.189 CCCCOCN1CCC(C1)OC e1a175ddbfe10619ff79d362af643e54 [0,1,0,1,0,0|2,0,0]=4 20979 B13R1.189 CCCCOCN1CC[C@@H](C1)CO a9c36e95129ab08439bf72b32682e6aa [0,1,0,1,0,0|2,0,0]=4 20980 B13R1.189 CCCCOCN1CC[C@@H](C1)OC 9db7e8ad2eef854aa834732d0e4109f0 [0,1,0,1,0,0|2,0,0]=4 20981 B13R1.189 CCCCOCN1CC[C@H](C1)CO b881a29e2284d1d8f467b3c792423601 [0,1,0,1,0,0|2,0,0]=4 20982 B13R1.189 CCCCOCN1CC[C@H](C1)OC d16b249dfa403fc25210b0a62aff34d2 [0,1,0,1,0,0|2,0,0]=4 20983 B13R1.189 CCCOCCN1CCC(C1)CO 5bdc42ee5fc36728885b58f1b2ddd4c0 [0,1,0,1,0,0|2,0,0]=4 20984 B13R1.189 CCCOCCN1CCC(C1)OC 89437e7369a7e48e7ed4c720ccc4f6d1 [0,1,0,1,0,0|2,0,0]=4 20985 B13R1.189 CCCOCCN1CC[C@@H](C1)CO d5d607ec7291938e606609254deb3259 [0,1,0,1,0,0|2,0,0]=4 20986 B13R1.189 CCCOCCN1CC[C@@H](C1)OC f23d5ffcc14f02930d3bfa519b64d8ae [0,1,0,1,0,0|2,0,0]=4 20987 B13R1.189 CCCOCCN1CC[C@H](C1)CO 7862ede6e430b0b33d54687e6f7d742c [0,1,0,1,0,0|2,0,0]=4 20988 B13R1.189 CCCOCCN1CC[C@H](C1)OC e67fb3b62c1fecd621c15c51fb81ff1f [0,1,0,1,0,0|2,0,0]=4 20989 B13R1.189 CCOCCCN1CCC(C1)CO a4587721392b7bb8c3e613029a96a2af [0,1,0,1,0,0|2,0,0]=4 20990 B13R1.189 CCOCCCN1CCC(C1)OC a1697cbc8bc84ca600b6a29a17d73e78 [0,1,0,1,0,0|2,0,0]=4 20991 B13R1.189 CCOCCCN1CC[C@@H](C1)CO df207a963852a2b345cc725bab976d2a [0,1,0,1,0,0|2,0,0]=4 20992 B13R1.189 CCOCCCN1CC[C@@H](C1)OC af431e4b8807a3ff9de9140269a594aa [0,1,0,1,0,0|2,0,0]=4 20993 B13R1.189 CCOCCCN1CC[C@H](C1)CO df6cb51af7878def2973a6b5904bade5 [0,1,0,1,0,0|2,0,0]=4 20994 B13R1.189 CCOCCCN1CC[C@H](C1)OC d6aac179a3e7d953f01744c815b10c26 [0,1,0,1,0,0|2,0,0]=4 20995 B13R1.189 CCOCCNC1CCC(C1)CO 5b07c8dd3b7d3a54a64aae8569f15940 [0,1,0,1,0,0|2,0,0]=4 20996 B13R1.189 CCOCCNC1CCC(C1)OC 1c586ddc0be58348b98680b08ee93949 [0,1,0,1,0,0|2,0,0]=4 20997 B13R1.189 CCOCCN[C@@H]1CC[C@@H](C1)CO c047a75b7f68d2da4f6af2eb0bdc810a [0,1,0,1,0,0|2,0,0]=4 20998 B13R1.189 CCOCCN[C@@H]1CC[C@@H](C1)OC a498ecdd60bd607c309f9e76e8170e0f [0,1,0,1,0,0|2,0,0]=4 20999 B13R1.189 CCOCCN[C@@H]1CC[C@H](C1)CO 94de7629b40f8f63fe0bf996fcd75446 [0,1,0,1,0,0|2,0,0]=4 21000 B13R1.189 CCOCCN[C@H]1CC[C@@H](C1)CO 201238bb6e094c112304e943a6a0ad3a [0,1,0,1,0,0|2,0,0]=4 21001 B13R1.189 CCOCCN[C@H]1CC[C@H](C1)CO 07a29f76aedb06c88f58744fbabe1468 [0,1,0,1,0,0|2,0,0]=4 21002 B13R1.189 CCOCCOC1CCC(C1)OC e26816723b19ff03ec03e738d5fe8d5a [0,1,0,1,0,0|2,0,0]=4 21003 B13R1.189 CCOCCO[C@@H]1CC[C@H](C1)OC 671d80add68df2240e06c2c51aaea512 [0,1,0,1,0,0|2,0,0]=4 21004 B13R1.189 CCOCCO[C@H]1CC[C@H](C1)OC 2e66a0df09f23ea419db1a214ea94046 [0,1,0,1,0,0|2,0,0]=4 21005 B13R1.189 CCSCCCN1CCC(C1)CO b5619ee89fa2390e51208e8e090bf7f7 [0,1,0,1,0,0|2,0,0]=4 21006 B13R1.189 CCSCCCN1CCC(C1)OC c50dd8fa12674bf71646d1d1f35164f7 [0,1,0,1,0,0|2,0,0]=4 21007 B13R1.189 CCSCCCN1CC[C@@H](C1)CO dfd53a323b347a91f7e593bc4145fe78 [0,1,0,1,0,0|2,0,0]=4 21008 B13R1.189 CCSCCCN1CC[C@@H](C1)OC feebaeb97307a3a536c7f567cf1ec1f9 [0,1,0,1,0,0|2,0,0]=4 21009 B13R1.189 CCSCCCN1CC[C@H](C1)CO 34430f8d0094944b96bf8c4cdc378b24 [0,1,0,1,0,0|2,0,0]=4 21010 B13R1.189 CCSCCCN1CC[C@H](C1)OC 1668388db1d50ebefd79903d8ef0046b [0,1,0,1,0,0|2,0,0]=4 21011 B13R1.189 CCSCCNC1CCC(C1)CO 5414c1f3927102a01435b7a045ba38d7 [0,1,0,1,0,0|2,0,0]=4 21012 B13R1.189 CCSCCNC1CCC(C1)OC 2fea857212f1f728a8ffa960eeeac67f [0,1,0,1,0,0|2,0,0]=4 21013 B13R1.189 CCSCCN[C@@H]1CC[C@@H](C1)CO 37a6449f74365b4931049859f4d69a03 [0,1,0,1,0,0|2,0,0]=4 21014 B13R1.189 CCSCCN[C@@H]1CC[C@@H](C1)OC d4ff6da43481c7899a852b3996401f2a [0,1,0,1,0,0|2,0,0]=4 21015 B13R1.189 CCSCCN[C@@H]1CC[C@H](C1)CO 2943f3a3692ae5403bc9213d1148d11f [0,1,0,1,0,0|2,0,0]=4 21016 B13R1.189 CCSCCN[C@H]1CC[C@@H](C1)CO 8d38b631b463d64928033dc791cb4ce6 [0,1,0,1,0,0|2,0,0]=4 21017 B13R1.189 CCSCCN[C@H]1CC[C@H](C1)CO 38cb0787debd566eb0f5dc6bfebde331 [0,1,0,1,0,0|2,0,0]=4 21018 B13R1.189 CCSCCOC1CCC(C1)OC a4f73fb253ae366048f6c0f35ef9ee25 [0,1,0,1,0,0|2,0,0]=4 21019 B13R1.189 CCSCCO[C@@H]1CC[C@H](C1)OC cca076affb377f859810005fee70c3c8 [0,1,0,1,0,0|2,0,0]=4 21020 B13R1.189 CCSCCO[C@H]1CC[C@H](C1)OC 0ddbb3a1eedfb72b551092bab56c70d7 [0,1,0,1,0,0|2,0,0]=4 21021 B13R1.189 COC1CCC(C1)NCCCCCl 4cdcb2643f7957af5b21ec546dc3f6e2 [0,1,0,1,0,0|2,0,0]=4 21022 B13R1.189 COC1CCC(C1)NCCCCO 8688e3c027d1d4aa7f40a96572b7616b [0,1,0,1,0,0|2,0,0]=4 21023 B13R1.189 COC1CCC(C1)NCCCCS 9044fcb5c8d372aec0e49191f42b5191 [0,1,0,1,0,0|2,0,0]=4 21024 B13R1.189 COC1CCC(C1)NCCCSC 8bb3beab9be6b3affe72008317301387 [0,1,0,1,0,0|2,0,0]=4 21025 B13R1.189 COC1CCC(C1)OCCCCF 7c552eebeb5bbdac7bbc7f8362d40b59 [0,1,0,1,0,0|2,0,0]=4 21026 B13R1.189 COC1CCC(C1)OCCCCS f20582bbd4061b166e5eab6e4f62db59 [0,1,0,1,0,0|2,0,0]=4 21027 B13R1.189 COC1CCC(C1)OCCCSC e3e3a7cc06fb6ae32f33165f40323362 [0,1,0,1,0,0|2,0,0]=4 21028 B13R1.189 COC1CCN(C1)CCCCCF 324b48f82994049bd6fcfbafcb2b9789 [0,1,0,1,0,0|2,0,0]=4 21029 B13R1.189 COC1CCN(C1)CCCCCO f05140a63500c13906abf12e3f8a3ccc [0,1,0,1,0,0|2,0,0]=4 21030 B13R1.189 COCCCCN1CCC(C1)CO 2a03a726a909ab02714c261d309bf455 [0,1,0,1,0,0|2,0,0]=4 21031 B13R1.189 COCCCCN1CCC(C1)OC 04cec87ea80f036f17e9f4422de6f30b [0,1,0,1,0,0|2,0,0]=4 21032 B13R1.189 COCCCCN1CC[C@@H](C1)CO 3d7b1d2311a0c5dbe34fff78084f3a5b [0,1,0,1,0,0|2,0,0]=4 21033 B13R1.189 COCCCCN1CC[C@@H](C1)OC 72f35a0caaa3a2445798c41ddfa8f3a4 [0,1,0,1,0,0|2,0,0]=4 21034 B13R1.189 COCCCCN1CC[C@H](C1)CO ce472d48823c1d0c64f4b99c4a992114 [0,1,0,1,0,0|2,0,0]=4 21035 B13R1.189 COCCCCN1CC[C@H](C1)OC 16dbcc1b529c86f14884411e6b032af9 [0,1,0,1,0,0|2,0,0]=4 21036 B13R1.189 COCCCNC1CCC(C1)CO 80d5e19bdabff5abeaf359752d0d78db [0,1,0,1,0,0|2,0,0]=4 21037 B13R1.189 COCCCNC1CCC(C1)OC c5817c59dde7051f8969f4c08265199c [0,1,0,1,0,0|2,0,0]=4 21038 B13R1.189 COCCCN[C@@H]1CC[C@@H](C1)CO b89be2a6b7b92a0a407d21f40ad9cb10 [0,1,0,1,0,0|2,0,0]=4 21039 B13R1.189 COCCCN[C@@H]1CC[C@@H](C1)OC 2e06a32254c6fbf96e2f7871e200792d [0,1,0,1,0,0|2,0,0]=4 21040 B13R1.189 COCCCN[C@@H]1CC[C@H](C1)CO 86c1d7149ded604d8623d94c66d363cc [0,1,0,1,0,0|2,0,0]=4 21041 B13R1.189 COCCCN[C@H]1CC[C@@H](C1)CO 02e81a4fd2c76a6eba2f5556893e1704 [0,1,0,1,0,0|2,0,0]=4 21042 B13R1.189 COCCCN[C@H]1CC[C@H](C1)CO 5efd02db02a252999c6067773150e07a [0,1,0,1,0,0|2,0,0]=4 21043 B13R1.189 COCCCOC1CCC(C1)OC 747320553a12c55d1dbda19fda369625 [0,1,0,1,0,0|2,0,0]=4 21044 B13R1.189 COCCCO[C@@H]1CC[C@H](C1)OC d50030a7e893a47988acd7814be3e6e5 [0,1,0,1,0,0|2,0,0]=4 21045 B13R1.189 COCCCO[C@H]1CC[C@H](C1)OC f40e044b17609ab615384d1138ac7507 [0,1,0,1,0,0|2,0,0]=4 21046 B13R1.189 CO[C@@H]1CCN(C1)CCCCCF ec22e76741f7160c708efbccd33b7b2e [0,1,0,1,0,0|2,0,0]=4 21047 B13R1.189 CO[C@@H]1CCN(C1)CCCCCO 27fad5fa7a313deaaa915c5983375a02 [0,1,0,1,0,0|2,0,0]=4 21048 B13R1.189 CO[C@@H]1CC[C@@H](C1)OCCCCF f86d09463591c6f9ecdf7bc903d6f607 [0,1,0,1,0,0|2,0,0]=4 21049 B13R1.189 CO[C@@H]1CC[C@@H](C1)OCCCSC f48c65d4bd27b99dad1612dcc16a84a8 [0,1,0,1,0,0|2,0,0]=4 21050 B13R1.189 CO[C@@H]1CC[C@H](C1)OCCCCF 51fbb8adcc96673fdfdc4a8e8aa468a3 [0,1,0,1,0,0|2,0,0]=4 21051 B13R1.189 CO[C@@H]1CC[C@H](C1)OCCCSC 8267c245810fd9ebc581b20bcb99b1d4 [0,1,0,1,0,0|2,0,0]=4 21052 B13R1.189 CO[C@H]1CCN(C1)CCCCCF aa89dfe4d1d2f3846b6bb351abcfdab9 [0,1,0,1,0,0|2,0,0]=4 21053 B13R1.189 CO[C@H]1CCN(C1)CCCCCO b0e9b288e7352ad23dccda65b5d934dc [0,1,0,1,0,0|2,0,0]=4 21054 B13R1.189 CO[C@H]1CC[C@H](C1)NCCCCF 817c89d846dc1d66cc58af510e533234 [0,1,0,1,0,0|2,0,0]=4 21055 B13R1.189 CO[C@H]1CC[C@H](C1)NCCCCO 8df076d2593eed0efb165232df11f440 [0,1,0,1,0,0|2,0,0]=4 21056 B13R1.189 CO[C@H]1CC[C@H](C1)NCCCSC a0d901da8674b6c3f9b84f5c28c4031e [0,1,0,1,0,0|2,0,0]=4 21057 B13R1.189 CSCCCNC1CCC(C1)CO e4de3e5e8198aa5510a9f7caf4dde578 [0,1,0,1,0,0|2,0,0]=4 21058 B13R1.189 CSCCCN[C@@H]1CC[C@@H](C1)CO bb897b1945e920e112891c51211a7c07 [0,1,0,1,0,0|2,0,0]=4 21059 B13R1.189 CSCCCN[C@@H]1CC[C@H](C1)CO 7f9fb0732b62551b642b20ff6198527b [0,1,0,1,0,0|2,0,0]=4 21060 B13R1.189 CSCCCN[C@H]1CC[C@@H](C1)CO 5d5870c2fb3af67655b5d04d67d8b88b [0,1,0,1,0,0|2,0,0]=4 21061 B13R1.189 CSCCCN[C@H]1CC[C@H](C1)CO 98ef5bcab7ca141aa605425e64d8ac94 [0,1,0,1,0,0|2,0,0]=4 21062 B13R1.189 OCC1CCC(C1)NCCCCF 3bbf49ee2ff35ee4ce181fcdb18ce768 [0,1,0,1,0,0|2,0,0]=4 21063 B13R1.189 OCC1CCN(C1)CCCCCF c3c118f30df39fe997f14e36ac38beb7 [0,1,0,1,0,0|2,0,0]=4 21064 B13R1.189 OCCCCCN1CCC(C1)CO 9800ed736804817c6ec89ea8f20793f3 [0,1,0,1,0,0|2,0,0]=4 21065 B13R1.189 OCCCCCN1CC[C@@H](C1)CO 2a5c26434487cc9f218ce89999479e77 [0,1,0,1,0,0|2,0,0]=4 21066 B13R1.189 OCCCCCN1CC[C@H](C1)CO 04525e9711d42950b4fc72821116ffbb [0,1,0,1,0,0|2,0,0]=4 21067 B13R1.189 OCCCCNC1CCC(C1)CO 88ca4daf8b9b3f8c705c40ba701d5970 [0,1,0,1,0,0|2,0,0]=4 21068 B13R1.189 OCCCCN[C@@H]1CC[C@@H](C1)CO cd73d387a69a1be02e4976c28d093d32 [0,1,0,1,0,0|2,0,0]=4 21069 B13R1.189 OCCCCN[C@@H]1CC[C@H](C1)CO 1df71562be59d6ca544a5658775f4865 [0,1,0,1,0,0|2,0,0]=4 21070 B13R1.189 OCCCCN[C@H]1CC[C@@H](C1)CO af2c76aa6574da55227ba1f88982f885 [0,1,0,1,0,0|2,0,0]=4 21071 B13R1.189 OCCCCN[C@H]1CC[C@H](C1)CO 1f61347256f5dca70276d4d88741f903 [0,1,0,1,0,0|2,0,0]=4 21072 B13R1.189 OC[C@@H]1CCN(C1)CCCCCF a68732025e592fc56cdacc03180dead1 [0,1,0,1,0,0|2,0,0]=4 21073 B13R1.189 OC[C@@H]1CC[C@@H](C1)NCCCCF ecbfb152b80a18b33f62d9bdfb6c2bd6 [0,1,0,1,0,0|2,0,0]=4 21074 B13R1.189 OC[C@@H]1CC[C@H](C1)NCCCCF dd2bc313887bd053361e27ee9e8273c0 [0,1,0,1,0,0|2,0,0]=4 21075 B13R1.189 OC[C@H]1CCN(C1)CCCCCF 510ea724e89dd20df2614f5ad8b1b2cf [0,1,0,1,0,0|2,0,0]=4 21076 B13R1.189 OC[C@H]1CC[C@@H](C1)NCCCCF 240d4958c9f79788305d4b6d2e6e11a0 [0,1,0,1,0,0|2,0,0]=4 21077 B13R1.189 OC[C@H]1CC[C@H](C1)NCCCCF 5a58aa979f62b716edbd94c0a84a1686 [0,1,0,1,0,0|2,0,0]=4 21078 B13R1.222 CC(CO)CCN1CCC1CCO d5de2273912cd8cc9ba26d9a05231748 [0,1,0,1,0,0|2,0,0]=4 21079 B13R1.222 COCC1CCN1CCC(C)CO 3599496a8ddb5298fb2bf495bf1bdcf5 [0,1,0,1,0,0|2,0,0]=4 21080 B13R1.222 COC[C@@H]1CCN1CCC(C)CO 77e1816386c38db351091d32f1ebf376 [0,1,0,1,0,0|2,0,0]=4 21081 B13R1.222 COC[C@H]1CCN1CCC(C)CO 18342cfdd813495a09cfe4df09247d74 [0,1,0,1,0,0|2,0,0]=4 21082 B13R1.246 COC[C@@H]1C[C@@H]1NCCC(C)CO 50b263ceac67512ae22c637a92fbe310 [0,1,0,1,0,0|2,0,0]=4 21083 B13R1.246 COC[C@H]1C[C@@H]1NCCC(C)CO 7589f127b451f55b0d0ac5bccfc3f669 [0,1,0,1,0,0|2,0,0]=4 21084 B13R1.382 CC(CO)N1CCCCC1CCCl 31379b5fd29dd3828629ce56e75f0509 [0,1,0,1,0,0|2,0,0]=4 21085 B13R1.382 CC(CO)N1CCCCC1CCO 0e0fb8eb4c0f43c8c4ce80c0ed8da968 [0,1,0,1,0,0|2,0,0]=4 21086 B13R1.382 CC(CO)N1CCCC[C@@H]1CCO 1a8d2ba6e7a8267014d5e91361c700b8 [0,1,0,1,0,0|2,0,0]=4 21087 B13R1.382 CC(CO)N1CCCC[C@H]1CCO 414f1195728bea3bad1c988c4ead44d1 [0,1,0,1,0,0|2,0,0]=4 21088 B13R1.382 CCCC1COCCN1C(C)CO e365865caa5cadcd067aacdbda702af3 [0,1,0,1,0,0|2,0,0]=4 21089 B13R1.382 CCCC1COCCN1[C@@H](C)CO 9cfb9a54ae60346a49bd5f246fdc9380 [0,1,0,1,0,0|2,0,0]=4 21090 B13R1.382 CCCC1COCCN1[C@H](C)CO 690bc6673f038b4c2e61b5761b427340 [0,1,0,1,0,0|2,0,0]=4 21091 B13R1.382 CCCN1CCCCC1C(O)CO 91abcdb2f3e28c561cdcc2bcfbaff87e [0,1,0,1,0,0|1,0,0]=3 21092 B13R1.382 COCC1CCCCN1C(C)CO ab33970faf5657660941afbf19f8f5a1 [0,1,0,1,0,0|2,0,0]=4 21093 B13R1.382 COCC1CCCCN1[C@@H](C)CO 12a91d823a7b972dc674cf95390f945a [0,1,0,1,0,0|2,0,0]=4 21094 B13R1.382 COCC1CCCCN1[C@H](C)CO b262c01256d0b5837749b9c924007035 [0,1,0,1,0,0|2,0,0]=4 21095 B13R1.382 COCN1CCCCC1C(O)CO 3c51948a28bfc0f760a86ce0f9decfa0 [0,1,0,1,0,0|2,0,0]=4 21096 B13R1.382 CSCN1CCCCC1C(O)CO ada6b62da179732c530523563b384ffb [0,1,0,1,0,0|2,0,0]=4 21097 B13R1.382 C[C@@H](CO)N1CCCCC1CCCl aa65dfc5935faa36bc548b332dfc3480 [0,1,0,1,0,0|2,0,0]=4 21098 B13R1.382 C[C@@H](CO)N1CCCCC1CCO a916ca1f9f9646727e157501165d9637 [0,1,0,1,0,0|2,0,0]=4 21099 B13R1.382 C[C@@H](CO)N1CCCC[C@@H]1CCO 9804d096fe1a9f518ba01308787070b5 [0,1,0,1,0,0|2,0,0]=4 21100 B13R1.382 C[C@@H](CO)N1CCCC[C@H]1CCO e2363f4b52032025b65255ab8377f4b3 [0,1,0,1,0,0|2,0,0]=4 21101 B13R1.382 C[C@H](CO)N1CCCCC1CCCl ca1300bed6552a195eb54019622edd67 [0,1,0,1,0,0|2,0,0]=4 21102 B13R1.382 C[C@H](CO)N1CCCCC1CCO a7c56065b3fac4f4a3f0798168d25b4f [0,1,0,1,0,0|2,0,0]=4 21103 B13R1.382 C[C@H](CO)N1CCCC[C@@H]1CCO 2edec0c49c8fde05c912d836c85e177f [0,1,0,1,0,0|2,0,0]=4 21104 B13R1.382 C[C@H](CO)N1CCCC[C@H]1CCO 8c658087210658959c1ac09476889317 [0,1,0,1,0,0|2,0,0]=4 21105 B13R1.382 OCC(O)C1CCCCN1CCF 42b9e1f0991d30d3e673f2d04756b106 [0,1,0,1,0,0|2,0,0]=4 21106 B13R1.382 OCC(O)C1CCCCN1CCS be61e563dffea39fafe1efbf75bebfb4 [0,1,0,1,0,0|2,0,0]=4 21107 B13R1.382 OCCN1CCCCC1C(O)CO a6ff49bf84249b56efbe24b1be80bd9f [0,1,0,1,0,0|2,0,0]=4 21108 B13R1.393 CC(CO)CN1CCCC1CCO 21578d57549bf6c3d9542eb05cb7d28b [0,1,0,1,0,0|2,0,0]=4 21109 B13R1.393 CC(CO)CN1CCC[C@@H]1CCO 070fab7c4438ae6177d217795cece624 [0,1,0,1,0,0|2,0,0]=4 21110 B13R1.393 CCC(O)CN1CCCC1CCO e136e3c6b56dd7061800671e6b67b10e [0,1,0,1,0,0|2,0,0]=4 21111 B13R1.393 CCC(O)CN1CCCC1COC 3c06a4e600f6484044dcc2617c29f6db [0,1,0,1,0,0|2,0,0]=4 21112 B13R1.393 CCC(O)CN1CCCC1CSC 5499fbb7321403c534bd217ed2c5623f [0,1,0,1,0,0|2,0,0]=4 21113 B13R1.393 CCC(O)CN1CCC[C@@H]1CCO 53fe52858f10a45e0d2460125353eadc [0,1,0,1,0,0|2,0,0]=4 21114 B13R1.393 CCC(O)CN1CCC[C@@H]1COC 5870584b84e3ba84406fc0037bfc9e10 [0,1,0,1,0,0|2,0,0]=4 21115 B13R1.393 CCC(O)CN1CCC[C@H]1COC 235a639af1bfb7a715ec5beae6851b2b [0,1,0,1,0,0|2,0,0]=4 21116 B13R1.393 CCCC1SCCN1CC(C)CO 5428102b88b83e9b68e4dc17b046d598 [0,1,0,1,0,0|2,0,0]=4 21117 B13R1.393 CCCC1SCCN1CC(C)OC ae2c8e48dfc4648574bcd82c5dabe2dd [0,1,0,1,0,0|2,0,0]=4 21118 B13R1.393 CCCC1SCCN1CC(O)CC 201b48a98a1c209f3111ac43071b2923 [0,1,0,1,0,0|2,0,0]=4 21119 B13R1.393 CCCC1SCCN1CC(O)CF d423cc0764f4c3a723f8073a875361ff [0,1,0,1,0,0|2,0,0]=4 21120 B13R1.393 CCCC1SCCN1CC(O)CO 5d4b1c12585918f46a527480c7193563 [0,1,0,1,0,0|2,0,0]=4 21121 B13R1.393 CCCC1SCCN1C[C@@H](C)CO f7a66498b0639693b1eefc48cb4ee1e0 [0,1,0,1,0,0|2,0,0]=4 21122 B13R1.393 CCCC1SCCN1C[C@@H](C)OC 42dce12cd93d82a473ecd3849b884fe6 [0,1,0,1,0,0|2,0,0]=4 21123 B13R1.393 CCCC1SCCN1C[C@@H](O)CO 8650ce9bceac84d0ea1e618f0d6d322c [0,1,0,1,0,0|2,0,0]=4 21124 B13R1.393 CCCC1SCCN1C[C@H](C)CO 9cb84379154b5926e8b71d6f95878917 [0,1,0,1,0,0|2,0,0]=4 21125 B13R1.393 CCCC1SCCN1C[C@H](C)OC 2c29676b37b984ef9200b2999a3922f2 [0,1,0,1,0,0|2,0,0]=4 21126 B13R1.393 CCCC1SCCN1C[C@H](O)CO ecbfaa64ee949cc3e6c8a5022384a90f [0,1,0,1,0,0|2,0,0]=4 21127 B13R1.393 COC(C)CN1CCCC1CCO aca9978c4138a81ea62fe803de06ef66 [0,1,0,1,0,0|2,0,0]=4 21128 B13R1.393 COC(C)CN1CCCC1CSC b0e6dc29e10bc2e367644cc32f879985 [0,1,0,1,0,0|2,0,0]=4 21129 B13R1.393 COC(C)CN1CCC[C@@H]1CCO 0a00a280dc8dcec7f4749f6e64ada561 [0,1,0,1,0,0|2,0,0]=4 21130 B13R1.393 COCC1CCCN1CC(C)CO fbf769f6a7f9c966e9f2443106f43908 [0,1,0,1,0,0|2,0,0]=4 21131 B13R1.393 COCC1CCCN1CC(C)OC 5d0d1bf0faafae8ad371ca7fe4ea529f [0,1,0,1,0,0|2,0,0]=4 21132 B13R1.393 COCC1CCCN1CC(O)CF 440fd70185ece40a47c428287b00f374 [0,1,0,1,0,0|2,0,0]=4 21133 B13R1.393 COCC1CCCN1CC(O)CO 8619cf9b0fa53d73532461705da7e45e [0,1,0,1,0,0|2,0,0]=4 21134 B13R1.393 COCC1CCCN1C[C@@H](C)CO 4a29d94c749659833d4eef5bc2b9943f [0,1,0,1,0,0|2,0,0]=4 21135 B13R1.393 COCC1CCCN1C[C@@H](C)OC c3f2f8c43b61b865741ba3d9a372ad8f [0,1,0,1,0,0|2,0,0]=4 21136 B13R1.393 COCC1CCCN1C[C@@H](O)CO e955f0ab2b14e80c873a4ef56f54341d [0,1,0,1,0,0|2,0,0]=4 21137 B13R1.393 COCC1CCCN1C[C@H](C)CO aa4f8468a53b2c66e6233989d8689125 [0,1,0,1,0,0|2,0,0]=4 21138 B13R1.393 COCC1CCCN1C[C@H](C)OC eaeec9cd557e24fbc925364f1eb1e886 [0,1,0,1,0,0|2,0,0]=4 21139 B13R1.393 COCC1CCCN1C[C@H](O)CO b5cdc35d5b900fca5691012674469e9e [0,1,0,1,0,0|2,0,0]=4 21140 B13R1.393 COC[C@@H]1CCCN1CC(C)CO 39173f7f3af961171e0f617cc4191016 [0,1,0,1,0,0|2,0,0]=4 21141 B13R1.393 COC[C@@H]1CCCN1CC(C)OC b542b8290c3e3676778f55bff35bc6a4 [0,1,0,1,0,0|2,0,0]=4 21142 B13R1.393 COC[C@@H]1CCCN1CC(O)CF 57d6ccad2ff152a6d6e79dff5617293a [0,1,0,1,0,0|2,0,0]=4 21143 B13R1.393 COC[C@@H]1CCCN1CC(O)CO 253d879bbd3f82ce0634641739493939 [0,1,0,1,0,0|2,0,0]=4 21144 B13R1.393 COC[C@@H]1CCCN1C[C@@H](C)CO ec88f306c83a4d9168e810b3871d791e [0,1,0,1,0,0|2,0,0]=4 21145 B13R1.393 COC[C@@H]1CCCN1C[C@@H](C)OC 6a7159bfbfc1a612e0c5d807ad9405f5 [0,1,0,1,0,0|2,0,0]=4 21146 B13R1.393 COC[C@@H]1CCCN1C[C@@H](O)CO faf6f1db9b21ccfdf72ebca846b2d1cb [0,1,0,1,0,0|2,0,0]=4 21147 B13R1.393 COC[C@@H]1CCCN1C[C@H](C)CO e236e33ad390bcd9455de7b660762f93 [0,1,0,1,0,0|2,0,0]=4 21148 B13R1.393 COC[C@@H]1CCCN1C[C@H](C)OC bbcd167bc8beefdb4d7c65f5b0988aa5 [0,1,0,1,0,0|2,0,0]=4 21149 B13R1.393 COC[C@@H]1CCCN1C[C@H](O)CO ff7cdeb35a0a1fa693d2175e39fd5e60 [0,1,0,1,0,0|2,0,0]=4 21150 B13R1.393 COC[C@@H]1CCC[C@@H]1NC(C)CO 4b8cf60bf3c29957ad6d7e75b2ada087 [0,1,0,1,0,0|2,0,0]=4 21151 B13R1.393 COC[C@@H]1CCC[C@@H]1N[C@@H](C)CO 7e8c2b6a230c47703e06eb3f901f8ed1 [0,1,0,1,0,0|2,0,0]=4 21152 B13R1.393 COC[C@@H]1CCC[C@@H]1N[C@H](C)CO 6863f8450c6c6fa95a0dd9cdc777068e [0,1,0,1,0,0|2,0,0]=4 21153 B13R1.393 COC[C@H]1CCCN1CC(C)CO 3575717529a3aca141c667388d0341e2 [0,1,0,1,0,0|2,0,0]=4 21154 B13R1.393 COC[C@H]1CCCN1CC(C)OC 06a585a87d2a6792ff83744ff2162d63 [0,1,0,1,0,0|2,0,0]=4 21155 B13R1.393 COC[C@H]1CCCN1CC(O)CF d5eb02125b311a0eede529a3d6d84674 [0,1,0,1,0,0|2,0,0]=4 21156 B13R1.393 COC[C@H]1CCCN1CC(O)CO e0144b3734bdc3fd8e2bd246a1d15acf [0,1,0,1,0,0|2,0,0]=4 21157 B13R1.393 COC[C@H]1CCCN1C[C@@H](C)CO e67b59dd4cce3021fc285cf470501239 [0,1,0,1,0,0|2,0,0]=4 21158 B13R1.393 COC[C@H]1CCCN1C[C@@H](C)OC 5b5313c8277ce68fec02c18882916cc7 [0,1,0,1,0,0|2,0,0]=4 21159 B13R1.393 COC[C@H]1CCCN1C[C@@H](O)CO d414f2c9e77f41a099d8290696a611c5 [0,1,0,1,0,0|2,0,0]=4 21160 B13R1.393 COC[C@H]1CCCN1C[C@H](C)CO 2b5a6c26a066c2727e128c5d3f1d0156 [0,1,0,1,0,0|2,0,0]=4 21161 B13R1.393 COC[C@H]1CCCN1C[C@H](C)OC fff0acc2d1cfe3fda274cb03fc02d7eb [0,1,0,1,0,0|2,0,0]=4 21162 B13R1.393 COC[C@H]1CCCN1C[C@H](O)CO f0b99147ea776e3dc71e12830bc7bad5 [0,1,0,1,0,0|2,0,0]=4 21163 B13R1.393 COC[C@H]1CCC[C@H]1NC(C)CO 5538c63beecfe534c16a5f7991612c78 [0,1,0,1,0,0|2,0,0]=4 21164 B13R1.393 COC[C@H]1CCC[C@H]1N[C@@H](C)CO b300a0207dfad07494d93193d057a943 [0,1,0,1,0,0|2,0,0]=4 21165 B13R1.393 COC[C@H]1CCC[C@H]1N[C@H](C)CO 58719936238f478f49d11122478e5917 [0,1,0,1,0,0|2,0,0]=4 21166 B13R1.393 CO[C@@H](C)CN1CCCC1CCO 626ed5858af1e1f6123cfa183288171c [0,1,0,1,0,0|2,0,0]=4 21167 B13R1.393 CO[C@@H](C)CN1CCCC1CSC a8e9a6a3f0a5793acbd07eb2c99bdf27 [0,1,0,1,0,0|2,0,0]=4 21168 B13R1.393 CO[C@@H](C)CN1CCC[C@@H]1CCO 71d3474ac03edbb935cc4a3e14fa41d6 [0,1,0,1,0,0|2,0,0]=4 21169 B13R1.393 CO[C@H](C)CN1CCCC1CCO a85746b3f8c94546d8cea418910095d0 [0,1,0,1,0,0|2,0,0]=4 21170 B13R1.393 CO[C@H](C)CN1CCCC1CSC afed91be3ba510937eacce615fdc5f58 [0,1,0,1,0,0|2,0,0]=4 21171 B13R1.393 CO[C@H](C)CN1CCC[C@@H]1CCO 0fd6a4427a103a6f550a149863e163f6 [0,1,0,1,0,0|2,0,0]=4 21172 B13R1.393 CSCC1CCCN1CC(C)CO cdfa126ba2d008cd14552dcba119deac [0,1,0,1,0,0|2,0,0]=4 21173 B13R1.393 CSCC1CCCN1CC(O)CF f4b2b795374775b5b3573d26edc54579 [0,1,0,1,0,0|2,0,0]=4 21174 B13R1.393 CSCC1CCCN1CC(O)CO 7a65e8b294b29a5b6db9bd7870f98a26 [0,1,0,1,0,0|2,0,0]=4 21175 B13R1.393 CSCC1CCCN1C[C@@H](C)CO 6f344bc58cbeeec820ee3d746fcd970f [0,1,0,1,0,0|2,0,0]=4 21176 B13R1.393 CSCC1CCCN1C[C@@H](O)CO 55a10f5fce11ace90e8acf6fd93c1284 [0,1,0,1,0,0|2,0,0]=4 21177 B13R1.393 CSCC1CCCN1C[C@H](C)CO daa22a3a5fa0cc03b49b83d6e3edc068 [0,1,0,1,0,0|2,0,0]=4 21178 B13R1.393 CSCC1CCCN1C[C@H](O)CO a1f3a7973b92691eee83a6ac27262be8 [0,1,0,1,0,0|2,0,0]=4 21179 B13R1.393 C[C@@H](CO)CN1CCCC1CCO c9deeaea20d19f8706802588577fd389 [0,1,0,1,0,0|2,0,0]=4 21180 B13R1.393 C[C@@H](CO)CN1CCC[C@@H]1CCO 48dd0376d66525c26ba4d97460fccf72 [0,1,0,1,0,0|2,0,0]=4 21181 B13R1.393 C[C@H](CO)CN1CCCC1CCO df75afb3fba972de9b4bb0a7b41a5d47 [0,1,0,1,0,0|2,0,0]=4 21182 B13R1.393 C[C@H](CO)CN1CCC[C@@H]1CCO df1c7545bd9b90b2a444180f4062bfde [0,1,0,1,0,0|2,0,0]=4 21183 B13R1.393 OCCC1CCCN1CC(O)CF bd791b520b254a5e4d476085d5ff6e0d [0,1,0,1,0,0|2,0,0]=4 21184 B13R1.393 OCCC1CCCN1CC(O)CO b76bd7288f1000ca02a4b0b71aeddd09 [0,1,0,1,0,0|2,0,0]=4 21185 B13R1.393 OCCC1CCCN1C[C@@H](O)CO 2d2066647d23ddd2500675c1eb0999d3 [0,1,0,1,0,0|2,0,0]=4 21186 B13R1.393 OCCC1CCCN1C[C@H](O)CO 174046e15b072dc3de9326956a5b1bef [0,1,0,1,0,0|2,0,0]=4 21187 B13R1.393 OCC[C@H]1CCCN1CC(O)CF c730a02eea4bb5d4f7f5b39fad2510fb [0,1,0,1,0,0|2,0,0]=4 21188 B13R1.393 OCC[C@H]1CCCN1CC(O)CO 92eff63760d1403422d74e5389a055a9 [0,1,0,1,0,0|2,0,0]=4 21189 B13R1.393 OCC[C@H]1CCCN1C[C@@H](O)CO eaa3261aa9e6599dd3a18b9b3a197f18 [0,1,0,1,0,0|2,0,0]=4 21190 B13R1.393 OCC[C@H]1CCCN1C[C@H](O)CO 5d5753b60c6a6c208e75282779fd5056 [0,1,0,1,0,0|2,0,0]=4 21191 B13R1.527 CC(C#N)CN1CCCCCC1C 1c39adda18a8a56e5adb46d21c435d36 [0,1,0,1,0,0|2,0,0]=4 21192 B13R1.527 CC(CO)CN1CCCCCC1C 3cf314847a502de44222248d846633db [0,1,0,1,0,0|1,0,0]=3 21193 B13R1.527 CC(CO)CN1CCCOCC1C 4395d41c229e5d1be144a901c9795c9c [0,1,0,1,0,0|2,0,0]=4 21194 B13R1.527 CC(CO)CN1CCOCCC1C babb3f3e3b010370e655fdf66a1015a3 [0,1,0,1,0,0|2,0,0]=4 21195 B13R1.527 CC(CO)CN1CCSCCC1C 3f96b12a73bebac1bc0aa663f9638a02 [0,1,0,1,0,0|2,0,0]=4 21196 B13R1.527 CC(CO)N[C@@H]1CCCCC[C@@H]1O 5f0fa90020df75cc7ee41c4d78eab5c3 [0,1,0,1,0,0|2,0,0]=4 21197 B13R1.527 CC(CO)N[C@@H]1CCCCC[C@H]1O da9da4d762c58142a3aec730d1a57e8d [0,1,0,1,0,0|2,0,0]=4 21198 B13R1.527 CC(CO)N[C@H]1CCCCC[C@@H]1O 14ce4071c4400903f11c2c4b1ee095ed [0,1,0,1,0,0|2,0,0]=4 21199 B13R1.527 CC1CCCCCN1CC(O)CF cccc9777ab18e7f29e4c4ef013fe879f [0,1,0,1,0,0|1,0,0]=3 21200 B13R1.527 CC1CCCCCN1CC(O)CO b0822532944278e9ce92cb2f4c645d8b [0,1,0,1,0,0|1,0,0]=3 21201 B13R1.527 CC1CCCCCN1C[C@@H](C)CO 4d2566a0bd8a20e7423c43d57d94b53c [0,1,0,1,0,0|1,0,0]=3 21202 B13R1.527 CC1CCCCCN1C[C@@H](O)CO 9e009d66407a1b7eb573a2badb75d242 [0,1,0,1,0,0|1,0,0]=3 21203 B13R1.527 CC1CCCCCN1C[C@H](C)CO a76f753e169a1571ef5343995eb31834 [0,1,0,1,0,0|1,0,0]=3 21204 B13R1.527 CC1CCCCCN1C[C@H](O)CO 3a02a2540fb7d2ce38131ce07a5a70c7 [0,1,0,1,0,0|1,0,0]=3 21205 B13R1.527 CC1CCOCCN1CC(O)CF 87695086274e25f3c67ecaa0d7fa1aa1 [0,1,0,1,0,0|2,0,0]=4 21206 B13R1.527 CC1CCOCCN1CC(O)CO 4c2bb4e2291e7d22e3cc7bd0a91efdea [0,1,0,1,0,0|2,0,0]=4 21207 B13R1.527 CC1CCOCCN1C[C@@H](C)CO 02e35349ed90bbb0942f9759c531021b [0,1,0,1,0,0|2,0,0]=4 21208 B13R1.527 CC1CCOCCN1C[C@@H](O)CO 49d760259476fe80f3275cade48da133 [0,1,0,1,0,0|2,0,0]=4 21209 B13R1.527 CC1CCOCCN1C[C@H](C)CO 2eee904a91600f30b97ecd45c28aba3f [0,1,0,1,0,0|2,0,0]=4 21210 B13R1.527 CC1CCOCCN1C[C@H](O)CO 0d1d67cfaf005cd496f6ba0e6bed0342 [0,1,0,1,0,0|2,0,0]=4 21211 B13R1.527 CC1CCSCCN1CC(O)CF cfe9bf78b6da8a9c31d7dcc53e3acf9e [0,1,0,1,0,0|2,0,0]=4 21212 B13R1.527 CC1CCSCCN1CC(O)CO 24b38bfcead2f1ceeba2b8a6a7b2c54c [0,1,0,1,0,0|2,0,0]=4 21213 B13R1.527 CC1CCSCCN1C[C@@H](C)CO 2f7d14fa5e2ddc1613ef89c1d4672eba [0,1,0,1,0,0|2,0,0]=4 21214 B13R1.527 CC1CCSCCN1C[C@@H](O)CO 89efb0738fd3ed7c05a91da27836d4e5 [0,1,0,1,0,0|2,0,0]=4 21215 B13R1.527 CC1CCSCCN1C[C@H](C)CO cee5208888748b9da06e577a7ef99ff1 [0,1,0,1,0,0|2,0,0]=4 21216 B13R1.527 CC1CCSCCN1C[C@H](O)CO 7eead6405d3757f5ceadc4631b560a3f [0,1,0,1,0,0|2,0,0]=4 21217 B13R1.527 CC1COCCCN1CC(O)CF 93f34c7bc44c3c1d8c7c578b3868869c [0,1,0,1,0,0|2,0,0]=4 21218 B13R1.527 CC1COCCCN1CC(O)CO be1824afb0e06aa71bb3bf889a890fbc [0,1,0,1,0,0|2,0,0]=4 21219 B13R1.527 CC1COCCCN1C[C@@H](C)CO c2a6a0dffe572e94c7bfe15e5ad1537f [0,1,0,1,0,0|2,0,0]=4 21220 B13R1.527 CC1COCCCN1C[C@@H](O)CO 93586ce008c8c59cf4df855a081c9d91 [0,1,0,1,0,0|2,0,0]=4 21221 B13R1.527 CC1COCCCN1C[C@H](C)CO a592c3f91e7bf23765a97fe0423f9864 [0,1,0,1,0,0|2,0,0]=4 21222 B13R1.527 CC1COCCCN1C[C@H](O)CO 1a642ff79b124fb1a36c4d0e4c84e7b2 [0,1,0,1,0,0|2,0,0]=4 21223 B13R1.527 CCC(C)CN1CCCCCC1C a6bf3fda28d15194f381347656f86bec [0,1,0,1,0,0|2,0,0]=4 21224 B13R1.527 CCC(O)CN1CCCCCC1C 9e38a2d55f81c264d0b1e4cd803abe1b [0,1,0,1,0,0|1,0,0]=3 21225 B13R1.527 CCC(O)CN1CCCOCC1C 2fffd0e38f64421c17c6973f8d2ecee5 [0,1,0,1,0,0|2,0,0]=4 21226 B13R1.527 CCC(O)CN1CCOCCC1C 7fc533cca723085f04d7eccfa0114e5f [0,1,0,1,0,0|2,0,0]=4 21227 B13R1.527 CCC(O)CN1CCSCCC1C 41e399b6e249909e8f9467581bd8a2a1 [0,1,0,1,0,0|2,0,0]=4 21228 B13R1.527 CC[C@@H](C)CN1CCCCCC1C dc391fcd18eee3df8db21b3d7bfe5cf3 [0,1,0,1,0,0|2,0,0]=4 21229 B13R1.527 CC[C@H](C)CN1CCCCCC1C a5cdeeb18c8f50dac6a468075201da83 [0,1,0,1,0,0|2,0,0]=4 21230 B13R1.527 COC(C)CN1CCCCCC1C b7291f68da58cc061eecb5a8d2274db9 [0,1,0,1,0,0|1,0,0]=3 21231 B13R1.527 COC(C)CN1CCCOCC1C 7f91e67279003aef678db97743e8ae7e [0,1,0,1,0,0|2,0,0]=4 21232 B13R1.527 COC(C)CN1CCOCCC1C d0c33fef31ce7320fab8a4a4e5b4c3df [0,1,0,1,0,0|2,0,0]=4 21233 B13R1.527 COC(C)CN1CCSCCC1C 52d9b7ba6514bf2647591e2b19b7d6bb [0,1,0,1,0,0|2,0,0]=4 21234 B13R1.527 CO[C@@H](C)CN1CCCCCC1C f898a4a94296dff0c0c14f672c3f010f [0,1,0,1,0,0|1,0,0]=3 21235 B13R1.527 CO[C@@H](C)CN1CCCOCC1C c029b1ff054eaa047d297da6bbf59927 [0,1,0,1,0,0|2,0,0]=4 21236 B13R1.527 CO[C@@H](C)CN1CCOCCC1C 63651a66a90cdf3fe162e3808e67467f [0,1,0,1,0,0|2,0,0]=4 21237 B13R1.527 CO[C@@H](C)CN1CCSCCC1C d4b2b1a0fa917e4f98e04b7340c42fe1 [0,1,0,1,0,0|2,0,0]=4 21238 B13R1.527 CO[C@H](C)CN1CCCCCC1C c9f3f63ac7adb63ce57ccc5296694edd [0,1,0,1,0,0|1,0,0]=3 21239 B13R1.527 CO[C@H](C)CN1CCCOCC1C c623b3649730e9cc96a3bd9e69bcd6c4 [0,1,0,1,0,0|2,0,0]=4 21240 B13R1.527 CO[C@H](C)CN1CCOCCC1C d4cdcbed00bf6e9a0ab7f27f6de94b30 [0,1,0,1,0,0|2,0,0]=4 21241 B13R1.527 CO[C@H](C)CN1CCSCCC1C 0b1638afe698ae1bca7d0c70c3a7bc47 [0,1,0,1,0,0|2,0,0]=4 21242 B13R1.527 C[C@@H](CO)N[C@@H]1CCCCC[C@@H]1O 282ac3845f1b661dba2f1b18d485b4e0 [0,1,0,1,0,0|2,0,0]=4 21243 B13R1.527 C[C@@H](CO)N[C@@H]1CCCCC[C@H]1O 45ad0c9fcba68c3ae7b6362c6c8c1afa [0,1,0,1,0,0|2,0,0]=4 21244 B13R1.527 C[C@@H](CO)N[C@H]1CCCCC[C@@H]1O 637b95b947cde514401eb28da1a9d1f3 [0,1,0,1,0,0|2,0,0]=4 21245 B13R1.527 C[C@H](CO)N[C@@H]1CCCCC[C@@H]1O 2d8f01b4cb4c65e6efcc0a290c17e664 [0,1,0,1,0,0|2,0,0]=4 21246 B13R1.527 C[C@H](CO)N[C@@H]1CCCCC[C@H]1O cf9b705dea45e01592945144a46dd176 [0,1,0,1,0,0|2,0,0]=4 21247 B13R1.527 C[C@H](CO)N[C@H]1CCCCC[C@@H]1O bfe0df02543f1496b8ebb8635b7bf58f [0,1,0,1,0,0|2,0,0]=4 21248 B13R1.528 C#CC(C)NCC1CCCCC1C 5a9ef89abae6488fbe0ac1143cdf24f7 [0,1,0,1,0,0|2,0,0]=4 21249 B13R1.528 C=CC(C)CO[C@H]1CCCC[C@H]1C 64657898d63737a1d88745bdc225b647 [0,1,0,1,0,0|2,0,0]=4 21250 B13R1.528 C=CC(C)NCC1CCCCC1C c6f2d61bf50b618871cd460c5474d78e [0,1,0,1,0,0|2,0,0]=4 21251 B13R1.528 C=CC(O)CN[C@H]1CCCC[C@H]1C 2aa8729067a2637555f1a4b833d3a147 [0,1,0,1,0,0|1,0,1]=4 21252 B13R1.528 CC(C#N)CNC1CCCCC1C 0c7bf75cf9d3f5b3ee88b25b65fab277 [0,1,0,1,0,0|2,0,0]=4 21253 B13R1.528 CC(C#N)CN[C@@H]1CCCC[C@@H]1C 8fefd93ae94a1f11ccfa99fe618625b3 [0,1,0,1,0,0|2,0,0]=4 21254 B13R1.528 CC(C#N)CN[C@@H]1CCCC[C@H]1C 1ffd680fa3fdcf6180df047e4724b7d3 [0,1,0,1,0,0|2,0,0]=4 21255 B13R1.528 CC(C#N)CN[C@H]1CCCC[C@@H]1C 33a6a91eea709a2760ccb81914f0fd0d [0,1,0,1,0,0|2,0,0]=4 21256 B13R1.528 CC(C#N)CN[C@H]1CCCC[C@H]1C d96e8c1f93f0a6ca43fb217b6f317e91 [0,1,0,1,0,0|2,0,0]=4 21257 B13R1.528 CC(C#N)COC1CCCCC1C c63cf25742dc7646a6694b3b3593355c [0,1,0,1,0,0|2,0,0]=4 21258 B13R1.528 CC(C#N)CO[C@@H]1CCCC[C@@H]1C a19f3a3731d761267ca41ba17c7c7005 [0,1,0,1,0,0|2,0,0]=4 21259 B13R1.528 CC(C#N)CO[C@H]1CCCC[C@@H]1C fa6eb7a81fb79014b5e2eff36017a5e1 [0,1,0,1,0,0|2,0,0]=4 21260 B13R1.528 CC(C#N)CO[C@H]1CCCC[C@H]1C 43be4fc550fee0b16c4ecb9fe0b5b0f9 [0,1,0,1,0,0|2,0,0]=4 21261 B13R1.528 CC(C#N)NCC1CCCCC1C 38abaebe18172e71ad9ad3b92282f752 [0,1,0,1,0,0|2,0,0]=4 21262 B13R1.528 CC(C=O)NCC1CCCCC1C 1cffd4f365241702ae44200e17146ef2 [0,1,0,1,0,0|1,0,1]=4 21263 B13R1.528 CC(CO)CCN1CCCCC1C 22c5aca312d215a79429d6706d904ff6 [0,1,0,1,0,0|1,0,0]=3 21264 B13R1.528 CC(CO)CCN1CCCC[C@@H]1C 507de6f80fc9b9d2c8f186065e02327e [0,1,0,1,0,0|1,0,0]=3 21265 B13R1.528 CC(CO)CCN1CCCC[C@H]1C d97a1b1063211a7e84c409b2998cad87 [0,1,0,1,0,0|1,0,0]=3 21266 B13R1.528 CC(CO)CCN1CCOCC1C 0bb795a10e05fbce7e365cd2cdbdf2a0 [0,1,0,1,0,0|2,0,0]=4 21267 B13R1.528 CC(CO)CCN1CCOC[C@@H]1C 95a3295b72a43d9cc3351bf848d57683 [0,1,0,1,0,0|2,0,0]=4 21268 B13R1.528 CC(CO)CCN1CCOC[C@H]1C d018bbcdd450a02a36ec85036490a017 [0,1,0,1,0,0|2,0,0]=4 21269 B13R1.528 CC(CO)CNC1CCCCC1C 391e0de6bac073525e4d49159665e4a4 [0,1,0,1,0,0|1,0,0]=3 21270 B13R1.528 CC(CO)CNC1CCCCC1F b6606fb1bdb9c3e4364537fd1af3f7d5 [0,1,0,1,0,0|2,0,0]=4 21271 B13R1.528 CC(CO)CNC1CCCCC1O 6e46e1c4641131eb1f95ac72ece037d0 [0,1,0,1,0,0|2,0,0]=4 21272 B13R1.528 CC(CO)CNC1CCOCC1C 2cab889ea6c6cedde19e149728b420bb [0,1,0,1,0,0|2,0,0]=4 21273 B13R1.528 CC(CO)CN[C@@H]1CCCC[C@@H]1C ad79ea01cbf06d86246dd6f594c48b4c [0,1,0,1,0,0|1,0,0]=3 21274 B13R1.528 CC(CO)CN[C@@H]1CCCC[C@H]1C 6d36a5bd6c32c56851076a00fa11a79c [0,1,0,1,0,0|1,0,0]=3 21275 B13R1.528 CC(CO)CN[C@@H]1CCCC[C@H]1O a94fc26c45bd58b1d6ab5aa00914b6cc [0,1,0,1,0,0|2,0,0]=4 21276 B13R1.528 CC(CO)CN[C@@H]1CCOC[C@@H]1C 8c335809a28d6cf43c1ada9276a29774 [0,1,0,1,0,0|2,0,0]=4 21277 B13R1.528 CC(CO)CN[C@H]1CCCC[C@@H]1C 468b8aeb6fe05b37857fa8d94efe1c3a [0,1,0,1,0,0|1,0,0]=3 21278 B13R1.528 CC(CO)CN[C@H]1CCCC[C@@H]1O bf5d4f543eaa4b323d28f6420e4b0e5b [0,1,0,1,0,0|2,0,0]=4 21279 B13R1.528 CC(CO)CN[C@H]1CCCC[C@H]1C 875693a3b93bfbcb0cd016a66ee7c294 [0,1,0,1,0,0|1,0,0]=3 21280 B13R1.528 CC(CO)CN[C@H]1CCCC[C@H]1O 164af1c190f808492069063d7ff88c05 [0,1,0,1,0,0|2,0,0]=4 21281 B13R1.528 CC(CO)CN[C@H]1CCOC[C@H]1C 28eb73e0c99d680448adc48b4864be87 [0,1,0,1,0,0|2,0,0]=4 21282 B13R1.528 CC(CO)NCC1CCCCC1C d3d49ba7fbab14f81f472005b4806fa6 [0,1,0,1,0,0|1,0,0]=3 21283 B13R1.528 CC(CO)NCC1CCCCC1O dca1b613162a34312a2746bae3557e9a [0,1,0,1,0,0|2,0,0]=4 21284 B13R1.528 CC(CO)NCC1CCCCN1C 79371daf0ae6d1dcb745e1d32fb080d5 [0,1,0,1,0,0|2,0,0]=4 21285 B13R1.528 CC1CCCCC1CN[C@@H](C)CO 670822e5e8350c88313605f35abe1fe5 [0,1,0,1,0,0|1,0,0]=3 21286 B13R1.528 CC1CCCCC1CN[C@H](C)C=O 5bc0e03ca848ca8447e52748a6067259 [0,1,0,1,0,0|1,0,1]=4 21287 B13R1.528 CC1CCCCC1CN[C@H](C)CO 88a1ae91852dd00f84bb49e76e4bbd89 [0,1,0,1,0,0|1,0,0]=3 21288 B13R1.528 CC1CCCCC1NCC(O)CF 3a1cd22ba0844540d3f5b3e957951e12 [0,1,0,1,0,0|1,0,0]=3 21289 B13R1.528 CC1CCCCC1NCC(O)CO 1d90b981aa1e23e1dbaa8064e9df94ea [0,1,0,1,0,0|1,0,0]=3 21290 B13R1.528 CC1CCCCC1NC[C@@H](C)CO 0b58a5d8121e00cd7a2cf03c86d1b770 [0,1,0,1,0,0|1,0,0]=3 21291 B13R1.528 CC1CCCCC1NC[C@@H](O)CO 98d273621c173d04a60eca7d3ace2137 [0,1,0,1,0,0|1,0,0]=3 21292 B13R1.528 CC1CCCCC1NC[C@H](C)CO 0363397487763b00737322c03a3bbc5a [0,1,0,1,0,0|1,0,0]=3 21293 B13R1.528 CC1CCCCC1NC[C@H](O)CO 0cc01c6fbe7eb02cb3ce78a53cbd6b89 [0,1,0,1,0,0|1,0,0]=3 21294 B13R1.528 CC1CCCCC1OCC(O)CO 03184e6448477797b35334dbf47532e2 [0,1,0,1,0,0|1,0,0]=3 21295 B13R1.528 CC1CCCCC1OC[C@@H](O)CO 5cf7cd60fa3bb60e19f8a9f67693f78a [0,1,0,1,0,0|1,0,0]=3 21296 B13R1.528 CC1CCCCC1OC[C@H](O)CO b73442ed004ede0597c58a3c79512f6d [0,1,0,1,0,0|1,0,0]=3 21297 B13R1.528 CC1CCCCN1CCN(C)CO 3e2e00cf005e7d8413a62fac1bfea31d [0,1,0,1,0,0|2,0,0]=4 21298 B13R1.528 CC1COCCC1NCC(O)CF bc34291a9ddeba496f1dcdf5757c4684 [0,1,0,1,0,0|2,0,0]=4 21299 B13R1.528 CC1COCCC1NCC(O)CO 0678addcc677ceebc90958311b75f500 [0,1,0,1,0,0|2,0,0]=4 21300 B13R1.528 CC1COCCC1NC[C@@H](C)CO bdca72e4b7d20afc342513302d957ee7 [0,1,0,1,0,0|2,0,0]=4 21301 B13R1.528 CC1COCCC1NC[C@@H](O)CO 817890f291d4e0d4c31c05ef0d7d8ad4 [0,1,0,1,0,0|2,0,0]=4 21302 B13R1.528 CC1COCCC1NC[C@H](C)CO 7d246ff5b96da3642932fa84f8640226 [0,1,0,1,0,0|2,0,0]=4 21303 B13R1.528 CC1COCCC1NC[C@H](O)CO ad88cec8c3fa330e4ceed979d26468a6 [0,1,0,1,0,0|2,0,0]=4 21304 B13R1.528 CC1COCCC1OCC(O)CO bee45f1272eb48c13a53a2404f300b5c [0,1,0,1,0,0|2,0,0]=4 21305 B13R1.528 CC1COCCC1OC[C@@H](O)CO 5dc0c9b789ecc6e5c43271ded11a84ee [0,1,0,1,0,0|2,0,0]=4 21306 B13R1.528 CC1COCCC1OC[C@H](O)CO c11549e663a1ca314b440642645b7af9 [0,1,0,1,0,0|2,0,0]=4 21307 B13R1.528 CCC(C)CCN1CCCCC1C d9631025eba65f7de9bfa857dd85b21f [0,1,0,1,0,0|2,0,0]=4 21308 B13R1.528 CCC(C)CCN1CCCC[C@@H]1C 3791aee6a32b176b7466d977d2564e57 [0,1,0,1,0,0|2,0,0]=4 21309 B13R1.528 CCC(C)CCN1CCCC[C@H]1C 756d66b9be46426a91a3c0f8dd1221aa [0,1,0,1,0,0|2,0,0]=4 21310 B13R1.528 CCC(C)CNC1CCCCC1C 12feea866f6f3002b19ff2a6e2da9c34 [0,1,0,1,0,0|2,0,0]=4 21311 B13R1.528 CCC(C)CN[C@@H]1CCCC[C@@H]1C eff2c6fc334cab2f1ebbbc61962e5f75 [0,1,0,1,0,0|2,0,0]=4 21312 B13R1.528 CCC(C)CN[C@@H]1CCCC[C@H]1C 6c7e346960701e492d41b65d26bc544c [0,1,0,1,0,0|2,0,0]=4 21313 B13R1.528 CCC(C)CN[C@H]1CCCC[C@@H]1C 03b7427b972fcf6ec464100f64af0134 [0,1,0,1,0,0|2,0,0]=4 21314 B13R1.528 CCC(C)CN[C@H]1CCCC[C@H]1C 7220ee08348bf66454717dd13ace822f [0,1,0,1,0,0|2,0,0]=4 21315 B13R1.528 CCC(C)COC1CCCCC1C 852d6b01d67c9ac47fe2dd6b127a108e [0,1,0,1,0,0|2,0,0]=4 21316 B13R1.528 CCC(C)CO[C@@H]1CCCC[C@@H]1C ae3ca6374b638ba0db32b4150536686a [0,1,0,1,0,0|2,0,0]=4 21317 B13R1.528 CCC(C)CO[C@H]1CCCC[C@@H]1C 5bdfec169244caf979186028b1dc1821 [0,1,0,1,0,0|2,0,0]=4 21318 B13R1.528 CCC(C)CO[C@H]1CCCC[C@H]1C fcdeaf3b743edda8838a7eb9c67f6d95 [0,1,0,1,0,0|2,0,0]=4 21319 B13R1.528 CCC(C)NCC1CCCCC1C 5bb792d730daef7733b6d3219324e127 [0,1,0,1,0,0|2,0,0]=4 21320 B13R1.528 CCC(O)CNC1CCCCC1C d51b456ca49b9b63c6f52473ab66aadb [0,1,0,1,0,0|1,0,0]=3 21321 B13R1.528 CCC(O)CNC1CCCCC1F 98dba0ce4c7b49821c60ad4c33ecaeeb [0,1,0,1,0,0|2,0,0]=4 21322 B13R1.528 CCC(O)CNC1CCCCC1O 0e0edf4a0582d6605e2dedb26b7cb6be [0,1,0,1,0,0|2,0,0]=4 21323 B13R1.528 CCC(O)CNC1CCOCC1C 77397c7a23e2e23693b840c4195019c0 [0,1,0,1,0,0|2,0,0]=4 21324 B13R1.528 CCC(O)CN[C@@H]1CCCC[C@@H]1C 70d44629b225e80f2aecc868e021a7e6 [0,1,0,1,0,0|1,0,0]=3 21325 B13R1.528 CCC(O)CN[C@@H]1CCCC[C@H]1C 27cb92e834cb3c3470d4f67cce8d077f [0,1,0,1,0,0|1,0,0]=3 21326 B13R1.528 CCC(O)CN[C@@H]1CCCC[C@H]1O 66a40ae6934a3f38a4b7dc2432b33fd2 [0,1,0,1,0,0|2,0,0]=4 21327 B13R1.528 CCC(O)CN[C@@H]1CCOC[C@@H]1C e38fe0dd661c18d9ad4b98466d6e480d [0,1,0,1,0,0|2,0,0]=4 21328 B13R1.528 CCC(O)CN[C@H]1CCCC[C@@H]1C c222f030e121291f0e7b7d77d6eb4e2d [0,1,0,1,0,0|1,0,0]=3 21329 B13R1.528 CCC(O)CN[C@H]1CCCC[C@@H]1O b62721a7e17b69d902119783d0c92fa3 [0,1,0,1,0,0|2,0,0]=4 21330 B13R1.528 CCC(O)CN[C@H]1CCCC[C@H]1C 8bacf8b2bd6f57c11e016cc04d3c499e [0,1,0,1,0,0|1,0,0]=3 21331 B13R1.528 CCC(O)CN[C@H]1CCCC[C@H]1O ac6fe8132a608402f7249f25cb679f68 [0,1,0,1,0,0|2,0,0]=4 21332 B13R1.528 CCC(O)CN[C@H]1CCOC[C@H]1C b048ec4386449cf6b92bb26723a80c48 [0,1,0,1,0,0|2,0,0]=4 21333 B13R1.528 CC[C@@H](C)CNC1CCCCC1C 5ef81ac53c2c8b8346254dc4c8d9352e [0,1,0,1,0,0|2,0,0]=4 21334 B13R1.528 CC[C@@H](C)CN[C@@H]1CCCC[C@@H]1C a3d9cfec4c0ea19daca21eb89542cd0a [0,1,0,1,0,0|2,0,0]=4 21335 B13R1.528 CC[C@@H](C)CN[C@@H]1CCCC[C@H]1C 6546844794dc8020b1b4d6d6afce4b8b [0,1,0,1,0,0|2,0,0]=4 21336 B13R1.528 CC[C@@H](C)CN[C@H]1CCCC[C@@H]1C c8f5e79674dc283f65083b329a142e41 [0,1,0,1,0,0|2,0,0]=4 21337 B13R1.528 CC[C@@H](C)CN[C@H]1CCCC[C@H]1C 63dc8bb022b491b860a23aa194d8c674 [0,1,0,1,0,0|2,0,0]=4 21338 B13R1.528 CC[C@@H](C)COC1CCCCC1C 44441259c3517199cfaf0420a7757efa [0,1,0,1,0,0|2,0,0]=4 21339 B13R1.528 CC[C@@H](C)CO[C@@H]1CCCC[C@@H]1C 52210e527ee5502442f673c76fe84b93 [0,1,0,1,0,0|2,0,0]=4 21340 B13R1.528 CC[C@@H](C)CO[C@H]1CCCC[C@@H]1C b454455b38bb2aa1b19690defb8ddc2f [0,1,0,1,0,0|2,0,0]=4 21341 B13R1.528 CC[C@@H](C)CO[C@H]1CCCC[C@H]1C 31e6eb3c8f9ba2d4bc427b1f6f6c3f3c [0,1,0,1,0,0|2,0,0]=4 21342 B13R1.528 CC[C@@H](O)CNC1CCCCC1F 6c6acf6d0fad3fccccde9046ed97f501 [0,1,0,1,0,0|2,0,0]=4 21343 B13R1.528 CC[C@@H](O)CNC1CCCCC1O c9d4fe71b9435512ccfda38ab26cec19 [0,1,0,1,0,0|2,0,0]=4 21344 B13R1.528 CC[C@@H](O)CN[C@H]1CCCC[C@@H]1O 66088ea73a493653ec3e8373a8a038cb [0,1,0,1,0,0|2,0,0]=4 21345 B13R1.528 CC[C@@H](O)CN[C@H]1CCCC[C@H]1C 2c8358fcaee4e692d3a2da375624e700 [0,1,0,1,0,0|1,0,0]=3 21346 B13R1.528 CC[C@H](C)CNC1CCCCC1C 149a2bedf152b8d3c4ac752a5745120d [0,1,0,1,0,0|2,0,0]=4 21347 B13R1.528 CC[C@H](C)CN[C@@H]1CCCC[C@@H]1C 068a649fd4fbada82fe585e39b3b0b29 [0,1,0,1,0,0|2,0,0]=4 21348 B13R1.528 CC[C@H](C)CN[C@@H]1CCCC[C@H]1C 6c3d1d7cec9100acf51fd327b3ca87a2 [0,1,0,1,0,0|2,0,0]=4 21349 B13R1.528 CC[C@H](C)CN[C@H]1CCCC[C@@H]1C 279a29f9cd7b003f0f9e4fd58ae62608 [0,1,0,1,0,0|2,0,0]=4 21350 B13R1.528 CC[C@H](C)CN[C@H]1CCCC[C@H]1C 95e239f8d05b2a48bd96e85f8cac69c3 [0,1,0,1,0,0|2,0,0]=4 21351 B13R1.528 CC[C@H](C)COC1CCCCC1C 1a758817a85d1d2e7357836df43d360b [0,1,0,1,0,0|2,0,0]=4 21352 B13R1.528 CC[C@H](C)CO[C@@H]1CCCC[C@@H]1C 725aa28fa9640091093f5fecaacfff4e [0,1,0,1,0,0|2,0,0]=4 21353 B13R1.528 CC[C@H](C)CO[C@H]1CCCC[C@@H]1C 7f67831fc4458bc773d10322f42f3251 [0,1,0,1,0,0|2,0,0]=4 21354 B13R1.528 CC[C@H](C)CO[C@H]1CCCC[C@H]1C f07d53ca571500a16de59318909a5ec3 [0,1,0,1,0,0|2,0,0]=4 21355 B13R1.528 COC(C)CNC1CCCCC1C 6a7c968de2b99691624a262bdfef6007 [0,1,0,1,0,0|1,0,0]=3 21356 B13R1.528 COC(C)CNC1CCCCC1O b9ef9897c0382f4d5d1222ff41e7714e [0,1,0,1,0,0|2,0,0]=4 21357 B13R1.528 COC(C)CNC1CCOCC1C aed65f3f5131bc1db075e5594de461a5 [0,1,0,1,0,0|2,0,0]=4 21358 B13R1.528 COC(C)CN[C@@H]1CCCC[C@@H]1C 0f14affdc2d79f1415f8220bc7c51ed5 [0,1,0,1,0,0|1,0,0]=3 21359 B13R1.528 COC(C)CN[C@@H]1CCCC[C@H]1C d5b108dcbb1c48faf70801b7b386e1c1 [0,1,0,1,0,0|1,0,0]=3 21360 B13R1.528 COC(C)CN[C@@H]1CCCC[C@H]1O c105f5176ec751bed8475b29c4565b36 [0,1,0,1,0,0|2,0,0]=4 21361 B13R1.528 COC(C)CN[C@@H]1CCOC[C@@H]1C 8cdd090949b6eb28e73efbb1fbc23a36 [0,1,0,1,0,0|2,0,0]=4 21362 B13R1.528 COC(C)CN[C@H]1CCCC[C@@H]1C 7df3015d88428a953c9340daf263a4f3 [0,1,0,1,0,0|1,0,0]=3 21363 B13R1.528 COC(C)CN[C@H]1CCCC[C@@H]1O 1f06f90d67b0740bc5ffb7e789d8bd4f [0,1,0,1,0,0|2,0,0]=4 21364 B13R1.528 COC(C)CN[C@H]1CCCC[C@H]1C 6aecdb228043fca59fb5eb1386a3d591 [0,1,0,1,0,0|1,0,0]=3 21365 B13R1.528 COC(C)CN[C@H]1CCCC[C@H]1O 4fed107f96f0e5fc9b0ea6f59046fa8b [0,1,0,1,0,0|2,0,0]=4 21366 B13R1.528 COC(C)CN[C@H]1CCOC[C@H]1C ed0b84e0718d1663c2e5abce8613e1d1 [0,1,0,1,0,0|2,0,0]=4 21367 B13R1.528 COC(C)COC1CCCCC1C ef082f655ab0ad2ffbecade68499948f [0,1,0,1,0,0|1,0,0]=3 21368 B13R1.528 COC(C)COC1CCCCC1F 76d710a59c9c1534f1578ccac8e6dee0 [0,1,0,1,0,0|2,0,0]=4 21369 B13R1.528 COC(C)COC1CCOCC1C 4e7d729c1fb7b053d895b8d86afb0247 [0,1,0,1,0,0|2,0,0]=4 21370 B13R1.528 COC(C)CO[C@@H]1CCCC[C@@H]1C 94a293d11f3393c83f58eebc0248bedf [0,1,0,1,0,0|1,0,0]=3 21371 B13R1.528 COC(C)CO[C@@H]1CCCC[C@H]1F 1d86ae4ee770da64385ea1c7541710c7 [0,1,0,1,0,0|2,0,0]=4 21372 B13R1.528 COC(C)CO[C@H]1CCCC[C@@H]1C 8fea08557fe94b3b8e67f13bb9eb2fc5 [0,1,0,1,0,0|1,0,0]=3 21373 B13R1.528 COC(C)CO[C@H]1CCCC[C@H]1C 2679a193a3185e9d238f342987ccc017 [0,1,0,1,0,0|1,0,0]=3 21374 B13R1.528 CO[C@@H](C)CNC1CCCCC1C b427f0ed5d221b953b2893e510a02779 [0,1,0,1,0,0|1,0,0]=3 21375 B13R1.528 CO[C@@H](C)CNC1CCCCC1F 6deb8b88abcaea4616002ac7630b5627 [0,1,0,1,0,0|2,0,0]=4 21376 B13R1.528 CO[C@@H](C)CNC1CCCCC1O 0b8d418f66eba13a90291643d5ba0cb0 [0,1,0,1,0,0|2,0,0]=4 21377 B13R1.528 CO[C@@H](C)CNC1CCOCC1C 652e2c33cc98591ae8305f35a2f43ffe [0,1,0,1,0,0|2,0,0]=4 21378 B13R1.528 CO[C@@H](C)CN[C@@H]1CCCC[C@@H]1C 2ff9eb2910a4bcacea25c05fef0124ae [0,1,0,1,0,0|1,0,0]=3 21379 B13R1.528 CO[C@@H](C)CN[C@@H]1CCCC[C@H]1C 65764ac7dde8c31bf49aef4fc6c185f2 [0,1,0,1,0,0|1,0,0]=3 21380 B13R1.528 CO[C@@H](C)CN[C@@H]1CCCC[C@H]1O 1d2ce27c7afe97eecbfbc4337ed3264b [0,1,0,1,0,0|2,0,0]=4 21381 B13R1.528 CO[C@@H](C)CN[C@@H]1CCOC[C@@H]1C f42dfdb3b206551cdc39ebecc494218c [0,1,0,1,0,0|2,0,0]=4 21382 B13R1.528 CO[C@@H](C)CN[C@H]1CCCC[C@@H]1C a876702097e46590fe2a04fb562c720f [0,1,0,1,0,0|1,0,0]=3 21383 B13R1.528 CO[C@@H](C)CN[C@H]1CCCC[C@@H]1O c54b16073a65a2adad355cf4a7ad2e74 [0,1,0,1,0,0|2,0,0]=4 21384 B13R1.528 CO[C@@H](C)CN[C@H]1CCCC[C@H]1C 8e0a53aa92ea855c376f372ba30c5bdf [0,1,0,1,0,0|1,0,0]=3 21385 B13R1.528 CO[C@@H](C)CN[C@H]1CCCC[C@H]1O e38eb98d24859892733da6694a1d5452 [0,1,0,1,0,0|2,0,0]=4 21386 B13R1.528 CO[C@@H](C)CN[C@H]1CCOC[C@H]1C 99da0cae64497812daa10ab29f33252d [0,1,0,1,0,0|2,0,0]=4 21387 B13R1.528 CO[C@@H](C)COC1CCCCC1C 3025bef3f7bd730e63df844148e15e3b [0,1,0,1,0,0|1,0,0]=3 21388 B13R1.528 CO[C@@H](C)COC1CCCCC1F dc68791ada6d1d8919f291efe02de51d [0,1,0,1,0,0|2,0,0]=4 21389 B13R1.528 CO[C@@H](C)COC1CCOCC1C 7658481d69caffe994358cb36f86ca30 [0,1,0,1,0,0|2,0,0]=4 21390 B13R1.528 CO[C@@H](C)CO[C@@H]1CCCC[C@@H]1C 7ad94e17c5f096cf178510bffb057bef [0,1,0,1,0,0|1,0,0]=3 21391 B13R1.528 CO[C@@H](C)CO[C@@H]1CCCC[C@H]1F 775d256f4f5399bc23fcdb45d21b832d [0,1,0,1,0,0|2,0,0]=4 21392 B13R1.528 CO[C@@H](C)CO[C@H]1CCCC[C@@H]1C f0719b934e75d78d9f45d393aa659d45 [0,1,0,1,0,0|1,0,0]=3 21393 B13R1.528 CO[C@@H](C)CO[C@H]1CCCC[C@H]1C 4e1548cc0bcbac5dfeceb17076358bd8 [0,1,0,1,0,0|1,0,0]=3 21394 B13R1.528 CO[C@H](C)CNC1CCCCC1C 9ed080f56d3736ecbbe9a3f5a2a283fa [0,1,0,1,0,0|1,0,0]=3 21395 B13R1.528 CO[C@H](C)CNC1CCCCC1F e683e5c05cd50ba0aa3e4e2f2539958b [0,1,0,1,0,0|2,0,0]=4 21396 B13R1.528 CO[C@H](C)CNC1CCCCC1O d427938f497beeb7c3ff99ebbb775c56 [0,1,0,1,0,0|2,0,0]=4 21397 B13R1.528 CO[C@H](C)CNC1CCOCC1C d5ab54af34d059b3021dad472c4e34f3 [0,1,0,1,0,0|2,0,0]=4 21398 B13R1.528 CO[C@H](C)CN[C@@H]1CCCC[C@@H]1C 1f77540f29ef4aa6cd8a2158aa788c94 [0,1,0,1,0,0|1,0,0]=3 21399 B13R1.528 CO[C@H](C)CN[C@@H]1CCCC[C@H]1C 0cf7d7a98f5da70208f9adcf548773c1 [0,1,0,1,0,0|1,0,0]=3 21400 B13R1.528 CO[C@H](C)CN[C@@H]1CCCC[C@H]1O 9bbae0f513bfa8b503612f594c951fd2 [0,1,0,1,0,0|2,0,0]=4 21401 B13R1.528 CO[C@H](C)CN[C@@H]1CCOC[C@@H]1C 6d4a12207bef0cff08bd0d67a9da4eb3 [0,1,0,1,0,0|2,0,0]=4 21402 B13R1.528 CO[C@H](C)CN[C@H]1CCCC[C@@H]1C 8ee78b4c2b7882cce533115cc4dd9ba8 [0,1,0,1,0,0|1,0,0]=3 21403 B13R1.528 CO[C@H](C)CN[C@H]1CCCC[C@@H]1O 6fd1270ded28067e99eac2708e74caa6 [0,1,0,1,0,0|2,0,0]=4 21404 B13R1.528 CO[C@H](C)CN[C@H]1CCCC[C@H]1C 3db969667aa43eed16ee5f15345f505e [0,1,0,1,0,0|1,0,0]=3 21405 B13R1.528 CO[C@H](C)CN[C@H]1CCCC[C@H]1O c3574a9229db8295775b63cf283a37e1 [0,1,0,1,0,0|2,0,0]=4 21406 B13R1.528 CO[C@H](C)CN[C@H]1CCOC[C@H]1C 1bf25c1416318fdd2c6a5c70bfbd53c9 [0,1,0,1,0,0|2,0,0]=4 21407 B13R1.528 CO[C@H](C)COC1CCCCC1C e78e2a8502efed7c99f9191c052d0c10 [0,1,0,1,0,0|1,0,0]=3 21408 B13R1.528 CO[C@H](C)COC1CCCCC1F aabb8672423c2b31e0de123d37aebcd2 [0,1,0,1,0,0|2,0,0]=4 21409 B13R1.528 CO[C@H](C)COC1CCOCC1C 66f5e7eca8eb99835ee3c15c0fe89147 [0,1,0,1,0,0|2,0,0]=4 21410 B13R1.528 CO[C@H](C)CO[C@@H]1CCCC[C@@H]1C e8dd624d8a823cb421ff451f66512081 [0,1,0,1,0,0|1,0,0]=3 21411 B13R1.528 CO[C@H](C)CO[C@@H]1CCCC[C@H]1F 921297bcc380eb71666099243b7b8676 [0,1,0,1,0,0|2,0,0]=4 21412 B13R1.528 CO[C@H](C)CO[C@H]1CCCC[C@@H]1C c248f477b1a99808f21dd56af9f845b1 [0,1,0,1,0,0|1,0,0]=3 21413 B13R1.528 CO[C@H](C)CO[C@H]1CCCC[C@H]1C 737b7fb8e2f6e78e2cc0c4dc303c8e29 [0,1,0,1,0,0|1,0,0]=3 21414 B13R1.528 C[C@@H](CO)CNC1CCCCC1O f57646f68ac4a7c0fa68c6b847db55c8 [0,1,0,1,0,0|2,0,0]=4 21415 B13R1.528 C[C@@H](CO)CN[C@@H]1CCCC[C@@H]1C 9fa6dfcd5db0ef68d2c07f4ac67138af [0,1,0,1,0,0|1,0,0]=3 21416 B13R1.528 C[C@@H](CO)CN[C@@H]1CCCC[C@H]1C ca29e5d5d6304297071a3561c225ca93 [0,1,0,1,0,0|1,0,0]=3 21417 B13R1.528 C[C@@H](CO)CN[C@@H]1CCCC[C@H]1O c1ab94cda898d8cbaf86cfc831027983 [0,1,0,1,0,0|2,0,0]=4 21418 B13R1.528 C[C@@H](CO)CN[C@@H]1CCOC[C@@H]1C dba3dbca2b1f9ffc21a78fd084835b87 [0,1,0,1,0,0|2,0,0]=4 21419 B13R1.528 C[C@@H](CO)CN[C@H]1CCCC[C@@H]1C aa064aa48152514ed4700009f9a40edb [0,1,0,1,0,0|1,0,0]=3 21420 B13R1.528 C[C@@H](CO)CN[C@H]1CCCC[C@@H]1O ff81bdefbc7e994fc596aaa81ae5033f [0,1,0,1,0,0|2,0,0]=4 21421 B13R1.528 C[C@@H](CO)CN[C@H]1CCCC[C@H]1C b6bb800405d1e65c21679aeb32d437b0 [0,1,0,1,0,0|1,0,0]=3 21422 B13R1.528 C[C@@H](CO)CN[C@H]1CCCC[C@H]1O d2f30b6f65367a6d13340fd1c652c6c8 [0,1,0,1,0,0|2,0,0]=4 21423 B13R1.528 C[C@@H](CO)CN[C@H]1CCOC[C@H]1C 235bdc7b6152b5cde52dd069bbfaef20 [0,1,0,1,0,0|2,0,0]=4 21424 B13R1.528 C[C@@H](CO)NCC1CCCCC1O 96909cd11d7fda3ef72c8783a0150990 [0,1,0,1,0,0|2,0,0]=4 21425 B13R1.528 C[C@@H](CO)NCC1CCCCN1C 96adb05d04c1df7451cb8647284eda30 [0,1,0,1,0,0|2,0,0]=4 21426 B13R1.528 C[C@@H]1CCCC[C@@H]1NCC(Br)CBr 3f86238f2bb69e4fc972eb500ba427e9 [0,1,0,1,0,0|2,0,0]=4 21427 B13R1.528 C[C@@H]1CCCC[C@@H]1NCC(F)CO 3eac50723c188cce5f29aa4b6e418e5e [0,1,0,1,0,0|2,0,0]=4 21428 B13R1.528 C[C@@H]1CCCC[C@@H]1NCC(O)CF ef785f504c01ceda1a83de993e6a2516 [0,1,0,1,0,0|1,0,0]=3 21429 B13R1.528 C[C@@H]1CCCC[C@@H]1NCC(O)CO df4409c8bf913a9b2da80b259ab49b8b [0,1,0,1,0,0|1,0,0]=3 21430 B13R1.528 C[C@@H]1CCCC[C@@H]1NC[C@@H](F)CO 025082171b97fe34fb4b1dc92c98fa25 [0,1,0,1,0,0|2,0,0]=4 21431 B13R1.528 C[C@@H]1CCCC[C@@H]1NC[C@@H](O)CO 61332a8df7e5605eeace847a4f0703a0 [0,1,0,1,0,0|1,0,0]=3 21432 B13R1.528 C[C@@H]1CCCC[C@@H]1NC[C@H](F)CO e15d87469697660c1a762e4d417f0868 [0,1,0,1,0,0|2,0,0]=4 21433 B13R1.528 C[C@@H]1CCCC[C@@H]1NC[C@H](O)CO 9978de99fcb78cb6ab633494d03d4ddc [0,1,0,1,0,0|1,0,0]=3 21434 B13R1.528 C[C@@H]1CCCC[C@@H]1OCC(Br)CBr f44329442e3ff6e5b26ecbb9aea5af09 [0,1,0,1,0,0|2,0,0]=4 21435 B13R1.528 C[C@@H]1CCCC[C@@H]1OCC(Cl)CCl 6e52755ad954760ad8f5ce3f48e1152b [0,1,0,1,0,0|2,0,0]=4 21436 B13R1.528 C[C@@H]1CCCC[C@@H]1OCC(O)CO b840b10fa9527a1cf6ba5e3594316faf [0,1,0,1,0,0|1,0,0]=3 21437 B13R1.528 C[C@@H]1CCCC[C@@H]1OCC(S)CS 4e61e6eeda50792547a695c6d47061cb [0,1,0,1,0,0|1,1,0]=4 21438 B13R1.528 C[C@@H]1CCCC[C@@H]1OC[C@@H](O)CO 468f11f3df6e2bfb35ecf6cac9ede652 [0,1,0,1,0,0|1,0,0]=3 21439 B13R1.528 C[C@@H]1CCCC[C@@H]1OC[C@H](O)CO e83afcfa98b8d843e7c99762d618b414 [0,1,0,1,0,0|1,0,0]=3 21440 B13R1.528 C[C@@H]1CCCC[C@H]1NCC(O)CF da00b74cec596fcb2eee7393e7d6c075 [0,1,0,1,0,0|1,0,0]=3 21441 B13R1.528 C[C@@H]1CCCC[C@H]1NCC(O)CO 7daccfc1a735ce42f6bd9e8e6066a91f [0,1,0,1,0,0|1,0,0]=3 21442 B13R1.528 C[C@@H]1CCCC[C@H]1NC[C@@H](O)CO 6d49f50f0b4ea93d44ee470b6cf7b2c7 [0,1,0,1,0,0|1,0,0]=3 21443 B13R1.528 C[C@@H]1CCCC[C@H]1NC[C@H](O)CO e06804d599b4789a91dbaf37cbdd12fe [0,1,0,1,0,0|1,0,0]=3 21444 B13R1.528 C[C@@H]1COCC[C@@H]1NCC(O)CF 86643e764a2c2e8ee7462fa1eb18ab1b [0,1,0,1,0,0|2,0,0]=4 21445 B13R1.528 C[C@@H]1COCC[C@@H]1NCC(O)CO 07b55fa09b0d6d528fadf252cb1d76f3 [0,1,0,1,0,0|2,0,0]=4 21446 B13R1.528 C[C@@H]1COCC[C@@H]1NC[C@@H](O)CO b5eb645b99880cae26fa28255cb9cfef [0,1,0,1,0,0|2,0,0]=4 21447 B13R1.528 C[C@@H]1COCC[C@@H]1NC[C@H](O)CO e2884ddd04433ee9d211312f97fc6e9c [0,1,0,1,0,0|2,0,0]=4 21448 B13R1.528 C[C@H](CO)CNC1CCCCC1F 061330e17f86fba2a60acb6f45643ec3 [0,1,0,1,0,0|2,0,0]=4 21449 B13R1.528 C[C@H](CO)CNC1CCCCC1O 2bb3c0749cfa9d3e010e0cd55c647aea [0,1,0,1,0,0|2,0,0]=4 21450 B13R1.528 C[C@H](CO)CN[C@@H]1CCCC[C@@H]1C 6dc1ff03c27d5fd26e91c32c520727f2 [0,1,0,1,0,0|1,0,0]=3 21451 B13R1.528 C[C@H](CO)CN[C@@H]1CCCC[C@H]1C cb2976ee44d790062d114dbf44a7bf46 [0,1,0,1,0,0|1,0,0]=3 21452 B13R1.528 C[C@H](CO)CN[C@@H]1CCCC[C@H]1O 682c38d9e0870ae5a7d758ca9987f8a3 [0,1,0,1,0,0|2,0,0]=4 21453 B13R1.528 C[C@H](CO)CN[C@@H]1CCOC[C@@H]1C 561a217369e17d4a66e2b76358ad8646 [0,1,0,1,0,0|2,0,0]=4 21454 B13R1.528 C[C@H](CO)CN[C@H]1CCCC[C@@H]1C 53d7f15c93e3531d47bfc5a164412ed7 [0,1,0,1,0,0|1,0,0]=3 21455 B13R1.528 C[C@H](CO)CN[C@H]1CCCC[C@@H]1O 40bee5a53f9ff9449e18f4f6bd1abdc4 [0,1,0,1,0,0|2,0,0]=4 21456 B13R1.528 C[C@H](CO)CN[C@H]1CCCC[C@H]1C 49997cecba10b43c0f8d97d3f9d50879 [0,1,0,1,0,0|1,0,0]=3 21457 B13R1.528 C[C@H](CO)CN[C@H]1CCCC[C@H]1O 30a826e8609e77fe1057030abfcaa553 [0,1,0,1,0,0|2,0,0]=4 21458 B13R1.528 C[C@H](CO)CN[C@H]1CCOC[C@H]1C 655988004c15699e4ad533a7031e7ceb [0,1,0,1,0,0|2,0,0]=4 21459 B13R1.528 C[C@H](CO)NCC1CCCCC1O e333d2a4d3ce2db78f0be13b368c96e8 [0,1,0,1,0,0|2,0,0]=4 21460 B13R1.528 C[C@H](CO)NCC1CCCCN1C 420935f0882a12dbd2147b99a02dcb1b [0,1,0,1,0,0|2,0,0]=4 21461 B13R1.528 C[C@H]1CCCC[C@@H]1NCC(O)CF 44b26dd9827930246a96cddf767d7666 [0,1,0,1,0,0|1,0,0]=3 21462 B13R1.528 C[C@H]1CCCC[C@@H]1NCC(O)CO b9dc595277797456148e7d6da46a1ac2 [0,1,0,1,0,0|1,0,0]=3 21463 B13R1.528 C[C@H]1CCCC[C@@H]1NC[C@@H](O)CO 841344b90aa94cf83aa8f7a3e4e6e198 [0,1,0,1,0,0|1,0,0]=3 21464 B13R1.528 C[C@H]1CCCC[C@@H]1NC[C@H](O)CO f944de3b67f83b24b1218a99ce113b2c [0,1,0,1,0,0|1,0,0]=3 21465 B13R1.528 C[C@H]1CCCC[C@@H]1OCC(O)CO 6b57533ae32d9cc3adb2736cefcaec76 [0,1,0,1,0,0|1,0,0]=3 21466 B13R1.528 C[C@H]1CCCC[C@@H]1OC[C@@H](O)CO 5ab3f6d735eef2e0b8549dca19b980f8 [0,1,0,1,0,0|1,0,0]=3 21467 B13R1.528 C[C@H]1CCCC[C@@H]1OC[C@H](O)CO 1bc9f92e95d4f3a30cb195f0630435a3 [0,1,0,1,0,0|1,0,0]=3 21468 B13R1.528 C[C@H]1CCCC[C@H]1NCC(O)CF 4c9dfa56e6f1e06517f5e19314ed8b5f [0,1,0,1,0,0|1,0,0]=3 21469 B13R1.528 C[C@H]1CCCC[C@H]1NCC(O)CO 44038e80b270fbdb55d7778a84a1293b [0,1,0,1,0,0|1,0,0]=3 21470 B13R1.528 C[C@H]1CCCC[C@H]1NC[C@@H](O)CO bfe0c6740f0bcb0cba498b48d06ab766 [0,1,0,1,0,0|1,0,0]=3 21471 B13R1.528 C[C@H]1CCCC[C@H]1NC[C@H](O)CO 91bd48c1861f426a39493c388a88455b [0,1,0,1,0,0|1,0,0]=3 21472 B13R1.528 C[C@H]1CCCC[C@H]1OCC(O)CO 2d36d17885c4b0acacb5270f9de96305 [0,1,0,1,0,0|1,0,0]=3 21473 B13R1.528 C[C@H]1CCCC[C@H]1OC[C@@H](O)CO c0645a0b1791b352e7b7f2587554aebf [0,1,0,1,0,0|1,0,0]=3 21474 B13R1.528 C[C@H]1CCCC[C@H]1OC[C@H](O)CO 4c05de16834a9a35c8cde91db2b7439f [0,1,0,1,0,0|1,0,0]=3 21475 B13R1.528 C[C@H]1COCC[C@H]1NCC(O)CF 5e0a6a6b2c937d4b20d3b39cab3f7ed4 [0,1,0,1,0,0|2,0,0]=4 21476 B13R1.528 C[C@H]1COCC[C@H]1NCC(O)CO 5e3abe86914dd73ab0bfa3690f0d0186 [0,1,0,1,0,0|2,0,0]=4 21477 B13R1.528 C[C@H]1COCC[C@H]1NC[C@@H](O)CO 27cf8519e8d4e26acff52e0a1d32a823 [0,1,0,1,0,0|2,0,0]=4 21478 B13R1.528 C[C@H]1COCC[C@H]1NC[C@H](O)CO 6cc8030678265fd5aefdb3b3e8118bcf [0,1,0,1,0,0|2,0,0]=4 21479 B13R1.528 OC(CF)CNC1CCCCC1O b69c99c4238aeaa72726da9f420bcb53 [0,1,0,1,0,0|2,0,0]=4 21480 B13R1.528 OC(CF)CN[C@@H]1CCCC[C@H]1O 3d161e8b5e64dfe3c94c62ed05e11a8c [0,1,0,1,0,0|2,0,0]=4 21481 B13R1.528 OC(CF)CN[C@H]1CCCC[C@@H]1O 5e77bc05e4287da0a18281797c129cf5 [0,1,0,1,0,0|2,0,0]=4 21482 B13R1.528 OC(CF)CN[C@H]1CCCC[C@H]1O fe527a1050f0ddce0daea9cc66ae6d82 [0,1,0,1,0,0|2,0,0]=4 21483 B13R1.528 OCC(O)CNC1CCCCC1F 4b9fac1195005fa9feeaff012d6c4e90 [0,1,0,1,0,0|2,0,0]=4 21484 B13R1.528 OCC(O)CNC1CCCCC1O 3afdd69aaa4d8a60a3fa17dc0d2a1f29 [0,1,0,1,0,0|2,0,0]=4 21485 B13R1.528 OCC(O)CN[C@@H]1CCCC[C@H]1O e90326e09b7694eba43681a37195a9c4 [0,1,0,1,0,0|2,0,0]=4 21486 B13R1.528 OCC(O)CN[C@H]1CCCC[C@@H]1O 4d0cb902bbbfec702a551ff48d901431 [0,1,0,1,0,0|2,0,0]=4 21487 B13R1.528 OCC(O)CN[C@H]1CCCC[C@H]1O 47a31254be7aa52238285f1333872db0 [0,1,0,1,0,0|2,0,0]=4 21488 B13R1.528 OCC(O)COC1CCCCC1F 38506150f683343c88321e9962126ad1 [0,1,0,1,0,0|2,0,0]=4 21489 B13R1.528 OCC(O)CO[C@@H]1CCCC[C@H]1F 859f3e0eba159147a2635b05a27a18f2 [0,1,0,1,0,0|2,0,0]=4 21490 B13R1.528 OC[C@@H](O)CNC1CCCCC1F f49121032157c1f7f43414b13bec3ab9 [0,1,0,1,0,0|2,0,0]=4 21491 B13R1.528 OC[C@@H](O)CNC1CCCCC1O 5e713fa3738fe59d52ffff1b727ad870 [0,1,0,1,0,0|2,0,0]=4 21492 B13R1.528 OC[C@@H](O)CN[C@@H]1CCCC[C@H]1O 51aa78f202ab02edeeb563fafda6f520 [0,1,0,1,0,0|2,0,0]=4 21493 B13R1.528 OC[C@@H](O)CN[C@H]1CCCC[C@@H]1O c321b40b0b63f35ef36f195752eaa5e8 [0,1,0,1,0,0|2,0,0]=4 21494 B13R1.528 OC[C@@H](O)CN[C@H]1CCCC[C@H]1O 3089bb0147d37a864fd360b4f33c0cb2 [0,1,0,1,0,0|2,0,0]=4 21495 B13R1.528 OC[C@@H](O)COC1CCCCC1F dded9776402f55cc5dc5c56a144e89dd [0,1,0,1,0,0|2,0,0]=4 21496 B13R1.528 OC[C@@H](O)CO[C@@H]1CCCC[C@H]1F 8fd5bd561d2238541adda89046db8c0f [0,1,0,1,0,0|2,0,0]=4 21497 B13R1.528 OC[C@H](O)CNC1CCCCC1F 0e97d44a148894a137d69982f95c8c50 [0,1,0,1,0,0|2,0,0]=4 21498 B13R1.528 OC[C@H](O)CNC1CCCCC1O 6100082ed6831d2cf9397a8894125db1 [0,1,0,1,0,0|2,0,0]=4 21499 B13R1.528 OC[C@H](O)CN[C@@H]1CCCC[C@H]1O 449846f647089baa06a1d673641f53c2 [0,1,0,1,0,0|2,0,0]=4 21500 B13R1.528 OC[C@H](O)CN[C@H]1CCCC[C@@H]1O 1c50ce5c737d1e1a771883ca63d088aa [0,1,0,1,0,0|2,0,0]=4 21501 B13R1.528 OC[C@H](O)CN[C@H]1CCCC[C@H]1O 51e0ef4d91d2bdebb7134707dfe1f8ae [0,1,0,1,0,0|2,0,0]=4 21502 B13R1.528 OC[C@H](O)COC1CCCCC1F 4662572f3ee41f73638aea5e4bfdc1a8 [0,1,0,1,0,0|2,0,0]=4 21503 B13R1.528 OC[C@H](O)CO[C@@H]1CCCC[C@H]1F ff08df66a0bb7b0a5eac0099d640fb6f [0,1,0,1,0,0|2,0,0]=4 21504 B13R1.536 BrCC(Br)CNCCC1CCCC1 bd5ab35c7aaa3e6826a4bf3dcb03d573 [0,1,0,1,0,0|2,0,0]=4 21505 B13R1.536 BrCC(Br)COCCC1CCCC1 2d3335839b006453f8afc15edea8ef7d [0,1,0,1,0,0|2,0,0]=4 21506 B13R1.536 C#CC(C)NCCCC1CCCC1 8b3b021763c97d03bf7a297b66289f85 [0,1,0,1,0,0|2,0,0]=4 21507 B13R1.536 C#CC(C)OCCCC1CCCC1 f100e3b9100176c9abb2a7c5a02f4301 [0,1,0,1,0,0|2,0,0]=4 21508 B13R1.536 C#C[C@@H](C)NCCCC1CCCC1 b8bdecf59b0c09a4eee5ecd611797f20 [0,1,0,1,0,0|2,0,0]=4 21509 B13R1.536 C#C[C@@H](C)OCCCC1CCCC1 a72975c4462da2d440713229832c9f3a [0,1,0,1,0,0|2,0,0]=4 21510 B13R1.536 C#C[C@H](C)NCCCC1CCCC1 93f44053ff37f9548ee77c93b30ada40 [0,1,0,1,0,0|2,0,0]=4 21511 B13R1.536 C#C[C@H](C)OCCCC1CCCC1 5eb585aff114bc1f25e7ef60d5e71cbf [0,1,0,1,0,0|2,0,0]=4 21512 B13R1.536 C=CC(C)COCCC1CCCC1 176a2f2bdbd00a6ea3a4f19be0870d14 [0,1,0,1,0,0|2,0,0]=4 21513 B13R1.536 C=CC(C)NCCCC1CCCC1 42f12aa32fa85075f97a44a71d265273 [0,1,0,1,0,0|2,0,0]=4 21514 B13R1.536 C=CC(C)OCCCC1CCCC1 82ed113e6a8b1eba91dc8266084b4328 [0,1,0,1,0,0|2,0,0]=4 21515 B13R1.536 C=CC(O)CNCCC1CCCC1 7c70a0d3f54538aa995132abe05fcae2 [0,1,0,1,0,0|1,0,1]=4 21516 B13R1.536 C=C[C@H](C)OCCCC1CCCC1 06619f2afd742609909b52c3028e43c2 [0,1,0,1,0,0|2,0,0]=4 21517 B13R1.536 CC(C#N)CNCCC1CCCC1 d0c119bf0f8a3091025650c37df52990 [0,1,0,1,0,0|2,0,0]=4 21518 B13R1.536 CC(C#N)COCCC1CCCC1 95c5a4304599983c157139295a474232 [0,1,0,1,0,0|2,0,0]=4 21519 B13R1.536 CC(C#N)NCCCC1CCCC1 487d7f691bef6f34bda7bbcb70b5269d [0,1,0,1,0,0|2,0,0]=4 21520 B13R1.536 CC(C#N)OCCCC1CCCC1 94b9ec895f01e232d5a4c60ee58eac57 [0,1,0,1,0,0|2,0,0]=4 21521 B13R1.536 CC(C=O)NCCCC1CCCC1 b26ec44e3a4cf4b86d3c2dd3f1cfdb39 [0,1,0,1,0,0|1,0,1]=4 21522 B13R1.536 CC(C=O)OCCCC1CCCC1 4a27a83f4a286a2888df504cb4cfe10f [0,1,0,1,0,0|1,0,1]=4 21523 B13R1.536 CC(CF)OCCCC1CCCC1 2d6254529fac25f27ff5df8bea7e2194 [0,1,0,1,0,0|2,0,0]=4 21524 B13R1.536 CC(CO)CCCNC1CCCC1 3029cd7aa341f4c82954ad7128b6b31d [0,1,0,1,0,0|1,0,0]=3 21525 B13R1.536 CC(CO)CCCNC1CCOC1 ec8ac6758f368bb0cdd67f3df4f1a4ef [0,1,0,1,0,0|2,0,0]=4 21526 B13R1.536 CC(CO)CCCN[C@@H]1CCOC1 f117205c88f86f02b2dec500d16079fb [0,1,0,1,0,0|2,0,0]=4 21527 B13R1.536 CC(CO)CCCN[C@H]1CCOC1 56ae1a1b3762d00221516ad3caec1b39 [0,1,0,1,0,0|2,0,0]=4 21528 B13R1.536 CC(CO)CCNCC1CCCC1 ade4c5459f646ba074ed1e0e1b5c9ca0 [0,1,0,1,0,0|1,0,0]=3 21529 B13R1.536 CC(CO)CCNCC1CCCO1 3a0789e416b8a50cf97f92a826479f71 [0,1,0,1,0,0|2,0,0]=4 21530 B13R1.536 CC(CO)CCNCC1CCOC1 a0d022975280e7c5c5fff6c045c7e114 [0,1,0,1,0,0|2,0,0]=4 21531 B13R1.536 CC(CO)CCNC[C@@H]1CCCO1 0e6b06557c0d3757cf7036b69a756d6b [0,1,0,1,0,0|2,0,0]=4 21532 B13R1.536 CC(CO)CCNC[C@@H]1CCOC1 4565c397bd75e53478b9a3c7823d06aa [0,1,0,1,0,0|2,0,0]=4 21533 B13R1.536 CC(CO)CCNC[C@H]1CCCO1 5594189b0fc2d94d2a53c760195e060c [0,1,0,1,0,0|2,0,0]=4 21534 B13R1.536 CC(CO)CCNC[C@H]1CCOC1 f62bfb9cfcb61a46d9d5a2ba0dbf847c [0,1,0,1,0,0|2,0,0]=4 21535 B13R1.536 CC(CO)CNCCC1CCCC1 a1f04428f3bde4db5a76c62a938933f7 [0,1,0,1,0,0|1,0,0]=3 21536 B13R1.536 CC(CO)CNCCC1CCCO1 8a0241d9719d65b262f63d331223c00e [0,1,0,1,0,0|2,0,0]=4 21537 B13R1.536 CC(CO)CNCCC1CCOC1 86f6a58d0f70f1b4aeb8f5cb6fe442b2 [0,1,0,1,0,0|2,0,0]=4 21538 B13R1.536 CC(CO)CNCCN1CCCC1 a31b85e4bb99862ffe4034c4691b0f69 [0,1,0,1,0,0|2,0,0]=4 21539 B13R1.536 CC(CO)NCCCC1CCCC1 de2da13511a023fdb0cb8f9323747f6d [0,1,0,1,0,0|1,0,0]=3 21540 B13R1.536 CC(CO)NCCCC1CCOC1 547cb1783f2af1d5206113b09cb820d0 [0,1,0,1,0,0|2,0,0]=4 21541 B13R1.536 CC(CO)NCCCN1CCCC1 c13eb5807e2c69dce0206fd919b5b71b [0,1,0,1,0,0|2,0,0]=4 21542 B13R1.536 CC(CO)NCCOC1CCCC1 90dca6223c1abbc517a7989bb1b3dd2d [0,1,0,1,0,0|2,0,0]=4 21543 B13R1.536 CC(CO)NCCSC1CCCC1 47f21e2b76ea76da0044ea607344b20d [0,1,0,1,0,0|2,0,0]=4 21544 B13R1.536 CC(CS)OCCCC1CCCC1 069cd97f8ec7d06ea53f20ca509eeb7b [0,1,0,1,0,0|1,1,0]=4 21545 B13R1.536 CCC(C)CCCOC1CCCC1 264fe2c13fa05676b15d18c6c3256e19 [0,1,0,1,0,0|2,0,0]=4 21546 B13R1.536 CCC(C)CCNCC1CCCC1 7e8921c93a1583c17dec549a9cbb88dd [0,1,0,1,0,0|2,0,0]=4 21547 B13R1.536 CCC(C)CCOCC1CCCC1 eff5abcd3e9e1622866a0c41e73bddb5 [0,1,0,1,0,0|2,0,0]=4 21548 B13R1.536 CCC(C)CNCCC1CCCC1 8fb344a9828821283900a2afcd8ec201 [0,1,0,1,0,0|2,0,0]=4 21549 B13R1.536 CCC(C)COCCC1CCCC1 5f6dff6ab73866ae92e2e03c15b5ae73 [0,1,0,1,0,0|2,0,0]=4 21550 B13R1.536 CCC(C)NCCCC1CCCC1 be727344bde13c70fbba86476243a1ac [0,1,0,1,0,0|2,0,0]=4 21551 B13R1.536 CCC(C)OCCCC1CCCC1 6d1355dbeed8bc511e1aa79bbb1a9df3 [0,1,0,1,0,0|2,0,0]=4 21552 B13R1.536 CCC(O)CNCCC1CCCC1 369a402c00c986643ca3c2052350b5fd [0,1,0,1,0,0|1,0,0]=3 21553 B13R1.536 CCC(O)CNCCC1CCCO1 f8541dee6393b78dda98ec8b4022dfc4 [0,1,0,1,0,0|2,0,0]=4 21554 B13R1.536 CCC(O)CNCCC1CCOC1 86a2c5492894e93a0510009af5dffba5 [0,1,0,1,0,0|2,0,0]=4 21555 B13R1.536 CCC(O)CNCCN1CCCC1 9b416085cfd186dffd875365f050738c [0,1,0,1,0,0|2,0,0]=4 21556 B13R1.536 CCC(S)CCOCC1CCCC1 5f0eac02cacbb8ba49c879b1138f7139 [0,1,0,1,0,0|1,1,0]=4 21557 B13R1.536 CC[C@@H](C)CNCCC1CCCC1 8deeb8728919e0a5d2a3b25d4681f3a6 [0,1,0,1,0,0|2,0,0]=4 21558 B13R1.536 CC[C@@H](C)COCCC1CCCC1 0ea05b364380d38de4e094585886bfcf [0,1,0,1,0,0|2,0,0]=4 21559 B13R1.536 CC[C@@H](C)NCCCC1CCCC1 6a70dcc9f117b48b120a8f45d9f3a484 [0,1,0,1,0,0|2,0,0]=4 21560 B13R1.536 CC[C@@H](C)OCCCC1CCCC1 2bafe1a7e8f0aa87a3247618ab74e201 [0,1,0,1,0,0|2,0,0]=4 21561 B13R1.536 CC[C@@H](O)CNCCC1CCCC1 7b181f1def1584d628f6748805d33c2d [0,1,0,1,0,0|1,0,0]=3 21562 B13R1.536 CC[C@@H](O)CNCCC1CCCO1 7478bd643273d61d541636412ddaf480 [0,1,0,1,0,0|2,0,0]=4 21563 B13R1.536 CC[C@@H](O)CNCCC1CCOC1 73142eda32b9e0234d05ebf5df0e651b [0,1,0,1,0,0|2,0,0]=4 21564 B13R1.536 CC[C@@H](O)CNCCN1CCCC1 f7d743e257aac28f233cf0c317ececc8 [0,1,0,1,0,0|2,0,0]=4 21565 B13R1.536 CC[C@H](C)CCCOC1CCCC1 ff389698f872ef76223991baa5bc3683 [0,1,0,1,0,0|2,0,0]=4 21566 B13R1.536 CC[C@H](C)CCOCC1CCCC1 8d9e93b9223768779d4c90102208ff01 [0,1,0,1,0,0|2,0,0]=4 21567 B13R1.536 CC[C@H](C)CNCCC1CCCC1 02dbc74a6bd9ba8b641bb3f5ee712f09 [0,1,0,1,0,0|2,0,0]=4 21568 B13R1.536 CC[C@H](C)COCCC1CCCC1 9b6e1fa1dcb1eeccc2939119b24f6cee [0,1,0,1,0,0|2,0,0]=4 21569 B13R1.536 CC[C@H](C)NCCCC1CCCC1 868889d77464348df7ad5e91cf5436f5 [0,1,0,1,0,0|2,0,0]=4 21570 B13R1.536 CC[C@H](C)OCCCC1CCCC1 3bbfe4feb956d2ee45289704cb1e1fe3 [0,1,0,1,0,0|2,0,0]=4 21571 B13R1.536 COC(C)CCOCC1CCCC1 d3ae5bf50a60dae40de83ed3516e0a07 [0,1,0,1,0,0|1,0,0]=3 21572 B13R1.536 COC(C)CCOCC1CCCO1 2b337f60053e1eb0193f7a53fbd44154 [0,1,0,1,0,0|2,0,0]=4 21573 B13R1.536 COC(C)CCOCC1CCOC1 4d39fe6ae88f43780dcabca39286e532 [0,1,0,1,0,0|2,0,0]=4 21574 B13R1.536 COC(C)CNCCC1CCCC1 d5d29ec07a0fe292b3702b02967c3ceb [0,1,0,1,0,0|1,0,0]=3 21575 B13R1.536 COC(C)CNCCC1CCCO1 37e9e0d7daa06a1cccdb75b7941de225 [0,1,0,1,0,0|2,0,0]=4 21576 B13R1.536 COC(C)CNCCC1CCOC1 e8d36dc9129cad785f1c9711f972d997 [0,1,0,1,0,0|2,0,0]=4 21577 B13R1.536 COC(C)CNCCN1CCCC1 08daf3d84880ab5e3ad3f9b7dcd162e5 [0,1,0,1,0,0|2,0,0]=4 21578 B13R1.536 COC(C)COCCC1CCCC1 e3bc30eccc0a0adddf75464cde6b7160 [0,1,0,1,0,0|1,0,0]=3 21579 B13R1.536 COC(C)COCCC1CCCO1 e0d342a4969812e0d921859a15a12267 [0,1,0,1,0,0|2,0,0]=4 21580 B13R1.536 COC(C)COCCC1CCOC1 f76f44eb1587999704cabffb39a9cc32 [0,1,0,1,0,0|2,0,0]=4 21581 B13R1.536 COC(C)COCCN1CCCC1 763b7188f71d3469a4f5d952b7c53705 [0,1,0,1,0,0|2,0,0]=4 21582 B13R1.536 CO[C@@H](C)CNCCC1CCCC1 e4f69f9e486c767d0027da8cbd1feea8 [0,1,0,1,0,0|1,0,0]=3 21583 B13R1.536 CO[C@@H](C)CNCCC1CCCO1 d5bd4842f2a114a0a929da5db731d59e [0,1,0,1,0,0|2,0,0]=4 21584 B13R1.536 CO[C@@H](C)CNCCC1CCOC1 053800aa705df688337c547705d99b3d [0,1,0,1,0,0|2,0,0]=4 21585 B13R1.536 CO[C@@H](C)CNCCN1CCCC1 4d95f9bcc0fdb6953bf6a9431b4adf84 [0,1,0,1,0,0|2,0,0]=4 21586 B13R1.536 CO[C@@H](C)COCCC1CCCC1 9893c312b678695f4e169c93739e94d4 [0,1,0,1,0,0|1,0,0]=3 21587 B13R1.536 CO[C@@H](C)COCCC1CCCO1 0775d3d21a062086bf90729936594690 [0,1,0,1,0,0|2,0,0]=4 21588 B13R1.536 CO[C@@H](C)COCCC1CCOC1 7d5ade0f9b86d2f5008f8299f92ec929 [0,1,0,1,0,0|2,0,0]=4 21589 B13R1.536 CO[C@@H](C)COCCN1CCCC1 242340b7bf5c3187a88be5e72aceb3f9 [0,1,0,1,0,0|2,0,0]=4 21590 B13R1.536 CO[C@H](C)CNCCC1CCCC1 f704d2b82380bc06dd3adcad719263b0 [0,1,0,1,0,0|1,0,0]=3 21591 B13R1.536 CO[C@H](C)CNCCC1CCCO1 abd6b77ea8cce10e232f54f7f71d236b [0,1,0,1,0,0|2,0,0]=4 21592 B13R1.536 CO[C@H](C)CNCCC1CCOC1 1725eee6201301cf611e70005dbee946 [0,1,0,1,0,0|2,0,0]=4 21593 B13R1.536 CO[C@H](C)CNCCN1CCCC1 abdd82afaeb8468367ee79f52e1f5725 [0,1,0,1,0,0|2,0,0]=4 21594 B13R1.536 CO[C@H](C)COCCC1CCCC1 dcd3b7f8b1239873465b93032e469718 [0,1,0,1,0,0|1,0,0]=3 21595 B13R1.536 CO[C@H](C)COCCC1CCCO1 19ad7239e859e1537c9381992847b00b [0,1,0,1,0,0|2,0,0]=4 21596 B13R1.536 CO[C@H](C)COCCC1CCOC1 630272a40c1a49bd52932aa5dbe50986 [0,1,0,1,0,0|2,0,0]=4 21597 B13R1.536 CO[C@H](C)COCCN1CCCC1 4d560856aa5137d43a6ccee09b3d2818 [0,1,0,1,0,0|2,0,0]=4 21598 B13R1.536 C[C@@H](CO)CCNCC1CCCC1 872d8f0247b9f322119bd2a9e9f5d129 [0,1,0,1,0,0|1,0,0]=3 21599 B13R1.536 C[C@@H](CO)CCNCC1CCCO1 83f9eac54fd45427fd42ae5e251adf0c [0,1,0,1,0,0|2,0,0]=4 21600 B13R1.536 C[C@@H](CO)CCNCC1CCOC1 fe8bab212b9f2f6b64a8af5d7b6e9e4e [0,1,0,1,0,0|2,0,0]=4 21601 B13R1.536 C[C@@H](CO)CNCCC1CCCC1 2ed68807b9059303a840aa52e2dbf0cd [0,1,0,1,0,0|1,0,0]=3 21602 B13R1.536 C[C@@H](CO)CNCCC1CCCO1 6067a9702a8122f3cb076a01e2dae333 [0,1,0,1,0,0|2,0,0]=4 21603 B13R1.536 C[C@@H](CO)CNCCC1CCOC1 264bff0462284070b555ba73d681372a [0,1,0,1,0,0|2,0,0]=4 21604 B13R1.536 C[C@@H](CO)CNCCN1CCCC1 8ae2c6c887432a3e7a2e4213bc1053f2 [0,1,0,1,0,0|2,0,0]=4 21605 B13R1.536 C[C@@H](CO)NCCCC1CCCC1 fb3b04c88ec4c9f798386705833087a5 [0,1,0,1,0,0|1,0,0]=3 21606 B13R1.536 C[C@@H](CO)NCCCC1CCOC1 90430b80265129eff8eeac0424a0654e [0,1,0,1,0,0|2,0,0]=4 21607 B13R1.536 C[C@@H](CO)NCCCN1CCCC1 d88a0426a34671dae8d4f2ff3fe9585d [0,1,0,1,0,0|2,0,0]=4 21608 B13R1.536 C[C@@H](CO)NCCOC1CCCC1 6a65a13dcdb589b9b50bd18a999a1856 [0,1,0,1,0,0|2,0,0]=4 21609 B13R1.536 C[C@@H](CO)NCCSC1CCCC1 408e92031db2ebc408d7739c330aa220 [0,1,0,1,0,0|2,0,0]=4 21610 B13R1.536 C[C@H](C=O)NCCCC1CCCC1 e620b37c0ffc1762ca6506d8da48ed19 [0,1,0,1,0,0|1,0,1]=4 21611 B13R1.536 C[C@H](C=O)OCCCC1CCCC1 f4fcfe3a175278fea37073aeb1f01961 [0,1,0,1,0,0|1,0,1]=4 21612 B13R1.536 C[C@H](CO)CNCCC1CCCC1 18c937f28251e9853f4d5b4c4af3208f [0,1,0,1,0,0|1,0,0]=3 21613 B13R1.536 C[C@H](CO)CNCCC1CCCO1 172f9b3b796a4c76aed81b5f9bb16c3a [0,1,0,1,0,0|2,0,0]=4 21614 B13R1.536 C[C@H](CO)CNCCC1CCOC1 c82233218214862e3ce2ccd37d60dd9b [0,1,0,1,0,0|2,0,0]=4 21615 B13R1.536 C[C@H](CO)CNCCN1CCCC1 d9bf27bd16c9569a210dc8860d77b389 [0,1,0,1,0,0|2,0,0]=4 21616 B13R1.536 C[C@H](CO)NCCCC1CCCC1 abe2322d870f5150b5c76af599e83531 [0,1,0,1,0,0|1,0,0]=3 21617 B13R1.536 C[C@H](CO)NCCCC1CCOC1 21d162c8411b9da8b597960c8c9fb02f [0,1,0,1,0,0|2,0,0]=4 21618 B13R1.536 C[C@H](CO)NCCCN1CCCC1 00a58f2824e10d06890890170a3df5ac [0,1,0,1,0,0|2,0,0]=4 21619 B13R1.536 C[C@H](CO)NCCOC1CCCC1 23d282095b10aefb8df3371770435655 [0,1,0,1,0,0|2,0,0]=4 21620 B13R1.536 C[C@H](CO)NCCSC1CCCC1 7b76b7daf1cf8a1ed496a4919ef754e5 [0,1,0,1,0,0|2,0,0]=4 21621 B13R1.536 C[C@H](CS)OCCCC1CCCC1 6637261fb9057bac3f783170116a290c [0,1,0,1,0,0|1,1,0]=4 21622 B13R1.536 ClCC(Cl)COCCC1CCCC1 f438a9bb2535bf757ae5a21ec23b6ebd [0,1,0,1,0,0|2,0,0]=4 21623 B13R1.536 OC(CF)CNCCC1CCCC1 470a83e6a5bf8ba81d690fb7707cb242 [0,1,0,1,0,0|1,0,0]=3 21624 B13R1.536 OC(CF)CNCCC1CCCO1 c4b87f1b48396ced68b42d8c23edd8ef [0,1,0,1,0,0|2,0,0]=4 21625 B13R1.536 OC(CF)CNCCC1CCOC1 d171b9f06cb470703da014ce2532909c [0,1,0,1,0,0|2,0,0]=4 21626 B13R1.536 OC(CF)CNCCN1CCCC1 33b9982ce47ca2340ef2e36a230beeef [0,1,0,1,0,0|2,0,0]=4 21627 B13R1.536 OCC(F)CNCCC1CCCC1 23cb83662f7dbd8728f062bf11ef6b3e [0,1,0,1,0,0|2,0,0]=4 21628 B13R1.536 OCC(O)CCNCC1CCCC1 561e2367ed3505866500d9ff1d4da0ed [0,1,0,1,0,0|1,0,0]=3 21629 B13R1.536 OCC(O)CCNCC1CCCO1 1843da59d63b4152ed6c1265d635017a [0,1,0,1,0,0|2,0,0]=4 21630 B13R1.536 OCC(O)CCNCC1CCOC1 da1202f565f7bceef340de3bf52ca68a [0,1,0,1,0,0|2,0,0]=4 21631 B13R1.536 OCC(O)CNCCC1CCCC1 9a2bf4930b4fc2a6ea3b87663ad74f6b [0,1,0,1,0,0|1,0,0]=3 21632 B13R1.536 OCC(O)CNCCC1CCCO1 a094e83f6bfe7c8596c18dd1495f9466 [0,1,0,1,0,0|2,0,0]=4 21633 B13R1.536 OCC(O)CNCCC1CCOC1 0ad958391415b7e13b153e9e7c6fcdc2 [0,1,0,1,0,0|2,0,0]=4 21634 B13R1.536 OCC(O)CNCCN1CCCC1 ceaee2f3939b641802f191c5579d798d [0,1,0,1,0,0|2,0,0]=4 21635 B13R1.536 OCC(O)COCCC1CCCC1 089909da969ae3eb9ddc38f205836ad2 [0,1,0,1,0,0|1,0,0]=3 21636 B13R1.536 OCC(O)COCCC1CCCO1 ad181a9c3a2400e38b5274042d1b4075 [0,1,0,1,0,0|2,0,0]=4 21637 B13R1.536 OCC(O)COCCC1CCOC1 66adde30fd82c661932a3b169e660f56 [0,1,0,1,0,0|2,0,0]=4 21638 B13R1.536 OCC(O)COCCN1CCCC1 4807eed66ecf9050319241ba7653f5ce [0,1,0,1,0,0|2,0,0]=4 21639 B13R1.536 OC[C@@H](F)CNCCC1CCCC1 fbf72a0c9989fc54522b78c0ca22bdd7 [0,1,0,1,0,0|2,0,0]=4 21640 B13R1.536 OC[C@@H](O)CNCCC1CCCC1 40fd946d01690d64abbdfedc33ca4702 [0,1,0,1,0,0|1,0,0]=3 21641 B13R1.536 OC[C@@H](O)CNCCC1CCCO1 aaf1781c907f701fe4b2d4716f24014f [0,1,0,1,0,0|2,0,0]=4 21642 B13R1.536 OC[C@@H](O)CNCCC1CCOC1 5da75484d8a3bd2e554ad5905d4b8473 [0,1,0,1,0,0|2,0,0]=4 21643 B13R1.536 OC[C@@H](O)CNCCN1CCCC1 cb1366a036a5bda797c43becfbaff883 [0,1,0,1,0,0|2,0,0]=4 21644 B13R1.536 OC[C@@H](O)COCCC1CCCC1 aa35882c32bd386de51004b997fe6db9 [0,1,0,1,0,0|1,0,0]=3 21645 B13R1.536 OC[C@@H](O)COCCC1CCCO1 a0f2e0eb0c3219d5df5016232f7ed51d [0,1,0,1,0,0|2,0,0]=4 21646 B13R1.536 OC[C@@H](O)COCCC1CCOC1 1d057197240533d151aa094e25bcc375 [0,1,0,1,0,0|2,0,0]=4 21647 B13R1.536 OC[C@@H](O)COCCN1CCCC1 bd42fdc2d7552db02a8077f08c440898 [0,1,0,1,0,0|2,0,0]=4 21648 B13R1.536 OC[C@H](F)CNCCC1CCCC1 f7f7008d4f3dbe0aa732409b8138da34 [0,1,0,1,0,0|2,0,0]=4 21649 B13R1.536 OC[C@H](O)CNCCC1CCCC1 87e0d3304bccce93263bc687b1496acf [0,1,0,1,0,0|1,0,0]=3 21650 B13R1.536 OC[C@H](O)CNCCC1CCCO1 3215760cb56ce3aa4cf494381d3a83a2 [0,1,0,1,0,0|2,0,0]=4 21651 B13R1.536 OC[C@H](O)CNCCC1CCOC1 cd8ffc2970f65f843d6bbf8aeae36cdb [0,1,0,1,0,0|2,0,0]=4 21652 B13R1.536 OC[C@H](O)CNCCN1CCCC1 d2c240a7e69c263b0b8666c51b4bd4cc [0,1,0,1,0,0|2,0,0]=4 21653 B13R1.536 OC[C@H](O)COCCC1CCCC1 d8f2734b656f0163dfcbf212ca536839 [0,1,0,1,0,0|1,0,0]=3 21654 B13R1.536 OC[C@H](O)COCCC1CCCO1 20727750f215d511a900b97054547d37 [0,1,0,1,0,0|2,0,0]=4 21655 B13R1.536 OC[C@H](O)COCCC1CCOC1 7d105f1623d5ee63afa47313f048bc68 [0,1,0,1,0,0|2,0,0]=4 21656 B13R1.536 OC[C@H](O)COCCN1CCCC1 2b27b9fec0a82b7aa88cca0bef04c0fb [0,1,0,1,0,0|2,0,0]=4 21657 B13R1.536 SCC(S)COCCC1CCCC1 8ab21d455973ea96043e5f2ffea8da46 [0,1,0,1,0,0|1,1,0]=4 21658 B13R1.539 C#CC(O)CCCCCN1CCC1 9e7791bceca75c7f8fd64aab9c4a4be0 [0,1,0,1,0,0|1,0,1]=4 21659 B13R1.539 CC(C#N)COCCCC1CCC1 15c567fb755d100755a26827690b9de0 [0,1,0,1,0,0|2,0,0]=4 21660 B13R1.539 CC(CO)CCCNCC1CCC1 a4f7813c1395045bfeaf6e6e9a1b5bc5 [0,1,0,1,0,0|1,0,0]=3 21661 B13R1.539 CC(CO)CCCNCC1CCO1 73e1b12bd514b4b17575de0eb92ee5d2 [0,1,0,1,0,0|2,0,0]=4 21662 B13R1.539 CC(CO)CCCNCC1COC1 1d223425949a7b366b96cd17b3b66474 [0,1,0,1,0,0|2,0,0]=4 21663 B13R1.539 CC(CO)CCCNC[C@@H]1CCO1 cc750cc4a3e2fb9936ed29ebc2dfb375 [0,1,0,1,0,0|2,0,0]=4 21664 B13R1.539 CC(CO)CCCNC[C@H]1CCO1 8ea52e374d6fbc142c0f4c4d28044f71 [0,1,0,1,0,0|2,0,0]=4 21665 B13R1.539 CC(CO)CCNCCC1CCC1 08e2799783a47b38fe21b53f63a7d55e [0,1,0,1,0,0|1,0,0]=3 21666 B13R1.539 CC(CO)CCNCCC1CCO1 b5c356f008a5902c01c8d345ebba7e99 [0,1,0,1,0,0|2,0,0]=4 21667 B13R1.539 CC(CO)CCNCCC1COC1 0ab5ec06e1b340961ceaeeb1cd3e0978 [0,1,0,1,0,0|2,0,0]=4 21668 B13R1.539 CC(CO)CCNCCN1CCC1 80a9ac1038e8c805cc02c18ba8f398f0 [0,1,0,1,0,0|2,0,0]=4 21669 B13R1.539 CC(CO)CCNCC[C@@H]1CCO1 e40d66858734014a9e5e3fb74a86845c [0,1,0,1,0,0|2,0,0]=4 21670 B13R1.539 CC(CO)CNCCCN1CCC1 8ffafa61afcffdfa852fce1ae40f1ece [0,1,0,1,0,0|2,0,0]=4 21671 B13R1.539 CC(CO)CNCCOC1CCC1 726eef712a04c173b9871f494528f3ed [0,1,0,1,0,0|2,0,0]=4 21672 B13R1.539 CCC(C)CCCCOC1CCC1 3c96973c9eed89e4629d96b3f53f6367 [0,1,0,1,0,0|2,0,0]=4 21673 B13R1.539 CCC(C)CCCOCC1CCC1 f700c5f3d3e15bcff9c80b01967ab0f3 [0,1,0,1,0,0|2,0,0]=4 21674 B13R1.539 CCC(C)CCNCCC1CCC1 986e440d81c512a5e344515e5a4b95ce [0,1,0,1,0,0|2,0,0]=4 21675 B13R1.539 CCC(C)CCOCCC1CCC1 6926ca783ae037831e8e5217523976ce [0,1,0,1,0,0|2,0,0]=4 21676 B13R1.539 CCC(C)COCCCC1CCC1 00778cf0ec5cf6623a6df0706413e2f0 [0,1,0,1,0,0|2,0,0]=4 21677 B13R1.539 CCC(O)CNCCCN1CCC1 0af0269e552105dbbc0318fb6b569646 [0,1,0,1,0,0|2,0,0]=4 21678 B13R1.539 CCC(O)CNCCOC1CCC1 e458a9a5ffec58ae03e1b8dbb00ac367 [0,1,0,1,0,0|2,0,0]=4 21679 B13R1.539 CCC(S)CCOCCC1CCC1 3c36b463819cc44f00640a54d968b6e3 [0,1,0,1,0,0|1,1,0]=4 21680 B13R1.539 CC[C@@H](C)COCCCC1CCC1 619e034a29c4f56bc16791ab47b67fbf [0,1,0,1,0,0|2,0,0]=4 21681 B13R1.539 CC[C@@H](O)CNCCOC1CCC1 dd601c841b792b49d9b56fccd1af1633 [0,1,0,1,0,0|2,0,0]=4 21682 B13R1.539 CC[C@H](C)CCCCOC1CCC1 06ed95ff974c04b3698a1dc48507d980 [0,1,0,1,0,0|2,0,0]=4 21683 B13R1.539 CC[C@H](C)CCCOCC1CCC1 17008dfdc25e80331f69dcb98bf77b13 [0,1,0,1,0,0|2,0,0]=4 21684 B13R1.539 CC[C@H](C)CCOCCC1CCC1 4495074938211d84a5722e3aae669597 [0,1,0,1,0,0|2,0,0]=4 21685 B13R1.539 CC[C@H](C)COCCCC1CCC1 a527678dd7773af29823db6c2ddcf769 [0,1,0,1,0,0|2,0,0]=4 21686 B13R1.539 COC(C)CCOCCC1CCC1 ce31c529c6e297223e12153f96a34862 [0,1,0,1,0,0|1,0,0]=3 21687 B13R1.539 COC(C)CCOCCC1CCO1 b179a9fe2a1a1c30dfcc1e886d067ddf [0,1,0,1,0,0|2,0,0]=4 21688 B13R1.539 COC(C)CCOCCC1COC1 1c82f4d25d853e36bff306159f5ac4ea [0,1,0,1,0,0|2,0,0]=4 21689 B13R1.539 COC(C)CNCCCN1CCC1 52226ea10e1b05788c8f7dc1c871ebbb [0,1,0,1,0,0|2,0,0]=4 21690 B13R1.539 COC(C)COCCCC1CCC1 45f30081c9284d828d81b4e2081c61b4 [0,1,0,1,0,0|1,0,0]=3 21691 B13R1.539 COC(C)COCCCC1COC1 90d7e0460d1ad6324cb054fa173955e7 [0,1,0,1,0,0|2,0,0]=4 21692 B13R1.539 COC(C)COCCCN1CCC1 841b83d5a426a39c9da221a29e2857fc [0,1,0,1,0,0|2,0,0]=4 21693 B13R1.539 COC(C)COCCOC1CCC1 18012b899c8459ce4f28b41c42553cda [0,1,0,1,0,0|2,0,0]=4 21694 B13R1.539 CO[C@@H](C)CNCCCN1CCC1 7fc322bec0ee229e9385b40656edb878 [0,1,0,1,0,0|2,0,0]=4 21695 B13R1.539 CO[C@@H](C)CNCCOC1CCC1 b64bb02467ccd8f1fbd5a6054d0ca830 [0,1,0,1,0,0|2,0,0]=4 21696 B13R1.539 CO[C@@H](C)COCCCC1CCC1 bc6546f80e2655743b9b801510a57167 [0,1,0,1,0,0|1,0,0]=3 21697 B13R1.539 CO[C@@H](C)COCCCC1COC1 ecdf12a89d8d03aad4602955b75aa31e [0,1,0,1,0,0|2,0,0]=4 21698 B13R1.539 CO[C@@H](C)COCCCN1CCC1 f23f1133e347867352a2df3697c3c819 [0,1,0,1,0,0|2,0,0]=4 21699 B13R1.539 CO[C@@H](C)COCCOC1CCC1 f9c8eb1f4984567ea31129b37edbbfd3 [0,1,0,1,0,0|2,0,0]=4 21700 B13R1.539 CO[C@H](C)CNCCCN1CCC1 3f10252755f8a7c3a501293fbdf8ad61 [0,1,0,1,0,0|2,0,0]=4 21701 B13R1.539 CO[C@H](C)CNCCOC1CCC1 03846c0a4189864b773a8242477becb5 [0,1,0,1,0,0|2,0,0]=4 21702 B13R1.539 CO[C@H](C)COCCCC1CCC1 a7b8e0d3ffdf3e654a22166615b0df7a [0,1,0,1,0,0|1,0,0]=3 21703 B13R1.539 CO[C@H](C)COCCCC1COC1 7fce04728724dd38190b570370dccf56 [0,1,0,1,0,0|2,0,0]=4 21704 B13R1.539 CO[C@H](C)COCCCN1CCC1 84d062e8c8034e6e5bb3017994f8b916 [0,1,0,1,0,0|2,0,0]=4 21705 B13R1.539 CO[C@H](C)COCCOC1CCC1 a0efa8e07d3013e34f415abe7369f633 [0,1,0,1,0,0|2,0,0]=4 21706 B13R1.539 C[C@@H](CO)CCNCCC1CCC1 a9c8cb976307a98b60774fbe24559e95 [0,1,0,1,0,0|1,0,0]=3 21707 B13R1.539 C[C@@H](CO)CCNCCC1CCO1 cd9628fbed3d6c6325e083c20011a7ec [0,1,0,1,0,0|2,0,0]=4 21708 B13R1.539 C[C@@H](CO)CCNCCC1COC1 12ccbb5744b4c8856767de96690060aa [0,1,0,1,0,0|2,0,0]=4 21709 B13R1.539 C[C@@H](CO)CNCCCN1CCC1 cc14e6aef6a818589697eac3e60435c4 [0,1,0,1,0,0|2,0,0]=4 21710 B13R1.539 C[C@H](CO)CNCCCN1CCC1 0b2216762cfba09abb5cfa6d62a07c0a [0,1,0,1,0,0|2,0,0]=4 21711 B13R1.539 C[C@H](CO)CNCCOC1CCC1 b86de6b581fa617b5803a475de46c2c7 [0,1,0,1,0,0|2,0,0]=4 21712 B13R1.539 OC(CF)CNCCCN1CCC1 706a51232910de510402cd50c2051ca5 [0,1,0,1,0,0|2,0,0]=4 21713 B13R1.539 OCC(O)CCNCCC1CCC1 6fc1f1b283a5aeb5fd11bd297e7c336a [0,1,0,1,0,0|1,0,0]=3 21714 B13R1.539 OCC(O)CCNCCC1CCO1 0c49e5acdab6b5edae528e6eaa622f49 [0,1,0,1,0,0|2,0,0]=4 21715 B13R1.539 OCC(O)CCNCCC1COC1 9571152d188ad6e8ebb3f43ffec1a98b [0,1,0,1,0,0|2,0,0]=4 21716 B13R1.539 OCC(O)CNCCCN1CCC1 0cb9eb0becacf2cef859bd70d7e48a7d [0,1,0,1,0,0|2,0,0]=4 21717 B13R1.539 OCC(O)CNCCOC1CCC1 0cfe4de6cfbbdebb787ec09c17c16167 [0,1,0,1,0,0|2,0,0]=4 21718 B13R1.539 OCC(O)COCCCC1CCC1 77fb3aecc385a1a3d5a031fb87f1b75a [0,1,0,1,0,0|1,0,0]=3 21719 B13R1.539 OCC(O)COCCCC1COC1 57128d0409d5d9cfd2c21e603e041d7e [0,1,0,1,0,0|2,0,0]=4 21720 B13R1.539 OCC(O)COCCCN1CCC1 68e004788edbbad46dde8ac577d56de7 [0,1,0,1,0,0|2,0,0]=4 21721 B13R1.539 OCC(O)COCCOC1CCC1 4411d66305c48b20f489e7094275a87b [0,1,0,1,0,0|2,0,0]=4 21722 B13R1.539 OC[C@@H](O)CNCCCN1CCC1 45c4d1a7b23581ef93e41084e95aeeba [0,1,0,1,0,0|2,0,0]=4 21723 B13R1.539 OC[C@@H](O)CNCCOC1CCC1 5edcd26397fb498aeb7f807a16a2f731 [0,1,0,1,0,0|2,0,0]=4 21724 B13R1.539 OC[C@@H](O)COCCCC1CCC1 797e02ab1fff723b9d5626b05df27fbc [0,1,0,1,0,0|1,0,0]=3 21725 B13R1.539 OC[C@@H](O)COCCCC1COC1 6e4867ec2d0a2af97ce896c0d50c6c42 [0,1,0,1,0,0|2,0,0]=4 21726 B13R1.539 OC[C@@H](O)COCCCN1CCC1 08dda54752694440fe1cb6586f741f76 [0,1,0,1,0,0|2,0,0]=4 21727 B13R1.539 OC[C@@H](O)COCCOC1CCC1 a9dc121c85f60677d856bce3a1032a47 [0,1,0,1,0,0|2,0,0]=4 21728 B13R1.539 OC[C@H](O)CNCCCN1CCC1 a23e729adcfa2d10d2f2958067daefe4 [0,1,0,1,0,0|2,0,0]=4 21729 B13R1.539 OC[C@H](O)CNCCOC1CCC1 0b3771b43acd12effab463f459464eb7 [0,1,0,1,0,0|2,0,0]=4 21730 B13R1.539 OC[C@H](O)COCCCC1CCC1 490ee009a6201549121d3aafe4389e8e [0,1,0,1,0,0|1,0,0]=3 21731 B13R1.539 OC[C@H](O)COCCCC1COC1 fccdf0723706aa2b6865b21986133de9 [0,1,0,1,0,0|2,0,0]=4 21732 B13R1.539 OC[C@H](O)COCCCN1CCC1 23dcdb056d468255fac19c8cc1c3cc96 [0,1,0,1,0,0|2,0,0]=4 21733 B13R1.539 OC[C@H](O)COCCOC1CCC1 4efed5b3c2c8d25de72363120db2aa70 [0,1,0,1,0,0|2,0,0]=4 21734 B13R1.560 CCCCCCCCCN1CCC1 8415792d8ef9aa45623a8bd2666a18c2 [0,1,0,1,0,0|2,0,0]=4 21735 B13R1.560 CCCCCCCCNC1CCC1 8d3cb3f23c78f9d41aa3d8a53856c908 [0,1,0,1,0,0|2,0,0]=4 21736 B13R1.560 CCCCCCCCNC1COC1 60cfe7f0e9c1bcc5b314cc8db9d4b356 [0,1,0,1,0,0|1,0,0]=3 21737 B13R1.560 CCCCCCCCOC1CCC1 9464a2dda318051b86c4a9cc9c353875 [0,1,0,1,0,0|2,0,0]=4 21738 B13R1.560 CCCCCCCCOC1COC1 a3ffbf28d331d7e068094b07301330e7 [0,1,0,1,0,0|1,0,0]=3 21739 B13R1.560 CCCCCCCCOC1CSC1 a35be2e9cdcb299b76d2d935849c2d48 [0,1,0,1,0,0|1,1,0]=4 21740 B13R1.560 CCCCCCCNCC1CCC1 08eee35fed8c778c6f900b984092645b [0,1,0,1,0,0|2,0,0]=4 21741 B13R1.560 CCCCCCCNCC1CCO1 8182d1e4f2838622b2ef14fd641b92c5 [0,1,0,1,0,0|1,0,0]=3 21742 B13R1.560 CCCCCCCNCC1COC1 f7f4e60fedb32a59a9b136b7f561453d [0,1,0,1,0,0|1,0,0]=3 21743 B13R1.560 CCCCCCCNC[C@@H]1CCO1 3d3f804269ccbf34d21ef11e438ef062 [0,1,0,1,0,0|1,0,0]=3 21744 B13R1.560 CCCCCCCNC[C@H]1CCO1 1d454962b4a9f076c464c3b27acd43f7 [0,1,0,1,0,0|1,0,0]=3 21745 B13R1.560 CCCCCCCOCC1CCC1 57a133d1a185a6eb9a872ee036b29bd3 [0,1,0,1,0,0|2,0,0]=4 21746 B13R1.560 CCCCCCCOCC1CCO1 3173a822462bbb023d0bd87a1ba66315 [0,1,0,1,0,0|1,0,0]=3 21747 B13R1.560 CCCCCCCOCC1COC1 bdab5b6e3c94c9debae9773c9bfc6446 [0,1,0,1,0,0|1,0,0]=3 21748 B13R1.560 CCCCCCCOCC1CSC1 86b259d6f757c525f105d36978bbab9e [0,1,0,1,0,0|1,1,0]=4 21749 B13R1.560 CCCCCCCOC[C@@H]1CCO1 655ef5d64b3ab653ee569b4a721a41c3 [0,1,0,1,0,0|1,0,0]=3 21750 B13R1.560 CCCCCCCOC[C@H]1CCO1 857b17a6f7c2048d870aaa4598d5bd37 [0,1,0,1,0,0|1,0,0]=3 21751 B13R1.560 CCCCCCNCCC1CCC1 5cb4cb34c80feb141fdcae745074ddce [0,1,0,1,0,0|2,0,0]=4 21752 B13R1.560 CCCCCCNCCC1CCO1 9ead18049a5dac566e95277d14108301 [0,1,0,1,0,0|1,0,0]=3 21753 B13R1.560 CCCCCCNCCC1COC1 d483caf9efca17a0b368e99a7cf0fed4 [0,1,0,1,0,0|1,0,0]=3 21754 B13R1.560 CCCCCCNCC[C@@H]1CCO1 a10e56292a1033aa6ada3c3fee992b71 [0,1,0,1,0,0|1,0,0]=3 21755 B13R1.560 CCCCCCOCCC1CCC1 6a6c83ec1edff515f1cb874d22ba5c5b [0,1,0,1,0,0|2,0,0]=4 21756 B13R1.560 CCCCCCOCCC1CCO1 9965d245d12c84ab30b3f204c2e37d64 [0,1,0,1,0,0|1,0,0]=3 21757 B13R1.560 CCCCCCOCCC1COC1 c19d2f267eb9bceacf6b4a21f71cf3e6 [0,1,0,1,0,0|1,0,0]=3 21758 B13R1.560 CCCCCCOCC[C@@H]1CCO1 2cee67cfa86c76f322e164507d9ba2bd [0,1,0,1,0,0|1,0,0]=3 21759 B13R1.560 CCCCCCOCC[C@H]1CCO1 01732b06b15baed90a35c83504743a31 [0,1,0,1,0,0|1,0,0]=3 21760 B13R1.560 CCCCCOCCCC1CCC1 34ad130bedf6349d71232abfdc37236c [0,1,0,1,0,0|2,0,0]=4 21761 B13R1.560 CCCCCOCCCC1COC1 1c36bc23e5ca0428b8f6a4f3d0c6c01d [0,1,0,1,0,0|1,0,0]=3 21762 B13R1.560 CCCCCOCCOC1COC1 9f010d26fea832d906b3ff3fcb202932 [0,1,0,1,0,0|2,0,0]=4 21763 B13R1.560 CCCCOCCCNC1COC1 3b6e33d29d6eb750ba24d8c6f008d62a [0,1,0,1,0,0|2,0,0]=4 21764 B13R1.560 CCCCOCCCOC1COC1 f98bb5dd63519417e0735b14736f16ee [0,1,0,1,0,0|2,0,0]=4 21765 B13R1.560 CCCCOCCNCC1CCO1 ee293f9c4df93986e0452a004f58df83 [0,1,0,1,0,0|2,0,0]=4 21766 B13R1.560 CCCCOCCNCC1COC1 c97a92acf04879ac0adf6ee54e9ab508 [0,1,0,1,0,0|2,0,0]=4 21767 B13R1.560 CCCCOCCNC[C@@H]1CCO1 890457e835aadb41ddfd978fd854aac2 [0,1,0,1,0,0|2,0,0]=4 21768 B13R1.560 CCCCOCCNC[C@H]1CCO1 ef723e7fe4fa87bf6598ff519eddd9cd [0,1,0,1,0,0|2,0,0]=4 21769 B13R1.560 CCCCOCCOCC1CCO1 fcfcd3a420c76abd04b179b26a3127bc [0,1,0,1,0,0|2,0,0]=4 21770 B13R1.560 CCCCOCCOCC1COC1 3c7182b874fc290e47275a93434d62bb [0,1,0,1,0,0|2,0,0]=4 21771 B13R1.560 CCCCOCCOC[C@@H]1CCO1 6f38c46ccc39c2d67482be295f251ebf [0,1,0,1,0,0|2,0,0]=4 21772 B13R1.560 CCCCOCCOC[C@H]1CCO1 7fae4810cd54e4cb75ef0fbc2e95a5d8 [0,1,0,1,0,0|2,0,0]=4 21773 B13R1.560 CCCCOCNCCC1CCO1 a00ab63cf2a2c7a38261e055c5d41d98 [0,1,0,1,0,0|2,0,0]=4 21774 B13R1.560 CCCCOCNCCC1COC1 cd490cea425785ff42933cbacc6a64ab [0,1,0,1,0,0|2,0,0]=4 21775 B13R1.560 CCCCOCNCC[C@@H]1CCO1 016c85b5fe5094af616a956eb90456e5 [0,1,0,1,0,0|2,0,0]=4 21776 B13R1.560 CCCCOCOCCC1CCO1 b58f0b6908787788b63f63bc8666b758 [0,1,0,1,0,0|2,0,0]=4 21777 B13R1.560 CCCCOCOCCC1COC1 35c534b874b3909efd3ebb5810ffa88c [0,1,0,1,0,0|2,0,0]=4 21778 B13R1.560 CCCCOCOCC[C@@H]1CCO1 1a80bb0a0c0f8d22f4fb3ff440073053 [0,1,0,1,0,0|2,0,0]=4 21779 B13R1.560 CCCCOCOCC[C@H]1CCO1 4a5854b1459f96ec0b9c54bb9684cd90 [0,1,0,1,0,0|2,0,0]=4 21780 B13R1.560 CCCCSCCOCC1CCO1 f39c2722f66dcac8de26983f991baa5f [0,1,0,1,0,0|2,0,0]=4 21781 B13R1.560 CCCCSCCOCC1COC1 7d1b1a21f3b73d8c707aa058f4e3fd8a [0,1,0,1,0,0|2,0,0]=4 21782 B13R1.560 CCCCSCCOC[C@@H]1CCO1 ea19e1277aefa3804cbc2569d1500c17 [0,1,0,1,0,0|2,0,0]=4 21783 B13R1.560 CCCCSCCOC[C@H]1CCO1 3010c3342fef61b8d55719c8138fe792 [0,1,0,1,0,0|2,0,0]=4 21784 B13R1.560 CCCOCCCNCC1CCO1 1f503eca772e88d9f2ed7c0e112e11b3 [0,1,0,1,0,0|2,0,0]=4 21785 B13R1.560 CCCOCCCNCC1COC1 20504a78fc65185fceb145a506a5c3c9 [0,1,0,1,0,0|2,0,0]=4 21786 B13R1.560 CCCOCCCNC[C@@H]1CCO1 bc840556bba593ee2b08c051c972bc87 [0,1,0,1,0,0|2,0,0]=4 21787 B13R1.560 CCCOCCCNC[C@H]1CCO1 4f8d08c647ecc45693c0cb36810f05f3 [0,1,0,1,0,0|2,0,0]=4 21788 B13R1.560 CCCOCCCOCC1CCO1 4c6b79daa41fab0e05b470ced66bc331 [0,1,0,1,0,0|2,0,0]=4 21789 B13R1.560 CCCOCCCOCC1COC1 8d3f16bba6ab78885f36c69d306427be [0,1,0,1,0,0|2,0,0]=4 21790 B13R1.560 CCCOCCCOC[C@@H]1CCO1 441125e671846c9a8e6b0d37c439f37e [0,1,0,1,0,0|2,0,0]=4 21791 B13R1.560 CCCOCCCOC[C@H]1CCO1 34d27d1740df2613186ef7da8aa2f3df [0,1,0,1,0,0|2,0,0]=4 21792 B13R1.560 CCCOCCNCCC1CCO1 2380c758cce8abc46f7c8a7037da61b4 [0,1,0,1,0,0|2,0,0]=4 21793 B13R1.560 CCCOCCNCCC1COC1 187eeffa659789a8a7dd223e2ca52704 [0,1,0,1,0,0|2,0,0]=4 21794 B13R1.560 CCCOCCNCC[C@@H]1CCO1 2590a5970e992f68e56dcce406ecdaf4 [0,1,0,1,0,0|2,0,0]=4 21795 B13R1.560 CCCOCCOCCC1CCO1 0bf1f1808daacdf6d665335ce5697938 [0,1,0,1,0,0|2,0,0]=4 21796 B13R1.560 CCCOCCOCCC1COC1 40f9bf94fff08b4960136f4a7e2dd618 [0,1,0,1,0,0|2,0,0]=4 21797 B13R1.560 CCCOCCOCC[C@@H]1CCO1 bb4c55617fa3823f1c62f068db49b9d1 [0,1,0,1,0,0|2,0,0]=4 21798 B13R1.560 CCCOCCOCC[C@H]1CCO1 5e4a2d05e5d9ff3075275c3fdaa1187e [0,1,0,1,0,0|2,0,0]=4 21799 B13R1.560 CCCSCCCCNC1COC1 4c7b05b4eab4e8f8bc2d02e5125d1a55 [0,1,0,1,0,0|2,0,0]=4 21800 B13R1.560 CCCSCCOCCC1CCO1 0ac4f041e02157b0451ff01d4e178eec [0,1,0,1,0,0|2,0,0]=4 21801 B13R1.560 CCCSCCOCCC1COC1 eea8058db4b538fa32c6d9e63e1d38e4 [0,1,0,1,0,0|2,0,0]=4 21802 B13R1.560 CCOCCCNCCC1CCO1 bdc1d3a8d0d24f7d6f36afd3b53f8866 [0,1,0,1,0,0|2,0,0]=4 21803 B13R1.560 CCOCCCNCCC1COC1 31ace5f19de94958d6e552fe3abb048c [0,1,0,1,0,0|2,0,0]=4 21804 B13R1.560 CCOCCCNCC[C@@H]1CCO1 48b964e15354d920fd4db147ad5250ff [0,1,0,1,0,0|2,0,0]=4 21805 B13R1.560 CCOCCCOCCC1CCO1 1b7f2132dcbeac0c977dfd89ee03544f [0,1,0,1,0,0|2,0,0]=4 21806 B13R1.560 CCOCCCOCCC1COC1 07caa3c0f5f41a56b0702f1c5bf2d924 [0,1,0,1,0,0|2,0,0]=4 21807 B13R1.560 CCOCCCOCC[C@@H]1CCO1 6e3a87c90847487ef38a99ebb2688a2a [0,1,0,1,0,0|2,0,0]=4 21808 B13R1.560 CCOCCCOCC[C@H]1CCO1 6e0ca993c78f9146021e5092d8e08d73 [0,1,0,1,0,0|2,0,0]=4 21809 B13R1.560 CCOCCOCCCC1COC1 f73fd3088160c809c480eaee25b5c0cf [0,1,0,1,0,0|2,0,0]=4 21810 B13R1.560 CCSCCCCNCC1CCO1 0a230e94a5df7eecc8a0542b9a8d13c9 [0,1,0,1,0,0|2,0,0]=4 21811 B13R1.560 CCSCCCCNCC1COC1 9d80f448ea688ddb89a904e793cad7bd [0,1,0,1,0,0|2,0,0]=4 21812 B13R1.560 CCSCCCCNC[C@@H]1CCO1 b51620152195500c6d49392c39bd724f [0,1,0,1,0,0|2,0,0]=4 21813 B13R1.560 CCSCCCCNC[C@H]1CCO1 6f252cd80b17996e2aa9abc5d2a0f08f [0,1,0,1,0,0|2,0,0]=4 21814 B13R1.560 CCSCCCNCCC1CCO1 178b9b0af84dbad6140daa06255b3896 [0,1,0,1,0,0|2,0,0]=4 21815 B13R1.560 CCSCCCNCCC1COC1 d1b0ca545f7d933a5dcfab7159068087 [0,1,0,1,0,0|2,0,0]=4 21816 B13R1.560 CCSCCCNCC[C@@H]1CCO1 0e715fc40d8c34e57b81197b90dc7ed7 [0,1,0,1,0,0|2,0,0]=4 21817 B13R1.560 CCSCCCOCCC1CCO1 98401c00678f628b7b7deadc923e3c2b [0,1,0,1,0,0|2,0,0]=4 21818 B13R1.560 CCSCCCOCCC1COC1 ea4dc1b82b446be67ba492088ff7c09a [0,1,0,1,0,0|2,0,0]=4 21819 B13R1.560 CCSCCCOCC[C@@H]1CCO1 3a9e17a2a8bc8143c0ad7d3c52f94e7f [0,1,0,1,0,0|2,0,0]=4 21820 B13R1.560 CCSCCCOCC[C@H]1CCO1 c0bd751ecaafb4455c02ecd06f0e59ed [0,1,0,1,0,0|2,0,0]=4 21821 B13R1.560 CCSCCOCCCC1COC1 7e79128f0dd24a820cc833232c9e33d4 [0,1,0,1,0,0|2,0,0]=4 21822 B13R1.560 COCCCCCCNC1COC1 ed082edb58906fb5dc3d55a583ab8b8d [0,1,0,1,0,0|2,0,0]=4 21823 B13R1.560 COCCCCCCOC1COC1 1372fa580f76535e515f3427bd60c457 [0,1,0,1,0,0|2,0,0]=4 21824 B13R1.560 COCCCCCNCC1CCO1 012db1be0eece6079c8e98914bad89c9 [0,1,0,1,0,0|2,0,0]=4 21825 B13R1.560 COCCCCCNCC1COC1 9f4bd6447d49b011c78003f3b7b29324 [0,1,0,1,0,0|2,0,0]=4 21826 B13R1.560 COCCCCCNC[C@@H]1CCO1 93bcb84a05b673ca9e8fdb79f6c72945 [0,1,0,1,0,0|2,0,0]=4 21827 B13R1.560 COCCCCCNC[C@H]1CCO1 57ba18d8d1ebb5d6ced7b2b1a53dec7a [0,1,0,1,0,0|2,0,0]=4 21828 B13R1.560 COCCCCCOCC1CCO1 08225d8fe4c56c6b88484a07f7545349 [0,1,0,1,0,0|2,0,0]=4 21829 B13R1.560 COCCCCCOCC1COC1 7becedc440b6a55c3ea81a2a0d6a104b [0,1,0,1,0,0|2,0,0]=4 21830 B13R1.560 COCCCCCOC[C@@H]1CCO1 c3d4d1ca27f30a87d6554f168b2400f5 [0,1,0,1,0,0|2,0,0]=4 21831 B13R1.560 COCCCCCOC[C@H]1CCO1 0ec8c1f4bdbb569691955e9a7d634e7e [0,1,0,1,0,0|2,0,0]=4 21832 B13R1.560 COCCCCNCCC1CCO1 8f5deb9dac99b321453e6c000f8eefb0 [0,1,0,1,0,0|2,0,0]=4 21833 B13R1.560 COCCCCNCCC1COC1 572aff6178d0eec56063fd6cc9ea9768 [0,1,0,1,0,0|2,0,0]=4 21834 B13R1.560 COCCCCNCC[C@@H]1CCO1 5cdb3c06c8542e589acbbdca1263947f [0,1,0,1,0,0|2,0,0]=4 21835 B13R1.560 COCCCCOCCC1CCO1 24d6beb60571140fe476eb5a84aee6b4 [0,1,0,1,0,0|2,0,0]=4 21836 B13R1.560 COCCCCOCCC1COC1 21eaf6fdefc697a1d8085ca514e7f5da [0,1,0,1,0,0|2,0,0]=4 21837 B13R1.560 COCCCCOCC[C@@H]1CCO1 bdf0392784c17b4658f2b75b15aaae7f [0,1,0,1,0,0|2,0,0]=4 21838 B13R1.560 COCCCCOCC[C@H]1CCO1 a8134ebd70c6c43c238880cff59015e0 [0,1,0,1,0,0|2,0,0]=4 21839 B13R1.560 COCCCOCCCC1COC1 e94c16fea7ef5584155ce597e51b208a [0,1,0,1,0,0|2,0,0]=4 21840 B13R1.560 CSCCCCNCCC1CCO1 7fc9267ac4043cfebfc04f85729889d4 [0,1,0,1,0,0|2,0,0]=4 21841 B13R1.560 CSCCCCNCCC1COC1 3025fd277ed1e40c9205f6bbad329e44 [0,1,0,1,0,0|2,0,0]=4 21842 B13R1.560 CSCCCCOCCC1CCO1 7f2a8036f116ee86520903beaf597569 [0,1,0,1,0,0|2,0,0]=4 21843 B13R1.560 CSCCCCOCCC1COC1 04ca791eaecec7fd29092b1ae09aab51 [0,1,0,1,0,0|2,0,0]=4 21844 B13R1.560 CSCCCOCCCC1COC1 7bb5a4efb70d0f21e8ad2829bafac1ba [0,1,0,1,0,0|2,0,0]=4 21845 B13R1.560 ClCCCCCCNCC1CCO1 1e0f665ce7cce5577139523bc769bd2e [0,1,0,1,0,0|2,0,0]=4 21846 B13R1.560 ClCCCCCCNCC1COC1 b76549e94eba0144c525a0261f0133f5 [0,1,0,1,0,0|2,0,0]=4 21847 B13R1.560 ClCCCCCCNC[C@@H]1CCO1 c8395d8eaba34a6341b8d2039778252d [0,1,0,1,0,0|2,0,0]=4 21848 B13R1.560 ClCCCCCCNC[C@H]1CCO1 4aa74c18a22e0b822eac494c6dd890ff [0,1,0,1,0,0|2,0,0]=4 21849 B13R1.560 ClCCCCCNCCC1CCO1 37ff34e71e90fecbc1e5af96cd9c2410 [0,1,0,1,0,0|2,0,0]=4 21850 B13R1.560 ClCCCCCNCCC1COC1 25c0891f168834456eefeda4900fc23f [0,1,0,1,0,0|2,0,0]=4 21851 B13R1.560 FCCCCCCNCC1CCO1 11961140156e20c6d2c6f673b7e676cf [0,1,0,1,0,0|2,0,0]=4 21852 B13R1.560 FCCCCCCNCC1COC1 8a39fbcda76735eadc4eab70dc16bf6d [0,1,0,1,0,0|2,0,0]=4 21853 B13R1.560 FCCCCCCNC[C@@H]1CCO1 8714a680c5b914e72d91a3e932155d62 [0,1,0,1,0,0|2,0,0]=4 21854 B13R1.560 FCCCCCCNC[C@H]1CCO1 1a14e4226cd87e1053de2652de3b3eae [0,1,0,1,0,0|2,0,0]=4 21855 B13R1.560 FCCCCCCOCC1CCO1 2db1a25c7cde9de00a82fdfc2d2c71c7 [0,1,0,1,0,0|2,0,0]=4 21856 B13R1.560 FCCCCCCOCC1COC1 5bc242fe523c06fa92f476ab9347fa4f [0,1,0,1,0,0|2,0,0]=4 21857 B13R1.560 FCCCCCCOC[C@@H]1CCO1 da1ee4d58f57065e1f87cf069688659d [0,1,0,1,0,0|2,0,0]=4 21858 B13R1.560 FCCCCCCOC[C@H]1CCO1 2b66f613a8c428b7c1ada43fbec61a3f [0,1,0,1,0,0|2,0,0]=4 21859 B13R1.560 FCCCCCNCCC1CCO1 1e955eb10cd483780a445194599b29c9 [0,1,0,1,0,0|2,0,0]=4 21860 B13R1.560 FCCCCCNCCC1COC1 45f0daf05f64f05b56cede8fd723c9cf [0,1,0,1,0,0|2,0,0]=4 21861 B13R1.560 FCCCCCNCC[C@@H]1CCO1 562d464722e24123977b22cfb02a88ed [0,1,0,1,0,0|2,0,0]=4 21862 B13R1.560 FCCCCCOCCC1CCO1 a18ae17bd064c6020d4232941a91c841 [0,1,0,1,0,0|2,0,0]=4 21863 B13R1.560 FCCCCCOCCC1COC1 1a4dd1cabf98c5fc0c5d0c3e100bbdcb [0,1,0,1,0,0|2,0,0]=4 21864 B13R1.560 FCCCCCOCC[C@@H]1CCO1 808ecc10b9061c4ca93b48d75dfcf7de [0,1,0,1,0,0|2,0,0]=4 21865 B13R1.560 FCCCCCOCC[C@H]1CCO1 7e3507143b926b78c4004aed4571828e [0,1,0,1,0,0|2,0,0]=4 21866 B13R1.560 FCCCCOCCCC1COC1 7e55d122bcacc67b7e767aa602a3f3e9 [0,1,0,1,0,0|2,0,0]=4 21867 B13R1.560 OCCCCCCCNC1COC1 3ce2884aeddcaef08ce2dc51d645ad2d [0,1,0,1,0,0|2,0,0]=4 21868 B13R1.560 OCCCCCCNCC1CCO1 a3f317f577d2b528a48d3628a41048e5 [0,1,0,1,0,0|2,0,0]=4 21869 B13R1.560 OCCCCCCNCC1COC1 247d2baa99924957891a8fdef3c4544a [0,1,0,1,0,0|2,0,0]=4 21870 B13R1.560 OCCCCCCNC[C@@H]1CCO1 4dbf2036b3ac6c5ee5bdc9357c714666 [0,1,0,1,0,0|2,0,0]=4 21871 B13R1.560 OCCCCCCNC[C@H]1CCO1 a2a67c83a56bfea05f0eef0f51da138c [0,1,0,1,0,0|2,0,0]=4 21872 B13R1.560 OCCCCCNCCC1CCO1 1351542c2efe31e8fb1201ed080b67d0 [0,1,0,1,0,0|2,0,0]=4 21873 B13R1.560 OCCCCCNCCC1COC1 8243aee692d4f4bb667fb8a3a683f085 [0,1,0,1,0,0|2,0,0]=4 21874 B13R1.560 OCCCCCNCC[C@@H]1CCO1 1dc0971e761f16eaa1bd6905a357e4d7 [0,1,0,1,0,0|2,0,0]=4 21875 B13R1.560 SCCCCCCOCC1CCO1 2b999ede2e785c09cf773f0b9e1b10d3 [0,1,0,1,0,0|2,0,0]=4 21876 B13R1.560 SCCCCCCOCC1COC1 3cbcc9170097880a34e66db837b095e6 [0,1,0,1,0,0|2,0,0]=4 21877 B13R1.560 SCCCCCCOC[C@@H]1CCO1 5c40a8e6d9b0b8b857ea65eaa297614b [0,1,0,1,0,0|2,0,0]=4 21878 B13R1.560 SCCCCCCOC[C@H]1CCO1 d03479ecfec9962d02a4091c0f775cbc [0,1,0,1,0,0|2,0,0]=4 21879 B13R1.573 CCCCN1CCOCC1(C)CO 38cee8382fe740e8b1b75f962f248f84 [0,1,0,1,0,0|2,0,0]=4 21880 B13R1.581 C#CC(C)N1CCCC1CCCC e541f6b7290a7e39726ec11799fc024b [0,1,0,1,0,0|2,0,0]=4 21881 B13R1.581 C=CC(C)N1CCCC1CCCC 798bab50062b1b34a5ffde01f864d3cb [0,1,0,1,0,0|2,0,0]=4 21882 B13R1.581 CCCCC1CCCN1C(C)C#N f48c32360174d2512d254bca0a6b6056 [0,1,0,1,0,0|2,0,0]=4 21883 B13R1.581 CCCCC1CCCN1C(C)C=O 0842e7c8ee57b343d4aaa157304d9219 [0,1,0,1,0,0|1,0,1]=4 21884 B13R1.581 CCCCC1CCCN1C(C)CC 329300d003b7b240a35b744f33cfe839 [0,1,0,1,0,0|2,0,0]=4 21885 B13R1.581 CCCCC1CCCN1C(C)CO 7a6d7a3bc573d6bb6f5075f278db0407 [0,1,0,1,0,0|1,0,0]=3 21886 B13R1.581 CCCCC1CCCN1[C@@H](C)CO 034f033e3f0285f3e71b3abf06c2589d [0,1,0,1,0,0|1,0,0]=3 21887 B13R1.581 CCCCC1CCCN1[C@H](C)C=O 0b3d9539db4ac448d2163eff883ac13a [0,1,0,1,0,0|1,0,1]=4 21888 B13R1.581 CCCCC1CCCN1[C@H](C)CO 08c451931885e5c86e7a07d71ac45018 [0,1,0,1,0,0|1,0,0]=3 21889 B13R1.581 CCOCC1CCCN1C(C)CO 270b800707e457fc489e24f3842f2e64 [0,1,0,1,0,0|2,0,0]=4 21890 B13R1.581 CCOCC1CCCN1[C@@H](C)CO 8ab692ace21e48ed29ad5f13f8738562 [0,1,0,1,0,0|2,0,0]=4 21891 B13R1.581 CCOCC1CCCN1[C@H](C)CO f8aeb540966992e518fbcae1b9f5e4db [0,1,0,1,0,0|2,0,0]=4 21892 B13R1.581 CCOC[C@@H]1CCCN1C(C)CO 7b33a11a96b4e2501c56536438a52488 [0,1,0,1,0,0|2,0,0]=4 21893 B13R1.581 CCOC[C@@H]1CCCN1[C@@H](C)CO db66e09b5dac95d75a022b8370d66d8b [0,1,0,1,0,0|2,0,0]=4 21894 B13R1.581 CCOC[C@@H]1CCCN1[C@H](C)CO 04c159539e8abb56ac1b54a56cd296ff [0,1,0,1,0,0|2,0,0]=4 21895 B13R1.581 COCCC1CCCN1C(C)CO 8e3769d9b0ca7954b7e7757faf6c15db [0,1,0,1,0,0|2,0,0]=4 21896 B13R1.581 COCCC1CCCN1[C@@H](C)CO e2a073fe5c54e01347ae534a0bc12b0a [0,1,0,1,0,0|2,0,0]=4 21897 B13R1.581 COCCC1CCCN1[C@H](C)CO 318549212f4374b24ce3b7064c8a547b [0,1,0,1,0,0|2,0,0]=4 21898 B13R1.595 CC(CO)CCNCC1CCN1C d4f8671d49b552234d0f3719ff4c9a06 [0,1,0,1,0,0|2,0,0]=4 21899 B13R1.599 CC(C#N)COCC1CCCC1C c5d716f185c31dc35a70db7b1204c24b [0,1,0,1,0,0|2,0,0]=4 21900 B13R1.599 CC(CO)CCNC1CCCC1O 1b670e33897fb05b00807ff8d210a5d6 [0,1,0,1,0,0|2,0,0]=4 21901 B13R1.599 CC(CO)CCN[C@@H]1CCC[C@@H]1O 28917aeca28cb8fe8b08d7bf7b7a489b [0,1,0,1,0,0|2,0,0]=4 21902 B13R1.599 CC(CO)CCN[C@@H]1CCC[C@H]1O 66f47cb8fba934cc0e7ad8ed19004192 [0,1,0,1,0,0|2,0,0]=4 21903 B13R1.599 CC(CO)CCN[C@H]1CCC[C@@H]1O 044d3b9d47d559e50560b4b2c263cca3 [0,1,0,1,0,0|2,0,0]=4 21904 B13R1.599 CC(CO)CCN[C@H]1CCC[C@H]1O 0946bb1ee6c907f77aa8319b1907bc99 [0,1,0,1,0,0|2,0,0]=4 21905 B13R1.599 CC(CO)CNCC1CCCC1O 8c3e81fd2c46aea50f4e4096fcd0f941 [0,1,0,1,0,0|2,0,0]=4 21906 B13R1.599 CC(CO)CNCC1CCCN1C 3eec26c0a7aaeb40209dde69e9d8bf85 [0,1,0,1,0,0|2,0,0]=4 21907 B13R1.599 CC(CO)CNCC1COCC1C c25d93228ddf0d1176cda634ef69edb7 [0,1,0,1,0,0|2,0,0]=4 21908 B13R1.599 CC(CO)CNC[C@@H]1CCCN1C fc4615d0afe36b026d215c1e0b4a7d54 [0,1,0,1,0,0|2,0,0]=4 21909 B13R1.599 CC(CO)CNC[C@H]1CCCN1C 54d076cb225039b7b8ffbf4c9e14dc65 [0,1,0,1,0,0|2,0,0]=4 21910 B13R1.599 CC(CO)NCCC1CCCN1C cff44faf02a627609291186deb47f25b [0,1,0,1,0,0|2,0,0]=4 21911 B13R1.599 CC(CO)NCC[C@@H]1CCCN1C 7110167d763bbf294b1b7e28f5ddd441 [0,1,0,1,0,0|2,0,0]=4 21912 B13R1.599 CC(CO)NCC[C@H]1CCCN1C 78a40cf02d2c996d3fab68e615e9c4f8 [0,1,0,1,0,0|2,0,0]=4 21913 B13R1.599 CC1CCCC1COCC(O)CO b9375548abc35e06b49491601d940214 [0,1,0,1,0,0|1,0,0]=3 21914 B13R1.599 CC1CCCC1COC[C@@H](O)CO 1efacb7e204f76041ef4c7934615f3b8 [0,1,0,1,0,0|1,0,0]=3 21915 B13R1.599 CC1CCCC1COC[C@H](O)CO b8bc11cc394fa0381526e9052e5ccd09 [0,1,0,1,0,0|1,0,0]=3 21916 B13R1.599 CC1CCOC1COCC(O)CO 3ec393e65fe30ce65132de605ba929de [0,1,0,1,0,0|2,0,0]=4 21917 B13R1.599 CC1CCOC1COC[C@@H](O)CO 84c52631ca31e7d41695fc46373480e6 [0,1,0,1,0,0|2,0,0]=4 21918 B13R1.599 CC1CCOC1COC[C@H](O)CO b19a5868d2713419a31af9313e5ffaf1 [0,1,0,1,0,0|2,0,0]=4 21919 B13R1.599 CC1COCC1CNCC(O)CO 1ee9bcc047d9f55f1659a400efc9bf94 [0,1,0,1,0,0|2,0,0]=4 21920 B13R1.599 CC1COCC1CNC[C@@H](O)CO c82d711ce954b76b60e3cf1f5dba1d16 [0,1,0,1,0,0|2,0,0]=4 21921 B13R1.599 CC1COCC1CNC[C@H](C)CO f6634413e39211ab1ad8df20ca3d803f [0,1,0,1,0,0|2,0,0]=4 21922 B13R1.599 CC1COCC1CNC[C@H](O)CO 5bdf12153c81e0ee47f839cd721a750f [0,1,0,1,0,0|2,0,0]=4 21923 B13R1.599 CC1COCC1COCC(O)CO 795d30f808017a4c2c6c6fd116ff56a3 [0,1,0,1,0,0|2,0,0]=4 21924 B13R1.599 CC1COCC1COC[C@@H](O)CO 373a13c33279789b907a958aeefb40ab [0,1,0,1,0,0|2,0,0]=4 21925 B13R1.599 CC1COCC1COC[C@H](O)CO 3581c8f7c20230aeb44b5ec9b46d47ae [0,1,0,1,0,0|2,0,0]=4 21926 B13R1.599 CCC(C)CCOC1CCCC1C 6fb43c0f2af48173367a56001894a706 [0,1,0,1,0,0|2,0,0]=4 21927 B13R1.599 CCC(C)CCO[C@@H]1CCC[C@@H]1C a295686ece801d817301eda9f0abebe0 [0,1,0,1,0,0|2,0,0]=4 21928 B13R1.599 CCC(C)CCO[C@@H]1CCC[C@H]1C b45f82b08c9414430adf463b74921271 [0,1,0,1,0,0|2,0,0]=4 21929 B13R1.599 CCC(C)CCO[C@H]1CCC[C@@H]1C 34a4b1f5e605747ec76bd0be8b099cae [0,1,0,1,0,0|2,0,0]=4 21930 B13R1.599 CCC(C)CCO[C@H]1CCC[C@H]1C 86c4da953aef25ea68170db9b47d069e [0,1,0,1,0,0|2,0,0]=4 21931 B13R1.599 CCC(C)COCC1CCCC1C 418c542752ec1173ad0845cca9b5ac72 [0,1,0,1,0,0|2,0,0]=4 21932 B13R1.599 CCC(O)CNCC1CCCC1O 589de3d48ac0eea8647ad5482c67e8db [0,1,0,1,0,0|2,0,0]=4 21933 B13R1.599 CCC(O)CNCC1CCCN1C 8c8d5557bfcb1529fbce6ae265321c6d [0,1,0,1,0,0|2,0,0]=4 21934 B13R1.599 CCC(O)CNCC1COCC1C 90b3103d4aee1334e3bff24ef8d56dbb [0,1,0,1,0,0|2,0,0]=4 21935 B13R1.599 CCC(O)CNC[C@@H]1CCCN1C b5c39fe3d3df9539918e8d9e398dddff [0,1,0,1,0,0|2,0,0]=4 21936 B13R1.599 CCC(O)CNC[C@H]1CCCN1C 411fa6a91298933117eada5d9a7d29e3 [0,1,0,1,0,0|2,0,0]=4 21937 B13R1.599 CC[C@@H](C)COCC1CCCC1C e4aafd9f0b01c0b80fddf1628876a30c [0,1,0,1,0,0|2,0,0]=4 21938 B13R1.599 CC[C@@H](O)CNCC1COCC1C 9f73984d80ab0b3e91a78966124acaad [0,1,0,1,0,0|2,0,0]=4 21939 B13R1.599 CC[C@H](C)COCC1CCCC1C a669564aeaadbec12ee3074afa5184dc [0,1,0,1,0,0|2,0,0]=4 21940 B13R1.599 CN1CCCC1CNCC(O)CF d413f72fae2eb33c0f2c0061ecbbc546 [0,1,0,1,0,0|2,0,0]=4 21941 B13R1.599 CN1CCCC1CNCC(O)CO 0aebf610bf137d50be260ae03b20c296 [0,1,0,1,0,0|2,0,0]=4 21942 B13R1.599 CN1CCCC1CNC[C@@H](O)CO c184488d2c506ae9432ce8bd97452b43 [0,1,0,1,0,0|2,0,0]=4 21943 B13R1.599 CN1CCCC1CNC[C@H](O)CO 3fd417064d3ba1ca21b7c6a437260634 [0,1,0,1,0,0|2,0,0]=4 21944 B13R1.599 CN1CCCC1COCC(O)CO 32910bcf4e1ae5995ec1edddd8b356c4 [0,1,0,1,0,0|2,0,0]=4 21945 B13R1.599 CN1CCCC1COC[C@@H](O)CO 45a91ed0cc1f9d9fc1da939e172d3419 [0,1,0,1,0,0|2,0,0]=4 21946 B13R1.599 CN1CCCC1COC[C@H](O)CO 9ec0b919542ec4cbb3d98cf84dde9851 [0,1,0,1,0,0|2,0,0]=4 21947 B13R1.599 CN1CCC[C@@H]1CNCC(O)CF 50d5508335ba9b057174e9f48271b337 [0,1,0,1,0,0|2,0,0]=4 21948 B13R1.599 CN1CCC[C@@H]1CNCC(O)CO a5dfb473449f11fb2111f14d4a58a173 [0,1,0,1,0,0|2,0,0]=4 21949 B13R1.599 CN1CCC[C@@H]1CNC[C@@H](O)CO 7f35c0708cdd049c8dae6afb57e58657 [0,1,0,1,0,0|2,0,0]=4 21950 B13R1.599 CN1CCC[C@@H]1CNC[C@H](O)CO 4d7326dfe1ef312bf67c21f43190c708 [0,1,0,1,0,0|2,0,0]=4 21951 B13R1.599 CN1CCC[C@@H]1COCC(O)CO af63585901b9d1d29870e85ab6377867 [0,1,0,1,0,0|2,0,0]=4 21952 B13R1.599 CN1CCC[C@@H]1COC[C@@H](O)CO 012e38c1c8b7b70774d6b20f9a70182c [0,1,0,1,0,0|2,0,0]=4 21953 B13R1.599 CN1CCC[C@@H]1COC[C@H](O)CO dc3a25a25ad652d95a74247a062f7bfa [0,1,0,1,0,0|2,0,0]=4 21954 B13R1.599 CN1CCC[C@H]1CNCC(O)CF d4b71d52afb672ecca68c4c17caf09b6 [0,1,0,1,0,0|2,0,0]=4 21955 B13R1.599 CN1CCC[C@H]1CNCC(O)CO 2309c8a2461884b898b9b90f3c180cb5 [0,1,0,1,0,0|2,0,0]=4 21956 B13R1.599 CN1CCC[C@H]1CNC[C@@H](O)CO 8dfb9eb69f417a185b98e879cd8da30c [0,1,0,1,0,0|2,0,0]=4 21957 B13R1.599 CN1CCC[C@H]1CNC[C@H](O)CO e992ddd8442e8a8ec80d2aa2d4cca205 [0,1,0,1,0,0|2,0,0]=4 21958 B13R1.599 CN1CCC[C@H]1COCC(O)CO 5b8713eb70d8752b1dc9c38cb3dcd517 [0,1,0,1,0,0|2,0,0]=4 21959 B13R1.599 CN1CCC[C@H]1COC[C@@H](O)CO 268a4cc734a980dc7faca7f4416070d1 [0,1,0,1,0,0|2,0,0]=4 21960 B13R1.599 CN1CCC[C@H]1COC[C@H](O)CO 8e8e26ff65498d9d5013f012a97aa2d0 [0,1,0,1,0,0|2,0,0]=4 21961 B13R1.599 COC(C)CNCC1CCCC1O 09b1e3042e5c957cc04bf8dbbe91f8a9 [0,1,0,1,0,0|2,0,0]=4 21962 B13R1.599 COC(C)CNCC1CCCN1C 73b413de34b37cf7abcffc40399192ec [0,1,0,1,0,0|2,0,0]=4 21963 B13R1.599 COC(C)CNC[C@@H]1CCCN1C f071aed452bc59cf413ad5dc72c7d403 [0,1,0,1,0,0|2,0,0]=4 21964 B13R1.599 COC(C)CNC[C@H]1CCCN1C 697f379621fedb153f723557cc194fe0 [0,1,0,1,0,0|2,0,0]=4 21965 B13R1.599 COC(C)COCC1CCCC1C eb4a9200c9a5b0970a0f6327efcc1359 [0,1,0,1,0,0|1,0,0]=3 21966 B13R1.599 COC(C)COCC1CCCN1C 941bacb92024b1d19afe657664fe44f3 [0,1,0,1,0,0|2,0,0]=4 21967 B13R1.599 COC(C)COCC1COCC1C 3ade3e4c7a8eedb7841704b39e2959d5 [0,1,0,1,0,0|2,0,0]=4 21968 B13R1.599 COC(C)COCC1OCCC1C 86636b97d5461c339767061a6a814024 [0,1,0,1,0,0|2,0,0]=4 21969 B13R1.599 COC(C)COC[C@@H]1CCCN1C b360e5974425c30b88611d3030bd544c [0,1,0,1,0,0|2,0,0]=4 21970 B13R1.599 COC(C)COC[C@@H]1CCC[C@H]1F 86ab4ed8fc4713b70eecf1d1b50c2a33 [0,1,0,1,0,0|2,0,0]=4 21971 B13R1.599 COC(C)COC[C@@H]1CCO[C@@H]1C 0bb0513b366ce399aa2176279ab31188 [0,1,0,1,0,0|2,0,0]=4 21972 B13R1.599 COC(C)COC[C@H]1CCCN1C 10db783bc15a9e347fa0d009fc65dd8e [0,1,0,1,0,0|2,0,0]=4 21973 B13R1.599 CO[C@@H](C)CNCC1CCCC1O 970c6fce75292396fc16b4e3cac5e1d8 [0,1,0,1,0,0|2,0,0]=4 21974 B13R1.599 CO[C@@H](C)CNCC1CCCN1C ca8f2219a220272df235d25961caeb88 [0,1,0,1,0,0|2,0,0]=4 21975 B13R1.599 CO[C@@H](C)CNCC1COCC1C 8aa612ccac005f67a89a3fba4d0c18cb [0,1,0,1,0,0|2,0,0]=4 21976 B13R1.599 CO[C@@H](C)CNC[C@@H]1CCCN1C c94570e5f4cfd6d544f8bd5e5134e108 [0,1,0,1,0,0|2,0,0]=4 21977 B13R1.599 CO[C@@H](C)CNC[C@H]1CCCN1C a0c8527ee340302d27b1e010d027bb34 [0,1,0,1,0,0|2,0,0]=4 21978 B13R1.599 CO[C@@H](C)COCC1CCCC1C 25d762b58d73c0578dc0d42d57245a77 [0,1,0,1,0,0|1,0,0]=3 21979 B13R1.599 CO[C@@H](C)COCC1CCCN1C c0311264908653d4faaf26d832cfad2e [0,1,0,1,0,0|2,0,0]=4 21980 B13R1.599 CO[C@@H](C)COCC1COCC1C b8ac8d4a3ab573983b9e2e230efa5798 [0,1,0,1,0,0|2,0,0]=4 21981 B13R1.599 CO[C@@H](C)COCC1OCCC1C 4277aca7e728d596788befc9cdba8880 [0,1,0,1,0,0|2,0,0]=4 21982 B13R1.599 CO[C@@H](C)COC[C@@H]1CCCN1C ba97fe4c5c95ffecf8ec2a484644ca29 [0,1,0,1,0,0|2,0,0]=4 21983 B13R1.599 CO[C@@H](C)COC[C@@H]1CCC[C@H]1F 8145862a53e3f9c254eeaebd23d23d95 [0,1,0,1,0,0|2,0,0]=4 21984 B13R1.599 CO[C@@H](C)COC[C@@H]1CCO[C@@H]1C cdf46cf1e363ddb46c94742669157510 [0,1,0,1,0,0|2,0,0]=4 21985 B13R1.599 CO[C@@H](C)COC[C@H]1CCCN1C 59d5d9bdb5d1c6958f05d3aa60c6fec6 [0,1,0,1,0,0|2,0,0]=4 21986 B13R1.599 CO[C@H](C)CNCC1CCCC1O f63fe0f48743c1b37c6439bc91a00631 [0,1,0,1,0,0|2,0,0]=4 21987 B13R1.599 CO[C@H](C)CNCC1CCCN1C 95dc613b61acae41cf277a3732860094 [0,1,0,1,0,0|2,0,0]=4 21988 B13R1.599 CO[C@H](C)CNCC1COCC1C e1548f45627b688d251c51bc3927d4d2 [0,1,0,1,0,0|2,0,0]=4 21989 B13R1.599 CO[C@H](C)CNC[C@@H]1CCCN1C 64649ff7b60cca8eac2f04bbf517dc25 [0,1,0,1,0,0|2,0,0]=4 21990 B13R1.599 CO[C@H](C)CNC[C@H]1CCCN1C 757e4f71e8237ad0906f7ea7c8d6f259 [0,1,0,1,0,0|2,0,0]=4 21991 B13R1.599 CO[C@H](C)COCC1CCCC1C 2e192230dfd81422ba883570262f4a8c [0,1,0,1,0,0|1,0,0]=3 21992 B13R1.599 CO[C@H](C)COCC1CCCN1C 5cd575cb2baa7bc2c8f4eb2ed95c4601 [0,1,0,1,0,0|2,0,0]=4 21993 B13R1.599 CO[C@H](C)COCC1COCC1C 64d846f9d3ec0c3b5bb4ab8024497bf9 [0,1,0,1,0,0|2,0,0]=4 21994 B13R1.599 CO[C@H](C)COCC1OCCC1C 8fd0ccb75c74ce460bbdf1c38ce7894b [0,1,0,1,0,0|2,0,0]=4 21995 B13R1.599 CO[C@H](C)COC[C@@H]1CCCN1C 5667cefc5b4bb811fd5a9f33bcc5fc31 [0,1,0,1,0,0|2,0,0]=4 21996 B13R1.599 CO[C@H](C)COC[C@@H]1CCC[C@H]1F dbe28acb564ba6c5a4659204f618ccb9 [0,1,0,1,0,0|2,0,0]=4 21997 B13R1.599 CO[C@H](C)COC[C@@H]1CCO[C@@H]1C 13a68c5ab4222ae88496c03d2ed26179 [0,1,0,1,0,0|2,0,0]=4 21998 B13R1.599 CO[C@H](C)COC[C@H]1CCCN1C 85690c6c0b9aa22f9946b327fdc08053 [0,1,0,1,0,0|2,0,0]=4 21999 B13R1.599 C[C@@H](CO)CCNC1CCCC1O d092834b89669ddfa7d052ffcff9e388 [0,1,0,1,0,0|2,0,0]=4 22000 B13R1.599 C[C@@H](CO)CCN[C@@H]1CCC[C@H]1O 5abb8a66ec55d3530833d8aae14ff1d3 [0,1,0,1,0,0|2,0,0]=4 22001 B13R1.599 C[C@@H](CO)CCN[C@H]1CCC[C@@H]1O e2ce51a2ee2762a4e186312c14420d53 [0,1,0,1,0,0|2,0,0]=4 22002 B13R1.599 C[C@@H](CO)CNCC1CCCC1O b43547d797b03723af00805a5512968c [0,1,0,1,0,0|2,0,0]=4 22003 B13R1.599 C[C@@H](CO)CNCC1CCCN1C 362a3e54a598d701a8927846ee10f6cd [0,1,0,1,0,0|2,0,0]=4 22004 B13R1.599 C[C@@H](CO)CNC[C@@H]1CCCN1C d8acbdeaa3f03ae2b76b7d551b8f9772 [0,1,0,1,0,0|2,0,0]=4 22005 B13R1.599 C[C@@H](CO)CNC[C@H]1CCCN1C ef67930cb7cb2660ef81f862b860750d [0,1,0,1,0,0|2,0,0]=4 22006 B13R1.599 C[C@@H](CO)NCCC1CCCN1C f8722f56052292bc52b87635800b6250 [0,1,0,1,0,0|2,0,0]=4 22007 B13R1.599 C[C@@H](CO)NCC[C@@H]1CCCN1C 26579b8e8b325fa4ca84d1d7c1b62783 [0,1,0,1,0,0|2,0,0]=4 22008 B13R1.599 C[C@@H](CO)NCC[C@H]1CCCN1C c9a1fd787b3e97908e37accc25bb0d2f [0,1,0,1,0,0|2,0,0]=4 22009 B13R1.599 C[C@H](CO)CNCC1CCCC1O 3a0de725d1e78c716771ce93ac0eea37 [0,1,0,1,0,0|2,0,0]=4 22010 B13R1.599 C[C@H](CO)CNCC1CCCN1C 0c77eb1dc3ea2d947e5b97cebd0fbabf [0,1,0,1,0,0|2,0,0]=4 22011 B13R1.599 C[C@H](CO)CNC[C@@H]1CCCN1C ba119201f1743600aa3ed50235214f58 [0,1,0,1,0,0|2,0,0]=4 22012 B13R1.599 C[C@H](CO)CNC[C@H]1CCCN1C 7a5c384053079c7f8f766e2fa0fe37dc [0,1,0,1,0,0|2,0,0]=4 22013 B13R1.599 C[C@H](CO)NCCC1CCCN1C 3764d2a125266174b34f17c62d1b6694 [0,1,0,1,0,0|2,0,0]=4 22014 B13R1.599 C[C@H](CO)NCC[C@@H]1CCCN1C e569c5606a4982617996b23ce2cf6a8f [0,1,0,1,0,0|2,0,0]=4 22015 B13R1.599 C[C@H](CO)NCC[C@H]1CCCN1C 3337797bfc8c35dbc7873a37d7b378c4 [0,1,0,1,0,0|2,0,0]=4 22016 B13R1.599 C[C@H]1OCC[C@H]1COCC(O)CO 3f36b6ef9e513cd7a08c2b57ad3f5267 [0,1,0,1,0,0|2,0,0]=4 22017 B13R1.599 C[C@H]1OCC[C@H]1COC[C@@H](O)CO f9fa21c854f04846325152199f453754 [0,1,0,1,0,0|2,0,0]=4 22018 B13R1.599 C[C@H]1OCC[C@H]1COC[C@H](O)CO 739d3e51a25b816fb1cfa7fa5ff7540a [0,1,0,1,0,0|2,0,0]=4 22019 B13R1.599 OC(CF)CNCC1CCCC1O 2f9d90467581c6b9e85d9e6d13acc2eb [0,1,0,1,0,0|2,0,0]=4 22020 B13R1.599 OCC(O)CCNC1CCCC1O e322ab684267f597a5aebd064f303b69 [0,1,0,1,0,0|2,0,0]=4 22021 B13R1.599 OCC(O)CCN[C@@H]1CCC[C@H]1O 101ac84dd195905afb9f476f9b4cecbe [0,1,0,1,0,0|2,0,0]=4 22022 B13R1.599 OCC(O)CCN[C@H]1CCC[C@@H]1O d8e9870d0b95155800467cabf219d0d5 [0,1,0,1,0,0|2,0,0]=4 22023 B13R1.599 OCC(O)CNCC1CCCC1O a2377f5842f86fd0c0998c3bfb7db842 [0,1,0,1,0,0|2,0,0]=4 22024 B13R1.599 OCC(O)COC[C@@H]1CCC[C@H]1F a49fe60766d11ac63878c0ed0007de58 [0,1,0,1,0,0|2,0,0]=4 22025 B13R1.599 OC[C@@H](O)CNCC1CCCC1O 2751febf457afe257db97ebd3ad644b9 [0,1,0,1,0,0|2,0,0]=4 22026 B13R1.599 OC[C@@H](O)COC[C@@H]1CCC[C@H]1F f201e1881a82dd0f0633cfd72aba483c [0,1,0,1,0,0|2,0,0]=4 22027 B13R1.599 OC[C@H](O)CNCC1CCCC1O 5f00d19fec1664246c8abaf4ae17bf5e [0,1,0,1,0,0|2,0,0]=4 22028 B13R1.599 OC[C@H](O)COC[C@@H]1CCC[C@H]1F 459086744a9168ffedc1396aa7eba1ea [0,1,0,1,0,0|2,0,0]=4 22029 B13R1.611 CC(CO)N1CCCCCC1CO e833f223f3271a9f356e90c0bc67b19d [0,1,0,1,0,0|2,0,0]=4 22030 B13R1.611 C[C@@H](CO)N1CCCCCC1CO bd1c46d2683cd7181b52abb11e556636 [0,1,0,1,0,0|2,0,0]=4 22031 B13R1.611 C[C@H](CO)N1CCCCCC1CO fd91e2c78cbcccf92c2939a299f54c43 [0,1,0,1,0,0|2,0,0]=4 22032 B13R1.613 CC(CO)CCN1CCCC1CO 13a8738a27ba4a34ed017628b56bd8db [0,1,0,1,0,0|2,0,0]=4 22033 B13R1.613 CC(CO)CCN1CCC[C@@H]1CF 1a3657abb3691fd2d442d9fbee1af55d [0,1,0,1,0,0|2,0,0]=4 22034 B13R1.613 CC(CO)CCN1CCC[C@@H]1CO 6c6e83d075e0c78a22118040fa0d301f [0,1,0,1,0,0|2,0,0]=4 22035 B13R1.613 CC(CO)CCN1CCC[C@H]1CF 564613c06d877838ae9c3c640d2b564b [0,1,0,1,0,0|2,0,0]=4 22036 B13R1.613 CC(CO)CCN1CCC[C@H]1CO d35bb6956ee8a318d54b145b97a25186 [0,1,0,1,0,0|2,0,0]=4 22037 B13R1.613 CC(CO)CN[C@H]1CCC[C@H]1CO 9cc64851f9da5c907722cc36613b02a3 [0,1,0,1,0,0|2,0,0]=4 22038 B13R1.613 CCC(C)CCN1CCCC1CC 74d85edc41985ebb1073d1bead41ecc3 [0,1,0,1,0,0|2,0,0]=4 22039 B13R1.613 CCC(C)CCN1CCC[C@H]1CC a6ddac470f71610346aaddd3a3c97866 [0,1,0,1,0,0|2,0,0]=4 22040 B13R1.613 CCC(C)CN[C@@H]1CCC[C@H]1CC fd2e5d1b4674700fb10c6533c18fe611 [0,1,0,1,0,0|2,0,0]=4 22041 B13R1.613 CCC(O)CNC1CCCC1OC badb8498a0114d404b7a0bc961e4b5a0 [0,1,0,1,0,0|2,0,0]=4 22042 B13R1.613 CCC(O)CN[C@@H]1CCC[C@H]1CC 5b42b527ab3ef918d45a4b87b41b9ec5 [0,1,0,1,0,0|1,0,0]=3 22043 B13R1.613 CCC(O)CN[C@@H]1CCC[C@H]1OC 3a09abf00f240419b63a62fcf18f8b92 [0,1,0,1,0,0|2,0,0]=4 22044 B13R1.613 CCC(O)CN[C@H]1CCC[C@@H]1OC 7104775c2572645af56d0845950904d2 [0,1,0,1,0,0|2,0,0]=4 22045 B13R1.613 CCC(O)CN[C@H]1CCC[C@H]1CO f903707d8809e770088bafd53474dc86 [0,1,0,1,0,0|2,0,0]=4 22046 B13R1.613 CCC(O)CN[C@H]1CCC[C@H]1OC 641401b4d0985078905d5dee66e055a6 [0,1,0,1,0,0|2,0,0]=4 22047 B13R1.613 CCC1CCCN1CCC(C)CO 8580df79df5df2d3c95a81091b513927 [0,1,0,1,0,0|1,0,0]=3 22048 B13R1.613 CCN1CCCC1CNC(C)CO 4721bb07d50d30cd8a5cd389c264c69a [0,1,0,1,0,0|2,0,0]=4 22049 B13R1.613 CCN1CCCC1CN[C@@H](C)CO bc19ee04f3335422ac391cf73a576d85 [0,1,0,1,0,0|2,0,0]=4 22050 B13R1.613 CCN1CCCC1CN[C@H](C)CO 2454e0bc8ffef0d0e59e170657717ea7 [0,1,0,1,0,0|2,0,0]=4 22051 B13R1.613 CCN1CCC[C@@H]1CNC(C)CO 86bc47ff377e60f55778d4336f83c193 [0,1,0,1,0,0|2,0,0]=4 22052 B13R1.613 CCN1CCC[C@@H]1CN[C@@H](C)CO c35a564dd04f49a46776e6dd307e0c4b [0,1,0,1,0,0|2,0,0]=4 22053 B13R1.613 CCN1CCC[C@@H]1CN[C@H](C)CO b2a4f06a9836fa2d89d3acf5d829fdf0 [0,1,0,1,0,0|2,0,0]=4 22054 B13R1.613 CCN1CCC[C@H]1CNC(C)CO de7b9dab821580456723f5262cdaf31f [0,1,0,1,0,0|2,0,0]=4 22055 B13R1.613 CCN1CCC[C@H]1CN[C@@H](C)CO 971263588c2af8c5e290c77c1ae97489 [0,1,0,1,0,0|2,0,0]=4 22056 B13R1.613 CCN1CCC[C@H]1CN[C@H](C)CO f95fe8bd8110e1906aa24d1ca2a406b6 [0,1,0,1,0,0|2,0,0]=4 22057 B13R1.613 CC[C@@H](C)CN[C@@H]1CCC[C@H]1CC 55abcbc5c869b6412a006a854bea677d [0,1,0,1,0,0|2,0,0]=4 22058 B13R1.613 CC[C@@H]1CCCN1CCC(C)CO 0306f8fb90a105208a3fddaec43f6d29 [0,1,0,1,0,0|1,0,0]=3 22059 B13R1.613 CC[C@@H]1CCC[C@H]1NCC(C)C#N c5ac7a2e5fc6309c010914a38f449aa6 [0,1,0,1,0,0|2,0,0]=4 22060 B13R1.613 CC[C@@H]1CCC[C@H]1NCC(C)CO 9dc7a4c37374482a8cd0a8ab57b3db61 [0,1,0,1,0,0|1,0,0]=3 22061 B13R1.613 CC[C@@H]1CCC[C@H]1NCC(C)OC 5dcdbc5117f95faae354eb4a55f02efe [0,1,0,1,0,0|1,0,0]=3 22062 B13R1.613 CC[C@@H]1CCC[C@H]1NCC(O)CF 9473463ef91fe75bcd7c7aca371c1774 [0,1,0,1,0,0|1,0,0]=3 22063 B13R1.613 CC[C@@H]1CCC[C@H]1NCC(O)CO bc1a1f3951ae9310cb613e9c4d58e309 [0,1,0,1,0,0|1,0,0]=3 22064 B13R1.613 CC[C@@H]1CCC[C@H]1NC[C@@H](C)CO 166ecef7d7a557e5b8fb62ed386dd272 [0,1,0,1,0,0|1,0,0]=3 22065 B13R1.613 CC[C@@H]1CCC[C@H]1NC[C@@H](C)OC c50bbb85eea03e8b247992534cb6a4af [0,1,0,1,0,0|1,0,0]=3 22066 B13R1.613 CC[C@@H]1CCC[C@H]1NC[C@@H](O)CO 9c6c42bdf1994a950922f379877b446e [0,1,0,1,0,0|1,0,0]=3 22067 B13R1.613 CC[C@@H]1CCC[C@H]1NC[C@H](C)CO 7992487bc68984c6868382bac6bf7fab [0,1,0,1,0,0|1,0,0]=3 22068 B13R1.613 CC[C@@H]1CCC[C@H]1NC[C@H](C)OC 9bdc485b06e330d766cb7f1932b3a0c8 [0,1,0,1,0,0|1,0,0]=3 22069 B13R1.613 CC[C@@H]1CCC[C@H]1NC[C@H](O)CO 30eb31d918296dd86173ac50cf2502a1 [0,1,0,1,0,0|1,0,0]=3 22070 B13R1.613 CC[C@H](C)CN[C@@H]1CCC[C@H]1CC b1bae74e0b24f752b283aff9d9abf956 [0,1,0,1,0,0|2,0,0]=4 22071 B13R1.613 COC(C)CNC1CCCC1OC f29ec148ef337ff7802ce3ec4a1d4e81 [0,1,0,1,0,0|2,0,0]=4 22072 B13R1.613 COC(C)CN[C@@H]1CCC[C@H]1OC c89845ad22d162ae02fc161e96be2b22 [0,1,0,1,0,0|2,0,0]=4 22073 B13R1.613 COC(C)CN[C@H]1CCC[C@@H]1OC 1514c6010bccd3126d914a639e44f35e [0,1,0,1,0,0|2,0,0]=4 22074 B13R1.613 COC(C)CN[C@H]1CCC[C@H]1CO 75c1282f8dfe59ab442c88df27425f61 [0,1,0,1,0,0|2,0,0]=4 22075 B13R1.613 COC(C)CN[C@H]1CCC[C@H]1OC 1803edc62e367c9f858c2a3aed60ad26 [0,1,0,1,0,0|2,0,0]=4 22076 B13R1.613 COC1CCCC1NCC(C)CO be82c4968ef64366c0f4ae119879eeb7 [0,1,0,1,0,0|2,0,0]=4 22077 B13R1.613 COC1CCCC1NCC(O)CF 31dc6f0c00fc0a209dac9596b6dbb4b1 [0,1,0,1,0,0|2,0,0]=4 22078 B13R1.613 COC1CCCC1NCC(O)CO f863b4d278f049d1a1033238d8c91b70 [0,1,0,1,0,0|2,0,0]=4 22079 B13R1.613 COC1CCCC1NC[C@@H](C)CO bcb0139ac8153aeb99a1bf2f303c7299 [0,1,0,1,0,0|2,0,0]=4 22080 B13R1.613 COC1CCCC1NC[C@@H](C)OC 2bbe219c73944f76484830dac0b371b1 [0,1,0,1,0,0|2,0,0]=4 22081 B13R1.613 COC1CCCC1NC[C@@H](O)CO 1658050acc8db3f0a539013f3c15340f [0,1,0,1,0,0|2,0,0]=4 22082 B13R1.613 COC1CCCC1NC[C@H](C)CO 4deab5b7f50ab5216d377217023f41b5 [0,1,0,1,0,0|2,0,0]=4 22083 B13R1.613 COC1CCCC1NC[C@H](C)OC 0b13162eb93c3bdcdeb0366215b3136f [0,1,0,1,0,0|2,0,0]=4 22084 B13R1.613 COC1CCCC1NC[C@H](O)CO 6f7da9122e2781658aaeaf59ad77763b [0,1,0,1,0,0|2,0,0]=4 22085 B13R1.613 COC1CCCN1CCC(C)CO 16b51e0eccec5c7d8d7d6f8b2f0b6d78 [0,1,0,1,0,0|2,0,0]=4 22086 B13R1.613 CO[C@@H](C)CN[C@@H]1CCC[C@H]1OC f8405cee8f37b174c2864d77d8d665e9 [0,1,0,1,0,0|2,0,0]=4 22087 B13R1.613 CO[C@@H](C)CN[C@H]1CCC[C@H]1CO d5c668814742e9dbf4b3bf83bf0ed91c [0,1,0,1,0,0|2,0,0]=4 22088 B13R1.613 CO[C@@H](C)CN[C@H]1CCC[C@H]1OC 0ef2339c2987d0b9a4b7c9bd147851d3 [0,1,0,1,0,0|2,0,0]=4 22089 B13R1.613 CO[C@@H]1CCC[C@@H]1NCC(C)CO 81db729795b88f5e3fcba49c0bd4b152 [0,1,0,1,0,0|2,0,0]=4 22090 B13R1.613 CO[C@@H]1CCC[C@@H]1NCC(O)CF 8f4e757bad1cb67eb00f4b61d43cf483 [0,1,0,1,0,0|2,0,0]=4 22091 B13R1.613 CO[C@@H]1CCC[C@@H]1NCC(O)CO b67a104c67fdd3d07237bb5aa33b1b39 [0,1,0,1,0,0|2,0,0]=4 22092 B13R1.613 CO[C@@H]1CCC[C@@H]1NC[C@@H](C)CO f43be0bf83a3a81f9d10c7c839e040ed [0,1,0,1,0,0|2,0,0]=4 22093 B13R1.613 CO[C@@H]1CCC[C@@H]1NC[C@@H](O)CO 3e870ae2d1917ed47dcbb109e90b56a3 [0,1,0,1,0,0|2,0,0]=4 22094 B13R1.613 CO[C@@H]1CCC[C@@H]1NC[C@H](C)CO 29f479e1510e5e255adcdfe8cab29d8d [0,1,0,1,0,0|2,0,0]=4 22095 B13R1.613 CO[C@@H]1CCC[C@@H]1NC[C@H](O)CO 490ca678b6aadf1676669eb48f9dd432 [0,1,0,1,0,0|2,0,0]=4 22096 B13R1.613 CO[C@@H]1CCC[C@H]1NCC(C)CO a9c935e85e25b614cee210162657db92 [0,1,0,1,0,0|2,0,0]=4 22097 B13R1.613 CO[C@@H]1CCC[C@H]1NCC(O)CF 8e99a5efae9e874a2036609722d92ac9 [0,1,0,1,0,0|2,0,0]=4 22098 B13R1.613 CO[C@@H]1CCC[C@H]1NCC(O)CO 1d6cceae4d4047d584d9e224f5083499 [0,1,0,1,0,0|2,0,0]=4 22099 B13R1.613 CO[C@@H]1CCC[C@H]1NC[C@@H](C)CO 6c829940595ac9e51883b7afcfb1c4a4 [0,1,0,1,0,0|2,0,0]=4 22100 B13R1.613 CO[C@@H]1CCC[C@H]1NC[C@@H](O)CO 2b6966f8e7bff1af48e40bca3440831b [0,1,0,1,0,0|2,0,0]=4 22101 B13R1.613 CO[C@@H]1CCC[C@H]1NC[C@H](C)CO f778c32bd7a25d9897f7d99d1799f008 [0,1,0,1,0,0|2,0,0]=4 22102 B13R1.613 CO[C@@H]1CCC[C@H]1NC[C@H](O)CO 7fa2c4cdf7e9d337e7433714b19ccc1f [0,1,0,1,0,0|2,0,0]=4 22103 B13R1.613 CO[C@H](C)CN[C@@H]1CCC[C@H]1OC e35f0b5a2b496dbc188b055c250c26d9 [0,1,0,1,0,0|2,0,0]=4 22104 B13R1.613 CO[C@H](C)CN[C@H]1CCC[C@@H]1OC e29d92177b634eb48212465d115fab53 [0,1,0,1,0,0|2,0,0]=4 22105 B13R1.613 CO[C@H](C)CN[C@H]1CCC[C@H]1CO 4c3d188356408e0628064be2783a540e [0,1,0,1,0,0|2,0,0]=4 22106 B13R1.613 CO[C@H](C)CN[C@H]1CCC[C@H]1OC 83de47842cf720032bc750ac919afb21 [0,1,0,1,0,0|2,0,0]=4 22107 B13R1.613 CO[C@H]1CCC[C@@H]1NCC(C)CO 4a5fd4c4e9238e4e0391978cdc544a18 [0,1,0,1,0,0|2,0,0]=4 22108 B13R1.613 CO[C@H]1CCC[C@@H]1NCC(O)CF 5e9d3c3d6da37c1b3c35fde4b5c3c79d [0,1,0,1,0,0|2,0,0]=4 22109 B13R1.613 CO[C@H]1CCC[C@@H]1NCC(O)CO d61bc15be71b48f302037949b4485004 [0,1,0,1,0,0|2,0,0]=4 22110 B13R1.613 CO[C@H]1CCC[C@@H]1NC[C@@H](C)CO 8e85ee3fa13f4aab90fded20e491c1cb [0,1,0,1,0,0|2,0,0]=4 22111 B13R1.613 CO[C@H]1CCC[C@@H]1NC[C@@H](O)CO 4fac3f997aacb5a7bf9a6f0f56d42daf [0,1,0,1,0,0|2,0,0]=4 22112 B13R1.613 CO[C@H]1CCC[C@@H]1NC[C@H](C)CO d7ba15320029e8b01a0487e2fd87bf32 [0,1,0,1,0,0|2,0,0]=4 22113 B13R1.613 CO[C@H]1CCC[C@@H]1NC[C@H](C)OC 56d550ba96b35f07fedc573b0d9aa253 [0,1,0,1,0,0|2,0,0]=4 22114 B13R1.613 CO[C@H]1CCC[C@@H]1NC[C@H](O)CO e3bfbfad609a9c1e7fdb8bead414b7b6 [0,1,0,1,0,0|2,0,0]=4 22115 B13R1.613 C[C@@H](CO)CN[C@H]1CCC[C@H]1CO 9a85ec49ecaef9ec5fc412605e97d088 [0,1,0,1,0,0|2,0,0]=4 22116 B13R1.613 C[C@H](CO)CN[C@H]1CCC[C@H]1CO 971b8de59fe0aec7a00941587cf88010 [0,1,0,1,0,0|2,0,0]=4 22117 B13R1.613 OCC(O)CN[C@H]1CCC[C@H]1CO f54c5f38445c4bb9e940fe010148df14 [0,1,0,1,0,0|2,0,0]=4 22118 B13R1.613 OC[C@@H](O)CN[C@H]1CCC[C@H]1CO 483da58f8fa3efd7f706c09a91e46389 [0,1,0,1,0,0|2,0,0]=4 22119 B13R1.613 OC[C@@H]1CCC[C@@H]1NCC(O)CF 743e5f2754d7f2cd4ab211e99c2cbe8b [0,1,0,1,0,0|2,0,0]=4 22120 B13R1.613 OC[C@H](O)CN[C@H]1CCC[C@H]1CO b133cf4ef40bb356fa4535d38c094f47 [0,1,0,1,0,0|2,0,0]=4 22121 B13R1.619 CC(CO)CCNCC1CC1CO d8e39032dad9e15be1e8160b1b108c09 [0,1,0,1,0,0|2,0,0]=4 22122 B13R1.648 COC(C)COCC1CCC1OC 0813065fcc7455651a4aa15cf0223dc1 [0,1,0,1,0,0|2,0,0]=4 22123 B13R1.648 COC(C)COC[C@@H]1CC[C@H]1OC 86350f0040d77a1d4086ce5cf76a5fc0 [0,1,0,1,0,0|2,0,0]=4 22124 B13R1.648 COC(C)COC[C@H]1CC[C@H]1OC 146b5a4ed37980f6699daa6d54f86ed5 [0,1,0,1,0,0|2,0,0]=4 22125 B13R1.648 COC1CCC1COCC(O)CO 9d17ab6688d3c22b35e1fb7e5f40545a [0,1,0,1,0,0|2,0,0]=4 22126 B13R1.648 COC1CCC1COC[C@@H](C)OC 7481ee3f0942a316a1e316ca067cc0ed [0,1,0,1,0,0|2,0,0]=4 22127 B13R1.648 COC1CCC1COC[C@@H](O)CO a932931cb8a0ed95501d219d2e503868 [0,1,0,1,0,0|2,0,0]=4 22128 B13R1.648 COC1CCC1COC[C@H](C)OC 11bd0405b9a39f121632c49f4430ed52 [0,1,0,1,0,0|2,0,0]=4 22129 B13R1.648 COC1CCC1COC[C@H](O)CO 5eab04a75da62fba80152d4133e7bc51 [0,1,0,1,0,0|2,0,0]=4 22130 B13R1.648 COC1CCC1NCCC(C)CO a82aa00974d818a7d96ceac8c809ff7b [0,1,0,1,0,0|2,0,0]=4 22131 B13R1.648 CO[C@@H](C)COC[C@@H]1CC[C@H]1OC e51344e8013d6e87663daefd67c29f36 [0,1,0,1,0,0|2,0,0]=4 22132 B13R1.648 CO[C@@H](C)COC[C@H]1CC[C@H]1OC 5c238d7a45f11d89b4af3fd6bc5b5212 [0,1,0,1,0,0|2,0,0]=4 22133 B13R1.648 CO[C@@H]1CC[C@@H]1COCC(O)CO e43e79674cf61da6c5ecba07afaa8d56 [0,1,0,1,0,0|2,0,0]=4 22134 B13R1.648 CO[C@@H]1CC[C@@H]1COC[C@@H](O)CO 4451c9ff2f819e610c5cfdc89dbb45da [0,1,0,1,0,0|2,0,0]=4 22135 B13R1.648 CO[C@@H]1CC[C@@H]1COC[C@H](O)CO cfcb3d8663d0cc6dbbb236b4c71a9901 [0,1,0,1,0,0|2,0,0]=4 22136 B13R1.648 CO[C@@H]1CC[C@@H]1NCCC(C)CO 27158ce8a8811206e6fc995e35df9cdb [0,1,0,1,0,0|2,0,0]=4 22137 B13R1.648 CO[C@@H]1CC[C@H]1COCC(O)CO ded3a9da1d679fd8c97bc974591f0ef4 [0,1,0,1,0,0|2,0,0]=4 22138 B13R1.648 CO[C@@H]1CC[C@H]1COC[C@@H](O)CO afb5cc5e28078ea07082346f8e76744c [0,1,0,1,0,0|2,0,0]=4 22139 B13R1.648 CO[C@@H]1CC[C@H]1COC[C@H](O)CO 144bbac3cfb843e2a1435a82ba350131 [0,1,0,1,0,0|2,0,0]=4 22140 B13R1.648 CO[C@@H]1CC[C@H]1NCCC(C)CO 4f48b0dea3c49ac5e3a15e55a6128027 [0,1,0,1,0,0|2,0,0]=4 22141 B13R1.648 CO[C@H](C)COC[C@@H]1CC[C@H]1OC ca0628ab5a04392be7ec506120ffd543 [0,1,0,1,0,0|2,0,0]=4 22142 B13R1.648 CO[C@H](C)COC[C@H]1CC[C@H]1OC f25312c4c268f2014891366914f00ec9 [0,1,0,1,0,0|2,0,0]=4 22143 B13R1.648 CO[C@H]1CC[C@@H]1NCCC(C)CO 9153b9176c6eaab160c52ecb9270bef2 [0,1,0,1,0,0|2,0,0]=4 22144 B13R1.648 CO[C@H]1CC[C@H]1NCCC(C)CO 20cbbe6743d09b85ad7444053d7fe945 [0,1,0,1,0,0|2,0,0]=4 22145 B13R1.666 C#CC1CCCN(C1)CCCCC 3c5ccb5f5af60fcf263d39188a057c66 [0,1,0,1,0,0|2,0,0]=4 22146 B13R1.666 CCCCCN1CCCC(C1)C#N 19695156247dee379de2d3a95d4119f1 [0,1,0,1,0,0|2,0,0]=4 22147 B13R1.666 CCCCCN1CCCC(C1)CC 19f1aa028312f9363ad5d37ef0b938c4 [0,1,0,1,0,0|2,0,0]=4 22148 B13R1.666 CCCCCN1CCCC(C1)CO d9c0e0e8d4d61d9f9b22b14be9f8076e [0,1,0,1,0,0|1,0,0]=3 22149 B13R1.666 CCCCCN1CCCC(C1)OC 54861a11b21b34879f897b68a83bd74b [0,1,0,1,0,0|1,0,0]=3 22150 B13R1.666 CCCCCN1CCC[C@@H](C1)CO 5c55457497e840dbcf09f1d33d6d64d8 [0,1,0,1,0,0|1,0,0]=3 22151 B13R1.666 CCCCCN1CCC[C@@H](C1)OC d8dcdbdfd694c386c17bb7ac30570bfb [0,1,0,1,0,0|1,0,0]=3 22152 B13R1.666 CCCCCN1CCC[C@H](C1)C#N fc1f5aed1e07c4d52ecb7df1130c3795 [0,1,0,1,0,0|2,0,0]=4 22153 B13R1.666 CCCCCN1CCC[C@H](C1)CO 0c1ed89b5a0dc2a02ad24fa597447410 [0,1,0,1,0,0|1,0,0]=3 22154 B13R1.666 CCCCCN1CCC[C@H](C1)OC fa812dcbeeaea0ce50ddce7ee36ac08b [0,1,0,1,0,0|1,0,0]=3 22155 B13R1.666 CCCCCN1CCOC(C1)CO bf0270484593fcca90b4b8a58254ce2e [0,1,0,1,0,0|2,0,0]=4 22156 B13R1.666 CCCCCN1CCO[C@@H](C1)CO 9ee6001657f866ee8fe4760268a06794 [0,1,0,1,0,0|2,0,0]=4 22157 B13R1.666 CCCCCN1CCO[C@H](C1)CO 4705849049a4058f7b11fe7617b90eb2 [0,1,0,1,0,0|2,0,0]=4 22158 B13R1.666 CCCCNC1CCCC(C1)CO 1d3dc1bafe95dcc6880baa95ae5cd7e9 [0,1,0,1,0,0|1,0,0]=3 22159 B13R1.666 CCCCNC1CCCC(C1)OC 1715f25822a2637a1ce2231419327348 [0,1,0,1,0,0|1,0,0]=3 22160 B13R1.666 CCCCN[C@@H]1CCC[C@@H](C1)CO 0c92f16f1a2c640a9d515d2a02761840 [0,1,0,1,0,0|1,0,0]=3 22161 B13R1.666 CCCCN[C@@H]1CCC[C@@H](C1)OC d0d7588f0c757530ed586d2447bd3a3f [0,1,0,1,0,0|1,0,0]=3 22162 B13R1.666 CCCCN[C@@H]1CCC[C@H](C1)CO 4d8aa10e370423aa5e472ae1cdf9535a [0,1,0,1,0,0|1,0,0]=3 22163 B13R1.666 CCCCN[C@@H]1CCC[C@H](C1)OC 4c9987b638fc9bc6378fcbcd3c9a24ed [0,1,0,1,0,0|1,0,0]=3 22164 B13R1.666 CCCCN[C@@H]1COC[C@@H](C1)OC 4555f6defdc29bde9df138a6373065a1 [0,1,0,1,0,0|2,0,0]=4 22165 B13R1.666 CCCCN[C@H]1CCC[C@@H](C1)CO 64c20857daf0481ce341fd83f1116b48 [0,1,0,1,0,0|1,0,0]=3 22166 B13R1.666 CCCCN[C@H]1CCC[C@@H](C1)OC c50913a2d727ca8cea64d1aaabbb7829 [0,1,0,1,0,0|1,0,0]=3 22167 B13R1.666 CCCCN[C@H]1CCC[C@H](C1)CO 50f32c55edd03a1369d27ce0afe3e622 [0,1,0,1,0,0|1,0,0]=3 22168 B13R1.666 CCCCN[C@H]1CCC[C@H](C1)OC 74f8a1c2870015a2570d75fb82bbaf1d [0,1,0,1,0,0|1,0,0]=3 22169 B13R1.666 CCCCN[C@H]1COC[C@H](C1)OC b9d16b4dbecc0da61eae128d04991f6d [0,1,0,1,0,0|2,0,0]=4 22170 B13R1.666 CCCCOC1CCCC(C1)CC f00e21fef105f9781efb016dec7fa696 [0,1,0,1,0,0|2,0,0]=4 22171 B13R1.666 CCCCOC1CCCC(C1)OC a0ac7831c8ce84e9dd9783286ebdef28 [0,1,0,1,0,0|1,0,0]=3 22172 B13R1.666 CCCCO[C@H]1CCC[C@@H](C1)OC c0e2b54ebbd7802dc74c022254f353b3 [0,1,0,1,0,0|1,0,0]=3 22173 B13R1.666 CCCCO[C@H]1CCC[C@H](C1)OC d9f9e992da0518e8358541af6756aec9 [0,1,0,1,0,0|1,0,0]=3 22174 B13R1.666 CCCOCC1CCCC(C1)OC bff946b72241faae0006d3b5139e83e6 [0,1,0,1,0,0|1,0,0]=3 22175 B13R1.666 CCNCCN1CCCC(C1)CO 6face4ff6f17539114f9d18e5bab245b [0,1,0,1,0,0|2,0,0]=4 22176 B13R1.666 CCOCCN1CCCC(C1)CO 9767c0753c826d872e171d320b6aa76d [0,1,0,1,0,0|2,0,0]=4 22177 B13R1.666 CCOCCN1CCCC(C1)OC 33060de0d851b260bc819fb591e32eec [0,1,0,1,0,0|2,0,0]=4 22178 B13R1.666 CCOCCN1CCC[C@@H](C1)CO 6189442c5b2d21e8bad52ad02484287f [0,1,0,1,0,0|2,0,0]=4 22179 B13R1.666 CCOCCN1CCC[C@@H](C1)OC 4ebc96f3a3fc7522bb375a3400b3dbd8 [0,1,0,1,0,0|2,0,0]=4 22180 B13R1.666 CCOCCN1CCC[C@H](C1)CO 23e94f37151e4ed2b0a90e668e092376 [0,1,0,1,0,0|2,0,0]=4 22181 B13R1.666 CCOCCN1CCC[C@H](C1)OC 01819c27d42f8f8e018136416ddd05db [0,1,0,1,0,0|2,0,0]=4 22182 B13R1.666 CCOCNC1CCCC(C1)CO daac1b9be26f63348c53550adbbdf4b9 [0,1,0,1,0,0|2,0,0]=4 22183 B13R1.666 CCOCNC1CCCC(C1)OC d7a1fadd222776883e023d60be47a93b [0,1,0,1,0,0|2,0,0]=4 22184 B13R1.666 CCOCN[C@@H]1CCC[C@@H](C1)CO 1f6225bf767179ae76c2b70a1df30d10 [0,1,0,1,0,0|2,0,0]=4 22185 B13R1.666 CCOCN[C@@H]1CCC[C@@H](C1)OC e824b4e3238939a84fcf868a1f1fb1f3 [0,1,0,1,0,0|2,0,0]=4 22186 B13R1.666 CCOCN[C@@H]1CCC[C@H](C1)CO 7d46f7b7b0a1f9fb6d6da5d0c39e6f92 [0,1,0,1,0,0|2,0,0]=4 22187 B13R1.666 CCOCN[C@@H]1CCC[C@H](C1)OC e468e6dec3110084b01b056cefd4d4bc [0,1,0,1,0,0|2,0,0]=4 22188 B13R1.666 CCOCN[C@H]1CCC[C@@H](C1)CO 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B13R1.666 COC1CCCC(C1)OCCSC 8e96c22ef1f12ef4b1115a6535ceb73c [0,1,0,1,0,0|2,0,0]=4 22211 B13R1.666 COC1CCCN(C1)CCCCF 0b7b0daf14dc56f3ebea451ba8ff7988 [0,1,0,1,0,0|2,0,0]=4 22212 B13R1.666 COC1CCCN(C1)CCCCO de06fc6760a806fe3c5481214eb5adee [0,1,0,1,0,0|2,0,0]=4 22213 B13R1.666 COC1CCCN(C1)CCCSC 72deca82db5803410fe3c1396baca4f6 [0,1,0,1,0,0|2,0,0]=4 22214 B13R1.666 COCCCC1CCCN(C1)CO d18ef0d8bb71d512a6f51e745941013a [0,1,0,1,0,0|2,0,0]=4 22215 B13R1.666 COCCCN1CCCC(C1)CO e934d15c967e3fce5f8b6b1aedc56f33 [0,1,0,1,0,0|2,0,0]=4 22216 B13R1.666 COCCCN1CCCC(C1)OC a0e5214d6adac357410c7cfd78a8dbba [0,1,0,1,0,0|2,0,0]=4 22217 B13R1.666 COCCCN1CCC[C@@H](C1)CO 3995550f85f8361da697fb040ae38eee [0,1,0,1,0,0|2,0,0]=4 22218 B13R1.666 COCCCN1CCC[C@@H](C1)OC b9d97ba03798d6ba2ed83eb756f01f9d [0,1,0,1,0,0|2,0,0]=4 22219 B13R1.666 COCCCN1CCC[C@H](C1)CO 69ae43442b8589bbd9369a46aa4471d6 [0,1,0,1,0,0|2,0,0]=4 22220 B13R1.666 COCCCN1CCC[C@H](C1)OC 852a51dd8faf01e56f5347a0e53a4fcd [0,1,0,1,0,0|2,0,0]=4 22221 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CO[C@H]1CCC[C@H](C1)NCCSC 32dd341b6945ad0846d432cb4c949430 [0,1,0,1,0,0|2,0,0]=4 22263 B13R1.666 CSCCCN1CCCC(C1)CO aea6f3f145e671ddb77d51ab92d55db3 [0,1,0,1,0,0|2,0,0]=4 22264 B13R1.666 CSCCCN1CCC[C@@H](C1)CO 2d95a1042edf277b58aab6dcc7657f4d [0,1,0,1,0,0|2,0,0]=4 22265 B13R1.666 CSCCCN1CCC[C@H](C1)CO c929664e044743d2294a36bc8b337a2d [0,1,0,1,0,0|2,0,0]=4 22266 B13R1.666 CSCCNC1CCCC(C1)CO ab46def379d973748196ca497cf708b1 [0,1,0,1,0,0|2,0,0]=4 22267 B13R1.666 CSCCN[C@@H]1CCC[C@@H](C1)CO 662cb7ce5300861f3e5febef4eef9c3b [0,1,0,1,0,0|2,0,0]=4 22268 B13R1.666 CSCCN[C@@H]1CCC[C@H](C1)CO d663d7ec31ea5b7a6f600ffa2819a105 [0,1,0,1,0,0|2,0,0]=4 22269 B13R1.666 CSCCN[C@H]1CCC[C@@H](C1)CO 5d5b0afdb9f023d874604e0b4a604c60 [0,1,0,1,0,0|2,0,0]=4 22270 B13R1.666 CSCCN[C@H]1CCC[C@H](C1)CO b5d3a5c893ef88cdb01df78363071da7 [0,1,0,1,0,0|2,0,0]=4 22271 B13R1.666 OCC1CCCC(C1)NCCCF c95af631814c3c88e7628d46f120fe50 [0,1,0,1,0,0|2,0,0]=4 22272 B13R1.666 OCC1CCCC(C1)NCCCS 4dfdc10f225020210d28069b5e9bab4c 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[0,1,0,1,0,0|2,0,0]=4 22294 B13R1.667 CC1OCC1NCCCCCCO 1ee5083e01845f9be8bb07349ef41787 [0,1,0,1,0,0|2,0,0]=4 22295 B13R1.667 CC1OCC1OCCCCCCF fa9580cf76a193dcf9e1542554f7b38c [0,1,0,1,0,0|2,0,0]=4 22296 B13R1.667 CCCCCCCNC1CCC1F ff5a9812c99f24659b127f904ace4d72 [0,1,0,1,0,0|2,0,0]=4 22297 B13R1.667 CCCCCCCNC1CCC1O 52345f84a61d1e6a9673cc0bcdff1c6c [0,1,0,1,0,0|1,0,0]=3 22298 B13R1.667 CCCCCCCNC1COC1C a5fd18c59fdc8f2e94c681ef2f6332f8 [0,1,0,1,0,0|1,0,0]=3 22299 B13R1.667 CCCCCCCN[C@@H]1CC[C@@H]1O 9ee43441e03b6a27a2614a73b7e8e14d [0,1,0,1,0,0|1,0,0]=3 22300 B13R1.667 CCCCCCCN[C@@H]1CC[C@H]1C 527517b06e58bc98332d3b204c32ce6b [0,1,0,1,0,0|2,0,0]=4 22301 B13R1.667 CCCCCCCN[C@@H]1CC[C@H]1O 2e248f3e5ac598e889458c155a8760e2 [0,1,0,1,0,0|1,0,0]=3 22302 B13R1.667 CCCCCCCN[C@H]1CC[C@@H]1O bba50a5002a47cfc2d1988df16e0cb4a [0,1,0,1,0,0|1,0,0]=3 22303 B13R1.667 CCCCCCCN[C@H]1CC[C@H]1C 1fa7e9b04fc5678aefa8d5155fcee40a [0,1,0,1,0,0|2,0,0]=4 22304 B13R1.667 CCCCCCCN[C@H]1CC[C@H]1O cc7d4a3742ac21aea6229a8432ae45e8 [0,1,0,1,0,0|1,0,0]=3 22305 B13R1.667 CCCCCCCOC1COC1C cb00f2f18fdd5811ff514f6fc840f147 [0,1,0,1,0,0|1,0,0]=3 22306 B13R1.667 CCCCCCOCC1CCC1F 0155663de02735b88a9944ea68f394d1 [0,1,0,1,0,0|2,0,0]=4 22307 B13R1.667 CCCCOCCNC1CCC1O ea983a6508e44ef4cccd594c59f8ef6e [0,1,0,1,0,0|2,0,0]=4 22308 B13R1.667 CCCCOCCNC1COC1C 835c2e0c76d8f2b83141895ed2f9d698 [0,1,0,1,0,0|2,0,0]=4 22309 B13R1.667 CCCCOCCN[C@@H]1CC[C@@H]1O 011bccaae27ad34131cda4ca822e1c3d [0,1,0,1,0,0|2,0,0]=4 22310 B13R1.667 CCCCOCCN[C@@H]1CC[C@H]1O fc9fd7677b3069496a1f4be9aca94391 [0,1,0,1,0,0|2,0,0]=4 22311 B13R1.667 CCCCOCCN[C@H]1CC[C@@H]1O 8c3e94185fb24120147669677f183100 [0,1,0,1,0,0|2,0,0]=4 22312 B13R1.667 CCCCOCCN[C@H]1CC[C@H]1O c0f9204f7559f76cfefa5716cea81a21 [0,1,0,1,0,0|2,0,0]=4 22313 B13R1.667 CCCCOCCOC1COC1C b4de560c1f95db1156aa8b0fd8a4d792 [0,1,0,1,0,0|2,0,0]=4 22314 B13R1.667 CCCOCCCNC1CCC1O 421af420a4c0f75e4d46b2fd40e2ff1e [0,1,0,1,0,0|2,0,0]=4 22315 B13R1.667 CCCOCCCNC1COC1C 497c6ee586e5f7b237ea776684a07380 [0,1,0,1,0,0|2,0,0]=4 22316 B13R1.667 CCCOCCCN[C@@H]1CC[C@@H]1O 627b2c27a83a960e02a4a6e5d306f91c [0,1,0,1,0,0|2,0,0]=4 22317 B13R1.667 CCCOCCCN[C@@H]1CC[C@H]1O ca8d98c822e08c8a4d8e299ea05c462a [0,1,0,1,0,0|2,0,0]=4 22318 B13R1.667 CCCOCCCN[C@H]1CC[C@@H]1O 27c1d570b0237654152520ad3860bdea [0,1,0,1,0,0|2,0,0]=4 22319 B13R1.667 CCCOCCCN[C@H]1CC[C@H]1O 2bd6e101ec7014d454f735afd3b3f05a [0,1,0,1,0,0|2,0,0]=4 22320 B13R1.667 CCCOCCCOC1COC1C 48dcf4ce433145b34e812044f3dc842e [0,1,0,1,0,0|2,0,0]=4 22321 B13R1.667 COCCCCCNC1CCC1O 47e4c3684d5f3057d4d450b3730d11c1 [0,1,0,1,0,0|2,0,0]=4 22322 B13R1.667 COCCCCCNC1COC1C 5b270c6066215e538d0dc25f6ffd94e0 [0,1,0,1,0,0|2,0,0]=4 22323 B13R1.667 COCCCCCN[C@@H]1CC[C@@H]1O 9c8e936debd8bcae81c8886cd1d2c043 [0,1,0,1,0,0|2,0,0]=4 22324 B13R1.667 COCCCCCN[C@@H]1CC[C@H]1O 331eb3eaee67c51849cc7a36989b4c99 [0,1,0,1,0,0|2,0,0]=4 22325 B13R1.667 COCCCCCN[C@H]1CC[C@@H]1O d38929c48d442c018689192f8c98a6e4 [0,1,0,1,0,0|2,0,0]=4 22326 B13R1.667 COCCCCCN[C@H]1CC[C@H]1O 98aa26ead90c2b8168b3e1efc1294818 [0,1,0,1,0,0|2,0,0]=4 22327 B13R1.667 COCCCCCOC1COC1C fd047588d6d8b33428ffb8bcdb8f4d94 [0,1,0,1,0,0|2,0,0]=4 22328 B13R1.667 OC1CCC1NCCCCCCF ad554e1e55729aa326c1ab6d82f2dd0e [0,1,0,1,0,0|2,0,0]=4 22329 B13R1.667 OCCCCCCNC1CCC1O f091c2aebc32adeac9f77a37e3ef3360 [0,1,0,1,0,0|2,0,0]=4 22330 B13R1.667 OCCCCCCN[C@@H]1CC[C@@H]1O 9ec38d094cbd09ebfbf4a9059393e591 [0,1,0,1,0,0|2,0,0]=4 22331 B13R1.667 OCCCCCCN[C@@H]1CC[C@H]1O 6cf0e4f13b95ba49540c740be00c948d [0,1,0,1,0,0|2,0,0]=4 22332 B13R1.667 OCCCCCCN[C@H]1CC[C@@H]1O f937b400c8932678e4caf689236d8fa8 [0,1,0,1,0,0|2,0,0]=4 22333 B13R1.667 OCCCCCCN[C@H]1CC[C@H]1O 8064af5532f8a0bca19d126a5733a302 [0,1,0,1,0,0|2,0,0]=4 22334 B13R1.667 O[C@@H]1CC[C@@H]1NCCCCCCF 3ae2fd06fe967923e07c5d24d230bb13 [0,1,0,1,0,0|2,0,0]=4 22335 B13R1.667 O[C@@H]1CC[C@H]1NCCCCCCF 3a44645feaa9f286927ade5c61526c49 [0,1,0,1,0,0|2,0,0]=4 22336 B13R1.667 O[C@H]1CC[C@@H]1NCCCCCCF ea7f9dbf32407554b7fab483d7f43be8 [0,1,0,1,0,0|2,0,0]=4 22337 B13R1.667 O[C@H]1CC[C@H]1NCCCCCCF a5e51678a6a5d880df2313a99a432c9b [0,1,0,1,0,0|2,0,0]=4 22338 B13R1.672 CC1(CCCN1CCCCF)CO 78091d0aa7950a6efb649382373f9fd1 [0,1,0,1,0,0|2,0,0]=4 22339 B13R1.672 CC1(CCCN1CCCCO)CO 8643f7d31589d2fd1d16834c5d796851 [0,1,0,1,0,0|2,0,0]=4 22340 B13R1.672 CCCCCN1CCCC1(C)C#N afc6bfe662986e6f1e955b21d0c55a53 [0,1,0,1,0,0|2,0,0]=4 22341 B13R1.672 CCCCCN1CCCC1(C)CO b2bdc1a86b8676fdf3c966d51ffbba63 [0,1,0,1,0,0|1,0,0]=3 22342 B13R1.672 CCOCCN1CCCC1(C)CO e0be27d6c2a9db95f39e46138b38997d [0,1,0,1,0,0|2,0,0]=4 22343 B13R1.672 CCSCCN1CCCC1(C)CO 5829f4508e4a0ad7cbd11b1c762e067c [0,1,0,1,0,0|2,0,0]=4 22344 B13R1.672 COCCCN1CCCC1(C)CO c5e6e2312754454ebe099928f1288775 [0,1,0,1,0,0|2,0,0]=4 22345 B13R1.672 CSCCCN1CCCC1(C)CO 63d7409b011a04e618c5f394b5106695 [0,1,0,1,0,0|2,0,0]=4 22346 B13R1.718 BrCC(Br)CNCC1CCCCC1 5f0581c523da997a8b9dab6ab63039e3 [0,1,0,1,0,0|2,0,0]=4 22347 B13R1.718 BrCC(Br)COCC1CCCCC1 bb4acc0084026691c18b635bddb4310a [0,1,0,1,0,0|2,0,0]=4 22348 B13R1.718 C#CC(C)NCCC1CCCCC1 31d2f42b4049dc17de9148522e8a5cd5 [0,1,0,1,0,0|2,0,0]=4 22349 B13R1.718 C#CC(C)OCCC1CCCCC1 ff7910917be0ab7b0d11e9caedacd74c [0,1,0,1,0,0|2,0,0]=4 22350 B13R1.718 C#C[C@@H](C)NCCC1CCCCC1 b6a719c9b6840b118cf39f634a746531 [0,1,0,1,0,0|2,0,0]=4 22351 B13R1.718 C#C[C@@H](C)OCCC1CCCCC1 4fc2fbc65ecbbc491a0354d4e0b8c55c [0,1,0,1,0,0|2,0,0]=4 22352 B13R1.718 C#C[C@H](C)NCCC1CCCCC1 e0330dc8c8274a00fcf8c12fc3976c7a [0,1,0,1,0,0|2,0,0]=4 22353 B13R1.718 C#C[C@H](C)OCCC1CCCCC1 a41b129f93790d7fac41a0d2b84421d2 [0,1,0,1,0,0|2,0,0]=4 22354 B13R1.718 C=CC(C)COCC1CCCCC1 d1c1038572b2bdb5a7f64028c48a1e71 [0,1,0,1,0,0|2,0,0]=4 22355 B13R1.718 C=CC(C)NCCC1CCCCC1 770763335b1f862e74a58afd3ef8cfca [0,1,0,1,0,0|2,0,0]=4 22356 B13R1.718 C=CC(C)OCCC1CCCCC1 403c217221f92232ce0392e6064692dd [0,1,0,1,0,0|2,0,0]=4 22357 B13R1.718 C=CC(O)CNCC1CCCCC1 c97e87db8240adf08a9d1eebda6efff6 [0,1,0,1,0,0|1,0,1]=4 22358 B13R1.718 C=C[C@H](C)OCCC1CCCCC1 75bcde216ff0078776507a731ba9b481 [0,1,0,1,0,0|2,0,0]=4 22359 B13R1.718 CC(C#N)CNCC1CCCCC1 95187058ead33feb79d94a72c2b5cd33 [0,1,0,1,0,0|2,0,0]=4 22360 B13R1.718 CC(C#N)COCC1CCCCC1 9916107d4360dbc72d51259d25f4619e [0,1,0,1,0,0|2,0,0]=4 22361 B13R1.718 CC(C#N)NCCC1CCCCC1 3d4c404f9861d17f34542baa64b5bd89 [0,1,0,1,0,0|2,0,0]=4 22362 B13R1.718 CC(C#N)OCCC1CCCCC1 bc1519af7bd9bc2f5c503985fde22810 [0,1,0,1,0,0|2,0,0]=4 22363 B13R1.718 CC(C=O)NCCC1CCCCC1 080346b987807dd3246082af2908ea44 [0,1,0,1,0,0|1,0,1]=4 22364 B13R1.718 CC(C=O)OCCC1CCCCC1 18780925f5b225d6165cc3cfcf95ccbf [0,1,0,1,0,0|1,0,1]=4 22365 B13R1.718 CC(CF)OCCC1CCCCC1 9c44781bae564401cd056823eb9521cd [0,1,0,1,0,0|2,0,0]=4 22366 B13R1.718 CC(CO)CCNC1CCCCC1 0739dd2faa512e0ecf6805fe80781610 [0,1,0,1,0,0|1,0,0]=3 22367 B13R1.718 CC(CO)CCNC1CCCCO1 ba7bcc81df1b704ddf5b93ed1522b81b [0,1,0,1,0,0|2,0,0]=4 22368 B13R1.718 CC(CO)CCNC1CCCOC1 2a17197afe61e6100ab477af757511c2 [0,1,0,1,0,0|2,0,0]=4 22369 B13R1.718 CC(CO)CCNC1CCOCC1 d3d4306c8447249502303130ad9713d9 [0,1,0,1,0,0|2,0,0]=4 22370 B13R1.718 CC(CO)CCNC1CCSCC1 785d75b5fd671f5b7eb8780f18fdd7b6 [0,1,0,1,0,0|2,0,0]=4 22371 B13R1.718 CC(CO)CCN[C@@H]1CCCOC1 d7f69608028e32242047e1ee21c0fd06 [0,1,0,1,0,0|2,0,0]=4 22372 B13R1.718 CC(CO)CCN[C@H]1CCCOC1 c6f1ca78d86148164796b0a1a1f28789 [0,1,0,1,0,0|2,0,0]=4 22373 B13R1.718 CC(CO)CNCC1CCCCC1 acd01d156c8e9155c0548044b4647626 [0,1,0,1,0,0|1,0,0]=3 22374 B13R1.718 CC(CO)CNCC1CCCCO1 e5dea21d46af9c42ec2c6c6d46031e4e [0,1,0,1,0,0|2,0,0]=4 22375 B13R1.718 CC(CO)CNCC1CCCOC1 257e16a62b2dd1a4f1fcf9b803d1ac54 [0,1,0,1,0,0|2,0,0]=4 22376 B13R1.718 CC(CO)CNCC1CCOCC1 04fdcf46b075e2b8a3e215cf7d0a15d4 [0,1,0,1,0,0|2,0,0]=4 22377 B13R1.718 CC(CO)CNCC1CCSCC1 2d496085d47791b976b618f0fde3564e [0,1,0,1,0,0|2,0,0]=4 22378 B13R1.718 CC(CO)CNC[C@@H]1CCCOC1 850602d27725b86e908e7718ebfa9958 [0,1,0,1,0,0|2,0,0]=4 22379 B13R1.718 CC(CO)CNC[C@H]1CCCOC1 4f42b4781914b3f6a293306b9dd09c0e [0,1,0,1,0,0|2,0,0]=4 22380 B13R1.718 CC(CO)NCCC1CCCCC1 f295d6a7721d9f95136065ab278e9a6d [0,1,0,1,0,0|1,0,0]=3 22381 B13R1.718 CC(CO)NCCC1CCCCO1 d236bad8a864bce8ed3cd05440efb32e [0,1,0,1,0,0|2,0,0]=4 22382 B13R1.718 CC(CO)NCCC1CCCOC1 37451cd9683ce0ec233b69b77d3cc51d [0,1,0,1,0,0|2,0,0]=4 22383 B13R1.718 CC(CO)NCCC1CCOCC1 4db0b4480b7a452ff135dcafe6c47b9f [0,1,0,1,0,0|2,0,0]=4 22384 B13R1.718 CC(CO)NCCC1CCSCC1 583086e226c3a130d29ed71c5957124d [0,1,0,1,0,0|2,0,0]=4 22385 B13R1.718 CC(CO)NCCN1CCCCC1 b37390dd879eb2cc2fc73e622af3c2ba [0,1,0,1,0,0|2,0,0]=4 22386 B13R1.718 CC(CO)NCOC1CCCCC1 6d9667c894b126cd5c6fcae2c85e29ef [0,1,0,1,0,0|2,0,0]=4 22387 B13R1.718 CC(CS)OCCC1CCCCC1 e4a18bf1401d24607e5bc3eae8652b67 [0,1,0,1,0,0|1,1,0]=4 22388 B13R1.718 CCC(C)CCNC1CCCCC1 770bb23e2e6430daecd711be7ac1b43c [0,1,0,1,0,0|2,0,0]=4 22389 B13R1.718 CCC(C)CCOC1CCCCC1 b7fabb58dfb6e64b854250d4572f2fed [0,1,0,1,0,0|2,0,0]=4 22390 B13R1.718 CCC(C)CNCC1CCCCC1 9542c3291f4d3fd2b759b913f1cdf5f3 [0,1,0,1,0,0|2,0,0]=4 22391 B13R1.718 CCC(C)COCC1CCCCC1 999ecb70eedcc54d07899824590f579d [0,1,0,1,0,0|2,0,0]=4 22392 B13R1.718 CCC(C)NCCC1CCCCC1 04d1da3d5b236fe8f405d1eccb402568 [0,1,0,1,0,0|2,0,0]=4 22393 B13R1.718 CCC(C)OCCC1CCCCC1 69d642abfef8160cc121adcf38ead5c6 [0,1,0,1,0,0|2,0,0]=4 22394 B13R1.718 CCC(O)CNCC1CCCCC1 aefe3ae325cf0bef937f23a28c056ef4 [0,1,0,1,0,0|1,0,0]=3 22395 B13R1.718 CCC(O)CNCC1CCCCO1 785fa29754fe72d6e546cf6e812a8d2f [0,1,0,1,0,0|2,0,0]=4 22396 B13R1.718 CCC(O)CNCC1CCCOC1 047b3a6ad77541e06d7cf367435bcd93 [0,1,0,1,0,0|2,0,0]=4 22397 B13R1.718 CCC(O)CNCC1CCOCC1 adc96aab7de46edb70bc00476dc72e3f [0,1,0,1,0,0|2,0,0]=4 22398 B13R1.718 CCC(O)CNCC1CCSCC1 90950eba48f86b013417c932a23ca3b6 [0,1,0,1,0,0|2,0,0]=4 22399 B13R1.718 CCC(O)CNC[C@@H]1CCCOC1 f9d3d2191f96a10ce3487951d6be2a94 [0,1,0,1,0,0|2,0,0]=4 22400 B13R1.718 CCC(O)CNC[C@H]1CCCOC1 f36f5b0d3af0bd98f57e19d6cedb0e4a [0,1,0,1,0,0|2,0,0]=4 22401 B13R1.718 CCC(S)CCOC1CCCCC1 8a9346a3846be364d6eb1b8006b06ee1 [0,1,0,1,0,0|1,1,0]=4 22402 B13R1.718 CCN(C)CCCC1CCCCC1 425ca29bbff0d16d78daacf262fc9bf3 [0,1,0,1,0,0|2,0,0]=4 22403 B13R1.718 CC[C@@H](C)CNCC1CCCCC1 21697784c58b066e6b0ecb0788f7dfd9 [0,1,0,1,0,0|2,0,0]=4 22404 B13R1.718 CC[C@@H](C)COCC1CCCCC1 0d2d904d07f79fb72a453cae8a60e431 [0,1,0,1,0,0|2,0,0]=4 22405 B13R1.718 CC[C@@H](C)NCCC1CCCCC1 6f7fcecf1872b1f901b16441de530966 [0,1,0,1,0,0|2,0,0]=4 22406 B13R1.718 CC[C@@H](C)OCCC1CCCCC1 783f6e8ca117f3313648e634a21ba88b [0,1,0,1,0,0|2,0,0]=4 22407 B13R1.718 CC[C@@H](O)CNCC1CCCCC1 56fc167ea2cc17f86332906b24b25b05 [0,1,0,1,0,0|1,0,0]=3 22408 B13R1.718 CC[C@@H](O)CNCC1CCCCO1 e45b64015c1afc63e0ccb991a8f2ff23 [0,1,0,1,0,0|2,0,0]=4 22409 B13R1.718 CC[C@@H](O)CNCC1CCCOC1 e28d83fce9f6585322c364fa97aacfde [0,1,0,1,0,0|2,0,0]=4 22410 B13R1.718 CC[C@@H](O)CNCC1CCOCC1 2863df9e452edacdb2a4ac8e6b9ae575 [0,1,0,1,0,0|2,0,0]=4 22411 B13R1.718 CC[C@@H](O)CNCC1CCSCC1 cd670d5765d94edc8e54002e8cdec2e4 [0,1,0,1,0,0|2,0,0]=4 22412 B13R1.718 CC[C@H](C)CCOC1CCCCC1 5a80f8c4a75241a71cfbbab741bd3272 [0,1,0,1,0,0|2,0,0]=4 22413 B13R1.718 CC[C@H](C)CNCC1CCCCC1 4e3df012b76183576618248ef08b1d15 [0,1,0,1,0,0|2,0,0]=4 22414 B13R1.718 CC[C@H](C)COCC1CCCCC1 e05abc78af9c7dec7de7d8d23921025b [0,1,0,1,0,0|2,0,0]=4 22415 B13R1.718 CC[C@H](C)NCCC1CCCCC1 b41eb40b562b700316b39a1620189da8 [0,1,0,1,0,0|2,0,0]=4 22416 B13R1.718 CC[C@H](C)OCCC1CCCCC1 8e202f6ea3416c3b356fdc2324c49163 [0,1,0,1,0,0|2,0,0]=4 22417 B13R1.718 CN(CO)CCCN1CCCCC1 945a63c0dd9e10c2fa8270bafdb20da1 [0,1,0,1,0,0|2,0,0]=4 22418 B13R1.718 COC(C)CCOC1CCCCC1 ecf6b43bc98aeba72aa6f3517b05ee4b [0,1,0,1,0,0|1,0,0]=3 22419 B13R1.718 COC(C)CCOC1CCCCO1 505c72cada23f371841e482ca0fd618a [0,1,0,1,0,0|2,0,0]=4 22420 B13R1.718 COC(C)CCOC1CCCOC1 fd3ef925cfde96a59695c262744329de [0,1,0,1,0,0|2,0,0]=4 22421 B13R1.718 COC(C)CCOC1CCOCC1 6c8b43dd514c1394c9661d4c3d1777f4 [0,1,0,1,0,0|2,0,0]=4 22422 B13R1.718 COC(C)CCOC1CCSCC1 5c0f6053c30e08b3cec2a55fb206a41b [0,1,0,1,0,0|2,0,0]=4 22423 B13R1.718 COC(C)CNCC1CCCCC1 a42bdf926682bc312e86942235e90297 [0,1,0,1,0,0|1,0,0]=3 22424 B13R1.718 COC(C)CNCC1CCCCO1 c448568f0bd8b95ff03886e7ca065fd7 [0,1,0,1,0,0|2,0,0]=4 22425 B13R1.718 COC(C)CNCC1CCCOC1 7735eb1441a413833343aa65ee390b31 [0,1,0,1,0,0|2,0,0]=4 22426 B13R1.718 COC(C)CNCC1CCOCC1 1400f9024b59ffd41ffbe31e891b764e [0,1,0,1,0,0|2,0,0]=4 22427 B13R1.718 COC(C)CNCC1CCSCC1 324187b44efc97a20c22479d01096f87 [0,1,0,1,0,0|2,0,0]=4 22428 B13R1.718 COC(C)CNC[C@@H]1CCCOC1 5b3885c15ba5b3bc06bee419fd5ec71d [0,1,0,1,0,0|2,0,0]=4 22429 B13R1.718 COC(C)CNC[C@H]1CCCOC1 dfa7ffff6269600d5a0ce1305bbe0f47 [0,1,0,1,0,0|2,0,0]=4 22430 B13R1.718 COC(C)COCC1CCCCC1 2c765b639097c38a499397cee70b03dc [0,1,0,1,0,0|1,0,0]=3 22431 B13R1.718 COC(C)COCC1CCCCO1 74f06e867ac952e0617fbb435b0c1cd3 [0,1,0,1,0,0|2,0,0]=4 22432 B13R1.718 COC(C)COCC1CCCOC1 bda58294b2b1a4db891d7d722ddc9201 [0,1,0,1,0,0|2,0,0]=4 22433 B13R1.718 COC(C)COCC1CCOCC1 146a82584f50d658c4a5a12546a7b9c5 [0,1,0,1,0,0|2,0,0]=4 22434 B13R1.718 COC(C)COCC1CCSCC1 016bb3337e6381caf5a0b6ee1a18fd8b [0,1,0,1,0,0|2,0,0]=4 22435 B13R1.718 COC(C)COC[C@@H]1CCCCO1 d7b3d43383873bc0bace24016adf2078 [0,1,0,1,0,0|2,0,0]=4 22436 B13R1.718 COC(C)COC[C@@H]1CCCOC1 c421439214d6a357b2741b4d656a6c33 [0,1,0,1,0,0|2,0,0]=4 22437 B13R1.718 COC(C)COC[C@H]1CCCCO1 a10bce201f7ec7e3a9713d898934e95e [0,1,0,1,0,0|2,0,0]=4 22438 B13R1.718 COC(C)COC[C@H]1CCCOC1 e53e9bb54482938b1cf237ab3b66d646 [0,1,0,1,0,0|2,0,0]=4 22439 B13R1.718 CO[C@@H](C)CNCC1CCCCC1 c2e355ed7bd224010fcd09fad3f76d0e [0,1,0,1,0,0|1,0,0]=3 22440 B13R1.718 CO[C@@H](C)CNCC1CCCCO1 d80d9f6a3c23be658f20239997666774 [0,1,0,1,0,0|2,0,0]=4 22441 B13R1.718 CO[C@@H](C)CNCC1CCCOC1 957ac4a04139a9cd28d415b4d1bc4333 [0,1,0,1,0,0|2,0,0]=4 22442 B13R1.718 CO[C@@H](C)CNCC1CCOCC1 1e7a418374583aba745d875a393c19d0 [0,1,0,1,0,0|2,0,0]=4 22443 B13R1.718 CO[C@@H](C)CNCC1CCSCC1 9334528ca860d2283991553bb25f6d4d [0,1,0,1,0,0|2,0,0]=4 22444 B13R1.718 CO[C@@H](C)CNC[C@@H]1CCCOC1 735e5e1aef0edcff680f3af4e5d442ee [0,1,0,1,0,0|2,0,0]=4 22445 B13R1.718 CO[C@@H](C)CNC[C@H]1CCCOC1 622562af80f4a4e589f236c84e96a910 [0,1,0,1,0,0|2,0,0]=4 22446 B13R1.718 CO[C@@H](C)COCC1CCCCC1 b8348b8e5c0a16aeef81adec3153211c [0,1,0,1,0,0|1,0,0]=3 22447 B13R1.718 CO[C@@H](C)COCC1CCCCO1 17e156461b94cc013e140f724c9146d5 [0,1,0,1,0,0|2,0,0]=4 22448 B13R1.718 CO[C@@H](C)COCC1CCCOC1 1243edca3c3f704d073e2ae6ac4f7990 [0,1,0,1,0,0|2,0,0]=4 22449 B13R1.718 CO[C@@H](C)COCC1CCOCC1 a2a0a477dbb90688c7779906ee51a47d [0,1,0,1,0,0|2,0,0]=4 22450 B13R1.718 CO[C@@H](C)COCC1CCSCC1 3dbbf8bf7fce7778253d1e374e04d516 [0,1,0,1,0,0|2,0,0]=4 22451 B13R1.718 CO[C@@H](C)COC[C@@H]1CCCCO1 0740ebb94cde5ebfa0fd50b487f722b0 [0,1,0,1,0,0|2,0,0]=4 22452 B13R1.718 CO[C@@H](C)COC[C@@H]1CCCOC1 7f9d3e20c1d48c43f052467c84fedbfd [0,1,0,1,0,0|2,0,0]=4 22453 B13R1.718 CO[C@@H](C)COC[C@H]1CCCCO1 965f7be3a9fe1d61e50ba78255d766ea [0,1,0,1,0,0|2,0,0]=4 22454 B13R1.718 CO[C@@H](C)COC[C@H]1CCCOC1 f4f74cdc04336f4c6cf9ef6dc9b98518 [0,1,0,1,0,0|2,0,0]=4 22455 B13R1.718 CO[C@H](C)CNCC1CCCCC1 4551f74cc8def0f722b1e1803998bfd5 [0,1,0,1,0,0|1,0,0]=3 22456 B13R1.718 CO[C@H](C)CNCC1CCCCO1 e45cf82bc8eb800d217ef3cd42237114 [0,1,0,1,0,0|2,0,0]=4 22457 B13R1.718 CO[C@H](C)CNCC1CCCOC1 40761b5b88500f986aa9f31fd97e6274 [0,1,0,1,0,0|2,0,0]=4 22458 B13R1.718 CO[C@H](C)CNCC1CCOCC1 67f09182c3344d43b4c51742ce36dca3 [0,1,0,1,0,0|2,0,0]=4 22459 B13R1.718 CO[C@H](C)CNCC1CCSCC1 db6463d50872fa0c80754b65f945b8cb [0,1,0,1,0,0|2,0,0]=4 22460 B13R1.718 CO[C@H](C)CNC[C@@H]1CCCOC1 f0b18aaec4a677ccf204535e0499d373 [0,1,0,1,0,0|2,0,0]=4 22461 B13R1.718 CO[C@H](C)CNC[C@H]1CCCOC1 f7ae992235cd3b943aa87245dfc84f15 [0,1,0,1,0,0|2,0,0]=4 22462 B13R1.718 CO[C@H](C)COCC1CCCCC1 de3a1f8d2799220f847a1575f2c2eb39 [0,1,0,1,0,0|1,0,0]=3 22463 B13R1.718 CO[C@H](C)COCC1CCCCO1 d3e884574f522e126f0c9ffd0ce97508 [0,1,0,1,0,0|2,0,0]=4 22464 B13R1.718 CO[C@H](C)COCC1CCCOC1 68a8df0ceb8d2d15642dc1a004fc1f7a [0,1,0,1,0,0|2,0,0]=4 22465 B13R1.718 CO[C@H](C)COCC1CCOCC1 1ed741059c121d6de93bc6f533bb7d6c [0,1,0,1,0,0|2,0,0]=4 22466 B13R1.718 CO[C@H](C)COCC1CCSCC1 84d346e25333d55d98bbdd79a0266690 [0,1,0,1,0,0|2,0,0]=4 22467 B13R1.718 CO[C@H](C)COC[C@@H]1CCCCO1 8a899ea381e6cf39fcf7a5fd5ac1d521 [0,1,0,1,0,0|2,0,0]=4 22468 B13R1.718 CO[C@H](C)COC[C@@H]1CCCOC1 a6cfe0cde8fda32286ea27102c4d2678 [0,1,0,1,0,0|2,0,0]=4 22469 B13R1.718 CO[C@H](C)COC[C@H]1CCCCO1 02ecdc70a16ac3cc2e6f431804885670 [0,1,0,1,0,0|2,0,0]=4 22470 B13R1.718 CO[C@H](C)COC[C@H]1CCCOC1 47ba1578459af073f29d2d9e6a0ecac4 [0,1,0,1,0,0|2,0,0]=4 22471 B13R1.718 C[C@@H](CO)CCNC1CCCCC1 d17782161730047fe1d3f97c73e02d2f [0,1,0,1,0,0|1,0,0]=3 22472 B13R1.718 C[C@@H](CO)CCNC1CCCCO1 58554862a3ea8ee77df26abac73ba373 [0,1,0,1,0,0|2,0,0]=4 22473 B13R1.718 C[C@@H](CO)CCNC1CCCOC1 8e09d499b35e23ef4dfeeb7b79e532a3 [0,1,0,1,0,0|2,0,0]=4 22474 B13R1.718 C[C@@H](CO)CCNC1CCOCC1 87da96d1db4d0df6a97ac9572d313591 [0,1,0,1,0,0|2,0,0]=4 22475 B13R1.718 C[C@@H](CO)CCNC1CCSCC1 fb6a6c395f62628cb63e8d00c39828c4 [0,1,0,1,0,0|2,0,0]=4 22476 B13R1.718 C[C@@H](CO)CNCC1CCCCC1 02533c1db2492b86d872ad478ac14d61 [0,1,0,1,0,0|1,0,0]=3 22477 B13R1.718 C[C@@H](CO)CNCC1CCCCO1 0fdaa8b358f5fdf6cc5917ba3ea7daa6 [0,1,0,1,0,0|2,0,0]=4 22478 B13R1.718 C[C@@H](CO)CNCC1CCCOC1 69eb1005eb896676b3c2abbe349cfb6b [0,1,0,1,0,0|2,0,0]=4 22479 B13R1.718 C[C@@H](CO)CNCC1CCOCC1 8068cb0fad34682e1332f6a6880613a3 [0,1,0,1,0,0|2,0,0]=4 22480 B13R1.718 C[C@@H](CO)CNCC1CCSCC1 d92a215616637661eacbf35774847228 [0,1,0,1,0,0|2,0,0]=4 22481 B13R1.718 C[C@@H](CO)CNC[C@@H]1CCCOC1 aa733f47622b26a9a6d684e0c69d37da [0,1,0,1,0,0|2,0,0]=4 22482 B13R1.718 C[C@@H](CO)CNC[C@H]1CCCOC1 a75211e97bb20190c2670094fb0fe862 [0,1,0,1,0,0|2,0,0]=4 22483 B13R1.718 C[C@@H](CO)NCCC1CCCCC1 c306c71ebe5f7fcec87563275f191b20 [0,1,0,1,0,0|1,0,0]=3 22484 B13R1.718 C[C@@H](CO)NCCC1CCCCO1 b39696e3f84cc3cc2025be03768fba91 [0,1,0,1,0,0|2,0,0]=4 22485 B13R1.718 C[C@@H](CO)NCCC1CCCOC1 10e9c39cfb568dab60a89cd721e73a12 [0,1,0,1,0,0|2,0,0]=4 22486 B13R1.718 C[C@@H](CO)NCCC1CCOCC1 5fdbc2fb9fbc7b3b9b416f66eead20e9 [0,1,0,1,0,0|2,0,0]=4 22487 B13R1.718 C[C@@H](CO)NCCC1CCSCC1 49c8fe7a0dfaee836eab94dba90e3cb4 [0,1,0,1,0,0|2,0,0]=4 22488 B13R1.718 C[C@@H](CO)NCCN1CCCCC1 ea91dcf1ac52ac3dd371168f03169301 [0,1,0,1,0,0|2,0,0]=4 22489 B13R1.718 C[C@@H](CO)NCOC1CCCCC1 f3fd6cdfb1ad83df5030ec957051e590 [0,1,0,1,0,0|2,0,0]=4 22490 B13R1.718 C[C@H](C=O)NCCC1CCCCC1 57a6774b66f78e44e085009b452b91c3 [0,1,0,1,0,0|1,0,1]=4 22491 B13R1.718 C[C@H](C=O)OCCC1CCCCC1 6221c19f992666fb0a5fa81381a65339 [0,1,0,1,0,0|1,0,1]=4 22492 B13R1.718 C[C@H](CO)CNCC1CCCCC1 6fdb25ef93ee7ce4cc9a185f856c8475 [0,1,0,1,0,0|1,0,0]=3 22493 B13R1.718 C[C@H](CO)CNCC1CCCCO1 e6bff7cc012660e630ce04649cc1b6d5 [0,1,0,1,0,0|2,0,0]=4 22494 B13R1.718 C[C@H](CO)CNCC1CCCOC1 b255b24491497a6e0353c4df0d483ca5 [0,1,0,1,0,0|2,0,0]=4 22495 B13R1.718 C[C@H](CO)CNCC1CCOCC1 79e8a4a9c858dbeecd8ec3ed02d6fa8f [0,1,0,1,0,0|2,0,0]=4 22496 B13R1.718 C[C@H](CO)CNCC1CCSCC1 47c34a1ec352d5f43465c30b435bd46a [0,1,0,1,0,0|2,0,0]=4 22497 B13R1.718 C[C@H](CO)CNC[C@@H]1CCCOC1 7c79d59a5a5dd5c80dff7d4937d65b18 [0,1,0,1,0,0|2,0,0]=4 22498 B13R1.718 C[C@H](CO)CNC[C@H]1CCCOC1 0336b5b8c2e18de8ef018b143d00d604 [0,1,0,1,0,0|2,0,0]=4 22499 B13R1.718 C[C@H](CO)NCCC1CCCCC1 db6fde76fa0615699cb0f317f664229f [0,1,0,1,0,0|1,0,0]=3 22500 B13R1.718 C[C@H](CO)NCCC1CCCCO1 4e4219998b3be0efc95dd5d25b9eaa2b [0,1,0,1,0,0|2,0,0]=4 22501 B13R1.718 C[C@H](CO)NCCC1CCCOC1 0f737dc4f2c8de507741223c3e1b9cfa [0,1,0,1,0,0|2,0,0]=4 22502 B13R1.718 C[C@H](CO)NCCC1CCOCC1 684bbc3bb673a0999a39f589c690f24d [0,1,0,1,0,0|2,0,0]=4 22503 B13R1.718 C[C@H](CO)NCCC1CCSCC1 28769c1c4a946a9eaf619ebb706588ed [0,1,0,1,0,0|2,0,0]=4 22504 B13R1.718 C[C@H](CO)NCCN1CCCCC1 6e53bfa674126deb6eb937874731cf78 [0,1,0,1,0,0|2,0,0]=4 22505 B13R1.718 C[C@H](CO)NCOC1CCCCC1 8bc694036eb4bea98e45eef469ade71f [0,1,0,1,0,0|2,0,0]=4 22506 B13R1.718 C[C@H](CS)OCCC1CCCCC1 f12e6d7edced49e7742b3f3a4870a186 [0,1,0,1,0,0|1,1,0]=4 22507 B13R1.718 ClCC(Cl)COCC1CCCCC1 faf7bb14c7798a9514e0517547d47745 [0,1,0,1,0,0|2,0,0]=4 22508 B13R1.718 OC(CF)CNCC1CCCCC1 4b53196945adf1550c3a33497cd32b43 [0,1,0,1,0,0|1,0,0]=3 22509 B13R1.718 OC(CF)CNCC1CCCCO1 5140c929672533caa572cbeb0ede9e0e [0,1,0,1,0,0|2,0,0]=4 22510 B13R1.718 OC(CF)CNCC1CCCOC1 0259088dc32260af93f21b1c2d9a8f0c [0,1,0,1,0,0|2,0,0]=4 22511 B13R1.718 OC(CF)CNCC1CCOCC1 98c91e388a1c3986d1c5019f19dd0c0a [0,1,0,1,0,0|2,0,0]=4 22512 B13R1.718 OC(CF)CNCC1CCSCC1 d3b9848ee0e2852b39e0c5f296404586 [0,1,0,1,0,0|2,0,0]=4 22513 B13R1.718 OC(CF)CNC[C@@H]1CCCOC1 10bab0adf196b8c844c2e2c3dd93b491 [0,1,0,1,0,0|2,0,0]=4 22514 B13R1.718 OC(CF)CNC[C@H]1CCCOC1 7ee942ee15824c26030e3402f2171d5d [0,1,0,1,0,0|2,0,0]=4 22515 B13R1.718 OCC(F)CNCC1CCCCC1 00577ea25bc7b4ca159a127ab76baefa [0,1,0,1,0,0|2,0,0]=4 22516 B13R1.718 OCC(O)CCNC1CCCCC1 73c15ecf725bdf7cc253e039739603a7 [0,1,0,1,0,0|1,0,0]=3 22517 B13R1.718 OCC(O)CCNC1CCCCO1 d2ad760757d6e56ed2947b3407a6abb6 [0,1,0,1,0,0|2,0,0]=4 22518 B13R1.718 OCC(O)CCNC1CCCOC1 e7c4233bac5c9fe9fc6dbd61b734604e [0,1,0,1,0,0|2,0,0]=4 22519 B13R1.718 OCC(O)CCNC1CCOCC1 f9194b0105ca95d0272072b0eefa0481 [0,1,0,1,0,0|2,0,0]=4 22520 B13R1.718 OCC(O)CCNC1CCSCC1 8bfbab3613934d8e464a2c8a43206417 [0,1,0,1,0,0|2,0,0]=4 22521 B13R1.718 OCC(O)CNCC1CCCCC1 ce1bcbc5584b721f6dfd7a465fd0a199 [0,1,0,1,0,0|1,0,0]=3 22522 B13R1.718 OCC(O)CNCC1CCCCO1 044323fb7eae9dfbed6214cbbb769b83 [0,1,0,1,0,0|2,0,0]=4 22523 B13R1.718 OCC(O)CNCC1CCCOC1 0f67f3e7df392fcc86b5e814d7d4c3f2 [0,1,0,1,0,0|2,0,0]=4 22524 B13R1.718 OCC(O)CNCC1CCOCC1 8afb2ff5c45aed1b3308a99efc245fd8 [0,1,0,1,0,0|2,0,0]=4 22525 B13R1.718 OCC(O)CNCC1CCSCC1 691ef5f76268f15f77589790a8ab97b1 [0,1,0,1,0,0|2,0,0]=4 22526 B13R1.718 OCC(O)CNC[C@@H]1CCCOC1 7eebc4c9a3de98fade05d229d0e24311 [0,1,0,1,0,0|2,0,0]=4 22527 B13R1.718 OCC(O)CNC[C@H]1CCCOC1 f887747ea809af52b8bdb69125f5cee1 [0,1,0,1,0,0|2,0,0]=4 22528 B13R1.718 OCC(O)COCC1CCCCC1 27a989e0a2dc9f14fa42bfc5b7323853 [0,1,0,1,0,0|1,0,0]=3 22529 B13R1.718 OCC(O)COCC1CCCCO1 0477b9b6773703c676cc1d9f67d3d75d [0,1,0,1,0,0|2,0,0]=4 22530 B13R1.718 OCC(O)COCC1CCCOC1 b7cc974167798fa09142f8ae5a756d4b [0,1,0,1,0,0|2,0,0]=4 22531 B13R1.718 OCC(O)COCC1CCOCC1 deec26096d1e24e12a28cfc35e02c1cd [0,1,0,1,0,0|2,0,0]=4 22532 B13R1.718 OCC(O)COCC1CCSCC1 0b0211cb71d27a1cf3903a81424855c2 [0,1,0,1,0,0|2,0,0]=4 22533 B13R1.718 OCC(O)COC[C@@H]1CCCCO1 4903c0392b0a42ce3bc759a4406ee83f [0,1,0,1,0,0|2,0,0]=4 22534 B13R1.718 OCC(O)COC[C@@H]1CCCOC1 6245dd90683a477555907e72ed31e47b [0,1,0,1,0,0|2,0,0]=4 22535 B13R1.718 OCC(O)COC[C@H]1CCCCO1 42dce2d0a713516b8514c1c4009e15c2 [0,1,0,1,0,0|2,0,0]=4 22536 B13R1.718 OCC(O)COC[C@H]1CCCOC1 69ed48e06887dd7d324a2e2e54fa72b1 [0,1,0,1,0,0|2,0,0]=4 22537 B13R1.718 OC[C@@H](F)CNCC1CCCCC1 1464c563b90e366f87d8bcf8a4af7772 [0,1,0,1,0,0|2,0,0]=4 22538 B13R1.718 OC[C@@H](O)CNCC1CCCCC1 76d13a90c2f714c0858347fb266544e2 [0,1,0,1,0,0|1,0,0]=3 22539 B13R1.718 OC[C@@H](O)CNCC1CCCCO1 47492b4b28d4d08520f5354bb1caa61b [0,1,0,1,0,0|2,0,0]=4 22540 B13R1.718 OC[C@@H](O)CNCC1CCCOC1 5a6c62de46b879600b9da84fb4b13641 [0,1,0,1,0,0|2,0,0]=4 22541 B13R1.718 OC[C@@H](O)CNCC1CCOCC1 9b7709db6ecdfb03cd0a7d0597d3e1df [0,1,0,1,0,0|2,0,0]=4 22542 B13R1.718 OC[C@@H](O)CNCC1CCSCC1 3681ede809e31eda473815d5c38d0d75 [0,1,0,1,0,0|2,0,0]=4 22543 B13R1.718 OC[C@@H](O)CNC[C@@H]1CCCOC1 af3f8addf64f93fa00ba8dbced5d27bf [0,1,0,1,0,0|2,0,0]=4 22544 B13R1.718 OC[C@@H](O)CNC[C@H]1CCCOC1 5b01735a813dfb988b2e09dc6880c375 [0,1,0,1,0,0|2,0,0]=4 22545 B13R1.718 OC[C@@H](O)COCC1CCCCC1 c566e90700f3f29984557eff1314545d [0,1,0,1,0,0|1,0,0]=3 22546 B13R1.718 OC[C@@H](O)COCC1CCCCO1 ce210bfabcb61b8b0019c64a5c472c59 [0,1,0,1,0,0|2,0,0]=4 22547 B13R1.718 OC[C@@H](O)COCC1CCCOC1 deb4eaa92941be7170f301565f032a86 [0,1,0,1,0,0|2,0,0]=4 22548 B13R1.718 OC[C@@H](O)COCC1CCOCC1 419dd8fcf3b20332d5f5f5db62fc4eab [0,1,0,1,0,0|2,0,0]=4 22549 B13R1.718 OC[C@@H](O)COCC1CCSCC1 83b1f3d5efb22ad6a8c7a4e95c39dd15 [0,1,0,1,0,0|2,0,0]=4 22550 B13R1.718 OC[C@@H](O)COC[C@@H]1CCCCO1 032bd4c30a823d316f02fe4629759605 [0,1,0,1,0,0|2,0,0]=4 22551 B13R1.718 OC[C@@H](O)COC[C@@H]1CCCOC1 464e2da899e189a43524a5bcaf4d7191 [0,1,0,1,0,0|2,0,0]=4 22552 B13R1.718 OC[C@@H](O)COC[C@H]1CCCCO1 3107bd07f9804fa2d7f7b1ffd937a9c3 [0,1,0,1,0,0|2,0,0]=4 22553 B13R1.718 OC[C@@H](O)COC[C@H]1CCCOC1 e5053ad7b4a3700eb87be999cd4921dc [0,1,0,1,0,0|2,0,0]=4 22554 B13R1.718 OC[C@H](F)CNCC1CCCCC1 440679b9d580653c8c6414b60df242d1 [0,1,0,1,0,0|2,0,0]=4 22555 B13R1.718 OC[C@H](O)CNCC1CCCCC1 9d5208ea5050e88b2abf85a92755488a [0,1,0,1,0,0|1,0,0]=3 22556 B13R1.718 OC[C@H](O)CNCC1CCCCO1 203ee33f891fc1d195edd279e57be042 [0,1,0,1,0,0|2,0,0]=4 22557 B13R1.718 OC[C@H](O)CNCC1CCCOC1 568e9f2a44baae45a5b5da4eeaf5a0e4 [0,1,0,1,0,0|2,0,0]=4 22558 B13R1.718 OC[C@H](O)CNCC1CCOCC1 2b8551f26e7a554e5270824c49eb58f3 [0,1,0,1,0,0|2,0,0]=4 22559 B13R1.718 OC[C@H](O)CNCC1CCSCC1 3090bccbe9b83074db9c96fabaef58b8 [0,1,0,1,0,0|2,0,0]=4 22560 B13R1.718 OC[C@H](O)CNC[C@@H]1CCCOC1 b1d543d4630dfe7e717317bd27dc6566 [0,1,0,1,0,0|2,0,0]=4 22561 B13R1.718 OC[C@H](O)CNC[C@H]1CCCOC1 fe8e04c859c6ad6fa1e3f69d5278dcb3 [0,1,0,1,0,0|2,0,0]=4 22562 B13R1.718 OC[C@H](O)COCC1CCCCC1 6aece18bdc83ab34c45bea8feec17ce9 [0,1,0,1,0,0|1,0,0]=3 22563 B13R1.718 OC[C@H](O)COCC1CCCCO1 524ebb1691b0f793352574094ed0558a [0,1,0,1,0,0|2,0,0]=4 22564 B13R1.718 OC[C@H](O)COCC1CCCOC1 a1c2ad691077d4ceb78f1e21f143dcff [0,1,0,1,0,0|2,0,0]=4 22565 B13R1.718 OC[C@H](O)COCC1CCOCC1 9536b4d766d5cb5341cfe2fc823a8eea [0,1,0,1,0,0|2,0,0]=4 22566 B13R1.718 OC[C@H](O)COCC1CCSCC1 30856a391d5775894f9fcc6435bddea8 [0,1,0,1,0,0|2,0,0]=4 22567 B13R1.718 OC[C@H](O)COC[C@@H]1CCCCO1 33c92c2be8c6b742e568c4757aa7adac [0,1,0,1,0,0|2,0,0]=4 22568 B13R1.718 OC[C@H](O)COC[C@@H]1CCCOC1 447b74fbc76d4de4e0e09294906f3164 [0,1,0,1,0,0|2,0,0]=4 22569 B13R1.718 OC[C@H](O)COC[C@H]1CCCCO1 3305ad8c8f4f90bb1a6c4937651b2e31 [0,1,0,1,0,0|2,0,0]=4 22570 B13R1.718 OC[C@H](O)COC[C@H]1CCCOC1 03149a4ba77a03ed58615eb6f036c6f9 [0,1,0,1,0,0|2,0,0]=4 22571 B13R1.718 SCC(S)COCC1CCCCC1 229b907d03a7c80eedb63f5bfbeb8174 [0,1,0,1,0,0|1,1,0]=4 22572 B13R1.1689 C#CC(C)N1CCCCCCCC1 c717b6a40b148a378f4fe491e81c25a9 [0,1,0,1,0,0|2,0,0]=4 22573 B13R1.1689 C=CC(C)N1CCCCCCCC1 35fe4f7c694013ebfbe3fd337db0d3bd [0,1,0,1,0,0|2,0,0]=4 22574 B13R1.1689 CC(C#N)N1CCCCCCCC1 7f3df1101aa6a1ae1e2c43714ba2d2cb [0,1,0,1,0,0|2,0,0]=4 22575 B13R1.1689 CC(C=O)N1CCCCCCCC1 516aa3c1abe504ea106765182f995c68 [0,1,0,1,0,0|1,0,1]=4 22576 B13R1.1689 CC(CO)N1CCCCCCCC1 b375b4c18b260a9df173c75a085c0116 [0,1,0,1,0,0|1,0,0]=3 22577 B13R1.1689 CCC(C)N1CCCCCCCC1 53d55845ed0ea1081e4a016911c092c4 [0,1,0,1,0,0|2,0,0]=4 22578 B13R1.1689 C[C@@H](CO)N1CCCCCCCC1 ca34842cf37eee5aebfa85cace6305df [0,1,0,1,0,0|1,0,0]=3 22579 B13R1.1689 C[C@H](C=O)N1CCCCCCCC1 b9b81c9fe1f144c28c84be301c9bd748 [0,1,0,1,0,0|1,0,1]=4 22580 B13R1.1689 C[C@H](CO)N1CCCCCCCC1 9afab610419f1a0de6d369f7db1ed0e0 [0,1,0,1,0,0|1,0,0]=3 22581 B13R1.1711 BrCC(Br)COC1CCCCCC1 a53a1a3afec67cd831f5392073a652fc [0,1,0,1,0,0|2,0,0]=4 22582 B13R1.1711 C#CC(C)NCC1CCCCCC1 5233c518644d93482dc0d95db18f8e0e [0,1,0,1,0,0|2,0,0]=4 22583 B13R1.1711 C#CC(C)OCC1CCCCCC1 b39dfe43effead9a6cfc8882f1b31e78 [0,1,0,1,0,0|2,0,0]=4 22584 B13R1.1711 C#C[C@@H](C)NCC1CCCCCC1 d207c64a613f3e096258f05ca21401b5 [0,1,0,1,0,0|2,0,0]=4 22585 B13R1.1711 C#C[C@@H](C)OCC1CCCCCC1 61283d4cf59045940bac7ccbbc60ab41 [0,1,0,1,0,0|2,0,0]=4 22586 B13R1.1711 C#C[C@H](C)NCC1CCCCCC1 50e03173c625437f9f3c6ee35a05e643 [0,1,0,1,0,0|2,0,0]=4 22587 B13R1.1711 C#C[C@H](C)OCC1CCCCCC1 8102e725608d7fae5f90e239a929337c [0,1,0,1,0,0|2,0,0]=4 22588 B13R1.1711 C=CC(C)COC1CCCCCC1 5a2eedd186636d69f53541ae987f6a80 [0,1,0,1,0,0|2,0,0]=4 22589 B13R1.1711 C=CC(C)NCC1CCCCCC1 d4a143bbffcea63d5c1af8004d0c6c53 [0,1,0,1,0,0|2,0,0]=4 22590 B13R1.1711 C=CC(C)OCC1CCCCCC1 4cc79fec7f986f395f5f094654e40f1b [0,1,0,1,0,0|2,0,0]=4 22591 B13R1.1711 C=CC(O)CNC1CCCCCC1 d9dccefbe83027ebc33f6b636dd8f117 [0,1,0,1,0,0|1,0,1]=4 22592 B13R1.1711 C=C[C@H](C)OCC1CCCCCC1 5dfa173025528b2586ba1670b4a3a3c2 [0,1,0,1,0,0|2,0,0]=4 22593 B13R1.1711 CC(C#N)CNC1CCCCCC1 e47c3d038fba8ef282ab4b18bbd67703 [0,1,0,1,0,0|2,0,0]=4 22594 B13R1.1711 CC(C#N)COC1CCCCCC1 808731d78605e645b771e19a0b990cf7 [0,1,0,1,0,0|2,0,0]=4 22595 B13R1.1711 CC(C#N)NCC1CCCCCC1 227644fc9be661ed288b5771de758879 [0,1,0,1,0,0|2,0,0]=4 22596 B13R1.1711 CC(C#N)OCC1CCCCCC1 4f02c8b28c78540ba5d4b2eda0ddb84b [0,1,0,1,0,0|2,0,0]=4 22597 B13R1.1711 CC(C=O)NCC1CCCCCC1 e5841922590e50e0a4f128774b4691c1 [0,1,0,1,0,0|1,0,1]=4 22598 B13R1.1711 CC(C=O)OCC1CCCCCC1 b7bf998ac059db8df45d70cbf8ef944c [0,1,0,1,0,0|1,0,1]=4 22599 B13R1.1711 CC(CF)OCC1CCCCCC1 c2273b24cacd4db98d2ba2f877d06b2c [0,1,0,1,0,0|2,0,0]=4 22600 B13R1.1711 CC(CO)CCN1CCCCCC1 9bb9b3085892ccf10491ef760e798e90 [0,1,0,1,0,0|1,0,0]=3 22601 B13R1.1711 CC(CO)CCN1CCCOCC1 c9588385faa7d8520b7ba5ab54dbb79f [0,1,0,1,0,0|2,0,0]=4 22602 B13R1.1711 CC(CO)CNC1CCCCCC1 2d5fe3c3353209c38aa89e585c723e1f [0,1,0,1,0,0|1,0,0]=3 22603 B13R1.1711 CC(CO)CNC1CCCOCC1 619a41332598f81d9d5dbb51fc7ee6d2 [0,1,0,1,0,0|2,0,0]=4 22604 B13R1.1711 CC(CO)NCC1CCCCCC1 ba232a47839348c6c784325683a2a57e [0,1,0,1,0,0|1,0,0]=3 22605 B13R1.1711 CC(CS)OCC1CCCCCC1 308bf38b028f274b7081f78267f8c7a3 [0,1,0,1,0,0|1,1,0]=4 22606 B13R1.1711 CCC(C)CCN1CCCCCC1 62ca2aa47673f68ee3dfcb84964fa1b8 [0,1,0,1,0,0|2,0,0]=4 22607 B13R1.1711 CCC(C)CNC1CCCCCC1 2199f5110e2ec7023cd83c1fc03e6751 [0,1,0,1,0,0|2,0,0]=4 22608 B13R1.1711 CCC(C)COC1CCCCCC1 6be58c83ed3c67f43f2c8f04f76a270b [0,1,0,1,0,0|2,0,0]=4 22609 B13R1.1711 CCC(C)NCC1CCCCCC1 3e2e72def5347d27e4eb53adeadcadec [0,1,0,1,0,0|2,0,0]=4 22610 B13R1.1711 CCC(C)OCC1CCCCCC1 402c311140cb145e40065ad3364efa9c [0,1,0,1,0,0|2,0,0]=4 22611 B13R1.1711 CCC(O)CNC1CCCCCC1 b8d5b6a990fc3030772f4f4b9fce7633 [0,1,0,1,0,0|1,0,0]=3 22612 B13R1.1711 CCC(O)CNC1CCCOCC1 1559f519e49b993bdf261bed32921ba5 [0,1,0,1,0,0|2,0,0]=4 22613 B13R1.1711 CC[C@@H](C)CNC1CCCCCC1 b2b34d0cdffbf522481c990ee3b37e4f [0,1,0,1,0,0|2,0,0]=4 22614 B13R1.1711 CC[C@@H](C)COC1CCCCCC1 087c66448a895f5dd96193e018b51bbd [0,1,0,1,0,0|2,0,0]=4 22615 B13R1.1711 CC[C@@H](C)NCC1CCCCCC1 4bd9eca11c374f19ea095ee96bc1107d [0,1,0,1,0,0|2,0,0]=4 22616 B13R1.1711 CC[C@@H](C)OCC1CCCCCC1 f7ae6aae3616bf03ed334df6e663fe3d [0,1,0,1,0,0|2,0,0]=4 22617 B13R1.1711 CC[C@@H](O)CNC1CCCCCC1 c6e8e533fb2d1dfa9dc7681883c36ef3 [0,1,0,1,0,0|1,0,0]=3 22618 B13R1.1711 CC[C@@H](O)CNC1CCCOCC1 ea63cdea71b71622dc83e465f2927870 [0,1,0,1,0,0|2,0,0]=4 22619 B13R1.1711 CC[C@H](C)CNC1CCCCCC1 873a3a80632b7a2f3d398e76232635f0 [0,1,0,1,0,0|2,0,0]=4 22620 B13R1.1711 CC[C@H](C)COC1CCCCCC1 c263dc6c4f41dcbd648f3edf64c962d0 [0,1,0,1,0,0|2,0,0]=4 22621 B13R1.1711 CC[C@H](C)NCC1CCCCCC1 51aa42d133636eb2ef52c526da96ae3b [0,1,0,1,0,0|2,0,0]=4 22622 B13R1.1711 CC[C@H](C)OCC1CCCCCC1 ec4277983f71f97b4fbf2f73de1310f2 [0,1,0,1,0,0|2,0,0]=4 22623 B13R1.1711 CN(CO)CCN1CCCCCC1 15fbcae06feabf245569c94144b16ac7 [0,1,0,1,0,0|2,0,0]=4 22624 B13R1.1711 COC(C)CNC1CCCCCC1 d9aa6610004e35bb188fa9e1f2341ad1 [0,1,0,1,0,0|1,0,0]=3 22625 B13R1.1711 COC(C)CNC1CCCOCC1 9479a623de54d17d320930d18486d2b3 [0,1,0,1,0,0|2,0,0]=4 22626 B13R1.1711 COC(C)COC1CCCCCC1 345b56aa360d3a24d0aab5e24889dd72 [0,1,0,1,0,0|1,0,0]=3 22627 B13R1.1711 COC(C)COC1CCCOCC1 9c9229631c266d0e21d52119a473bd81 [0,1,0,1,0,0|2,0,0]=4 22628 B13R1.1711 CO[C@@H](C)CNC1CCCCCC1 60e7c35c4ad9d1ca2267d77f71e24872 [0,1,0,1,0,0|1,0,0]=3 22629 B13R1.1711 CO[C@@H](C)CNC1CCCOCC1 6a07065a755b676665aae972b586df79 [0,1,0,1,0,0|2,0,0]=4 22630 B13R1.1711 CO[C@@H](C)COC1CCCCCC1 770abc8f152df7ca1a378fb4ef6f0efd [0,1,0,1,0,0|1,0,0]=3 22631 B13R1.1711 CO[C@@H](C)COC1CCCOCC1 efa70461486d132a6e3cd02e2eb0ac1b [0,1,0,1,0,0|2,0,0]=4 22632 B13R1.1711 CO[C@H](C)CNC1CCCCCC1 a46ae98cc9ebddb7430f5bb60571433d [0,1,0,1,0,0|1,0,0]=3 22633 B13R1.1711 CO[C@H](C)CNC1CCCOCC1 494e9e2e5be8ebfbc9318ba203b63322 [0,1,0,1,0,0|2,0,0]=4 22634 B13R1.1711 CO[C@H](C)COC1CCCCCC1 47a5fc7fe1060f2e658f516d778ee981 [0,1,0,1,0,0|1,0,0]=3 22635 B13R1.1711 CO[C@H](C)COC1CCCOCC1 b71cffb4536e3c7689bfc269d4aac659 [0,1,0,1,0,0|2,0,0]=4 22636 B13R1.1711 C[C@@H](CO)CNC1CCCCCC1 ab9f10119196b61c961e200a8c8c1af9 [0,1,0,1,0,0|1,0,0]=3 22637 B13R1.1711 C[C@@H](CO)CNC1CCCOCC1 3e11f8ebe80ea9de1e1dcc0686cb582f [0,1,0,1,0,0|2,0,0]=4 22638 B13R1.1711 C[C@@H](CO)NCC1CCCCCC1 36edfb66250ed727d3edecfd4f093bc5 [0,1,0,1,0,0|1,0,0]=3 22639 B13R1.1711 C[C@H](C=O)NCC1CCCCCC1 46eeaaf4a06a37585542455aa92946c2 [0,1,0,1,0,0|1,0,1]=4 22640 B13R1.1711 C[C@H](C=O)OCC1CCCCCC1 2dea65cf85ec84f3b26b092e231f5f1f [0,1,0,1,0,0|1,0,1]=4 22641 B13R1.1711 C[C@H](CO)CNC1CCCCCC1 66d3de579d9734099fcc1dfef6de7220 [0,1,0,1,0,0|1,0,0]=3 22642 B13R1.1711 C[C@H](CO)CNC1CCCOCC1 14c7fd2cd52eed33e8c987eafb8bfc02 [0,1,0,1,0,0|2,0,0]=4 22643 B13R1.1711 C[C@H](CO)NCC1CCCCCC1 e0ba1761b5f04a933e7c0e5d1096ec51 [0,1,0,1,0,0|1,0,0]=3 22644 B13R1.1711 C[C@H](CS)OCC1CCCCCC1 30f5a5ef949351ee0155b25da8d7964f [0,1,0,1,0,0|1,1,0]=4 22645 B13R1.1711 ClCC(Cl)COC1CCCCCC1 6b8ebcb30c785f3d466095ac7ff7da71 [0,1,0,1,0,0|2,0,0]=4 22646 B13R1.1711 OC(CF)CNC1CCCCCC1 d3ce60964e2afca20930815e7eca3f85 [0,1,0,1,0,0|1,0,0]=3 22647 B13R1.1711 OC(CF)CNC1CCCOCC1 0acbfd3fd9cb589293bbc64c97940c3f [0,1,0,1,0,0|2,0,0]=4 22648 B13R1.1711 OCC(F)CNC1CCCCCC1 0dc317942579d53ab3bf019e71d21e42 [0,1,0,1,0,0|2,0,0]=4 22649 B13R1.1711 OCC(O)CNC1CCCCCC1 8ec030f7adcecd65198ea4be81517e11 [0,1,0,1,0,0|1,0,0]=3 22650 B13R1.1711 OCC(O)CNC1CCCOCC1 aa24f5c00ccef8a81f603e34f64dc637 [0,1,0,1,0,0|2,0,0]=4 22651 B13R1.1711 OCC(O)COC1CCCCCC1 660805b328aad45e508c523aab30388b [0,1,0,1,0,0|1,0,0]=3 22652 B13R1.1711 OCC(O)COC1CCCOCC1 1c28630805e40685243f9fa328c118ee [0,1,0,1,0,0|2,0,0]=4 22653 B13R1.1711 OC[C@@H](F)CNC1CCCCCC1 d6cb43ad6080aa35812d202a4079e8b4 [0,1,0,1,0,0|2,0,0]=4 22654 B13R1.1711 OC[C@@H](O)CNC1CCCCCC1 16c8aae6abf1fe473ed41cfea0749297 [0,1,0,1,0,0|1,0,0]=3 22655 B13R1.1711 OC[C@@H](O)CNC1CCCOCC1 70d4c754ba09f2fff00f28432077f61c [0,1,0,1,0,0|2,0,0]=4 22656 B13R1.1711 OC[C@@H](O)COC1CCCCCC1 3ee870c210f6fc3374fd026877ce2d01 [0,1,0,1,0,0|1,0,0]=3 22657 B13R1.1711 OC[C@@H](O)COC1CCCOCC1 eb40e8463ed42f6f2a93e0a751354f0a [0,1,0,1,0,0|2,0,0]=4 22658 B13R1.1711 OC[C@H](F)CNC1CCCCCC1 a051ce4d7ae5183c8d54a1ca7755a6ea [0,1,0,1,0,0|2,0,0]=4 22659 B13R1.1711 OC[C@H](O)CNC1CCCCCC1 bd533dc52c0988b65814b028d75984b7 [0,1,0,1,0,0|1,0,0]=3 22660 B13R1.1711 OC[C@H](O)CNC1CCCOCC1 42d3a2cc9e9b2b7ca48d050c1730a3f1 [0,1,0,1,0,0|2,0,0]=4 22661 B13R1.1711 OC[C@H](O)COC1CCCCCC1 1188f2c5c340ad53073e6389579b5395 [0,1,0,1,0,0|1,0,0]=3 22662 B13R1.1711 OC[C@H](O)COC1CCCOCC1 731b480b15b70a6f8cbce10727de3e84 [0,1,0,1,0,0|2,0,0]=4 22663 B13R1.1711 SCC(S)COC1CCCCCC1 4ca77d369bb012815b45f9946afd7788 [0,1,0,1,0,0|1,1,0]=4 22664 B13R1.1870 C#CC(C)NC1CCCCCCC1 d7f56966136e48f5bf6de8066b7241f3 [0,1,0,1,0,0|2,0,0]=4 22665 B13R1.1870 C#CC(C)OC1CCCCCCC1 b6e91972bea9f49f5ef8839e57acc2d6 [0,1,0,1,0,0|2,0,0]=4 22666 B13R1.1870 C=CC(C)NC1CCCCCCC1 307cbd36a8f41c3f6339342ef60fd9d9 [0,1,0,1,0,0|2,0,0]=4 22667 B13R1.1870 C=CC(C)OC1CCCCCCC1 949ac575f736d5b5f61f8305cefd009d [0,1,0,1,0,0|2,0,0]=4 22668 B13R1.1870 CC(C#N)CN1CCCCCCC1 eace3f347446f8536972bc050185efdc [0,1,0,1,0,0|2,0,0]=4 22669 B13R1.1870 CC(C#N)NC1CCCCCCC1 5dd1493d6d68cfc650456a69232f793a [0,1,0,1,0,0|2,0,0]=4 22670 B13R1.1870 CC(C#N)OC1CCCCCCC1 bcd128a73eae223b97956851d430c801 [0,1,0,1,0,0|2,0,0]=4 22671 B13R1.1870 CC(C=O)NC1CCCCCCC1 3216e01e72d27f020567619eaeca2528 [0,1,0,1,0,0|1,0,1]=4 22672 B13R1.1870 CC(C=O)OC1CCCCCCC1 6e4523593df616706ed3fd48c2f94248 [0,1,0,1,0,0|1,0,1]=4 22673 B13R1.1870 CC(CO)CN1CCCCCCC1 48a558be5ac86183ee2f3c5582988c1a [0,1,0,1,0,0|1,0,0]=3 22674 B13R1.1870 CC(CO)NC1CCCCCCC1 8f0aa723b281cc1ccd8b0388710a4c03 [0,1,0,1,0,0|1,0,0]=3 22675 B13R1.1870 CCC(C)CN1CCCCCCC1 6a1ea3742f900561cecb3672372eda8d [0,1,0,1,0,0|2,0,0]=4 22676 B13R1.1870 CCC(C)NC1CCCCCCC1 9143c52dc7e16cf0f72c18ff6cb9c042 [0,1,0,1,0,0|2,0,0]=4 22677 B13R1.1870 CCC(C)OC1CCCCCCC1 9b2ef88b37def0b54a0e6344819951bb [0,1,0,1,0,0|2,0,0]=4 22678 B13R1.1870 CCC(O)CN1CCCCCCC1 15d814eaafdd2c254dcb5d426bedd7f7 [0,1,0,1,0,0|1,0,0]=3 22679 B13R1.1870 CC[C@@H](C)CN1CCCCCCC1 b5a2c27af75f55b28092f8f950f4bc2d [0,1,0,1,0,0|2,0,0]=4 22680 B13R1.1870 CC[C@H](C)CN1CCCCCCC1 6dd805bc4b387e13a38b41280a373a46 [0,1,0,1,0,0|2,0,0]=4 22681 B13R1.1870 COC(C)CN1CCCCCCC1 b06fb70bd426164aa7222841f33d6384 [0,1,0,1,0,0|1,0,0]=3 22682 B13R1.1870 CO[C@@H](C)CN1CCCCCCC1 367965626bbc379ddf5969b650f6f275 [0,1,0,1,0,0|1,0,0]=3 22683 B13R1.1870 CO[C@H](C)CN1CCCCCCC1 a0e2c187b2e186d4101fcadd5856403a [0,1,0,1,0,0|1,0,0]=3 22684 B13R1.1870 C[C@@H](CO)CN1CCCCCCC1 a38a194ca00baebde3eb621bf414325d [0,1,0,1,0,0|1,0,0]=3 22685 B13R1.1870 C[C@@H](CO)NC1CCCCCCC1 16c2b9e33f78424f6d3b9b0b3c4eee37 [0,1,0,1,0,0|1,0,0]=3 22686 B13R1.1870 C[C@H](C=O)NC1CCCCCCC1 4b71d1169649474ef7c0c440604d63d5 [0,1,0,1,0,0|1,0,1]=4 22687 B13R1.1870 C[C@H](C=O)OC1CCCCCCC1 d8f578811aa57222b02b9b6e29a0048e [0,1,0,1,0,0|1,0,1]=4 22688 B13R1.1870 C[C@H](CO)CN1CCCCCCC1 330d86d2e5b70a4377f20fd663da902a [0,1,0,1,0,0|1,0,0]=3 22689 B13R1.1870 C[C@H](CO)NC1CCCCCCC1 9f50cd78ff7d3c4ca2fa9dbaaf8e0fb2 [0,1,0,1,0,0|1,0,0]=3 22690 B13R1.1870 OC(CF)CN1CCCCCCC1 9fc25195a5a49ead735e0b5fd2bd8aa9 [0,1,0,1,0,0|1,0,0]=3 22691 B13R1.1870 OCC(O)CN1CCCCCCC1 50eda93a6b78e764f993da4047421b5d [0,1,0,1,0,0|1,0,0]=3 22692 B13R1.1870 OC[C@@H](O)CN1CCCCCCC1 4b3401921b7110f8fe674da6553c864e [0,1,0,1,0,0|1,0,0]=3 22693 B13R1.1870 OC[C@H](O)CN1CCCCCCC1 501e1fee1e27542393d715a5db18276f [0,1,0,1,0,0|1,0,0]=3 22694 B13R1.1919 CCCCN1CCCOC(C1)CO 671ea0773cea1a0f976e29666210a1f8 [0,1,0,1,0,0|2,0,0]=4 22695 B13R1.1919 CCCCN1CCOCC(C1)CO 23d4c39ec04891a8e9ee0ba51e3d5296 [0,1,0,1,0,0|2,0,0]=4 22696 B13R1.1919 CCCCN1CCOCC(C1)OC 72beee7a3e00424854ea5ebefb911bf3 [0,1,0,1,0,0|2,0,0]=4 22697 B13R1.1919 CCCCN1CCOC[C@@H](C1)OC 465371d80eed4845a89ebfe62a148f5c [0,1,0,1,0,0|2,0,0]=4 22698 B13R1.1919 CCCCN1CCOC[C@H](C1)OC c32defc15ec18985ebea0ee10f8c3f3b [0,1,0,1,0,0|2,0,0]=4 22699 B13R1.1919 CCCNC1CCCCC(C1)OC 3583f7d62e0ee42884c0f8ad8782075a [0,1,0,1,0,0|1,0,0]=3 22700 B13R1.1919 COC1CCCCC(C1)NCCF 8009d2b968a1589f4e6583db41ac6e24 [0,1,0,1,0,0|2,0,0]=4 22701 B13R1.1919 COC1CCCCC(C1)NCCO 777ff2c1c4aecc468194b8a891ca12d7 [0,1,0,1,0,0|2,0,0]=4 22702 B13R1.1919 COC1CCCCC(C1)NCCS 896b3b46f9fc9a299e6308fd175a83a6 [0,1,0,1,0,0|2,0,0]=4 22703 B13R1.1919 COC1CCCCC(C1)NCSC bf8925fbf261a2dcdb9c69bac30669ed [0,1,0,1,0,0|2,0,0]=4 22704 B13R1.1919 COCNC1CCCCC(C1)OC 11fd2da964eb156972fdca888c0ee680 [0,1,0,1,0,0|2,0,0]=4 22705 B13R1.2439 C#CC1CC(C1)COCCCCC cf56faff2e092266072e0afaa703c25f [0,1,0,1,0,0|2,0,0]=4 22706 B13R1.2439 C#C[C@H]1C[C@@H](C1)COCCCCC 694f673a2347a9fc45f85511342bac28 [0,1,0,1,0,0|2,0,0]=4 22707 B13R1.2439 CCCCCCCN1CC(C1)C#N 8ae326eac8838fcf8ad7d0d9f3d8d3f3 [0,1,0,1,0,0|2,0,0]=4 22708 B13R1.2439 CCCCCCCN1CC(C1)CC 41ee8aaf21d69cfddeb38b80a7caf24b [0,1,0,1,0,0|2,0,0]=4 22709 B13R1.2439 CCCCCCCN1CC(C1)CF d63167722a03c0daf03be0da02109639 [0,1,0,1,0,0|2,0,0]=4 22710 B13R1.2439 CCCCCCCN1CC(C1)CO 24e76fd86e988222121c2393236270d6 [0,1,0,1,0,0|1,0,0]=3 22711 B13R1.2439 CCCCCCCN1CC(C1)OC b8ab8a377583c87c0d5b770c511908d5 [0,1,0,1,0,0|1,0,0]=3 22712 B13R1.2439 CCCCCCCN1CC(C1)SC 172c7ac07101851871b5f8445596e4f5 [0,1,0,1,0,0|1,1,0]=4 22713 B13R1.2439 CCCCCCNC1CC(C1)C#N 5c3890ce52d06fcaa440b3720785b122 [0,1,0,1,0,0|2,0,0]=4 22714 B13R1.2439 CCCCCCNC1CC(C1)CO 6259d79255da74a97b9331f28c0d7f9a [0,1,0,1,0,0|1,0,0]=3 22715 B13R1.2439 CCCCCCNC1CC(C1)OC 0b6b83c8bb28b2f5caf0965159f66bfc [0,1,0,1,0,0|1,0,0]=3 22716 B13R1.2439 CCCCCCN[C@H]1C[C@@H](C1)CO 214e52136b2da36a57630f051cd7a8bf [0,1,0,1,0,0|1,0,0]=3 22717 B13R1.2439 CCCCCCN[C@H]1C[C@@H](C1)OC 50aa3a0d3e296935364893bca8a7ccd8 [0,1,0,1,0,0|1,0,0]=3 22718 B13R1.2439 CCCCCCN[C@H]1C[C@H](C1)CO be6de143967028974f8b73a24bf1a184 [0,1,0,1,0,0|1,0,0]=3 22719 B13R1.2439 CCCCCCN[C@H]1C[C@H](C1)OC f263b3f5d70164158efcaa125ac5a8dc [0,1,0,1,0,0|1,0,0]=3 22720 B13R1.2439 CCCCCCOC1CC(C1)C#N a79b9bce0cf96b98fde7c5140877dac4 [0,1,0,1,0,0|2,0,0]=4 22721 B13R1.2439 CCCCCCOC1CC(C1)OC 4c20e3fd4a92aa46b7b9f4f79341f406 [0,1,0,1,0,0|1,0,0]=3 22722 B13R1.2439 CCCCCCOC1CN(C1)CO 138ddf879964a5f1dc902c1697bea71e [0,1,0,1,0,0|2,0,0]=4 22723 B13R1.2439 CCCCCCO[C@H]1C[C@@H](C1)C#N 32f4a8cbc3f3d60828669deb15fcfd55 [0,1,0,1,0,0|2,0,0]=4 22724 B13R1.2439 CCCCCCO[C@H]1C[C@@H](C1)OC dec88f5d63e81a2913a1261fcfa9f56c [0,1,0,1,0,0|1,0,0]=3 22725 B13R1.2439 CCCCCCO[C@H]1C[C@H](C1)C#N 787cb2d38b3c64d9085d636798945aa9 [0,1,0,1,0,0|2,0,0]=4 22726 B13R1.2439 CCCCCCO[C@H]1C[C@H](C1)CF 0004a817f83ee0846f7c1a6bb80953c2 [0,1,0,1,0,0|2,0,0]=4 22727 B13R1.2439 CCCCCCO[C@H]1C[C@H](C1)OC 6521e41bc7e31fb6dc34037a710c9b57 [0,1,0,1,0,0|1,0,0]=3 22728 B13R1.2439 CCCCCNCC1CC(C1)C=O bf22a5683e3fbb8820beafbfca533936 [0,1,0,1,0,0|1,0,1]=4 22729 B13R1.2439 CCCCCNCC1CC(C1)CO 6ab3bc761a6e3e377ef6263a7bd27be0 [0,1,0,1,0,0|1,0,0]=3 22730 B13R1.2439 CCCCCNCC1CC(C1)OC 48b3690f20d16dad98f712ac54fa39da [0,1,0,1,0,0|1,0,0]=3 22731 B13R1.2439 CCCCCOCC1CC(C1)C#N 101fe373fba35f92772203891ee9e79f [0,1,0,1,0,0|2,0,0]=4 22732 B13R1.2439 CCCCCOCC1CC(C1)C=O aba2e479eb1316be64982167ad042af3 [0,1,0,1,0,0|1,0,1]=4 22733 B13R1.2439 CCCCCOCC1CC(C1)OC f3dd07261c4da61bb08cf9c33989b0d3 [0,1,0,1,0,0|1,0,0]=3 22734 B13R1.2439 CCCCCOC[C@H]1C[C@@H](C1)OC baf05e506586bbf5f8a9b1fd179c5224 [0,1,0,1,0,0|1,0,0]=3 22735 B13R1.2439 CCCCCOC[C@H]1C[C@H](C1)OC fd2bf3afaafc7d00eaafbf7d87e75f77 [0,1,0,1,0,0|1,0,0]=3 22736 B13R1.2439 CCCCNCCN1CC(C1)OC 8854ad8787dcfa947c020da5b826b53e [0,1,0,1,0,0|2,0,0]=4 22737 B13R1.2439 CCCCOCCN1CC(C1)CO 1d87a64eb8bc7bc0ee324fda562242d7 [0,1,0,1,0,0|2,0,0]=4 22738 B13R1.2439 CCCCOCCN1CC(C1)OC 6349c299d0206c76ed8e3c0401e7f128 [0,1,0,1,0,0|2,0,0]=4 22739 B13R1.2439 CCCCOCNC1CC(C1)CO d631aa42f4d5bfef2dec4b604e9acc0a [0,1,0,1,0,0|2,0,0]=4 22740 B13R1.2439 CCCCOCNC1CC(C1)OC e8d31df25febb502ae03fe5da09e160f [0,1,0,1,0,0|2,0,0]=4 22741 B13R1.2439 CCCCOCN[C@H]1C[C@@H](C1)CO b8156a1eb98e719ae4345aed9d196c56 [0,1,0,1,0,0|2,0,0]=4 22742 B13R1.2439 CCCCOCN[C@H]1C[C@@H](C1)OC 60cc8e2450c47c4b81aa2f71faea420a [0,1,0,1,0,0|2,0,0]=4 22743 B13R1.2439 CCCCOCN[C@H]1C[C@H](C1)CO 8c1e3a86c4f0707ab8b39a8470f1d38d [0,1,0,1,0,0|2,0,0]=4 22744 B13R1.2439 CCCCOCN[C@H]1C[C@H](C1)OC c9f524a7a8b8841ef4e04c79a4bc356b [0,1,0,1,0,0|2,0,0]=4 22745 B13R1.2439 CCCCOCOC1CC(C1)OC d5446ae36bb44e3d3248f50bf876165d [0,1,0,1,0,0|2,0,0]=4 22746 B13R1.2439 CCCCOCO[C@H]1C[C@@H](C1)OC 2a5c2d04aa8c5498ec71ec1b66a738eb [0,1,0,1,0,0|2,0,0]=4 22747 B13R1.2439 CCCCOCO[C@H]1C[C@H](C1)OC 048c379b893b6d95de170626b81c0407 [0,1,0,1,0,0|2,0,0]=4 22748 B13R1.2439 CCCOCCCN1CC(C1)CO bb185f0f0b6cdd52edd7660e566e224b [0,1,0,1,0,0|2,0,0]=4 22749 B13R1.2439 CCCOCCCN1CC(C1)OC b82a1b0b5c6f975ef03ff67bcd82797e [0,1,0,1,0,0|2,0,0]=4 22750 B13R1.2439 CCCOCCNC1CC(C1)CO c19203e5b3381c4a2f36651a8d0e838b [0,1,0,1,0,0|2,0,0]=4 22751 B13R1.2439 CCCOCCNC1CC(C1)OC 485559cfc61a3b23841d0daa94d81021 [0,1,0,1,0,0|2,0,0]=4 22752 B13R1.2439 CCCOCCN[C@H]1C[C@@H](C1)CO 32241c70dc954b9980402bc030c5f739 [0,1,0,1,0,0|2,0,0]=4 22753 B13R1.2439 CCCOCCN[C@H]1C[C@@H](C1)OC 56a3182df9b2e2a507b32b023ebb7720 [0,1,0,1,0,0|2,0,0]=4 22754 B13R1.2439 CCCOCCN[C@H]1C[C@H](C1)CO dec9d652659db97f655c0c4ef7d8e290 [0,1,0,1,0,0|2,0,0]=4 22755 B13R1.2439 CCCOCCN[C@H]1C[C@H](C1)OC d63897c02363390a9a7938d1b6f89a43 [0,1,0,1,0,0|2,0,0]=4 22756 B13R1.2439 CCCOCCOC1CC(C1)OC af2e3daa7bcfff4d50728764f151a0fc [0,1,0,1,0,0|2,0,0]=4 22757 B13R1.2439 CCCOCCO[C@H]1C[C@@H](C1)OC 2b1f30dab92ba3e84ded7a2015ab7b27 [0,1,0,1,0,0|2,0,0]=4 22758 B13R1.2439 CCCOCCO[C@H]1C[C@H](C1)OC d97452ca6d6c4a59d4e06014af6d5b37 [0,1,0,1,0,0|2,0,0]=4 22759 B13R1.2439 CCCSCCOC1CC(C1)OC afe1e14a8c87e9f6a3d0b542b582acca [0,1,0,1,0,0|2,0,0]=4 22760 B13R1.2439 CCCSCCO[C@H]1C[C@@H](C1)OC 4f4a0a2b75b3a8a34651da18ac0b4f2a [0,1,0,1,0,0|2,0,0]=4 22761 B13R1.2439 CCOCCCNC1CC(C1)CO 0420707cf2575cfd041e12e2b4622bd4 [0,1,0,1,0,0|2,0,0]=4 22762 B13R1.2439 CCOCCCNC1CC(C1)OC 6319cf38e4bd6f149fe2bd677efc7fb4 [0,1,0,1,0,0|2,0,0]=4 22763 B13R1.2439 CCOCCCN[C@H]1C[C@@H](C1)CO 7f6a4aaad6be5ac57a88b2f37352fb67 [0,1,0,1,0,0|2,0,0]=4 22764 B13R1.2439 CCOCCCN[C@H]1C[C@@H](C1)OC 7ddf2bb4a6f13690b2b8e1405dbb515b [0,1,0,1,0,0|2,0,0]=4 22765 B13R1.2439 CCOCCCN[C@H]1C[C@H](C1)CO 3e247facd3c6b35ccfa185879baafd85 [0,1,0,1,0,0|2,0,0]=4 22766 B13R1.2439 CCOCCCN[C@H]1C[C@H](C1)OC 465b211ef7b3eb1ff71a9f1db5721f52 [0,1,0,1,0,0|2,0,0]=4 22767 B13R1.2439 CCOCCCOC1CC(C1)OC a20cc9532b10e79cf5463b0b625d4bec [0,1,0,1,0,0|2,0,0]=4 22768 B13R1.2439 CCOCCCO[C@H]1C[C@@H](C1)OC b20157309dd36e40e452dabcd7aca43d [0,1,0,1,0,0|2,0,0]=4 22769 B13R1.2439 CCOCCCO[C@H]1C[C@H](C1)OC 40a7370d3de718c696182c3d2ca6b233 [0,1,0,1,0,0|2,0,0]=4 22770 B13R1.2439 CCOCCNCC1CC(C1)CO c87cf7205f5c7d3fa0c5e8071a7fbe09 [0,1,0,1,0,0|2,0,0]=4 22771 B13R1.2439 CCOCCNCC1CC(C1)OC bf9a886f349549f7b48f431b2b36e4e8 [0,1,0,1,0,0|2,0,0]=4 22772 B13R1.2439 CCOCCOCC1CC(C1)OC 649bc8e185ac85caa5d9a916944cf10a [0,1,0,1,0,0|2,0,0]=4 22773 B13R1.2439 CCOCCOC[C@H]1C[C@@H](C1)OC b9b87db3b366c07bb7737e6aa725a5a3 [0,1,0,1,0,0|2,0,0]=4 22774 B13R1.2439 CCOCCOC[C@H]1C[C@H](C1)OC 8c740d88fa67e21bf5d8d0459b65bfc3 [0,1,0,1,0,0|2,0,0]=4 22775 B13R1.2439 CCSCCCNC1CC(C1)CO 67bdb1a9eee83eb541f3346affdcb852 [0,1,0,1,0,0|2,0,0]=4 22776 B13R1.2439 CCSCCCNC1CC(C1)OC 8d543a1fccead5ff680c6d3a750ebf7d [0,1,0,1,0,0|2,0,0]=4 22777 B13R1.2439 CCSCCCN[C@H]1C[C@@H](C1)CO 7c6cdea43a5b5e6255e58c9b8aa512d2 [0,1,0,1,0,0|2,0,0]=4 22778 B13R1.2439 CCSCCCN[C@H]1C[C@@H](C1)OC e5d3627cc60cc04bbf60e49ebca433d0 [0,1,0,1,0,0|2,0,0]=4 22779 B13R1.2439 CCSCCCN[C@H]1C[C@H](C1)CO 6e22ee93e5a04a7c0a3b6cc9f377b952 [0,1,0,1,0,0|2,0,0]=4 22780 B13R1.2439 CCSCCCN[C@H]1C[C@H](C1)OC 45d363234725c6d014e9aa45078c0efc [0,1,0,1,0,0|2,0,0]=4 22781 B13R1.2439 CCSCCCOC1CC(C1)OC 676cad554085fc3b48906d8a4adb71d3 [0,1,0,1,0,0|2,0,0]=4 22782 B13R1.2439 CCSCCCO[C@H]1C[C@@H](C1)OC 68260f885e000736273df1ed513956b0 [0,1,0,1,0,0|2,0,0]=4 22783 B13R1.2439 CCSCCCO[C@H]1C[C@H](C1)OC cc4e39d434521a76655ba4b8d8f2db7e [0,1,0,1,0,0|2,0,0]=4 22784 B13R1.2439 CCSCCNCC1CC(C1)CO 3ce944ff55f4891abd81ec2cffac94d7 [0,1,0,1,0,0|2,0,0]=4 22785 B13R1.2439 CCSCCNCC1CC(C1)OC 5fddd646de5f22b8c76d9c792b575603 [0,1,0,1,0,0|2,0,0]=4 22786 B13R1.2439 CCSCCOCC1CC(C1)OC 6cb70cf03442ae89422edbbe64d2d28a [0,1,0,1,0,0|2,0,0]=4 22787 B13R1.2439 CCSCCOC[C@H]1C[C@@H](C1)OC a23b9810ba32c6314ac72e19d3da419a [0,1,0,1,0,0|2,0,0]=4 22788 B13R1.2439 CCSCCOC[C@H]1C[C@H](C1)OC 71c9a99bbb34a31f726f25e220dbc45c [0,1,0,1,0,0|2,0,0]=4 22789 B13R1.2439 COC1CC(C1)CNCCCCCl 144c2403eb752b311e0e2e30661210de [0,1,0,1,0,0|2,0,0]=4 22790 B13R1.2439 COC1CC(C1)CNCCCCF 7e55b07b5d9881717816676dc543b986 [0,1,0,1,0,0|2,0,0]=4 22791 B13R1.2439 COC1CC(C1)CNCCCCO 98d1f153902633f50cafa7e4441c9ed8 [0,1,0,1,0,0|2,0,0]=4 22792 B13R1.2439 COC1CC(C1)CNCCCCS b195b4112895135997a747c81d7e54ff [0,1,0,1,0,0|2,0,0]=4 22793 B13R1.2439 COC1CC(C1)CNCCCSC 3fff07db9ca31c405842677bc7b593a9 [0,1,0,1,0,0|2,0,0]=4 22794 B13R1.2439 COC1CC(C1)COCCCCF c089f3ec3949b9e7242bb8bb3d875d51 [0,1,0,1,0,0|2,0,0]=4 22795 B13R1.2439 COC1CC(C1)COCCCCS fba928d33fa74012fe1503c322a308f7 [0,1,0,1,0,0|2,0,0]=4 22796 B13R1.2439 COC1CC(C1)COCCCSC 61db2854391716f1f09ab6874f00dd1a [0,1,0,1,0,0|2,0,0]=4 22797 B13R1.2439 COC1CC(C1)NCCCCCCl fceefa579e7599d5e00293d1e711d2bc [0,1,0,1,0,0|2,0,0]=4 22798 B13R1.2439 COC1CC(C1)NCCCCCF f6a84964ad3a2423d28e14bf31a4e549 [0,1,0,1,0,0|2,0,0]=4 22799 B13R1.2439 COC1CC(C1)NCCCCCO 32f90a772e8d98f7e2e9a780e57d2613 [0,1,0,1,0,0|2,0,0]=4 22800 B13R1.2439 COC1CC(C1)NCCCCSC c763d93a3023b747e4319e2f86dc1385 [0,1,0,1,0,0|2,0,0]=4 22801 B13R1.2439 COC1CC(C1)OCCCCCF 9b0b5c7ffaf20bbfcd9f7990f191d411 [0,1,0,1,0,0|2,0,0]=4 22802 B13R1.2439 COC1CC(C1)OCCCCSC 8fc4012e8d6d8ec4a4e1209c7e4703db [0,1,0,1,0,0|2,0,0]=4 22803 B13R1.2439 COC1CN(C1)CCCCCCF f9083d3056987257fa9da20b359f3d23 [0,1,0,1,0,0|2,0,0]=4 22804 B13R1.2439 COC1CN(C1)CCCCCCO dfb9e45cb06d5d42dba450cd0f0424cd [0,1,0,1,0,0|2,0,0]=4 22805 B13R1.2439 COCCCCCN1CC(C1)CO 8eac1232391bf73f66d2464ff23a6ffd [0,1,0,1,0,0|2,0,0]=4 22806 B13R1.2439 COCCCCCN1CC(C1)OC a16a56a2155e0bc334e32d65aaa7318c [0,1,0,1,0,0|2,0,0]=4 22807 B13R1.2439 COCCCCNC1CC(C1)CO 521a9ba7eba3b663bebfb78e66851422 [0,1,0,1,0,0|2,0,0]=4 22808 B13R1.2439 COCCCCNC1CC(C1)OC cd89f35c827e630fde0f328cb9d91140 [0,1,0,1,0,0|2,0,0]=4 22809 B13R1.2439 COCCCCN[C@H]1C[C@@H](C1)CO c0610eec3118d46e78297ee2cbfebd9c [0,1,0,1,0,0|2,0,0]=4 22810 B13R1.2439 COCCCCN[C@H]1C[C@@H](C1)OC 3eeef8f5b6565f2c0e1a77bcd6bcb7e3 [0,1,0,1,0,0|2,0,0]=4 22811 B13R1.2439 COCCCCN[C@H]1C[C@H](C1)CO ee081d4f3de4c67fceae11e1f0f215aa [0,1,0,1,0,0|2,0,0]=4 22812 B13R1.2439 COCCCCN[C@H]1C[C@H](C1)OC 06d425dc1c48bf0adce18c96dc971056 [0,1,0,1,0,0|2,0,0]=4 22813 B13R1.2439 COCCCCOC1CC(C1)OC 1200f6eff4a5d7cc28a11f6ce5c38b38 [0,1,0,1,0,0|2,0,0]=4 22814 B13R1.2439 COCCCCO[C@H]1C[C@@H](C1)OC 411e0b5478f105128bc165572fa5fc16 [0,1,0,1,0,0|2,0,0]=4 22815 B13R1.2439 COCCCCO[C@H]1C[C@H](C1)OC 4d242579528cc7dfffcc811341a3174b [0,1,0,1,0,0|2,0,0]=4 22816 B13R1.2439 COCCCNCC1CC(C1)CO 6517d9c054f94a855db2a286249074d6 [0,1,0,1,0,0|2,0,0]=4 22817 B13R1.2439 COCCCNCC1CC(C1)OC a8d8e746833c3409ba7cfa3445444e87 [0,1,0,1,0,0|2,0,0]=4 22818 B13R1.2439 COCCCOCC1CC(C1)OC fa77e7f99ddb7a8e0bea7f929e6e8bb9 [0,1,0,1,0,0|2,0,0]=4 22819 B13R1.2439 COCCCOC[C@H]1C[C@@H](C1)OC 5c7063177965acd337294758c36353f2 [0,1,0,1,0,0|2,0,0]=4 22820 B13R1.2439 COCCCOC[C@H]1C[C@H](C1)OC e9dac339ff9d23aea3e4e709ec9e3c48 [0,1,0,1,0,0|2,0,0]=4 22821 B13R1.2439 CO[C@H]1C[C@@H](C1)COCCCCF cfc080dd2a63d02f62a9798eacb11c86 [0,1,0,1,0,0|2,0,0]=4 22822 B13R1.2439 CO[C@H]1C[C@@H](C1)COCCCSC 019acc84a7fe4a00aadbdb409eae3a89 [0,1,0,1,0,0|2,0,0]=4 22823 B13R1.2439 CO[C@H]1C[C@@H](C1)NCCCCCCl 3b4d3f69d53a157195295596ae062ce5 [0,1,0,1,0,0|2,0,0]=4 22824 B13R1.2439 CO[C@H]1C[C@@H](C1)NCCCCCF 2ac28010cbf8036e782686e12c43cb6d [0,1,0,1,0,0|2,0,0]=4 22825 B13R1.2439 CO[C@H]1C[C@@H](C1)NCCCCCO e00cd5f4a4199d42ad914cb0187bb931 [0,1,0,1,0,0|2,0,0]=4 22826 B13R1.2439 CO[C@H]1C[C@@H](C1)NCCCCSC 1c9dfd24ce52162bbee8a8eaf20b830a [0,1,0,1,0,0|2,0,0]=4 22827 B13R1.2439 CO[C@H]1C[C@@H](C1)OCCCCCF 30736e5e3bde932353eda10037817a7f [0,1,0,1,0,0|2,0,0]=4 22828 B13R1.2439 CO[C@H]1C[C@@H](C1)OCCCCSC f9cc063953ab47c557f3d6d1c0454d76 [0,1,0,1,0,0|2,0,0]=4 22829 B13R1.2439 CO[C@H]1C[C@H](C1)COCCCCF de483287970bc6a0767bed1ab0b1c848 [0,1,0,1,0,0|2,0,0]=4 22830 B13R1.2439 CO[C@H]1C[C@H](C1)COCCCSC 1b2a9520f95730d0e8d3e1d3bd22dd83 [0,1,0,1,0,0|2,0,0]=4 22831 B13R1.2439 CO[C@H]1C[C@H](C1)NCCCCCF b7658c934026b344af5001885fc35a42 [0,1,0,1,0,0|2,0,0]=4 22832 B13R1.2439 CO[C@H]1C[C@H](C1)NCCCCCO 58daf4362ed4a097652bbb3480c35395 [0,1,0,1,0,0|2,0,0]=4 22833 B13R1.2439 CO[C@H]1C[C@H](C1)OCCCCCF 6f787bfa6603efdb1b340fbf679a023a [0,1,0,1,0,0|2,0,0]=4 22834 B13R1.2439 CSCCCCNC1CC(C1)CO 4d2de23e58d103f271731d300637e02e [0,1,0,1,0,0|2,0,0]=4 22835 B13R1.2439 CSCCCNCC1CC(C1)CO 85b89adb16ac58cb41b8053212137771 [0,1,0,1,0,0|2,0,0]=4 22836 B13R1.2439 OCC1CC(C1)CNCCCCCl ec31b6a697c47f53cf8dc11cef004a3b [0,1,0,1,0,0|2,0,0]=4 22837 B13R1.2439 OCC1CC(C1)CNCCCCS 5cb69abccf3aae551e2d2e2d09341759 [0,1,0,1,0,0|2,0,0]=4 22838 B13R1.2439 OCC1CC(C1)NCCCCCCl 5db8bb652476c21c3f71ae192a7bb896 [0,1,0,1,0,0|2,0,0]=4 22839 B13R1.2439 OCC1CC(C1)NCCCCCF b16248b629b34d0f7d455e3d7992884b [0,1,0,1,0,0|2,0,0]=4 22840 B13R1.2439 OCC1CN(C1)CCCCCCF a1592f2483bb5f080adf89b08ed30972 [0,1,0,1,0,0|2,0,0]=4 22841 B13R1.2439 OCCCCCCN1CC(C1)CO d776697d40a1ab26d9526d2506bc83de [0,1,0,1,0,0|2,0,0]=4 22842 B13R1.2439 OCCCCCNC1CC(C1)CO 2299e57fb5f0af844788c2342888eeb2 [0,1,0,1,0,0|2,0,0]=4 22843 B13R1.2439 OCCCCCN[C@H]1C[C@@H](C1)CO 13f627a1a6b7049c0b552ae0b0f3ccf3 [0,1,0,1,0,0|2,0,0]=4 22844 B13R1.2439 OCCCCCN[C@H]1C[C@H](C1)CO 873b38f45e0e63158c988badcc1dccc2 [0,1,0,1,0,0|2,0,0]=4 22845 B13R1.2439 OCCCCNCC1CC(C1)CO 5ded4ac44289d076978633de4cc43dde [0,1,0,1,0,0|2,0,0]=4 22846 B13R1.2439 OC[C@H]1C[C@@H](C1)NCCCCCF 603db4c7ac9c14eb51579c78ca1288df [0,1,0,1,0,0|2,0,0]=4 22847 B13R1.2439 OC[C@H]1C[C@H](C1)NCCCCCF 8e5bb8a1c41491330adb1f6348e2a7af [0,1,0,1,0,0|2,0,0]=4 22848 B13R1.3440 CC1C(CCN1CCCCCF)O 8b45d6075098338cd67bfca2aa177a72 [0,1,0,1,0,0|2,0,0]=4 22849 B13R1.3440 CC1C(CCN1CCCCCO)O f58184ea20492664297912d1f9079176 [0,1,0,1,0,0|2,0,0]=4 22850 B13R1.3440 CCCCCCN1CCC(C1C)O 3a141cadf2954c92dbe50861bb524df1 [0,1,0,1,0,0|1,0,0]=3 22851 B13R1.3440 CCCCCCN1CC[C@@H]([C@@H]1C)O ff05a65b1957031235c9777bdbebd836 [0,1,0,1,0,0|1,0,0]=3 22852 B13R1.3440 CCCCCCN1CC[C@H]([C@H]1C)O a3a79dd7f6565a9b01f0df0b965cf2d3 [0,1,0,1,0,0|1,0,0]=3 22853 B13R1.3440 CCCCOCN1CCC(C1C)O e8544d9c70d2718be04801963522e1fe [0,1,0,1,0,0|2,0,0]=4 22854 B13R1.3440 CCCCOCN1CC[C@@H]([C@@H]1C)O 7e6c844c7023fc2c853aa15577a5a07f [0,1,0,1,0,0|2,0,0]=4 22855 B13R1.3440 CCCCOCN1CC[C@H]([C@H]1C)O c2c4fd1f148ed8a7cf60916aa29e8e40 [0,1,0,1,0,0|2,0,0]=4 22856 B13R1.3440 CCCOCCN1CCC(C1C)O f7bd1b7a9247bd0cf4987dd8678c9a22 [0,1,0,1,0,0|2,0,0]=4 22857 B13R1.3440 CCCOCCN1CC[C@@H]([C@@H]1C)O 55514f1e4a7ed12751d8c8ff4f4e95c2 [0,1,0,1,0,0|2,0,0]=4 22858 B13R1.3440 CCCOCCN1CC[C@H]([C@H]1C)O 1e8eceeeb0b1eca38a68d0ca0553c57e [0,1,0,1,0,0|2,0,0]=4 22859 B13R1.3440 CCOCCCN1CCC(C1C)O 02a0953a50d71485936d0b87938bc10a [0,1,0,1,0,0|2,0,0]=4 22860 B13R1.3440 CCOCCCN1CC[C@@H]([C@@H]1C)O 23459658b7689c0e3f0fffbaf0905062 [0,1,0,1,0,0|2,0,0]=4 22861 B13R1.3440 CCOCCCN1CC[C@H]([C@H]1C)O 904917baec39a7ceed7ea1cf645d6ba7 [0,1,0,1,0,0|2,0,0]=4 22862 B13R1.3440 CCSCCCN1CCC(C1C)O 7c121d58869e439c647486ca6eefeefc [0,1,0,1,0,0|2,0,0]=4 22863 B13R1.3440 CCSCCCN1CC[C@@H]([C@@H]1C)O d18495da6ff991c48a5ce9581ac5b376 [0,1,0,1,0,0|2,0,0]=4 22864 B13R1.3440 CCSCCCN1CC[C@H]([C@H]1C)O d392635ed2ad76533e04f68f35b7caf1 [0,1,0,1,0,0|2,0,0]=4 22865 B13R1.3440 COCCCCN1CCC(C1C)O 6d78a5f7a3cdfcde2666d8800357e13a [0,1,0,1,0,0|2,0,0]=4 22866 B13R1.3440 COCCCCN1CC[C@@H]([C@@H]1C)O 773ae25d7bb212e7d7d89bae8628b581 [0,1,0,1,0,0|2,0,0]=4 22867 B13R1.3440 COCCCCN1CC[C@H]([C@H]1C)O 152bafd2c63fa1eea24f38e047c3022b [0,1,0,1,0,0|2,0,0]=4 22868 B13R1.3440 C[C@@H]1[C@@H](CCN1CCCCCF)O 4c9f80138758dd9d66ac47ce4171ff03 [0,1,0,1,0,0|2,0,0]=4 22869 B13R1.3440 C[C@@H]1[C@@H](CCN1CCCCCO)O 2057bf2b0ab0947cea62c5b6171c5ffa [0,1,0,1,0,0|2,0,0]=4 22870 B13R1.3440 C[C@H]1[C@H](CCN1CCCCCF)O 9b7fce548fcdded2682a19a923f6f722 [0,1,0,1,0,0|2,0,0]=4 22871 B13R1.3440 C[C@H]1[C@H](CCN1CCCCCO)O 9ed9d234391ea8f9ad0bc3224c843a5e [0,1,0,1,0,0|2,0,0]=4 22872 B13R1.89 CCC1CCCCN1C(=O)C(C)O 6e69610dffb348612736006cd8cc6233 [0,1,0,1,0,0|1,0,1]=4 22873 B13R1.89 CCC1CCCCN1C(=O)[C@@H](C)O 47d7a961d6d6f0a532154c7d2c6a35a9 [0,1,0,1,0,0|1,0,1]=4 22874 B13R1.89 CCC1CCCCN1C(=O)[C@H](C)O 0210774339dffe46b5b6d5691b92bbd2 [0,1,0,1,0,0|1,0,1]=4 22875 B13R1.89 CCC1CCCCN1C(C)C(C)C 2d5526c4cab732f3b8b8201f69acef2c [0,1,0,1,0,0|2,0,0]=4 22876 B13R1.89 CC[C@@H]1CCCCN1C(=O)C(C)O 8a937317b22f41eb39e318643cc9ddf2 [0,1,0,1,0,0|1,0,1]=4 22877 B13R1.89 CC[C@@H]1CCCCN1C(=O)[C@@H](C)O 4efe6eda9cbea9738523468b84ebca8a [0,1,0,1,0,0|1,0,1]=4 22878 B13R1.89 CC[C@@H]1CCCCN1C(=O)[C@H](C)O ddb94ace26d75143a5652eab933fd089 [0,1,0,1,0,0|1,0,1]=4 22879 B13R1.89 CC[C@@H]1CCCCN1C(C)C(C)C ba23797fb5ec7e642b214fadd0ac1dc2 [0,1,0,1,0,0|2,0,0]=4 22880 B13R1.89 CC[C@H]1CCCCN1C(=O)C(C)O 9baae3b333ccc3f8d45b40ffe3b3948e [0,1,0,1,0,0|1,0,1]=4 22881 B13R1.89 CC[C@H]1CCCCN1C(=O)[C@@H](C)O dc52503ce89dd2ca0e4c7b976035f2ac [0,1,0,1,0,0|1,0,1]=4 22882 B13R1.89 CC[C@H]1CCCCN1C(=O)[C@H](C)O 9c55a91de7c6828b83c80fcae85c2ff5 [0,1,0,1,0,0|1,0,1]=4 22883 B13R1.89 CC[C@H]1CCCCN1C(C)C(C)C d0ac008c3602ee170567e3c06e3c1fad [0,1,0,1,0,0|2,0,0]=4 22884 B13R1.169 CC(C)C(C)COC1CCCC1C c9724b734aeba869bb3e5e20952f0e3c [0,1,0,1,0,0|2,0,0]=4 22885 B13R1.169 CC(C)C(C)CO[C@@H]1CCC[C@@H]1C 021a1f92c120d47d96d888fa17ac128b [0,1,0,1,0,0|2,0,0]=4 22886 B13R1.169 CC(C)C(C)CO[C@@H]1CCC[C@H]1C 7b83556bedd180d3c142665dc39dda6d [0,1,0,1,0,0|2,0,0]=4 22887 B13R1.169 CC(C)C(C)CO[C@H]1CCC[C@@H]1C 287e0df9ac4b4fbcab00736065bbe1ee [0,1,0,1,0,0|2,0,0]=4 22888 B13R1.169 CC(C)C(C)CO[C@H]1CCC[C@H]1C 3a8a746de9b232f8acfffa0fe8166ee2 [0,1,0,1,0,0|2,0,0]=4 22889 B13R1.169 CC(C)C(C)OCC1CCCC1C ec04840668da60fd4e63ba1ee4fc6df0 [0,1,0,1,0,0|2,0,0]=4 22890 B13R1.169 CC(O)C(C)NCC1COCC1C 3ab9e70d4df6ac949b7fbd1097f400bd [0,1,0,1,0,0|2,0,0]=4 22891 B13R1.191 CC1CN(CC1O)CCCCCF 50236e72b917ee0a6c7116fdcaac2c4c [0,1,0,1,0,0|2,0,0]=4 22892 B13R1.191 CC1CN(CC1O)CCCCCO 0837f4114722da22a144fc810c9b0531 [0,1,0,1,0,0|2,0,0]=4 22893 B13R1.191 CCCCCCN1CC(C(C1)Br)O e84e3317cd69879c9351f34809e485cd [0,1,0,1,0,0|1,0,0]=3 22894 B13R1.191 CCCCCCN1CC(C(C1)O)C c998de086cd2a186cc7cf9303e603210 [0,1,0,1,0,0|1,0,0]=3 22895 B13R1.191 CCCCCCN1C[C@@H]([C@H](C1)O)O f4f5d272a34c6c4b39510f061f7ef967 [0,1,0,1,0,0|1,0,0]=3 22896 B13R1.191 CCCCCCN1C[C@H]([C@@H](C1)F)O 6e50d52189ac2a12adfc39d19001125a [0,1,0,1,0,0|1,0,0]=3 22897 B13R1.191 CCCCCCN1C[C@H]([C@@H](C1)O)O eca023db4613480cbd837af84d5f84d4 [0,1,0,1,0,0|1,0,0]=3 22898 B13R1.191 CCCCCCN1C[C@H]([C@H](C1)O)C 3328c0c064ae77fe338366f372c74055 [0,1,0,1,0,0|1,0,0]=3 22899 B13R1.191 CCCCCCN1C[C@H]([C@H](C1)O)O 73ebba22545854e676077b06ba9bb322 [0,1,0,1,0,0|1,0,0]=3 22900 B13R1.191 CCCCOCN1CC(C(C1)Br)O 14c7a3223be25931ab7d21041a7ebb36 [0,1,0,1,0,0|2,0,0]=4 22901 B13R1.191 CCCCOCN1CC(C(C1)O)C e6cfdab589b0e42e79256c88cf779c4c [0,1,0,1,0,0|2,0,0]=4 22902 B13R1.191 CCCCOCN1C[C@@H]([C@H](C1)O)O 9846556c625d3e4b7e8cb149b8c9fc36 [0,1,0,1,0,0|2,0,0]=4 22903 B13R1.191 CCCCOCN1C[C@H]([C@@H](C1)F)O 954227c7cd0927ef33e8e289c255af02 [0,1,0,1,0,0|2,0,0]=4 22904 B13R1.191 CCCCOCN1C[C@H]([C@@H](C1)O)O fa44cdd0532a5cc030dfe2a16b5c8d5b [0,1,0,1,0,0|2,0,0]=4 22905 B13R1.191 CCCCOCN1C[C@H]([C@H](C1)O)C 000dbd29ffe4350f1d66b3822edf6ca1 [0,1,0,1,0,0|2,0,0]=4 22906 B13R1.191 CCCCOCN1C[C@H]([C@H](C1)O)O 943731790eb20dd6964657374db81d8c [0,1,0,1,0,0|2,0,0]=4 22907 B13R1.191 CCCOCCN1CC(C(C1)Br)O 79f3907b6bbaa6bcd63ec86b18fa4998 [0,1,0,1,0,0|2,0,0]=4 22908 B13R1.191 CCCOCCN1CC(C(C1)O)C 92d8a858ab98e38a3378b2a5477fda15 [0,1,0,1,0,0|2,0,0]=4 22909 B13R1.191 CCCOCCN1C[C@@H]([C@H](C1)O)O 2bd672e61bc9ae680f5519ed8bcba43a [0,1,0,1,0,0|2,0,0]=4 22910 B13R1.191 CCCOCCN1C[C@H]([C@@H](C1)F)O 99eea21abb764ce9476ff19794a55ec8 [0,1,0,1,0,0|2,0,0]=4 22911 B13R1.191 CCCOCCN1C[C@H]([C@@H](C1)O)O ca80fad66363b8ce854403744170d2ac [0,1,0,1,0,0|2,0,0]=4 22912 B13R1.191 CCCOCCN1C[C@H]([C@H](C1)O)C f4326e086444d0726863a7715da6bf95 [0,1,0,1,0,0|2,0,0]=4 22913 B13R1.191 CCCOCCN1C[C@H]([C@H](C1)O)O 87ed465c0dc95337ac05e15f843676d1 [0,1,0,1,0,0|2,0,0]=4 22914 B13R1.191 CCOCCCN1CC(C(C1)Br)O 2eb70c002de6a5ed05f5c6cbf94f1ad3 [0,1,0,1,0,0|2,0,0]=4 22915 B13R1.191 CCOCCCN1CC(C(C1)O)C 140920faf983d6d87832bea38be9a6db [0,1,0,1,0,0|2,0,0]=4 22916 B13R1.191 CCOCCCN1C[C@@H]([C@H](C1)O)O c4f115fd8f4557adbb35850d4c5d9732 [0,1,0,1,0,0|2,0,0]=4 22917 B13R1.191 CCOCCCN1C[C@H]([C@@H](C1)F)O aa135a74ac67b0cc3433ea8483437fd7 [0,1,0,1,0,0|2,0,0]=4 22918 B13R1.191 CCOCCCN1C[C@H]([C@@H](C1)O)O 1f9f0aa9ea7f874667d2c0c49f3e63d0 [0,1,0,1,0,0|2,0,0]=4 22919 B13R1.191 CCOCCCN1C[C@H]([C@H](C1)O)C 989c8c13866cbadc336b070b1b17ac17 [0,1,0,1,0,0|2,0,0]=4 22920 B13R1.191 CCOCCCN1C[C@H]([C@H](C1)O)O 4486b0813a23029ced6e3807a5487b44 [0,1,0,1,0,0|2,0,0]=4 22921 B13R1.191 CCSCCCN1CC(C(C1)Br)O 2d4bfb8784afc7b90b023dcf4683d41e [0,1,0,1,0,0|2,0,0]=4 22922 B13R1.191 CCSCCCN1CC(C(C1)O)C 2528fd7ea35b62f1e8d89a8cee6b3915 [0,1,0,1,0,0|2,0,0]=4 22923 B13R1.191 CCSCCCN1C[C@@H]([C@H](C1)O)O e46b9d1d28622918be57409f60e41d10 [0,1,0,1,0,0|2,0,0]=4 22924 B13R1.191 CCSCCCN1C[C@H]([C@@H](C1)F)O 921d68ed4fcd81b370fc4646e8be9217 [0,1,0,1,0,0|2,0,0]=4 22925 B13R1.191 CCSCCCN1C[C@H]([C@@H](C1)O)O 1f2a5b486e87ec60694de74c3600e1f0 [0,1,0,1,0,0|2,0,0]=4 22926 B13R1.191 CCSCCCN1C[C@H]([C@H](C1)O)C d42cae29e3ea1da60f776b59f83dcda2 [0,1,0,1,0,0|2,0,0]=4 22927 B13R1.191 CCSCCCN1C[C@H]([C@H](C1)O)O d00f611122185f3ca4621e41f634158e [0,1,0,1,0,0|2,0,0]=4 22928 B13R1.191 COCCCCN1CC(C(C1)Br)O 9d8b3cfd39218835f1666487ef8b5260 [0,1,0,1,0,0|2,0,0]=4 22929 B13R1.191 COCCCCN1CC(C(C1)O)C 0c2d4d9329cc40c40d3a3105d7bf66ac [0,1,0,1,0,0|2,0,0]=4 22930 B13R1.191 COCCCCN1C[C@@H]([C@H](C1)O)O 154f01c7bb7e27d877cfe5301da7a5f6 [0,1,0,1,0,0|2,0,0]=4 22931 B13R1.191 COCCCCN1C[C@H]([C@@H](C1)F)O f322c823b6ceb629479affabb98adf11 [0,1,0,1,0,0|2,0,0]=4 22932 B13R1.191 COCCCCN1C[C@H]([C@@H](C1)O)O b7ba6b8e33f7ced642fca452fc830cfa [0,1,0,1,0,0|2,0,0]=4 22933 B13R1.191 COCCCCN1C[C@H]([C@H](C1)O)C 43e9d1f3f65394c95233ef9d1d936aa5 [0,1,0,1,0,0|2,0,0]=4 22934 B13R1.191 COCCCCN1C[C@H]([C@H](C1)O)O 77b41ce60353690d785d4b877478b0fc [0,1,0,1,0,0|2,0,0]=4 22935 B13R1.191 C[C@@H]1CN(C[C@@H]1O)CCCCCF 6e8aae87e0c7b2e9a967919e1df30411 [0,1,0,1,0,0|2,0,0]=4 22936 B13R1.191 C[C@@H]1CN(C[C@@H]1O)CCCCCO ef051cab3f957ca2d3aea623764a7ef3 [0,1,0,1,0,0|2,0,0]=4 22937 B13R1.191 OC1CN(CC1Br)CCCCCF e5450bdae3360bdfd51d012abacfda11 [0,1,0,1,0,0|2,0,0]=4 22938 B13R1.191 OCCCCCN1CC(C(C1)Br)O 272e0c0e8b88f96601daad138a6958be [0,1,0,1,0,0|2,0,0]=4 22939 B13R1.191 OCCCCCN1C[C@@H]([C@H](C1)O)O ca9b82fbebf5bf258bfc2c361dabe052 [0,1,0,1,0,0|2,0,0]=4 22940 B13R1.191 OCCCCCN1C[C@H]([C@@H](C1)F)O 7a5e57ad21c007a58a1ecf85b34b6cc3 [0,1,0,1,0,0|2,0,0]=4 22941 B13R1.191 OCCCCCN1C[C@H]([C@@H](C1)O)O 66e878787094347a8e84500ff8a4b317 [0,1,0,1,0,0|2,0,0]=4 22942 B13R1.191 OCCCCCN1C[C@H]([C@H](C1)O)O d13a1570afc573b371faa1ced06e19e6 [0,1,0,1,0,0|2,0,0]=4 22943 B13R1.191 O[C@@H]1CN(C[C@@H]1O)CCCCCF 5f98d8bc932200c05f74e7ae9d13464c [0,1,0,1,0,0|2,0,0]=4 22944 B13R1.191 O[C@@H]1CN(C[C@H]1F)CCCCCF 11eda35459c7fe74661030e243a3f982 [0,1,0,1,0,0|2,0,0]=4 22945 B13R1.191 O[C@@H]1CN(C[C@H]1O)CCCCCF 0daafcbbd02f34ee10443a05e3ca2ce6 [0,1,0,1,0,0|2,0,0]=4 22946 B13R1.191 O[C@H]1CN(C[C@@H]1O)CCCCCF 0827d89576e884934c7056a971f69aac [0,1,0,1,0,0|2,0,0]=4 22947 B13R1.202 CC(C)C(C)CN1CCCCC1C 4b7c39a24d3f2d0c43f27e384478a2ca [0,1,0,1,0,0|2,0,0]=4 22948 B13R1.202 CC(C)C(C)CN1CCCC[C@@H]1C ff12d3b094943139a6c0d4b7ba5afa67 [0,1,0,1,0,0|2,0,0]=4 22949 B13R1.202 CC(C)C(C)CN1CCCC[C@H]1C 97b3054316efeed61c075bbe9924e1f5 [0,1,0,1,0,0|2,0,0]=4 22950 B13R1.202 CC(C)C(C)NC1CCCCC1C 87d0831076e78e84c43076f1af5bb6e8 [0,1,0,1,0,0|2,0,0]=4 22951 B13R1.202 CC(C)C(C)N[C@@H]1CCCC[C@@H]1C 8d87f339d024f81b1893f97006a7a963 [0,1,0,1,0,0|2,0,0]=4 22952 B13R1.202 CC(C)C(C)N[C@@H]1CCCC[C@H]1C 9f21c160b0e315ba37bc9bf38b147964 [0,1,0,1,0,0|2,0,0]=4 22953 B13R1.202 CC(C)C(C)N[C@H]1CCCC[C@@H]1C 60bdbb71970b6c19aed9090751114bf9 [0,1,0,1,0,0|2,0,0]=4 22954 B13R1.202 CC(C)C(C)N[C@H]1CCCC[C@H]1C 062eb564d15543d65dddf750441108d7 [0,1,0,1,0,0|2,0,0]=4 22955 B13R1.202 CC(C)C(C)OC1CCCCC1C ff812cf2a18c0b1caab8e51da3676fae [0,1,0,1,0,0|2,0,0]=4 22956 B13R1.202 CC(C)C(C)O[C@@H]1CCCC[C@@H]1C ab35fe716e4ed74fadbf26532b7d1ab1 [0,1,0,1,0,0|2,0,0]=4 22957 B13R1.202 CC(C)C(C)O[C@H]1CCCC[C@@H]1C 56d36553ee703a974c98e35c3be660f5 [0,1,0,1,0,0|2,0,0]=4 22958 B13R1.202 CC(C)C(C)O[C@H]1CCCC[C@H]1C 1223f547098aadaab97127b736af4152 [0,1,0,1,0,0|2,0,0]=4 22959 B13R1.202 CC(C)[C@@H](C)N[C@H]1CCCC[C@H]1C 3aa3cf2f408274f635de0b197b7fdaaa [0,1,0,1,0,0|2,0,0]=4 22960 B13R1.202 CC(C)[C@@H](C)O[C@H]1CCCC[C@H]1C 7e3a07b498244b0839f22c1dcbd91f7f [0,1,0,1,0,0|2,0,0]=4 22961 B13R1.202 CC(C)[C@H](C)N[C@H]1CCCC[C@H]1C 53f202d9cb08fb8277064aac954e3e79 [0,1,0,1,0,0|2,0,0]=4 22962 B13R1.202 CC(C)[C@H](C)O[C@H]1CCCC[C@H]1C 23d626c3ec7560cce21cb4e0cc4f0ad5 [0,1,0,1,0,0|2,0,0]=4 22963 B13R1.202 CC(O)C(=O)NC1CCCCC1C e30440d64daecfd9f9430c54ed619a78 [0,1,0,1,0,0|1,0,1]=4 22964 B13R1.202 CC(O)C(=O)N[C@@H]1CCCC[C@@H]1C a401c71a61942f07f5babe344bfe8d8f [0,1,0,1,0,0|1,0,1]=4 22965 B13R1.202 CC(O)C(=O)N[C@@H]1CCCC[C@H]1C 46adcf600209a78e84139de152e9dc29 [0,1,0,1,0,0|1,0,1]=4 22966 B13R1.202 CC(O)C(=O)N[C@H]1CCCC[C@@H]1C fa422512e80a3d33d2820333db25023e [0,1,0,1,0,0|1,0,1]=4 22967 B13R1.202 CC(O)C(=O)N[C@H]1CCCC[C@H]1C f0d78cd9b76f5f5e3a868c34609e6d8b [0,1,0,1,0,0|1,0,1]=4 22968 B13R1.202 CC(O)C(C)NC1CCCCC1F 7ae46ba7f9821843847a5984484218f1 [0,1,0,1,0,0|2,0,0]=4 22969 B13R1.202 CC(O)C(C)NC1CCCCC1O 38f843a26f804c34b1cb7b0acb5e6fcb [0,1,0,1,0,0|2,0,0]=4 22970 B13R1.202 CC(O)C(C)N[C@H]1CCCC[C@@H]1O 43ebc89cc980e507f1ff640e5e32e4eb [0,1,0,1,0,0|2,0,0]=4 22971 B13R1.202 CC(O)C(C)N[C@H]1CCCC[C@H]1C 8a3a3e19a6427808590218289aa589d0 [0,1,0,1,0,0|1,0,0]=3 22972 B13R1.202 CC(S)C(C)O[C@H]1CCCC[C@H]1C e907db080694d43c291c1926718f91dd [0,1,0,1,0,0|1,1,0]=4 22973 B13R1.202 CC1CCCCC1NC(=O)[C@@H](C)O 4f1cf493f38006b2101eb9e16d564acc [0,1,0,1,0,0|1,0,1]=4 22974 B13R1.202 CC1CCCCC1NC(=O)[C@H](C)O 995e7b67a8ff196a75c1fdcfde2255fe [0,1,0,1,0,0|1,0,1]=4 22975 B13R1.202 C[C@@H](O)C(=O)N[C@@H]1CCCC[C@@H]1C 7f00cdc3d383357540ad1d9a8dd6d097 [0,1,0,1,0,0|1,0,1]=4 22976 B13R1.202 C[C@@H](O)C(=O)N[C@H]1CCCC[C@@H]1C 986d2ac670acf4b213467c1d40088898 [0,1,0,1,0,0|1,0,1]=4 22977 B13R1.202 C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H](C)O d856357ef5b9edd8e58a69025ed1ad1e [0,1,0,1,0,0|1,0,1]=4 22978 B13R1.202 C[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)O 7a55fa9a266bf7f380be725a71344eb6 [0,1,0,1,0,0|1,0,1]=4 22979 B13R1.202 C[C@H](O)C(=O)N[C@@H]1CCCC[C@@H]1C 71cc941ce3091e14468e790829f7a788 [0,1,0,1,0,0|1,0,1]=4 22980 B13R1.202 C[C@H](O)C(=O)N[C@@H]1CCCC[C@H]1C 43422d21a088167119a99f682525a9f7 [0,1,0,1,0,0|1,0,1]=4 22981 B13R1.202 C[C@H](O)C(=O)N[C@H]1CCCC[C@@H]1C a846b4491b174d0a0077806b458d3493 [0,1,0,1,0,0|1,0,1]=4 22982 B13R1.202 C[C@H](O)C(=O)N[C@H]1CCCC[C@H]1C e05e04e5885aea44344043e3f28685f9 [0,1,0,1,0,0|1,0,1]=4 22983 B13R1.351 CC(C)C(C)COC1CCCCC1 ad041541a990bf998440c8154a5302fe [0,1,0,1,0,0|2,0,0]=4 22984 B13R1.351 CC(C)C(C)NCC1CCCCC1 8f2ae4d135247d7787deb39f24c650d9 [0,1,0,1,0,0|2,0,0]=4 22985 B13R1.351 CC(C)C(C)OCC1CCCCC1 dc12b8c760f1aab0741ea1516efda941 [0,1,0,1,0,0|2,0,0]=4 22986 B13R1.351 CC(C)C(O)CNC1CCCCC1 e20081dcea1eb67af033599767a986df [0,1,0,1,0,0|2,0,0]=4 22987 B13R1.351 CC(C)N(C)CCC1CCCCC1 7a166a7f69903992efa24a47f7269ebe [0,1,0,1,0,0|2,0,0]=4 22988 B13R1.351 CC(C)[C@@H](C)NCC1CCCCC1 cd8c6c1fac454fb7a1142bef0afaad33 [0,1,0,1,0,0|2,0,0]=4 22989 B13R1.351 CC(C)[C@@H](C)OCC1CCCCC1 bf9355b9d31b451338c4fe64b26d41ef [0,1,0,1,0,0|2,0,0]=4 22990 B13R1.351 CC(C)[C@H](C)NCC1CCCCC1 426ad3a97538611ea00fea801d403faa [0,1,0,1,0,0|2,0,0]=4 22991 B13R1.351 CC(C)[C@H](C)OCC1CCCCC1 5f67d8638c77fdc66752d34c5d373036 [0,1,0,1,0,0|2,0,0]=4 22992 B13R1.351 CC(O)C(=O)NCC1CCCCC1 c3d39601cc0eba7175331d0acf441cf9 [0,1,0,1,0,0|1,0,1]=4 22993 B13R1.351 CC(O)C(C)NCC1CCCCC1 33c5d8600c18a975951efda444012fd0 [0,1,0,1,0,0|1,0,0]=3 22994 B13R1.351 CC(O)C(C)NCC1CCCCO1 1be3a1673f0fb52ae8725e770ed99254 [0,1,0,1,0,0|2,0,0]=4 22995 B13R1.351 CC(O)C(C)NCC1CCCOC1 f4c13f3c6778450ee52f151ddf7d53ad [0,1,0,1,0,0|2,0,0]=4 22996 B13R1.351 CC(O)C(C)NCC1CCOCC1 3ba6cc9c73171afe6cb84abb04dd4830 [0,1,0,1,0,0|2,0,0]=4 22997 B13R1.351 CC(O)C(C)NCC1CCSCC1 b1468c2477700233ab8a7b5eca90c544 [0,1,0,1,0,0|2,0,0]=4 22998 B13R1.351 CC(S)C(C)OCC1CCCCC1 e782bbbacfefb981e09a0b194cc9c4d2 [0,1,0,1,0,0|1,1,0]=4 22999 B13R1.351 C[C@@H](O)C(=O)NCC1CCCCC1 f418c6e820e5e202d360541da958c52f [0,1,0,1,0,0|1,0,1]=4 23000 B13R1.351 C[C@H](O)C(=O)NCC1CCCCC1 9ad32d2ba62bdda02e7aa6d2dab62e86 [0,1,0,1,0,0|1,0,1]=4 23001 B13R1.669 CC1CCN(CC1O)CCCCF f9041ac004a5aae3a2c5300961e082f4 [0,1,0,1,0,0|2,0,0]=4 23002 B13R1.669 CC1CCN(CC1O)CCCCO 8f82483a24bc58a713cbf810965feca2 [0,1,0,1,0,0|2,0,0]=4 23003 B13R1.669 CCCCCN1CCC(C(C1)C)O 9559297dca4f9e1389be33a0f8839c52 [0,1,0,1,0,0|2,0,0]=4 23004 B13R1.669 CCCCCN1CCC(C(C1)O)C 2c5ff895a0dad0ffe8ba44eccb2456e6 [0,1,0,1,0,0|1,0,0]=3 23005 B13R1.669 CCCCCN1CC[C@@H]([C@@H](C1)O)C f3f220cb9613ff33c08819955617d85e [0,1,0,1,0,0|1,0,0]=3 23006 B13R1.669 CCCCCN1CC[C@@H]([C@H](C1)O)C e202e7ac70353af44056c03431e1b18a [0,1,0,1,0,0|1,0,0]=3 23007 B13R1.669 CCCCCN1CC[C@@H]([C@H](C1)O)O d747977eb272b2786fa092fc75f22019 [0,1,0,1,0,0|1,0,0]=3 23008 B13R1.669 CCCCCN1CC[C@H]([C@@H](C1)C)O 31a98756b6a86132bddced2eb9fd3071 [0,1,0,1,0,0|2,0,0]=4 23009 B13R1.669 CCCCCN1CC[C@H]([C@@H](C1)F)O f69b713be4ead4ffcfb1e1e1dbad602a [0,1,0,1,0,0|2,0,0]=4 23010 B13R1.669 CCCCCN1CC[C@H]([C@@H](C1)O)C e02939ab7ae80f1a0cf5010960890ef4 [0,1,0,1,0,0|1,0,0]=3 23011 B13R1.669 CCCCCN1CC[C@H]([C@@H](C1)O)F 4054b00e79a267644f91ec4a73705421 [0,1,0,1,0,0|1,0,0]=3 23012 B13R1.669 CCCCCN1CC[C@H]([C@H](C1)C)O 789316de48f252918066f4c1f15681a2 [0,1,0,1,0,0|2,0,0]=4 23013 B13R1.669 CCCCCN1CC[C@H]([C@H](C1)F)O 97a6d61a14966e7cf6d44679c953cc27 [0,1,0,1,0,0|2,0,0]=4 23014 B13R1.669 CCCCCN1CC[C@H]([C@H](C1)O)C a53c99168b8481e5095439cd1ad6bd39 [0,1,0,1,0,0|1,0,0]=3 23015 B13R1.669 CCCCCN1CC[C@H]([C@H](C1)O)F 75223dbd8e0501f3d6f8d2979318f659 [0,1,0,1,0,0|1,0,0]=3 23016 B13R1.669 CCCCOC1CCC(C(C1)C)C 8cac9b9c5b7327c69489625c16b8e9b1 [0,1,0,1,0,0|2,0,0]=4 23017 B13R1.669 CCOCCN1CCC(C(C1)O)C 53a8342a6611f99663d7686fddd3aaad [0,1,0,1,0,0|2,0,0]=4 23018 B13R1.669 CCOCCN1CC[C@@H]([C@@H](C1)O)C 094d012c9278656083197e118ea56593 [0,1,0,1,0,0|2,0,0]=4 23019 B13R1.669 CCOCCN1CC[C@@H]([C@H](C1)O)C d829eb9d39673e3012d414424eb8eb03 [0,1,0,1,0,0|2,0,0]=4 23020 B13R1.669 CCOCCN1CC[C@@H]([C@H](C1)O)O cb17fac1db2ac59745b1fae72c829f3b [0,1,0,1,0,0|2,0,0]=4 23021 B13R1.669 CCOCCN1CC[C@H]([C@@H](C1)O)C 8dc356247098d8bfbcf889b4044f6957 [0,1,0,1,0,0|2,0,0]=4 23022 B13R1.669 CCOCCN1CC[C@H]([C@@H](C1)O)F 4edf624ffc778dafd68c1e98de265090 [0,1,0,1,0,0|2,0,0]=4 23023 B13R1.669 CCOCCN1CC[C@H]([C@H](C1)O)C ac3e5ed0dfa5e5c207ca693b79956e73 [0,1,0,1,0,0|2,0,0]=4 23024 B13R1.669 CCOCCN1CC[C@H]([C@H](C1)O)F 6d6f6ec73391da40bed38a2705affd1b [0,1,0,1,0,0|2,0,0]=4 23025 B13R1.669 CCSCCN1CCC(C(C1)O)C e0cca8800e17bef5d41c7b0a6e5c3c9f [0,1,0,1,0,0|2,0,0]=4 23026 B13R1.669 CCSCCN1CC[C@@H]([C@@H](C1)O)C 0731489b06e22b00bcb7df79b68669f8 [0,1,0,1,0,0|2,0,0]=4 23027 B13R1.669 CCSCCN1CC[C@@H]([C@H](C1)O)C 58bf681eac031bd4e04b8a7bc55da23a [0,1,0,1,0,0|2,0,0]=4 23028 B13R1.669 CCSCCN1CC[C@@H]([C@H](C1)O)O eeb5573ed4e8fa13f314938d50ba8f86 [0,1,0,1,0,0|2,0,0]=4 23029 B13R1.669 CCSCCN1CC[C@H]([C@@H](C1)O)C c97de7c74980f6b27c57ec0b4e866ee5 [0,1,0,1,0,0|2,0,0]=4 23030 B13R1.669 CCSCCN1CC[C@H]([C@@H](C1)O)F 027ce92e60776bd956e861410d3aeb27 [0,1,0,1,0,0|2,0,0]=4 23031 B13R1.669 CCSCCN1CC[C@H]([C@H](C1)O)C 7a528a6f92b3cbc4441defdb495c7a0d [0,1,0,1,0,0|2,0,0]=4 23032 B13R1.669 CCSCCN1CC[C@H]([C@H](C1)O)F 0eb43b3793165e16fcdb77524fc5db5b [0,1,0,1,0,0|2,0,0]=4 23033 B13R1.669 COCCCN1CCC(C(C1)O)C f32f03263198426c645778c8387803e2 [0,1,0,1,0,0|2,0,0]=4 23034 B13R1.669 COCCCN1CC[C@@H]([C@@H](C1)O)C 7f45d8d2b6b2e75b96bd005c397fdc82 [0,1,0,1,0,0|2,0,0]=4 23035 B13R1.669 COCCCN1CC[C@@H]([C@H](C1)O)C 1e1bc5d567e215239c39740d7730fa10 [0,1,0,1,0,0|2,0,0]=4 23036 B13R1.669 COCCCN1CC[C@@H]([C@H](C1)O)O ffda267c144ec7f4b961a34cc7c228e3 [0,1,0,1,0,0|2,0,0]=4 23037 B13R1.669 COCCCN1CC[C@H]([C@@H](C1)O)C 134d09eb26f7715fed8f4632676e466b [0,1,0,1,0,0|2,0,0]=4 23038 B13R1.669 COCCCN1CC[C@H]([C@@H](C1)O)F bc6d88231e2678a57db0b35ccbf2046d [0,1,0,1,0,0|2,0,0]=4 23039 B13R1.669 COCCCN1CC[C@H]([C@H](C1)O)C d00c8ff8ec0f6aa505476bb95e0f37bd [0,1,0,1,0,0|2,0,0]=4 23040 B13R1.669 COCCCN1CC[C@H]([C@H](C1)O)F afcc8800bd679d82d8d30535c133ce1e [0,1,0,1,0,0|2,0,0]=4 23041 B13R1.669 CSCCCN1CCC(C(C1)O)C 1bb9944592bd804839cc6871be17daaa [0,1,0,1,0,0|2,0,0]=4 23042 B13R1.669 CSCCCN1CC[C@@H]([C@@H](C1)O)C 685c03ef281117d71339f08a8fa6d08b [0,1,0,1,0,0|2,0,0]=4 23043 B13R1.669 CSCCCN1CC[C@@H]([C@H](C1)O)C 0ab2a54d7b67bbae14bbab0053b8717b [0,1,0,1,0,0|2,0,0]=4 23044 B13R1.669 CSCCCN1CC[C@@H]([C@H](C1)O)O 69d6b917fd95c5b53bf94099173bddd1 [0,1,0,1,0,0|2,0,0]=4 23045 B13R1.669 CSCCCN1CC[C@H]([C@@H](C1)O)C 193d8f2338c0ec1b5b51494e6dbac6cc [0,1,0,1,0,0|2,0,0]=4 23046 B13R1.669 CSCCCN1CC[C@H]([C@@H](C1)O)F a80a885f1d5b8611509eec50566c8916 [0,1,0,1,0,0|2,0,0]=4 23047 B13R1.669 CSCCCN1CC[C@H]([C@H](C1)O)C cdf15dab2e06aa5e30e94b6820d30b31 [0,1,0,1,0,0|2,0,0]=4 23048 B13R1.669 CSCCCN1CC[C@H]([C@H](C1)O)F 41ac1984ad5f6c1f9fa1a2aa51d94721 [0,1,0,1,0,0|2,0,0]=4 23049 B13R1.669 C[C@@H]1CCN(C[C@@H]1O)CCCCF 2bb55f7cb7d68e298f092498a92a185c [0,1,0,1,0,0|2,0,0]=4 23050 B13R1.669 C[C@@H]1CCN(C[C@@H]1O)CCCCO e07a3272f3ab13c474dd0a4bb138cfc5 [0,1,0,1,0,0|2,0,0]=4 23051 B13R1.669 C[C@@H]1CCN(C[C@H]1O)CCCCF 1767b1afbec38f46f340176d317f1d6f [0,1,0,1,0,0|2,0,0]=4 23052 B13R1.669 C[C@@H]1CCN(C[C@H]1O)CCCCO 590c28cdb27cbc1c35cc16543dbd23c3 [0,1,0,1,0,0|2,0,0]=4 23053 B13R1.669 C[C@H]1CCN(C[C@@H]1O)CCCCF 4e3b8b495bba2faa712be46ec38091a5 [0,1,0,1,0,0|2,0,0]=4 23054 B13R1.669 C[C@H]1CCN(C[C@@H]1O)CCCCO 3ec4e8ec0dbd5309cb8e792d69c7a254 [0,1,0,1,0,0|2,0,0]=4 23055 B13R1.669 C[C@H]1CCN(C[C@H]1O)CCCCF a790a51000c04c1ffe8c5b7af9b56f90 [0,1,0,1,0,0|2,0,0]=4 23056 B13R1.669 C[C@H]1CCN(C[C@H]1O)CCCCO e81bf5163d70fc82bb442aa5ad32a664 [0,1,0,1,0,0|2,0,0]=4 23057 B13R1.669 OCCCCN1CC[C@@H]([C@H](C1)O)O 6461089dc3376f07088e20c5340cb8a6 [0,1,0,1,0,0|2,0,0]=4 23058 B13R1.669 OCCCCN1CC[C@H]([C@@H](C1)O)F 32c4e17fb3c85d53adc221e2aa6c7eb6 [0,1,0,1,0,0|2,0,0]=4 23059 B13R1.669 OCCCCN1CC[C@H]([C@H](C1)O)F b4bd12e6333360a618aceb37f9e23db9 [0,1,0,1,0,0|2,0,0]=4 23060 B13R1.669 O[C@@H]1CN(CC[C@H]1F)CCCCF 80ea61e0146001a2a4354f9829b6f215 [0,1,0,1,0,0|2,0,0]=4 23061 B13R1.669 O[C@H]1CCN(C[C@@H]1O)CCCCF 50a7a394ab1c9148b139917f47433315 [0,1,0,1,0,0|2,0,0]=4 23062 B13R1.669 O[C@H]1CN(CC[C@H]1F)CCCCF c7b313f31ef73a316b586ee52a808806 [0,1,0,1,0,0|2,0,0]=4 23063 B13R1.1110 CC(C)C(C)CCOC1CCCC1 482c00ac23ecfa524f899a1557d5a85c [0,1,0,1,0,0|2,0,0]=4 23064 B13R1.1110 CC(C)C(C)CNCC1CCCC1 7c2be5a1a76f9bdcf526d3e6364d47d1 [0,1,0,1,0,0|2,0,0]=4 23065 B13R1.1110 CC(C)C(C)COCC1CCCC1 3cf4a40249c63455758d8d422ab556fe [0,1,0,1,0,0|2,0,0]=4 23066 B13R1.1110 CC(C)C(C)NCCC1CCCC1 23a24893d282e0ffb6eee8a28e1b0985 [0,1,0,1,0,0|2,0,0]=4 23067 B13R1.1110 CC(C)C(C)OCCC1CCCC1 8ea8bff5047acb5a7ac320634d676b0c [0,1,0,1,0,0|2,0,0]=4 23068 B13R1.1110 CC(C)C(O)CNCC1CCCC1 16b6d8fea7576e30be48745b3d5dcb67 [0,1,0,1,0,0|2,0,0]=4 23069 B13R1.1110 CC(C)N(C)CCCC1CCCC1 cf2840dbe67864932a01f1013eaafc09 [0,1,0,1,0,0|2,0,0]=4 23070 B13R1.1110 CC(C)[C@@H](C)NCCC1CCCC1 0a3d5c908ff191f6ba4b015591d99b47 [0,1,0,1,0,0|2,0,0]=4 23071 B13R1.1110 CC(C)[C@@H](C)OCCC1CCCC1 388f1aa3515b5ac73066e75bda72410b [0,1,0,1,0,0|2,0,0]=4 23072 B13R1.1110 CC(C)[C@H](C)NCCC1CCCC1 6a68906b04ba34c453ab0d844887e2ae [0,1,0,1,0,0|2,0,0]=4 23073 B13R1.1110 CC(C)[C@H](C)OCCC1CCCC1 6371aa88d5630a8890a42931afa63d30 [0,1,0,1,0,0|2,0,0]=4 23074 B13R1.1110 CC(O)C(=O)NCCC1CCCC1 d62d085705996f93a2f8e50bfc14c3ef [0,1,0,1,0,0|1,0,1]=4 23075 B13R1.1110 CC(O)C(C)NCCC1CCCC1 1372e33e12e7b91159b1d4289e919090 [0,1,0,1,0,0|1,0,0]=3 23076 B13R1.1110 CC(O)C(C)NCCC1CCCO1 37b7d9a32bdde8e9ddeda27ba2e96661 [0,1,0,1,0,0|2,0,0]=4 23077 B13R1.1110 CC(O)C(C)NCCC1CCOC1 bc7b8cc5268aecd600e5f5e229bad262 [0,1,0,1,0,0|2,0,0]=4 23078 B13R1.1110 CC(O)C(C)NCCN1CCCC1 4ccccc9fb2c67ace2af2a1edf1963c50 [0,1,0,1,0,0|2,0,0]=4 23079 B13R1.1110 CC(S)C(C)OCCC1CCCC1 0586947797c8c26ab9f186de0e5de940 [0,1,0,1,0,0|1,1,0]=4 23080 B13R1.1110 C[C@@H](O)C(=O)NCCC1CCCC1 05d462f49bd978246d2f97d2d7d3c955 [0,1,0,1,0,0|1,0,1]=4 23081 B13R1.1110 C[C@H](O)C(=O)NCCC1CCCC1 2ac97c54fa73ce9842aebe612641c377 [0,1,0,1,0,0|1,0,1]=4 23082 B13R1.1889 CC(O)C1CN(C1)CCCCCF 14244c7edb7e4ec295e556049436cb8a [0,1,0,1,0,0|2,0,0]=4 23083 B13R1.1889 CC(O)C1CN(C1)CCCCCO c982ab3819d75ab714aa15447634ade4 [0,1,0,1,0,0|2,0,0]=4 23084 B13R1.1889 CCCCCCN1CC(C1)C(C)O b40bd28742ee02477102f78707ab3d41 [0,1,0,1,0,0|1,0,0]=3 23085 B13R1.1889 CCCCOCC1CC(C1)C(C)C 54e8a3233792ae1ffd9e41529e404dfb [0,1,0,1,0,0|2,0,0]=4 23086 B13R1.1889 CCCCOCN1CC(C1)C(C)O 4ad553efb45e02ca03cd905263c0a5f7 [0,1,0,1,0,0|2,0,0]=4 23087 B13R1.1889 CCCOCCN1CC(C1)C(C)O 2ae53fb122cb3fc7cf8405fc395d0018 [0,1,0,1,0,0|2,0,0]=4 23088 B13R1.1889 CCOCCCN1CC(C1)C(C)O faffe9f36d604edf99767cba77d10819 [0,1,0,1,0,0|2,0,0]=4 23089 B13R1.1889 CCSCCCN1CC(C1)C(C)O 95bb8edb15f13ad64dad2a69bf0e1139 [0,1,0,1,0,0|2,0,0]=4 23090 B13R1.1889 COCCCCN1CC(C1)C(C)O 57eeb550b8f9f3fd1604c35b98fa0121 [0,1,0,1,0,0|2,0,0]=4 23091 B13R1.2801 CCC1CCCN1CC(C)C(C)C 3a72a0159cf19446708bad9ad1d28bee [0,1,0,1,0,0|2,0,0]=4 23092 B13R1.2801 CC[C@@H]1CCCN1CC(C)C(C)C 5f9a3866e49a46e5d23a8899e4ea92b3 [0,1,0,1,0,0|2,0,0]=4 23093 B13R1.2801 CC[C@@H]1CCC[C@H]1NC(=O)C(C)O f840fbf8c77e8dc68d98e3674dfb51c2 [0,1,0,1,0,0|1,0,1]=4 23094 B13R1.2801 CC[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)O ec93370ef4df5dcb199e8e549848aa2b [0,1,0,1,0,0|1,0,1]=4 23095 B13R1.2801 CC[C@@H]1CCC[C@H]1NC(=O)[C@H](C)O 01aec41c2f63977d970f9a427be71e6b [0,1,0,1,0,0|1,0,1]=4 23096 B13R1.2801 CC[C@@H]1CCC[C@H]1NC(C)C(C)C 5b96fdfe4921c88eb668d2371330d5ac [0,1,0,1,0,0|2,0,0]=4 23097 B13R1.2839 CC(C)C(C)CCOCC1CCC1 effb16ac9e37ce75b9ad72d8da224eaf [0,1,0,1,0,0|2,0,0]=4 23098 B13R1.2839 CC(C)C(C)CNCCC1CCC1 a9834aca3bd86ddaa16100c36ddd31c3 [0,1,0,1,0,0|2,0,0]=4 23099 B13R1.2839 CC(C)C(C)COCCC1CCC1 c2821d9ff7e6c1ef70cc1f85438eb083 [0,1,0,1,0,0|2,0,0]=4 23100 B13R1.2839 CC(C)C(C)OCCCC1CCC1 36eaca82346cc92625d82acd2bf8417b [0,1,0,1,0,0|2,0,0]=4 23101 B13R1.2839 CC(C)C(O)CNCCC1CCC1 3ea5453377ac533c69f3c3ad1a54ec17 [0,1,0,1,0,0|2,0,0]=4 23102 B13R1.2839 CC(O)C(C)NCCOC1CCC1 d43fd72f26beaab45536533b76894e3c [0,1,0,1,0,0|2,0,0]=4 23103 B13R1.2840 CC(C)C(C)CCOCCC1CC1 afbf12e1c0175081e9a9dd3dd00824cb [0,1,0,1,0,0|2,0,0]=4 23104 B13R1.2840 CC(C)C(C)COCCCC1CC1 f56d9713c16c146b6a6ae1117cca94a6 [0,1,0,1,0,0|2,0,0]=4 23105 B13R1.2861 CCCCCN1CCC(C1(C)C)C 968265ffb0113b19e91c44cdc923e5a8 [0,1,0,1,0,0|2,0,0]=4 23106 B13R1.2861 CCCCCN1CCC(C1(C)C)O 0f79cb43be864623c649b9d63a147d90 [0,1,0,1,0,0|2,0,0]=4 23107 B13R1.3151 CCCCCCCCN(C)C1CC1 3a018319c48acf01359ddc2650d11859 [0,1,0,1,0,0|2,0,0]=4 23108 B13R1.3151 CCCCCCCNC(C)C1CC1 3a37b89d3588dabeea827a3731c308be [0,1,0,1,0,0|2,0,0]=4 23109 B13R1.3151 CCCCCCCN[C@@H](C)C1CC1 8c725f4987d92da42f11f89e64a7f54d [0,1,0,1,0,0|2,0,0]=4 23110 B13R1.3151 CCCCCCCN[C@H](C)C1CC1 53c243a2fec780275e931d8b3de5f741 [0,1,0,1,0,0|2,0,0]=4 23111 B13R1.3151 CCCCCCCOC(C)C1CC1 dd1213e1ed52f1e2df2fd1094ec80f3f [0,1,0,1,0,0|2,0,0]=4 23112 B13R1.3151 CCCCCCCO[C@@H](C)C1CC1 62c8878762e3c84aa895c22659863cbd [0,1,0,1,0,0|2,0,0]=4 23113 B13R1.3151 CCCCCCCO[C@H](C)C1CC1 51244f35230651b88be1ff4fa00e1c8e [0,1,0,1,0,0|2,0,0]=4 23114 B13R1.3151 CCCCCCNCC(O)C1CC1 91a65d667d2544121724e746545c9f67 [0,1,0,1,0,0|2,0,0]=4 23115 B13R1.3151 CCCCCCOCC(C)C1CC1 2514ad49fdfba869c7ba08f766068a45 [0,1,0,1,0,0|2,0,0]=4 23116 B13R1.3766 CC(C)C(C)N1CCCCCC1C 81936f3bc085e036b80ece6a920ab1cc [0,1,0,1,0,0|2,0,0]=4 23117 B13R1.3766 CC(O)C(=O)N1CCCCCC1C 7dfd9843ab5ae8a014523a38ded99e93 [0,1,0,1,0,0|1,0,1]=4 23118 B13R1.3766 CC1CCCCCN1C(=O)[C@@H](C)O 92bfc5be0cec05704c7072078b264c63 [0,1,0,1,0,0|1,0,1]=4 23119 B13R1.3766 CC1CCCCCN1C(=O)[C@H](C)O 1978dfaa2749837934dbdf9f3c91bc74 [0,1,0,1,0,0|1,0,1]=4 23120 B13R1.6161 CC(C)C(C)N1CCCCCCC1 eb1bddcdf55c06976739dd3cd778ed6a [0,1,0,1,0,0|2,0,0]=4 23121 B13R1.6161 CC(C)N(C)C1CCCCCCC1 ebb4aa207d90c07ffaa24538fbd723ce [0,1,0,1,0,0|2,0,0]=4 23122 B13R1.6161 CC(O)C(=O)N1CCCCCCC1 c5059bcfceba1cc7d5109975486cce53 [0,1,0,1,0,0|1,0,1]=4 23123 B13R1.6161 C[C@@H](O)C(=O)N1CCCCCCC1 da463784248c8886aca748c2d4dd4f96 [0,1,0,1,0,0|1,0,1]=4 23124 B13R1.6161 C[C@H](O)C(=O)N1CCCCCCC1 108e4cf72fb29d7061e8fba6623735ea [0,1,0,1,0,0|1,0,1]=4 23125 B13R1.6192 CC(C)C(C)CN1CCCCCC1 55af7a9c2dd30087b4928051ae715c28 [0,1,0,1,0,0|2,0,0]=4 23126 B13R1.6192 CC(C)C(C)NC1CCCCCC1 9c90ca6a1a05e0951623381ef27906b0 [0,1,0,1,0,0|2,0,0]=4 23127 B13R1.6192 CC(C)C(C)OC1CCCCCC1 33d3105b0f35136b24bec1e0c6a23b41 [0,1,0,1,0,0|2,0,0]=4 23128 B13R1.6192 CC(C)N(C)CC1CCCCCC1 de52c211f7adad4401dee86428738fae [0,1,0,1,0,0|2,0,0]=4 23129 B13R1.6192 CC(C)[C@@H](C)NC1CCCCCC1 eb0439e4a7bb1cdc3e3eb8c077757734 [0,1,0,1,0,0|2,0,0]=4 23130 B13R1.6192 CC(C)[C@@H](C)OC1CCCCCC1 32f05800c35bc674b4c0b7246dd87a86 [0,1,0,1,0,0|2,0,0]=4 23131 B13R1.6192 CC(C)[C@H](C)NC1CCCCCC1 b7f1f42dceefe9b0b18fa3b19da7f98f [0,1,0,1,0,0|2,0,0]=4 23132 B13R1.6192 CC(C)[C@H](C)OC1CCCCCC1 fd9094eb357ddbdf9ef38ff9ce332f3b [0,1,0,1,0,0|2,0,0]=4 23133 B13R1.6192 CC(O)C(=O)NC1CCCCCC1 679565b079fe9802752d234210f175dc [0,1,0,1,0,0|1,0,1]=4 23134 B13R1.6192 CC(O)C(C)NC1CCCCCC1 84297cb407be39af70444e2b82dc6e7e [0,1,0,1,0,0|1,0,0]=3 23135 B13R1.6192 CC(O)C(C)NC1CCCOCC1 71dfceb203b4bda77de0f2b18a72f45f [0,1,0,1,0,0|2,0,0]=4 23136 B13R1.6192 CC(S)C(C)OC1CCCCCC1 a31af0a7ccfd8b40b9b6cb0d765ecb41 [0,1,0,1,0,0|1,1,0]=4 23137 B13R1.6192 C[C@@H](O)C(=O)NC1CCCCCC1 e9a27258626e93cc34f6cd09e31daa2f [0,1,0,1,0,0|1,0,1]=4 23138 B13R1.6192 C[C@H](O)C(=O)NC1CCCCCC1 fd30c0a858b20ccdf9df9b60eac805c7 [0,1,0,1,0,0|1,0,1]=4 23139 B13R1.7836 CCCCCCOCC1(CC1F)C 5ba4b1f029c70018614a5c5b9f81322c [0,1,0,1,0,0|2,0,0]=4 23140 B13R1.45 CC(C)CCN(C)C1CCCCC1 8af095a1ced0897c14374f19ccea274e [0,1,0,1,0,0|2,0,0]=4 23141 B13R1.45 CC(C)CNC(C)C1CCCCC1 030492b5c8c9a0f8a6a047f0a758465a [0,1,0,1,0,0|2,0,0]=4 23142 B13R1.45 CC(C)CN[C@@H](C)C1CCCCC1 d5353892014a6232b09465cb137a6e4a [0,1,0,1,0,0|2,0,0]=4 23143 B13R1.45 CC(C)CN[C@H](C)C1CCCCC1 d1c900171607ff42f40775f61d05cf6d [0,1,0,1,0,0|2,0,0]=4 23144 B13R1.45 CC(C)COC(C)C1CCCCC1 36e2a8cde48952f8594ca8710ca123a6 [0,1,0,1,0,0|2,0,0]=4 23145 B13R1.45 CC(C)CO[C@@H](C)C1CCCCC1 13ed4e801165a9a951a8895389e4d4fa [0,1,0,1,0,0|2,0,0]=4 23146 B13R1.45 CC(C)CO[C@H](C)C1CCCCC1 745f7423eda23914e9f2b3e32b392e51 [0,1,0,1,0,0|2,0,0]=4 23147 B13R1.45 CC(C)NCC(O)C1CCCCC1 f28cf4b6f65ab29610d75c787e4806fa [0,1,0,1,0,0|2,0,0]=4 23148 B13R1.45 CC(C)OCC(C)C1CCCCC1 1238d5f33749eebe9bba8f56f9fa2974 [0,1,0,1,0,0|2,0,0]=4 23149 B13R1.45 CC(F)COC(C)C1CCCCC1 747355fe0b659c7e966d0f307feb8d45 [0,1,0,1,0,0|2,0,0]=4 23150 B13R1.45 CC(NC[C@@H](C)O)C1CCCCC1 abf95646e3d6fc7fa6b2c9c0e0093f07 [0,1,0,1,0,0|1,0,0]=3 23151 B13R1.45 CC(NC[C@@H](C)O)C1CCOCC1 b67099bcb7649d253efa5b2491929eb0 [0,1,0,1,0,0|2,0,0]=4 23152 B13R1.45 CC(NC[C@H](C)O)C1CCCCC1 0b61f10a73a12cb08d45e4de9ffc2289 [0,1,0,1,0,0|1,0,0]=3 23153 B13R1.45 CC(NC[C@H](C)O)C1CCOCC1 9b85c94f839d00eda6e86ecf5171c11a [0,1,0,1,0,0|2,0,0]=4 23154 B13R1.45 CC(O)CCN(C)C1CCCCC1 752e12d037dcd8e030e9b6a70598076d [0,1,0,1,0,0|1,0,0]=3 23155 B13R1.45 CC(O)CCN(C)C1CCCCO1 4ce1f6d7d34a106c7e2e97b4fb563ff0 [0,1,0,1,0,0|2,0,0]=4 23156 B13R1.45 CC(O)CCN(C)C1CCCOC1 0f0198b13f3912e827dc5daf42bf57e0 [0,1,0,1,0,0|2,0,0]=4 23157 B13R1.45 CC(O)CCN(C)C1CCOCC1 efde81e429b4a01dc752ef419647447b [0,1,0,1,0,0|2,0,0]=4 23158 B13R1.45 CC(O)CCN(C)C1CCSCC1 d5b48f36f94fd58aa08c2f930086e098 [0,1,0,1,0,0|2,0,0]=4 23159 B13R1.45 CC(O)CNC(C)C1CCCCC1 91804872b262982c62e7340f5c33f967 [0,1,0,1,0,0|1,0,0]=3 23160 B13R1.45 CC(O)CNC(C)C1CCOCC1 c6f8e892c4154b9ac19eb9fa2d20517c [0,1,0,1,0,0|2,0,0]=4 23161 B13R1.45 CC(O)CN[C@@H](C)C1CCCCC1 911694b74baa2ff4749ee99700b5b696 [0,1,0,1,0,0|1,0,0]=3 23162 B13R1.45 CC(O)CN[C@@H](C)C1CCOCC1 3e703b2e14663cae80ae9e56a199f448 [0,1,0,1,0,0|2,0,0]=4 23163 B13R1.45 CC(O)CN[C@H](C)C1CCCCC1 9f6f20387d38d07eb9979010b0f349f0 [0,1,0,1,0,0|1,0,0]=3 23164 B13R1.45 CC(O)CN[C@H](C)C1CCOCC1 f3fc0c0fdf444f7089205ffb21d3a7e2 [0,1,0,1,0,0|2,0,0]=4 23165 B13R1.45 CC(OC[C@@H](C)F)C1CCCCC1 5d53afffc92039b4cfe23abe181544d7 [0,1,0,1,0,0|2,0,0]=4 23166 B13R1.45 CC(OC[C@H](C)F)C1CCCCC1 5173c0d782cabdaaa0bba31a7d98933e [0,1,0,1,0,0|2,0,0]=4 23167 B13R1.45 CC(S)COC(C)C1CCCCC1 d242ac3a7af115286a06b06fea459408 [0,1,0,1,0,0|1,1,0]=4 23168 B13R1.45 C[C@@H](O)CN[C@H](C)C1CCCCC1 e97ca56f1a04c5cae72a2e67042c8689 [0,1,0,1,0,0|1,0,0]=3 23169 B13R1.45 C[C@@H](O)CN[C@H](C)C1CCOCC1 e0502e8f6715fefa8258fb48d1c2c6fc [0,1,0,1,0,0|2,0,0]=4 23170 B13R1.45 C[C@H](NC[C@@H](C)O)C1CCCCC1 b7ce2cd14ec2bd402b660bdd3852581c [0,1,0,1,0,0|1,0,0]=3 23171 B13R1.45 C[C@H](NC[C@@H](C)O)C1CCOCC1 7585c0c0dc44edb653239647b4155918 [0,1,0,1,0,0|2,0,0]=4 23172 B13R1.45 C[C@H](O)CN[C@@H](C)C1CCCCC1 0946893de2cd70d0172379df8e638ab3 [0,1,0,1,0,0|1,0,0]=3 23173 B13R1.45 C[C@H](O)CN[C@@H](C)C1CCOCC1 075f2c79bf6fa95bf9ca4427c0477349 [0,1,0,1,0,0|2,0,0]=4 23174 B13R1.45 C[C@H](O)CN[C@H](C)C1CCCCC1 5a0250219361530b096fa93a2d445086 [0,1,0,1,0,0|1,0,0]=3 23175 B13R1.45 C[C@H](O)CN[C@H](C)C1CCOCC1 b689d391282efe1cece5d3025f3708b1 [0,1,0,1,0,0|2,0,0]=4 23176 B13R1.141 CCCN1CCC(CC1C(C)C)O 556fecde3b3d42972ba9f418cdb40004 [0,1,0,1,0,0|2,0,0]=4 23177 B13R1.168 CC(C)CCC(C)N1CCCC1C 69117c99d46ca07420d2e006efe9bdc6 [0,1,0,1,0,0|2,0,0]=4 23178 B13R1.168 CC(C)CCC(C)N1CCC[C@@H]1C d7b4f2138ccc7c98a239cfdbf0297ba3 [0,1,0,1,0,0|2,0,0]=4 23179 B13R1.168 CC(C)CCC(C)N1CCC[C@H]1C 1d6105c5b72e81a41e1c63a695ad47ad [0,1,0,1,0,0|2,0,0]=4 23180 B13R1.168 CC(O)CCC(=O)N1CCCC1C 339a86df3862d94d4f062a3aba752dd1 [0,1,0,1,0,0|1,0,1]=4 23181 B13R1.168 CC(O)CCC(=O)N1CCC[C@@H]1C 158e6c71b6c2f6808d14320ebf75ef94 [0,1,0,1,0,0|1,0,1]=4 23182 B13R1.168 CC(O)CCC(=O)N1CCC[C@H]1C 8ecf0f60adbcabc8811429d993f5cc1a [0,1,0,1,0,0|1,0,1]=4 23183 B13R1.168 CC(O)CCN(C)C1CCCC1O f920f5c455a44d740c0152a95ce5b3ce [0,1,0,1,0,0|2,0,0]=4 23184 B13R1.168 CC(O)CCN(C)[C@@H]1CCC[C@@H]1O 64648f88bbdf966338ff63f14c8b44cd [0,1,0,1,0,0|2,0,0]=4 23185 B13R1.168 CC(O)CCN(C)[C@@H]1CCC[C@H]1O 6807e984781ea25c78299b62fe9cd659 [0,1,0,1,0,0|2,0,0]=4 23186 B13R1.168 CC(O)CCN(C)[C@H]1CCC[C@@H]1O 4ab1ec92335d47169998b06e87121241 [0,1,0,1,0,0|2,0,0]=4 23187 B13R1.168 CC(O)CCN(C)[C@H]1CCC[C@H]1O 34a7e1a5d6b850533d4d89756ade889f [0,1,0,1,0,0|2,0,0]=4 23188 B13R1.199 CC(C)CCC(C)CNC1CC1C fd644afbf1f80430f46d5f6117dbb888 [0,1,0,1,0,0|2,0,0]=4 23189 B13R1.199 CC(C)CCC(C)OCC1CC1C 9c3a08d447982e1dbd700670077c66fe [0,1,0,1,0,0|2,0,0]=4 23190 B13R1.199 CC(C)CCC(C)OC[C@@H]1C[C@@H]1C 68d433aef09427593d766c008f404db9 [0,1,0,1,0,0|2,0,0]=4 23191 B13R1.199 CC(C)CCC(C)OC[C@@H]1C[C@H]1C 58ef55fa342137bc077481418ec4062a [0,1,0,1,0,0|2,0,0]=4 23192 B13R1.199 CC(C)CCC(C)OC[C@H]1C[C@@H]1C 11d64c496b485b2f3cd98f89c48aef1c [0,1,0,1,0,0|2,0,0]=4 23193 B13R1.240 CC(O)CCN1CCC(C1)CCO 8d569595c2dff0760c0fbcd799770471 [0,1,0,1,0,0|2,0,0]=4 23194 B13R1.240 CCCC1CCN(C1)CCC(C)C e31267ab1d01bcec67125b87edb8c84a [0,1,0,1,0,0|2,0,0]=4 23195 B13R1.240 CCCC1CCN(C1)CCC(C)O 286c82634300858679b13f787f686c65 [0,1,0,1,0,0|1,0,0]=3 23196 B13R1.240 CCCN1CCC(C1)NCC(C)O 4ed414d2f46ad98fe7dd6de223d87865 [0,1,0,1,0,0|2,0,0]=4 23197 B13R1.240 CCCN1CCC(C1)NC[C@@H](C)O 18103ce5976f252c4934cf882ab0eb89 [0,1,0,1,0,0|2,0,0]=4 23198 B13R1.240 CCCN1CCC(C1)NC[C@H](C)O 978d4dfb8d7f615ae7c2ce4108998b7d [0,1,0,1,0,0|2,0,0]=4 23199 B13R1.240 CCO[C@@H]1CCN(C1)CCC(C)O c4b7f30d57c251a6923f772f73e2fed8 [0,1,0,1,0,0|2,0,0]=4 23200 B13R1.240 CCO[C@H]1CCN(C1)CCC(C)O 937177d2ea7a620c158363652c89d78b [0,1,0,1,0,0|2,0,0]=4 23201 B13R1.240 COCC1CCN(C1)CCC(C)O b8ca7d015a67c14a65811c83dd15ce2a [0,1,0,1,0,0|2,0,0]=4 23202 B13R1.240 COC[C@@H]1CCN(C1)CCC(C)O dde3816e27a67448155509ed31d197ef [0,1,0,1,0,0|2,0,0]=4 23203 B13R1.240 COC[C@H]1CCN(C1)CCC(C)O 00412714d3eb8b49112138787a9445e5 [0,1,0,1,0,0|2,0,0]=4 23204 B13R1.277 CC(C)CCC(C)N[C@@H]1CC[C@H]1C 6b995b8f38ba99eb36784711690a52d1 [0,1,0,1,0,0|2,0,0]=4 23205 B13R1.277 CC(C)CCC(C)N[C@H]1CC[C@H]1C ea5fd8e76360929feaaf7fc695e0dbec [0,1,0,1,0,0|2,0,0]=4 23206 B13R1.277 CC(O)CCC(=O)N[C@@H]1CC[C@H]1C f4c2fdef5e670c089528fe0fc1e85d9f [0,1,0,1,0,0|1,0,1]=4 23207 B13R1.277 CC(O)CCC(=O)N[C@H]1CC[C@H]1C 6f21165b34dd4efb32e9f708b6bfd813 [0,1,0,1,0,0|1,0,1]=4 23208 B13R1.344 CC(C)CCC(C)NC1CCCC1 0622a8145ccccda1058a0e03c3b385db [0,1,0,1,0,0|2,0,0]=4 23209 B13R1.344 CC(C)CCC(C)OC1CCCC1 7667cc6188e38551e10ff303fe846e06 [0,1,0,1,0,0|2,0,0]=4 23210 B13R1.344 CC(C)CCN(C)CC1CCCC1 4ca5ca97728e1df8f1b15d6018cd9153 [0,1,0,1,0,0|2,0,0]=4 23211 B13R1.344 CC(C)CNC(C)CC1CCCC1 f40b99be0ec1da9c6563c476cc90289d [0,1,0,1,0,0|2,0,0]=4 23212 B13R1.344 CC(CC1CCCC1)NC[C@@H](C)O cc3510a54ecb704a52d7e401faf2612e [0,1,0,1,0,0|1,0,0]=3 23213 B13R1.344 CC(CC1CCCC1)NC[C@H](C)O 8978fb02c239231d7dc3b516b1552fba [0,1,0,1,0,0|1,0,0]=3 23214 B13R1.344 CC(CN1CCCC1)NC[C@@H](C)O ca1bcf43482835dbbc2559cd29085d6b [0,1,0,1,0,0|2,0,0]=4 23215 B13R1.344 CC(CN1CCCC1)NC[C@H](C)O cbe48bfea1e4e6f6ebacb3ab40b147f0 [0,1,0,1,0,0|2,0,0]=4 23216 B13R1.344 CC(COC(C)C)CC1CCCC1 a3a858cdf29a039e4c5e1b4ba7aca698 [0,1,0,1,0,0|2,0,0]=4 23217 B13R1.344 CC(O)CCC(=O)NC1CCCC1 7622ee6f4325b6045f13be11fe51f347 [0,1,0,1,0,0|1,0,1]=4 23218 B13R1.344 CC(O)CCN(C)CC1CCCC1 2c637cadd9398916cb9eed65ec9cf9ea [0,1,0,1,0,0|1,0,0]=3 23219 B13R1.344 CC(O)CCN(C)CC1CCCO1 5d75116fb1f668d95adbbd0d146252e8 [0,1,0,1,0,0|2,0,0]=4 23220 B13R1.344 CC(O)CCN(C)CC1CCOC1 6a0c5f99e7d5e2e05486add2bf5aef8d [0,1,0,1,0,0|2,0,0]=4 23221 B13R1.344 CC(O)CNC(=O)CC1CCCC1 c60b23f8a5dde768b5e48f063e6c88b3 [0,1,0,1,0,0|1,0,1]=4 23222 B13R1.344 CC(O)CNC(C)CC1CCCC1 8eda1f72a285a23ca4509fcfd70f9142 [0,1,0,1,0,0|1,0,0]=3 23223 B13R1.344 CC(O)CNC(C)CN1CCCC1 52f47c8f9b1d93729d1300d170ac8793 [0,1,0,1,0,0|2,0,0]=4 23224 B13R1.344 C[C@@H](O)CNC(=O)CC1CCCC1 2630bca39110c79f2cb4f3689b703a2a [0,1,0,1,0,0|1,0,1]=4 23225 B13R1.344 C[C@H](O)CNC(=O)CC1CCCC1 0ac6fee29f56ec0043552d0a9bb6dd97 [0,1,0,1,0,0|1,0,1]=4 23226 B13R1.628 CCC1CC1CC(=O)NCC(C)O f8a89c7dc13079a4cd88ebb87e367be8 [0,1,0,1,0,0|1,0,1]=4 23227 B13R1.628 CCC1CC1CC(=O)NC[C@@H](C)O d4b49788849555e22dad88929daa80f9 [0,1,0,1,0,0|1,0,1]=4 23228 B13R1.628 CCC1CC1CC(=O)NC[C@H](C)O 56d1cad4af0802cb3932c5141e6670fd [0,1,0,1,0,0|1,0,1]=4 23229 B13R1.649 CCC1CCN1C(=O)CCC(C)O 44829fc05eeced207de0659d68dc4df6 [0,1,0,1,0,0|1,0,1]=4 23230 B13R1.649 CCC1CCN1C(C)CCC(C)C aa6c703efa0efdfc8a0beec4221ea095 [0,1,0,1,0,0|2,0,0]=4 23231 B13R1.656 CC1CCC(CN1CCCCF)O 9d351d0f8366e4041fa07c8068575ccd [0,1,0,1,0,0|2,0,0]=4 23232 B13R1.656 CC1CCC(CN1CCCCO)O d9643c92f0e98b3c05bf1854b936e78d [0,1,0,1,0,0|2,0,0]=4 23233 B13R1.656 CCCCCN1CC(CCC1C)O 5d0b2397a7f805b71c4edb78f583260e [0,1,0,1,0,0|1,0,0]=3 23234 B13R1.656 CCCCCN1C[C@@H](CC[C@H]1C)O c6b1cf7149c985aeb5f423297d1b3d9f [0,1,0,1,0,0|1,0,0]=3 23235 B13R1.656 CCCCOC1CC(CCC1C)C 4d8e198b0acb44c4ce552201131c611f [0,1,0,1,0,0|2,0,0]=4 23236 B13R1.656 CCOCCN1CC(CCC1C)O e743d90e3ee88b09dc829e5783a5c8c2 [0,1,0,1,0,0|2,0,0]=4 23237 B13R1.656 CCOCCN1C[C@@H](CC[C@H]1C)O 54b018cd5747c784f2b767b86874ca53 [0,1,0,1,0,0|2,0,0]=4 23238 B13R1.656 CCSCCN1CC(CCC1C)O 159537cad8d38a7ce5b28d9617576918 [0,1,0,1,0,0|2,0,0]=4 23239 B13R1.656 CCSCCN1C[C@@H](CC[C@H]1C)O 964ce6d0da7c1767613dc37aa8cf12aa [0,1,0,1,0,0|2,0,0]=4 23240 B13R1.656 COCCCN1CC(CCC1C)O 21656ede4129fff2ea83471d7e2d9808 [0,1,0,1,0,0|2,0,0]=4 23241 B13R1.656 COCCCN1C[C@@H](CC[C@H]1C)O b8699288991480f06c665232f8ed79bf [0,1,0,1,0,0|2,0,0]=4 23242 B13R1.656 CSCCCN1CC(CCC1C)O b08ed0dfc214d74238ddd9adc8192042 [0,1,0,1,0,0|2,0,0]=4 23243 B13R1.656 CSCCCN1C[C@@H](CC[C@H]1C)O 169d80b86b65568b398f3848a466a68b [0,1,0,1,0,0|2,0,0]=4 23244 B13R1.656 C[C@@H]1CC[C@H](CN1CCCCF)O 982df2fc91bab446163866ad3049fd4d [0,1,0,1,0,0|2,0,0]=4 23245 B13R1.656 C[C@@H]1CC[C@H](CN1CCCCO)O 182e7ff39afa507f49b9249365c4eebe [0,1,0,1,0,0|2,0,0]=4 23246 B13R1.1054 CC(C)CCC(C)CNC1CCC1 0718a0aafe5b5cde0d409abc4d76abe7 [0,1,0,1,0,0|2,0,0]=4 23247 B13R1.1054 CC(C)CCC(C)COC1CCC1 8f6114823028f1b6ccef883ea3f54cec [0,1,0,1,0,0|2,0,0]=4 23248 B13R1.1054 CC(C)CCC(C)NCC1CCC1 836252a75ebfeb5ec76c5cfad055e648 [0,1,0,1,0,0|2,0,0]=4 23249 B13R1.1054 CC(C)CCC(C)OCC1CCC1 fadfef9ecf5a5c1682d73ad5d114107f [0,1,0,1,0,0|2,0,0]=4 23250 B13R1.1054 CC(C)CCN(C)CCC1CCC1 4efb4387796939b7b3b9c1d1896065fd [0,1,0,1,0,0|2,0,0]=4 23251 B13R1.1054 CC(O)CCC(=O)NCC1CCC1 7b2ab7949d325679cbd9b0882f67f84d [0,1,0,1,0,0|1,0,1]=4 23252 B13R1.1054 CC(O)CCN(C)CCC1CCC1 8013594f44e5d866476ded7123af220f [0,1,0,1,0,0|1,0,0]=3 23253 B13R1.1054 CC(O)CCN(C)CCC1CCO1 9d840c43f173de4c19c867b023c9c8c9 [0,1,0,1,0,0|2,0,0]=4 23254 B13R1.1054 CC(O)CCN(C)CCC1COC1 ddb422609d90c7da9560d8ddf90ac770 [0,1,0,1,0,0|2,0,0]=4 23255 B13R1.1054 CC(O)CNC(=O)CCC1CCC1 cdad2311962f4beb29d4f10bff933d12 [0,1,0,1,0,0|1,0,1]=4 23256 B13R1.1054 C[C@@H](O)CNC(=O)CCC1CCC1 41fa1e30a378c4aaf3f8fd5f48d85208 [0,1,0,1,0,0|1,0,1]=4 23257 B13R1.1054 C[C@H](O)CNC(=O)CCC1CCC1 8f90fbeb3e83068d47b77f88f610e438 [0,1,0,1,0,0|1,0,1]=4 23258 B13R1.1055 CC(C)CCC(C)CNCC1CC1 1a4be4bb0486a13a395e5321b09607e6 [0,1,0,1,0,0|2,0,0]=4 23259 B13R1.1055 CC(C)CCC(C)COCC1CC1 57f3beef9957f2e4d2ceaceec94936af [0,1,0,1,0,0|2,0,0]=4 23260 B13R1.1055 CC(C)CCC(C)NCCC1CC1 f563e87584845f2a879b1a5e2731160a [0,1,0,1,0,0|2,0,0]=4 23261 B13R1.1055 CC(C)CCC(C)OCCC1CC1 36f285ce88be1e29b0adc7817e07875c [0,1,0,1,0,0|2,0,0]=4 23262 B13R1.1055 CC(O)CCC(=O)NCCC1CC1 017cba1ebd19583852c66118d6e1a8c1 [0,1,0,1,0,0|1,0,1]=4 23263 B13R1.1055 CC(O)CCN(C)CCOC1CC1 3ca9def87460056801068e6f5bcf20e1 [0,1,0,1,0,0|2,0,0]=4 23264 B13R1.1055 CC(O)CNC(=O)CCCC1CC1 e99fca2c5ecda65bc9ce4db8d2b417a1 [0,1,0,1,0,0|1,0,1]=4 23265 B13R1.1055 C[C@@H](O)CNC(=O)CCCC1CC1 b188ebd3f1493baedc588f9e39fcecfc [0,1,0,1,0,0|1,0,1]=4 23266 B13R1.1055 C[C@H](O)CNC(=O)CCCC1CC1 14d45bd45ded27160d30a1f7b94b87f7 [0,1,0,1,0,0|1,0,1]=4 23267 B13R1.2135 CC(O)CN1C(CCCC1CO)C 1123a8a9e4c4d59393304cad180dbca4 [0,1,0,1,0,0|2,0,0]=4 23268 B13R1.2135 CC1CCCC(N1C[C@@H](C)O)CO 51ee0cba37717c48f851275e2f461d3a [0,1,0,1,0,0|2,0,0]=4 23269 B13R1.2135 CC1CCCC(N1C[C@H](C)O)CO 6b4002a1e92ec9676c1a436cca144e02 [0,1,0,1,0,0|2,0,0]=4 23270 B13R1.2915 CCCCCCC(C)NC1CC1C 670beb73a105f263d4a3fcfc20d2262a [0,1,0,1,0,0|2,0,0]=4 23271 B13R1.2915 CCCCCCC(C)N[C@@H]1C[C@H]1F 95150cd52337af4b1d782681d2807b6f [0,1,0,1,0,0|2,0,0]=4 23272 B13R1.2915 CCCCCCC(C)N[C@H]1C[C@@H]1F 88d2ddc2fdea1c4f4ca8b7ba217c493d [0,1,0,1,0,0|2,0,0]=4 23273 B13R1.2915 CCCCCCC(C)N[C@H]1C[C@H]1F 02eca1014ece02ead6769ab12fcbdd25 [0,1,0,1,0,0|2,0,0]=4 23274 B13R1.2917 CCCCCCC(C)COC1CC1 df95f144b7593fd4b3b5ac9858538af6 [0,1,0,1,0,0|2,0,0]=4 23275 B13R1.2917 CCCCCCC(C)NCC1CC1 6f48491ce8d713645773db60d7065545 [0,1,0,1,0,0|2,0,0]=4 23276 B13R1.2917 CCCCCCC(C)OCC1CC1 fc63744f354eeace87f09b7b61e85c29 [0,1,0,1,0,0|2,0,0]=4 23277 B13R1.2917 CCCCCCN(C)CCC1CC1 182affbed9952d3030edfb829d33bd04 [0,1,0,1,0,0|2,0,0]=4 23278 B13R1.2917 CCCCCC[C@@H](C)NCC1CC1 893074bbbcfedb82d2880ce5833e3889 [0,1,0,1,0,0|2,0,0]=4 23279 B13R1.2917 CCCCCC[C@@H](C)OCC1CC1 9263be9ff618b6743788b98e9f699077 [0,1,0,1,0,0|2,0,0]=4 23280 B13R1.2917 CCCCCC[C@H](C)NCC1CC1 9a7e6dd83be05893fdb8f7f4bd283849 [0,1,0,1,0,0|2,0,0]=4 23281 B13R1.2917 CCCCCC[C@H](C)OCC1CC1 aae117d766553a766eb9702b08b73dbe [0,1,0,1,0,0|2,0,0]=4 23282 B13R1.2919 CC(NCCCCF)[C@H]1C[C@H](C1)O f15b5299da49eda696c9c303f36ee7c8 [0,1,0,1,0,0|2,0,0]=4 23283 B13R1.2919 CC(NCCCCO)[C@H]1C[C@H](C1)O 5c9206509a6d8216d7bd0ea9b2085c11 [0,1,0,1,0,0|2,0,0]=4 23284 B13R1.2919 CCCCCCC(=O)N1CC(C1)O ca62335eb53fabf8823713029e3c51a7 [0,1,0,1,0,0|1,0,1]=4 23285 B13R1.2919 CCCCCCC(C)N1CC(C1)F b8d4a78b749878c69eddd2b8d04cb6b5 [0,1,0,1,0,0|2,0,0]=4 23286 B13R1.2919 CCCCCCN(C)C1CC(C1)F a2c56c270d99d39ebe475c2dea3056c1 [0,1,0,1,0,0|2,0,0]=4 23287 B13R1.2919 CCCCCCN(C)C1CC(C1)O b589c6d2a8aba65f7ca3339d6ad2e62f [0,1,0,1,0,0|1,0,0]=3 23288 B13R1.2919 CCCCCCN(C)[C@H]1C[C@@H](C1)F 05cf1c01546a7ac30cae90c834d71054 [0,1,0,1,0,0|2,0,0]=4 23289 B13R1.2919 CCCCCCN(C)[C@H]1C[C@@H](C1)O 86258bfadd6587e3d6cdae2f8ac4599e [0,1,0,1,0,0|1,0,0]=3 23290 B13R1.2919 CCCCCCN(C)[C@H]1C[C@H](C1)F 2784b248416b8668ef1da8d69ef0fe9f [0,1,0,1,0,0|2,0,0]=4 23291 B13R1.2919 CCCCCNC(C)[C@H]1C[C@H](C1)O c576fcd60daa19d64073a7148a66335c [0,1,0,1,0,0|1,0,0]=3 23292 B13R1.2919 CCCCOCN(C)C1CC(C1)O 73282fd499374f686ee028db8f310882 [0,1,0,1,0,0|2,0,0]=4 23293 B13R1.2919 CCCCOCN(C)[C@H]1C[C@@H](C1)O eeec01942d2900a59228a74e0c8342bf [0,1,0,1,0,0|2,0,0]=4 23294 B13R1.2919 CCCOCCN(C)C1CC(C1)O f55cdcb9bef5924455fd2080663f3a9b [0,1,0,1,0,0|2,0,0]=4 23295 B13R1.2919 CCCOCCN(C)[C@H]1C[C@@H](C1)O 36c6a33271c23b0778c8145f71d8df09 [0,1,0,1,0,0|2,0,0]=4 23296 B13R1.2919 CCOCCCN(C)C1CC(C1)O 46ceca896e2fb2a1e28ec81faad5c9d3 [0,1,0,1,0,0|2,0,0]=4 23297 B13R1.2919 CCOCCCN(C)[C@H]1C[C@@H](C1)O 74fdecded30e4364c15d5cb3675e65e2 [0,1,0,1,0,0|2,0,0]=4 23298 B13R1.2919 CCOCCNC(C)[C@H]1C[C@H](C1)O 96af7fa20c9a89e24dace04bd0d4a721 [0,1,0,1,0,0|2,0,0]=4 23299 B13R1.2919 CCSCCCN(C)C1CC(C1)O f773b7e6d6317bf4e9940ebd504e40c8 [0,1,0,1,0,0|2,0,0]=4 23300 B13R1.2919 CCSCCCN(C)[C@H]1C[C@@H](C1)O 36a5494ada4fc6a2cd7184fa38516961 [0,1,0,1,0,0|2,0,0]=4 23301 B13R1.2919 CCSCCNC(C)[C@H]1C[C@H](C1)O 7481398ab52b5599e74addf252f807f1 [0,1,0,1,0,0|2,0,0]=4 23302 B13R1.2919 CN(CCCCCF)C1CC(C1)O c7c4cd91001891df718d794631b11ab9 [0,1,0,1,0,0|2,0,0]=4 23303 B13R1.2919 CN(CCCCCF)[C@H]1C[C@@H](C1)O 63250c20b8ad062c04d8e4ca854f0c85 [0,1,0,1,0,0|2,0,0]=4 23304 B13R1.2919 CN(CCCCCO)C1CC(C1)O 89a58ee31f97f4a204faff63ab8133f1 [0,1,0,1,0,0|2,0,0]=4 23305 B13R1.2919 CN(CCCCCO)[C@H]1C[C@@H](C1)O b622e1d1baf1a52dfd41428876a7d5d0 [0,1,0,1,0,0|2,0,0]=4 23306 B13R1.2919 COCCCCN(C)C1CC(C1)O a1ac8ebb9cca3be28b6646fe2d7d5d8f [0,1,0,1,0,0|2,0,0]=4 23307 B13R1.2919 COCCCCN(C)[C@H]1C[C@@H](C1)O b2f8ad37d2919b07db1b24a2617594f0 [0,1,0,1,0,0|2,0,0]=4 23308 B13R1.2919 COCCCNC(C)[C@H]1C[C@H](C1)O 9f6d38068030af304b7207636245fd84 [0,1,0,1,0,0|2,0,0]=4 23309 B13R1.2919 CSCCCNC(C)[C@H]1C[C@H](C1)O 56f02368192bd557651e2401625ea6a5 [0,1,0,1,0,0|2,0,0]=4 23310 B13R1.3688 CC1(CCC(C1)O)NCCCCF 103aaf1343b0520ec9eff089eb01fc36 [0,1,0,1,0,0|2,0,0]=4 23311 B13R1.3688 CC1(CCC(C1)O)NCCCCO af2c6849e4864fadc82fff20db91b4cf [0,1,0,1,0,0|2,0,0]=4 23312 B13R1.3688 CCCCCNC1(CCC(C1)O)C d362d0b8bd6c6631ab0664d5ca6c5cfa [0,1,0,1,0,0|1,0,0]=3 23313 B13R1.3688 CCCCCN[C@]1(CC[C@@H](C1)O)C bf608d1c8a6b4e3fa86e1e675c3e68ea [0,1,0,1,0,0|1,0,0]=3 23314 B13R1.3688 CCCCCN[C@]1(CC[C@H](C1)O)C 218d6b6c8a008b07ad058a51ec064d60 [0,1,0,1,0,0|1,0,0]=3 23315 B13R1.3688 CCOCCNC1(CCC(C1)O)C bad310135be2230b8fb9a627aeee9b2c [0,1,0,1,0,0|2,0,0]=4 23316 B13R1.3688 CCOCCN[C@]1(CC[C@@H](C1)O)C 1603886145a050531c20355b974f4d87 [0,1,0,1,0,0|2,0,0]=4 23317 B13R1.3688 CCOCCN[C@]1(CC[C@H](C1)O)C 13c7b15cd3fee0937a5ad8cef63eb7c4 [0,1,0,1,0,0|2,0,0]=4 23318 B13R1.3688 CCSCCNC1(CCC(C1)O)C 104915d2f96497ac65516307cdd2a57d [0,1,0,1,0,0|2,0,0]=4 23319 B13R1.3688 CCSCCN[C@]1(CC[C@@H](C1)O)C 71dc464da19b2d09b76bc3639cb288b0 [0,1,0,1,0,0|2,0,0]=4 23320 B13R1.3688 CCSCCN[C@]1(CC[C@H](C1)O)C 706460ceafed0ca3a5dc5126361e004d [0,1,0,1,0,0|2,0,0]=4 23321 B13R1.3688 COCCCNC1(CCC(C1)O)C b9b97831f36bfea899bd307e5946fde9 [0,1,0,1,0,0|2,0,0]=4 23322 B13R1.3688 COCCCN[C@]1(CC[C@@H](C1)O)C 7f0b8ad50fc504fd6372d35cbed80d5c [0,1,0,1,0,0|2,0,0]=4 23323 B13R1.3688 COCCCN[C@]1(CC[C@H](C1)O)C 73599568c3e391bc7ea84c8fc413a6e3 [0,1,0,1,0,0|2,0,0]=4 23324 B13R1.3688 CSCCCNC1(CCC(C1)O)C cdd950658879cc5f267151c988e5323b [0,1,0,1,0,0|2,0,0]=4 23325 B13R1.3688 CSCCCN[C@]1(CC[C@@H](C1)O)C d1038609808ab8734a813f958d8b9ab3 [0,1,0,1,0,0|2,0,0]=4 23326 B13R1.3688 CSCCCN[C@]1(CC[C@H](C1)O)C 19d6aa39e2847c267567a80a7140153a [0,1,0,1,0,0|2,0,0]=4 23327 B13R1.3688 C[C@@]1(CC[C@@H](C1)O)NCCCCF 7a66a19c9b820c140a704b1ae99e22eb [0,1,0,1,0,0|2,0,0]=4 23328 B13R1.3688 C[C@@]1(CC[C@@H](C1)O)NCCCCO e234ab065da9f0a57f98a27845ee0ef5 [0,1,0,1,0,0|2,0,0]=4 23329 B13R1.3688 C[C@@]1(CC[C@H](C1)O)NCCCCF 86ce0c988f93b548b81408ceb779041c [0,1,0,1,0,0|2,0,0]=4 23330 B13R1.3688 C[C@@]1(CC[C@H](C1)O)NCCCCO c0ecc6b46c12e29dd3abfcf102b8e23c [0,1,0,1,0,0|2,0,0]=4 23331 B13R1.6343 CCCCCCC(C)N1CC1(C)C 3303f4b8478cf73683f590a7b646fd5a [0,1,0,1,0,0|2,0,0]=4 23332 B13R1.6343 CCCCCCN(C)C1CC1(C)C 95530602c40ce78d894e677e02172059 [0,1,0,1,0,0|2,0,0]=4 23333 B13R1.8682 CC(C)CNC1(CCCCCC1)C 283c23ea8220ae161373ad9b4bd2dd55 [0,1,0,1,0,0|2,0,0]=4 23334 B13R1.8682 CC(C)NCC1(CCCCCC1)O 8b5159be4ebf211c6543003aff78bb8c [0,1,0,1,0,0|2,0,0]=4 23335 B13R1.8682 CC(O)CNC1(CCCCCC1)C 44af4a7640b9970e42c621c1cbd2181a [0,1,0,1,0,0|1,0,0]=3 23336 B13R1.8682 C[C@@H](O)CNC1(CCCCCC1)C 4f4e0bf356dbef5ade215092c62349a4 [0,1,0,1,0,0|1,0,0]=3 23337 B13R1.8682 C[C@H](O)CNC1(CCCCCC1)C 696bb43f7a454c7f197a4d1809d77909 [0,1,0,1,0,0|1,0,0]=3 23338 B13R1.292 C=C(C)CCCNCC1CC(C1)O fa8d1a9098387a67f356497f40240571 [0,1,0,1,0,0|1,0,1]=4 23339 B13R1.292 C=C(C)CCCNC[C@H]1C[C@@H](C1)O fed840f86bbc5fed42ad39e94f99d75c [0,1,0,1,0,0|1,0,1]=4 23340 B13R1.292 C=C(C)CCCNC[C@H]1C[C@H](C1)O 336a94a679e320752e2af6a45e4bb84c [0,1,0,1,0,0|1,0,1]=4 23341 B13R1.292 CC(=O)CCCCCN1CC(C1)O f5ef900251991593783b9ca556e4b808 [0,1,0,1,0,0|1,0,1]=4 23342 B13R1.292 CC(=O)CCCCNC1CC(C1)O 3cd8bb464f561f625d904665af101155 [0,1,0,1,0,0|1,0,1]=4 23343 B13R1.292 CC(=O)CCCCN[C@H]1C[C@@H](C1)O 7e42e5c3dd858b4a30c5f7c7af2667be [0,1,0,1,0,0|1,0,1]=4 23344 B13R1.292 CC(=O)CCCCN[C@H]1C[C@H](C1)O 672c1646170ec5f93bdf04f814aeaf82 [0,1,0,1,0,0|1,0,1]=4 23345 B13R1.292 CC(=O)CCCNCC1CC(C1)O 70faabb4714ec30b2890650d17be655c [0,1,0,1,0,0|1,0,1]=4 23346 B13R1.292 CC(=O)CCCNC[C@H]1C[C@@H](C1)O b4e187124b39c821742354fcc897460b [0,1,0,1,0,0|1,0,1]=4 23347 B13R1.292 CC(=O)CCCNC[C@H]1C[C@H](C1)O fd66c8081cf4947801333946df244f1c [0,1,0,1,0,0|1,0,1]=4 23348 B13R1.292 CC(C)CCCCCN1CC(C1)F 22a5ec44e349dcb6c2b2f3cca93cc87c [0,1,0,1,0,0|2,0,0]=4 23349 B13R1.292 CC(C)CCCCCN1CC(C1)O 7e64b7eded567ce395c608c865974f09 [0,1,0,1,0,0|1,0,0]=3 23350 B13R1.292 CC(C)CCCCNC1CC(C1)F 939602efb4347c19c409b7efada83927 [0,1,0,1,0,0|2,0,0]=4 23351 B13R1.292 CC(C)CCCCNC1CC(C1)O a972d7a78a8b8049eab2aecc7d343df9 [0,1,0,1,0,0|1,0,0]=3 23352 B13R1.292 CC(C)CCCCN[C@H]1C[C@@H](C1)F 0c22a0a02786a131d39b4259196db683 [0,1,0,1,0,0|2,0,0]=4 23353 B13R1.292 CC(C)CCCCN[C@H]1C[C@@H](C1)O c75ca5b6ea8bd209ee237201e9f571f7 [0,1,0,1,0,0|1,0,0]=3 23354 B13R1.292 CC(C)CCCCN[C@H]1C[C@H](C1)F 8668c926e5d74a95941457ddeba302b3 [0,1,0,1,0,0|2,0,0]=4 23355 B13R1.292 CC(C)CCCCN[C@H]1C[C@H](C1)O 8ebf45f2991e6d00f982b4b7ca1e4fa0 [0,1,0,1,0,0|1,0,0]=3 23356 B13R1.292 CC(C)CCCCOC1CC(C1)C 407d23813033b2b7527b7d41f7e0c6fc [0,1,0,1,0,0|2,0,0]=4 23357 B13R1.292 CC(C)CCCCOC1CC(C1)F 2e716cd5c5daba498e34169c10757358 [0,1,0,1,0,0|2,0,0]=4 23358 B13R1.292 CC(C)CCCCO[C@H]1C[C@@H](C1)F 42b86306f88a4476910bd33f6ef30bb7 [0,1,0,1,0,0|2,0,0]=4 23359 B13R1.292 CC(C)CCCCO[C@H]1C[C@H](C1)F 0f40b5e7732e79790c2c4b666d6a9952 [0,1,0,1,0,0|2,0,0]=4 23360 B13R1.292 CC(C)CCCNCC1CC(C1)C 55d1ce48704c1104b78f00ff4f33c1f8 [0,1,0,1,0,0|2,0,0]=4 23361 B13R1.292 CC(C)CCCNCC1CC(C1)O 8928e6cc2adad8b30321b2744c41721c [0,1,0,1,0,0|1,0,0]=3 23362 B13R1.292 CC(C)CCCNC[C@H]1C[C@@H](C1)O 845520df083337d0ccfa344327057a89 [0,1,0,1,0,0|1,0,0]=3 23363 B13R1.292 CC(C)CCCNC[C@H]1C[C@H](C1)F 0d476101e4105bd4ea41e6b043d83de4 [0,1,0,1,0,0|2,0,0]=4 23364 B13R1.292 CC(C)CCCNC[C@H]1C[C@H](C1)O 949510f604fd4f535c9602906f0b4088 [0,1,0,1,0,0|1,0,0]=3 23365 B13R1.292 CC(C)CCCOCC1CC(C1)C bbfdd85b7a391275aadf8e202fc415d4 [0,1,0,1,0,0|2,0,0]=4 23366 B13R1.292 CC(C)CCCOCC1CC(C1)F 379fc9863bd3f900c612269d1855a361 [0,1,0,1,0,0|2,0,0]=4 23367 B13R1.292 CC(C)CCCOC[C@H]1C[C@@H](C1)C 5e82640c7d620d438b5c2104520343c8 [0,1,0,1,0,0|2,0,0]=4 23368 B13R1.292 CC(C)CCCOC[C@H]1C[C@H](C1)F 24bdd98f28b3ca40f2a1f5c0a8bccfee [0,1,0,1,0,0|2,0,0]=4 23369 B13R1.292 CC(C)CCNCCN1CC(C1)O 7221d0179a925781a6322dce22d80244 [0,1,0,1,0,0|2,0,0]=4 23370 B13R1.292 CC(C)CNCCCN1CC(C1)O d0143bd88a66bf35563ff866b1f59442 [0,1,0,1,0,0|2,0,0]=4 23371 B13R1.292 CC(C)COCCNC1CC(C1)O 6416554ea5f1c489410654edd6b4d683 [0,1,0,1,0,0|2,0,0]=4 23372 B13R1.292 CC(C)COCCN[C@H]1C[C@@H](C1)O 9d3b56699ffa14af55077d57ad40d3a4 [0,1,0,1,0,0|2,0,0]=4 23373 B13R1.292 CC(C)COCCN[C@H]1C[C@H](C1)O 5514cf578acf3e6ee1a4556c5574fcc6 [0,1,0,1,0,0|2,0,0]=4 23374 B13R1.292 CC(C)OCCCNC1CC(C1)O d01da9865f0d32a5b1b754abecf3fe4a [0,1,0,1,0,0|2,0,0]=4 23375 B13R1.292 CC(C)OCCNCC1CC(C1)O 4057d3c249e2a3245d2d8d6ba509c0d2 [0,1,0,1,0,0|2,0,0]=4 23376 B13R1.292 CC(C)OCCNC[C@H]1C[C@@H](C1)O f9684f3143be416461b5949a87b103dc [0,1,0,1,0,0|2,0,0]=4 23377 B13R1.292 CC(C)OCCNC[C@H]1C[C@H](C1)O ba8aa3fc6450111208d61ebb7e1f3f4b [0,1,0,1,0,0|2,0,0]=4 23378 B13R1.292 CC(C)SCCCNC1CC(C1)O 7d283c76093bc2fe0de26b32192964ba [0,1,0,1,0,0|2,0,0]=4 23379 B13R1.292 CC(C)SCCNCC1CC(C1)O 7a989c42c2862c1a0fb732d3a73c7904 [0,1,0,1,0,0|2,0,0]=4 23380 B13R1.292 CC(C)SCCNC[C@H]1C[C@@H](C1)O 82aeef5017008533924e358c27444d2f [0,1,0,1,0,0|2,0,0]=4 23381 B13R1.292 CC(C)SCCNC[C@H]1C[C@H](C1)O 6b9b1fb4bc660f2a96b3be1c5bd5457e [0,1,0,1,0,0|2,0,0]=4 23382 B13R1.292 CC(O)CCCCNC1CC(C1)F c373d715cb9b7395fd57f725cfcb7b51 [0,1,0,1,0,0|1,0,0]=3 23383 B13R1.292 CC(O)CCCCNC1CC(C1)O 750edf40a4c59bb329e781b2eb482295 [0,1,0,1,0,0|1,0,0]=3 23384 B13R1.292 CC(O)CCCCNC1CN(C1)C 00cd2ddb6af1c9c5abbc6f80614108f2 [0,1,0,1,0,0|2,0,0]=4 23385 B13R1.292 CC(O)CCCCN[C@H]1C[C@@H](C1)F bd235b0985af002618d1da520353a4d4 [0,1,0,1,0,0|1,0,0]=3 23386 B13R1.292 CC(O)CCCCN[C@H]1C[C@@H](C1)O 3fb223e5bcbdfaa9e794ed611a5bdbdc [0,1,0,1,0,0|1,0,0]=3 23387 B13R1.292 CC(O)CCCCN[C@H]1C[C@H](C1)F f91724f22e22022cb4b0da44c2160b37 [0,1,0,1,0,0|1,0,0]=3 23388 B13R1.292 CC(O)CCCCN[C@H]1C[C@H](C1)O 753b23b6b144b47904e70c27580852bc [0,1,0,1,0,0|1,0,0]=3 23389 B13R1.292 CC(O)CCCNCC1CC(C1)O f3fc146238062409e65625143f35a592 [0,1,0,1,0,0|1,0,0]=3 23390 B13R1.292 CC(O)CCCNCC1CN(C1)C dfc1d7383223da0f28ea9889e1e9e328 [0,1,0,1,0,0|2,0,0]=4 23391 B13R1.292 CC(O)CCCNC[C@H]1C[C@@H](C1)O c24fdb8550b291ca488d26c923e7fac7 [0,1,0,1,0,0|1,0,0]=3 23392 B13R1.292 CC(O)CCCNC[C@H]1C[C@H](C1)O 0e72bfd86bd84aac86dfe9c915ae9e97 [0,1,0,1,0,0|1,0,0]=3 23393 B13R1.292 CC(O)CCNCCC1CN(C1)C 5397a4b624644192a41aa110dc33733e [0,1,0,1,0,0|2,0,0]=4 23394 B13R1.292 CC(O)CCNCCN1CC(C1)F 70c84b8fa03924f0136d641b14a33cdf [0,1,0,1,0,0|2,0,0]=4 23395 B13R1.292 CC(O)CCNCCN1CC(C1)O b771114769bac396500584e4c07fb13b [0,1,0,1,0,0|2,0,0]=4 23396 B13R1.292 CC(O)CNCCCN1CC(C1)O 146e10ad68418f83fba338af996b7ad4 [0,1,0,1,0,0|2,0,0]=4 23397 B13R1.292 CN(C)CCCCNC1CC(C1)O e9dfba52784a62ed00bf91ef5fce5170 [0,1,0,1,0,0|2,0,0]=4 23398 B13R1.292 CN(C)CCCCN[C@H]1C[C@@H](C1)O d2c934b029476fbd11564de11e07b298 [0,1,0,1,0,0|2,0,0]=4 23399 B13R1.292 CN(C)CCCCN[C@H]1C[C@H](C1)O 75867b402b23591842da6fc5eb1e9483 [0,1,0,1,0,0|2,0,0]=4 23400 B13R1.292 CN(C)CCCNCC1CC(C1)O fbe7c90f37342d3d2e7e6b8a9d33ce17 [0,1,0,1,0,0|2,0,0]=4 23401 B13R1.292 CN(C)CCCNC[C@H]1C[C@@H](C1)O 0d95b70bac4aa1b190b9cc30ddfabd9a [0,1,0,1,0,0|2,0,0]=4 23402 B13R1.292 CN(C)CCCNC[C@H]1C[C@H](C1)O 3274a98777566dc9fca90b4075bef30d [0,1,0,1,0,0|2,0,0]=4 23403 B13R1.292 CS(=O)CCCNCC1CC(C1)O 85b59c6f8a5d65198f447ca8f5e1319c [0,1,0,1,0,0|2,0,0]=4 23404 B13R1.292 C[C@@H](O)CCCCNC1CC(C1)F a8c575533dd181037b7c9ebe285c1bbc [0,1,0,1,0,0|1,0,0]=3 23405 B13R1.292 C[C@@H](O)CCCCNC1CC(C1)O ffbdc614514bafb55e850648cddc10be [0,1,0,1,0,0|1,0,0]=3 23406 B13R1.292 C[C@@H](O)CCCCNC1CN(C1)C 4a1255b4e3dcc8824e116d7ece962fb2 [0,1,0,1,0,0|2,0,0]=4 23407 B13R1.292 C[C@@H](O)CCCCN[C@H]1C[C@@H](C1)F 86ce7916208365f9e5b33acb644308b6 [0,1,0,1,0,0|1,0,0]=3 23408 B13R1.292 C[C@@H](O)CCCCN[C@H]1C[C@@H](C1)O 094974cb03079f716c59352a55c7be86 [0,1,0,1,0,0|1,0,0]=3 23409 B13R1.292 C[C@@H](O)CCCCN[C@H]1C[C@H](C1)F d4bef3dea7b2b117f37861b64f1094c9 [0,1,0,1,0,0|1,0,0]=3 23410 B13R1.292 C[C@@H](O)CCCCN[C@H]1C[C@H](C1)O 75ce8a7a6d2e66104b7dc0d2f8c4b67a [0,1,0,1,0,0|1,0,0]=3 23411 B13R1.292 C[C@@H](O)CNCCCN1CC(C1)O 57b35fed56fa89bb5b7bf2ab1520ed64 [0,1,0,1,0,0|2,0,0]=4 23412 B13R1.292 C[C@H](O)CNCCCN1CC(C1)O 22ec5c27788f1030445e6d431969780e [0,1,0,1,0,0|2,0,0]=4 23413 B13R1.292 OC1CC(C1)NCCCCC(F)F fcd38aca361644e02e4445dd8e97bcaa [0,1,0,1,0,0|2,0,0]=4 23414 B13R1.292 OC1CN(C1)CCCCCC(F)F 419d067ca7755ffa35245f22c09c1fc6 [0,1,0,1,0,0|2,0,0]=4 23415 B13R1.589 CC(=O)C1CCCCN1CC(C)O 292d0f641ab75d05d67aaa598a9153d2 [0,1,0,1,0,0|1,0,1]=4 23416 B13R1.589 CC(=O)C1CCCCN1C[C@@H](C)O a8baa60d920b9213bcf6906174937256 [0,1,0,1,0,0|1,0,1]=4 23417 B13R1.589 CC(=O)C1CCCCN1C[C@H](C)O bd4610e8bd394404fdc59cfed1f6e092 [0,1,0,1,0,0|1,0,1]=4 23418 B13R1.589 CC(C)C1COCCN1C[C@@H](C)O 4e9cd9b3f65d1415ed4d854f92492bf5 [0,1,0,1,0,0|2,0,0]=4 23419 B13R1.589 CC(C)C1COCCN1C[C@H](C)O 41af70d171f5cabed43ba293009b3ab6 [0,1,0,1,0,0|2,0,0]=4 23420 B13R1.589 CC(C)OC1CCCCC1C(C)C a1a64271611563584d7b94fc0636fad9 [0,1,0,1,0,0|2,0,0]=4 23421 B13R1.589 CC(C)[C@@H]1COCCN1C[C@@H](C)O 78d851eed0587d238d4a1d9996c9c20c [0,1,0,1,0,0|2,0,0]=4 23422 B13R1.589 CC(C)[C@@H]1COCCN1C[C@H](C)O 529defdb4eabfec17196140fbfdaf21d [0,1,0,1,0,0|2,0,0]=4 23423 B13R1.589 CC(C)[C@H]1COCCN1C[C@@H](C)O 9ea5c816d53a7eb274d3ba91d25ed35c [0,1,0,1,0,0|2,0,0]=4 23424 B13R1.589 CC(C)[C@H]1COCCN1C[C@H](C)O 41b92ee548748019cbf4629f06139f3b [0,1,0,1,0,0|2,0,0]=4 23425 B13R1.589 CC(O)CN1CCCCC1C(F)F a7cdcb86f103ed73957136766584d6ab [0,1,0,1,0,0|2,0,0]=4 23426 B13R1.589 CC(O)CN1CCCC[C@@H]1C(F)F 3fee5433e8e8eff84cc88304647ff6da [0,1,0,1,0,0|2,0,0]=4 23427 B13R1.589 CC(O)CN1CCCC[C@H]1C(F)F 92aa133b2bf0e6dad8d75fcd67988c8e [0,1,0,1,0,0|2,0,0]=4 23428 B13R1.589 CC(O)CN1CCOCC1C(C)C c63b260bdae6cecaff7ad2e35805b06c [0,1,0,1,0,0|2,0,0]=4 23429 B13R1.589 CC(O)CN1CCOC[C@@H]1C(C)C 67f2ff72aa86f79e14407d3f1775a04e [0,1,0,1,0,0|2,0,0]=4 23430 B13R1.589 CC(O)CN1CCOC[C@H]1C(C)C 47361c18212985cee211d2bff32f3928 [0,1,0,1,0,0|2,0,0]=4 23431 B13R1.589 C[C@@H](O)CN1CCCCC1C(F)F 4af8b63c77945f26c09c1d7101aa969d [0,1,0,1,0,0|2,0,0]=4 23432 B13R1.589 C[C@@H](O)CN1CCCC[C@@H]1C(F)F bbb808b77d8b5c3145eb07661588df4c [0,1,0,1,0,0|2,0,0]=4 23433 B13R1.589 C[C@@H](O)CN1CCCC[C@H]1C(F)F 4a0936fc5d578816a71ab128c7ea4204 [0,1,0,1,0,0|2,0,0]=4 23434 B13R1.589 C[C@H](O)CN1CCCCC1C(F)F 9f56bfb63f77702345b423991d28206d [0,1,0,1,0,0|2,0,0]=4 23435 B13R1.589 C[C@H](O)CN1CCCC[C@@H]1C(F)F 40814902783bb2ccf479a0e257812f84 [0,1,0,1,0,0|2,0,0]=4 23436 B13R1.589 C[C@H](O)CN1CCCC[C@H]1C(F)F 7574c0508b5d125de3d94b482ca89bca [0,1,0,1,0,0|2,0,0]=4 23437 B13R1.591 CC(C)CC1CCCN1CC(C)C c25b6121c9e51dc959287646796acd63 [0,1,0,1,0,0|2,0,0]=4 23438 B13R1.591 CC(C)CC1CCCN1CC(C)O 4498c0a7a1aab72a224a03f01b470ed1 [0,1,0,1,0,0|1,0,0]=3 23439 B13R1.591 CC(C)CC1CCCN1C[C@@H](C)O 4f90d1d498971813791082e660f75315 [0,1,0,1,0,0|1,0,0]=3 23440 B13R1.591 CC(C)CC1CCCN1C[C@H](C)O f0a00e6c85381013379d59b3766c74ef [0,1,0,1,0,0|1,0,0]=3 23441 B13R1.591 CC(O)CN1CCC[C@@H]1CN(C)C 783b869f14561f0261d82dddc09d126f [0,1,0,1,0,0|2,0,0]=4 23442 B13R1.591 CC(O)CN1CCC[C@H]1CN(C)C 097548a285953fc74db16f858bd0ff34 [0,1,0,1,0,0|2,0,0]=4 23443 B13R1.591 C[C@@H](O)CN1CCC[C@@H]1CN(C)C 06096588522810985fc914298b7e2fb4 [0,1,0,1,0,0|2,0,0]=4 23444 B13R1.591 C[C@@H](O)CN1CCC[C@H]1CN(C)C e64f5f5a5a90b45398f27ae4d472c497 [0,1,0,1,0,0|2,0,0]=4 23445 B13R1.591 C[C@H](O)CN1CCC[C@@H]1CN(C)C ef1b048d64f30b293037061f9c64e244 [0,1,0,1,0,0|2,0,0]=4 23446 B13R1.591 C[C@H](O)CN1CCC[C@H]1CN(C)C d6d29bc80c6f5dc6342594a728ae4c83 [0,1,0,1,0,0|2,0,0]=4 23447 B13R1.1013 C=C(C)CCNC1CCCC1(C)O d0922b067d68ffa66a008025519b3eef [0,1,0,1,0,0|1,0,1]=4 23448 B13R1.1013 C=C(C)CCN[C@@H]1CCC[C@@]1(C)O a838307abe1dedaaad5bd5d1bbd06073 [0,1,0,1,0,0|1,0,1]=4 23449 B13R1.1013 C=C(C)CCN[C@H]1CCC[C@]1(C)O 55d0f7bb4d19c0a71b2df330633edd76 [0,1,0,1,0,0|1,0,1]=4 23450 B13R1.1013 CC(=O)CCNC1CCCC1(C)O 53dd10d68c4789540d9c00661c266de0 [0,1,0,1,0,0|1,0,1]=4 23451 B13R1.1013 CC(=O)CCN[C@@H]1CCC[C@@]1(C)O c8690b874f875287d69668c88aed374b [0,1,0,1,0,0|1,0,1]=4 23452 B13R1.1013 CC(=O)CCN[C@H]1CCC[C@]1(C)O 54d1ebf4b2a48c37057cd65af56fc960 [0,1,0,1,0,0|1,0,1]=4 23453 B13R1.1013 CC(C)CCCN1CCCC1(C)C 8506ec7bde71b8f343795003d3755ae0 [0,1,0,1,0,0|2,0,0]=4 23454 B13R1.1013 CC(C)CCNC1CCCC1(C)C ef8063355b4d82f49115038e7115dbd0 [0,1,0,1,0,0|2,0,0]=4 23455 B13R1.1013 CC(C)CCNC1CCCC1(C)O 6f2355fd920e236c1a6704fc80a3016b [0,1,0,1,0,0|1,0,0]=3 23456 B13R1.1013 CC(C)CCN[C@@H]1CCC[C@@]1(C)O e12b0196298170d12f640dbe59a49937 [0,1,0,1,0,0|1,0,0]=3 23457 B13R1.1013 CC(C)CCN[C@H]1CCC[C@]1(C)O fde0d6600160a3297b342dd3e73bf4dc [0,1,0,1,0,0|1,0,0]=3 23458 B13R1.1013 CC(C)CCOC1CCCC1(C)C a0b4ba0aa564ac0e48e131aab7482276 [0,1,0,1,0,0|2,0,0]=4 23459 B13R1.1013 CC(C)CCO[C@@H]1CCCC1(C)C 1ea180622c8040b9e08056f9e5d7f8ab [0,1,0,1,0,0|2,0,0]=4 23460 B13R1.1013 CC(C)CCO[C@H]1CCCC1(C)C 5eace1d553239e762b2d20fae16ee502 [0,1,0,1,0,0|2,0,0]=4 23461 B13R1.1013 CC(C)OCNC1CCCC1(C)O 73c27a0a93e8d5ff55908fee6991437f [0,1,0,1,0,0|2,0,0]=4 23462 B13R1.1013 CC(C)OCN[C@@H]1CCC[C@@]1(C)O 31ea0cb7301cba831ca0b4b76fcd7e99 [0,1,0,1,0,0|2,0,0]=4 23463 B13R1.1013 CC(C)OCN[C@H]1CCC[C@]1(C)O fb6e23df108553aff8284b0eb384d561 [0,1,0,1,0,0|2,0,0]=4 23464 B13R1.1013 CC(O)CCCN1CCCC1(C)C 12af8127dce077519db638a51a7f7724 [0,1,0,1,0,0|1,0,0]=3 23465 B13R1.1013 CC(O)CCCN1CCOC1(C)C ca919c2b6de4459651ac09f8643baf99 [0,1,0,1,0,0|2,0,0]=4 23466 B13R1.1013 CC(O)CCCN1CCSC1(C)C 026a8772869b1551e4c41720d4d8b5d9 [0,1,0,1,0,0|2,0,0]=4 23467 B13R1.1013 CC(O)CCCN1COCC1(C)C 655c8357fa78115fe05415c430639c26 [0,1,0,1,0,0|2,0,0]=4 23468 B13R1.1013 CC(O)CCNC1CCCC1(C)C da35eb4f806291b71b4665c69e60f88d [0,1,0,1,0,0|1,0,0]=3 23469 B13R1.1013 CC(O)CCNC1CCCC1(C)O d1c40a7a5c1985fbaa94a26c0dbcc91b [0,1,0,1,0,0|1,0,0]=3 23470 B13R1.1013 CC(O)CCNC1CCCC1(F)F d64a73213b779c3d97d0cc8bd9b2eb9b [0,1,0,1,0,0|2,0,0]=4 23471 B13R1.1013 CC(O)CCNC1CCOC1(C)C d3cb5ccf828bcd9a2c31559b730af4a8 [0,1,0,1,0,0|2,0,0]=4 23472 B13R1.1013 CC(O)CCN[C@@H]1CCC[C@@]1(C)O 95e10d312f67ccf11294a1ef8066b1e4 [0,1,0,1,0,0|1,0,0]=3 23473 B13R1.1013 CC(O)CCN[C@H]1CCC[C@]1(C)O e24ba9976ee242c14539059b76876a13 [0,1,0,1,0,0|1,0,0]=3 23474 B13R1.1013 CC(O)CNCC1CCOC1(C)C 5a2bc35c72e152b0edcfce16d6536e9e [0,1,0,1,0,0|2,0,0]=4 23475 B13R1.1013 CN(C)CCNC1CCCC1(C)O 777dcdd369a3f006a462dabe6d039642 [0,1,0,1,0,0|2,0,0]=4 23476 B13R1.1013 CN(C)CCN[C@@H]1CCC[C@@]1(C)O 4036f82ccadb5525da4aa5ddd84445aa [0,1,0,1,0,0|2,0,0]=4 23477 B13R1.1013 CN(C)CCN[C@H]1CCC[C@]1(C)O 3a511162bdc1b0e266f976b8e050350f [0,1,0,1,0,0|2,0,0]=4 23478 B13R1.1013 CS(=O)CCNC1CCCC1(C)O 5112bff87429a454d7cf6a88333b70c1 [0,1,0,1,0,0|2,0,0]=4 23479 B13R1.1013 CS(=O)CCN[C@@H]1CCC[C@@]1(C)O 503c0af237f9eba40e8038dcbf844e3b [0,1,0,1,0,0|2,0,0]=4 23480 B13R1.1013 CS(=O)CCN[C@H]1CCC[C@]1(C)O 187ec7583ddc2db252f61ce4e4e460b5 [0,1,0,1,0,0|2,0,0]=4 23481 B13R1.1013 C[C@@H](O)CCNC1CCCC1(F)F 0af454f7790698de9bae398d945c7e40 [0,1,0,1,0,0|2,0,0]=4 23482 B13R1.1013 C[C@@H](O)CNCC1CCOC1(C)C 1da49e16dd8a456681ee3da27509bba9 [0,1,0,1,0,0|2,0,0]=4 23483 B13R1.1013 C[C@H](O)CCNC1CCCC1(F)F e1bf4840be1e5e6ef0c6b2314c9f2f6a [0,1,0,1,0,0|2,0,0]=4 23484 B13R1.1013 C[C@H](O)CNCC1CCOC1(C)C f0f34890bc50107796dd58cd564755ba [0,1,0,1,0,0|2,0,0]=4 23485 B13R1.1028 CC(C)CCCOC1CCC1(C)C 098b356344a55c24e81ca183baf6ea22 [0,1,0,1,0,0|2,0,0]=4 23486 B13R1.1028 CC(O)CCCNC1COC1(C)C 8ee8eda2194cedf672c85b963b6043fe [0,1,0,1,0,0|2,0,0]=4 23487 B13R1.1028 CC(O)CCNCC1CCC1(F)F 5ad9afcbdc871c9b6f5391e9bc5aab48 [0,1,0,1,0,0|2,0,0]=4 23488 B13R1.1028 CC(O)CCNCC1OCC1(C)C 14660f23b596bd98a8c11f4d20806578 [0,1,0,1,0,0|2,0,0]=4 23489 B13R1.1028 C[C@@H](O)CCNCC1CCC1(F)F eba0da79ee8ce6962ac2e097bb6200e0 [0,1,0,1,0,0|2,0,0]=4 23490 B13R1.1028 C[C@H](O)CCNCC1CCC1(F)F eace76eff0e6cb21e74e4a94e3d58353 [0,1,0,1,0,0|2,0,0]=4 23491 B13R1.1045 CC(C)CCCCCN1CC1(C)C 6cd1651fdd405b0a4828d9c89951886e [0,1,0,1,0,0|2,0,0]=4 23492 B13R1.1045 CC(C)CCCCNC1CC1(C)C 03cbaa0720cf27cef99410cbc62aefff [0,1,0,1,0,0|2,0,0]=4 23493 B13R1.1045 CC(C)CCCCN[C@@H]1CC1(C)C 75e5ff15db7a204f1659dec9e6b53e06 [0,1,0,1,0,0|2,0,0]=4 23494 B13R1.1045 CC(C)CCCCN[C@H]1CC1(C)C 61dab1c3f8064ab3b24bd0d444f74004 [0,1,0,1,0,0|2,0,0]=4 23495 B13R1.1045 CC(C)CCCCOC1CC1(C)C 73555a3b1403adb1b6a7055c8eaf6d7b [0,1,0,1,0,0|2,0,0]=4 23496 B13R1.1045 CC(C)CCCNC[C@@H]1CC1(C)C 575fb3c731f632ab99d6b1f60fae5006 [0,1,0,1,0,0|2,0,0]=4 23497 B13R1.1045 CC(C)CCCNC[C@H]1CC1(C)C d30e43318dd11db7635c0ce885229117 [0,1,0,1,0,0|2,0,0]=4 23498 B13R1.1045 CC(C)CCCOCC1CC1(C)C 2d04fa8139b766cbdaf556ab73b032e8 [0,1,0,1,0,0|2,0,0]=4 23499 B13R1.1045 CC(C)CCCOC[C@@H]1CC1(C)C e220e3fbf9b99fab0b8a68959a47f146 [0,1,0,1,0,0|2,0,0]=4 23500 B13R1.1045 CC(C)CCCOC[C@H]1CC1(C)C 161ec8ef52504bf13090a4922dd1e196 [0,1,0,1,0,0|2,0,0]=4 23501 B13R1.1045 CC(O)CCCCNC1CC1(C)C aaf22dc8723f22d9857d8cb3b40cb8e6 [0,1,0,1,0,0|1,0,0]=3 23502 B13R1.1045 CC(O)CCCCNC1CC1(F)F 670b08585853573fbc490c8bc3476b53 [0,1,0,1,0,0|2,0,0]=4 23503 B13R1.1045 CC(O)CCCCN[C@@H]1CC1(C)C c5a5f9419a8ec714872b181677ab517c [0,1,0,1,0,0|1,0,0]=3 23504 B13R1.1045 CC(O)CCCCN[C@H]1CC1(C)C 12cc25ac271036ab7b270674ba3fd097 [0,1,0,1,0,0|1,0,0]=3 23505 B13R1.1045 CC(O)CCCNC[C@@H]1CC1(C)C ba1b2ef2de68150ddd87208b295d64e1 [0,1,0,1,0,0|1,0,0]=3 23506 B13R1.1045 CC(O)CCCNC[C@H]1CC1(C)C c05f49d274458927ae27396d0773da45 [0,1,0,1,0,0|1,0,0]=3 23507 B13R1.1045 CC(O)CCNCCC1CC1(F)F c9e7cf508c06304a7b5039691a7634d5 [0,1,0,1,0,0|2,0,0]=4 23508 B13R1.1045 C[C@@H](O)CCCCNC1CC1(C)C 57d94bed63c14b0640ad63c378ad6e34 [0,1,0,1,0,0|1,0,0]=3 23509 B13R1.1045 C[C@@H](O)CCCCNC1CC1(F)F caebb262d1f7c2b5c698c38dece4da44 [0,1,0,1,0,0|2,0,0]=4 23510 B13R1.1045 C[C@@H](O)CCCCN[C@@H]1CC1(C)C a2c1c6c46b7554432d8797ea444c0d4a [0,1,0,1,0,0|1,0,0]=3 23511 B13R1.1045 C[C@@H](O)CCCCN[C@H]1CC1(C)C 5b1dc80e761c4005eb11896fb4bbec27 [0,1,0,1,0,0|1,0,0]=3 23512 B13R1.1045 C[C@@H](O)CCNCCC1CC1(F)F 98be464addfd171ff8c888c0ecf6d705 [0,1,0,1,0,0|2,0,0]=4 23513 B13R1.1045 C[C@H](O)CCNCCC1CC1(F)F 36e93b6fe6c1541bab1b03d8699454d5 [0,1,0,1,0,0|2,0,0]=4 23514 B13R1.1065 CC(O)CCNC1COC1C(C)C fd3ddf595afadab7c51f1e9eda91e555 [0,1,0,1,0,0|2,0,0]=4 23515 B13R1.1065 CC(O)CCN[C@@H]1CO[C@@H]1C(C)C 467f99e14cf8919d6f7fe14743d90dbf [0,1,0,1,0,0|2,0,0]=4 23516 B13R1.3575 C=C(C)CNC1CCCCC1(C)O 211320e409396365f1bd977f66c52086 [0,1,0,1,0,0|1,0,1]=4 23517 B13R1.3575 CC(C)CCN1CCCCC1(C)C 3120f9639f315e25528cf12db95ca75d [0,1,0,1,0,0|2,0,0]=4 23518 B13R1.3575 CC(C)CNC1CCCCC1(C)C 942414d97fc2c44560a9d12077c373ae [0,1,0,1,0,0|2,0,0]=4 23519 B13R1.3575 CC(C)CNC1CCCCC1(C)O cbac83ea3689befc2b1ad7fce165f53f [0,1,0,1,0,0|1,0,0]=3 23520 B13R1.3575 CC(C)COC1CCCCC1(C)C 59f6a6196e6fa0fc22fbaab710ed9af6 [0,1,0,1,0,0|2,0,0]=4 23521 B13R1.3575 CC(O)CCN1CCCCC1(C)C 11edb3dee568a320edbae96cb7ee6bbd [0,1,0,1,0,0|1,0,0]=3 23522 B13R1.3575 CC(O)CCN1CCOCC1(C)C 65beab78312301b5c516772c6971d935 [0,1,0,1,0,0|2,0,0]=4 23523 B13R1.3575 CC(O)CNC1CCCCC1(C)C 37ad29fe8c59b20278b07051c1145c2b [0,1,0,1,0,0|1,0,0]=3 23524 B13R1.3575 CC(O)CNC1CCCCC1(C)O 01052b381139cc7600d236e853393516 [0,1,0,1,0,0|1,0,0]=3 23525 B13R1.3575 CC(O)CNC1CCCCC1(F)F af128524a798dfc6fc82ea2ebd0f1f87 [0,1,0,1,0,0|2,0,0]=4 23526 B13R1.3575 CC(O)CNC1CCOCC1(C)C 62b707ad899727f6689faa0cfb4a49b6 [0,1,0,1,0,0|2,0,0]=4 23527 B13R1.3575 CC1(CCCCC1NCC(F)F)O efa1b6f761741efbc104d94a56b69a1d [0,1,0,1,0,0|2,0,0]=4 23528 B13R1.3575 CN(C)CNC1CCCCC1(C)O 080a9e29e01d9d1b5090b369bbc751ea [0,1,0,1,0,0|2,0,0]=4 23529 B13R1.3575 C[C@@H](O)CNC1CCCCC1(C)C 8bfff9dc013f48108bc86c6d93cbb9f9 [0,1,0,1,0,0|1,0,0]=3 23530 B13R1.3575 C[C@@H](O)CNC1CCCCC1(C)O 602419b18730608c5a464a5eebf334e2 [0,1,0,1,0,0|1,0,0]=3 23531 B13R1.3575 C[C@@H](O)CNC1CCCCC1(F)F 65b57397970256920a00e0d387af8bde [0,1,0,1,0,0|2,0,0]=4 23532 B13R1.3575 C[C@@H](O)CNC1CCOCC1(C)C a7da411fdabd2654d43e591ddb713267 [0,1,0,1,0,0|2,0,0]=4 23533 B13R1.3575 C[C@H](O)CNC1CCCCC1(C)C e5dcf81a09c7e3d11a9ad998d87b1fdb [0,1,0,1,0,0|1,0,0]=3 23534 B13R1.3575 C[C@H](O)CNC1CCCCC1(C)O 526320a73fd8a4aabc3feaf68bb2f105 [0,1,0,1,0,0|1,0,0]=3 23535 B13R1.3575 C[C@H](O)CNC1CCCCC1(F)F c9898eca68b221274a4f156f4434f9c8 [0,1,0,1,0,0|2,0,0]=4 23536 B13R1.3575 C[C@H](O)CNC1CCOCC1(C)C f9f935ae8b31d3d3056b016f2a6b2bfd [0,1,0,1,0,0|2,0,0]=4 23537 B13R1.3576 C=C(C)CCN1CCCC1C(C)O d4799a248c6f2bddca991dae7e75e4b0 [0,1,0,1,0,0|1,0,1]=4 23538 B13R1.3576 C=C(C)CCN1CCC[C@@H]1C(C)O ed95a0a511ee35a8b02fce007f31e52c [0,1,0,1,0,0|1,0,1]=4 23539 B13R1.3576 C=C(C)CCN1CCC[C@H]1[C@H](C)O a4ac62fc7a0cac3f7df8de0d48ba8351 [0,1,0,1,0,0|1,0,1]=4 23540 B13R1.3576 CC(=O)CCN1CCCC1C(C)O c891106e7dcb4b8700de5ef26849ab4d [0,1,0,1,0,0|1,0,1]=4 23541 B13R1.3576 CC(=O)CCN1CCC[C@@H]1C(C)O 7c90dd0887ccecb1f08105c5b53d57cb [0,1,0,1,0,0|1,0,1]=4 23542 B13R1.3576 CC(=O)CCN1CCC[C@H]1[C@H](C)O 5b49f5226ad76eddefeeb1a2d4ab67e5 [0,1,0,1,0,0|1,0,1]=4 23543 B13R1.3576 CC(C)CCN1CCCC1C(C)C f0f6154a9821c92154f620594f054aef [0,1,0,1,0,0|2,0,0]=4 23544 B13R1.3576 CC(C)CCN1CCCC1C(C)O 8f54a5da98b663cd48bd29e0110917ce [0,1,0,1,0,0|1,0,0]=3 23545 B13R1.3576 CC(C)CCN1CCC[C@@H]1C(C)O 367dcd07819ca1eb018694edbda99717 [0,1,0,1,0,0|1,0,0]=3 23546 B13R1.3576 CC(C)CCN1CCC[C@H]1C(C)C 3ee9b19cccba139a12165bbcc6da01ea [0,1,0,1,0,0|2,0,0]=4 23547 B13R1.3576 CC(C)CCN1CCC[C@H]1[C@H](C)O 0ca70a33a375dc52e8911b4ad943b6ee [0,1,0,1,0,0|1,0,0]=3 23548 B13R1.3576 CC(C)COC1CCCC1C(C)C 7557f9e802ce5ee8a7c58ae07739e8c2 [0,1,0,1,0,0|2,0,0]=4 23549 B13R1.3576 CC(C)OCN1CCCC1C(C)O 02e68f37c211bbb9b2be38a14f7e8b98 [0,1,0,1,0,0|2,0,0]=4 23550 B13R1.3576 CC(C)OCN1CCC[C@@H]1C(C)O b721fda51a66f7a1d2912863dbe8f610 [0,1,0,1,0,0|2,0,0]=4 23551 B13R1.3576 CC(C)OCN1CCC[C@H]1[C@H](C)O 238a293ea727546dc7f638e35f6ee4aa [0,1,0,1,0,0|2,0,0]=4 23552 B13R1.3576 CC(O)C1CCCN1CCN(C)C 413e22e14ce7feacc1845e3e961ad2c4 [0,1,0,1,0,0|2,0,0]=4 23553 B13R1.3576 CC(O)C1CCCN1CCS(=O)C 12134cc279c5453dd7c2ca75e7d7a188 [0,1,0,1,0,0|2,0,0]=4 23554 B13R1.3576 CC(O)CCN1CCCC1C(C)C 63adb1de268d041c6813b1010555986e [0,1,0,1,0,0|1,0,0]=3 23555 B13R1.3576 CC(O)CCN1CCCC1C(C)O 34d79bc82bcc409eb8e966d9c3b2a9f9 [0,1,0,1,0,0|1,0,0]=3 23556 B13R1.3576 CC(O)CCN1CCCC1C(F)F fedb413990c67ec36be5df98602c6831 [0,1,0,1,0,0|2,0,0]=4 23557 B13R1.3576 CC(O)CCN1CCC[C@@H]1C(C)O bcb1508f54b676267bcaac6e57fc00a3 [0,1,0,1,0,0|1,0,0]=3 23558 B13R1.3576 CC(O)CCN1CCC[C@@H]1C(F)F 6b647237e2dbbdd9f0fb8fe3be43cf29 [0,1,0,1,0,0|2,0,0]=4 23559 B13R1.3576 CC(O)CCN1CCC[C@H]1C(C)C ff0b7c6182433c37feb5f290d4a11a43 [0,1,0,1,0,0|1,0,0]=3 23560 B13R1.3576 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[0,1,0,1,0,0|1,0,0]=3 23632 B13R1.41 CCCC(C)COC1CCC(C1)C 8639b2d40ed3fec0ea581aa73d399266 [0,1,0,1,0,0|2,0,0]=4 23633 B13R1.41 CCCC(C)COC1CCC(C1)F 41407f0cd0a4ee4c2ad9a770064b9852 [0,1,0,1,0,0|2,0,0]=4 23634 B13R1.41 CCCC(C)NCC1CCC(C1)O c86fa8063f0be2ba49bb90159244472d [0,1,0,1,0,0|1,0,0]=3 23635 B13R1.41 CCCC(C)OCC1CCC(C1)C b8d8fbba6097b0e421fd3350098a525d [0,1,0,1,0,0|2,0,0]=4 23636 B13R1.41 CCCC(C)OCC1CCC(C1)F 1cc13d10d736bf806b0a9b9fbfc83234 [0,1,0,1,0,0|2,0,0]=4 23637 B13R1.41 CCCC(C)OCC1CCC(O1)C 5eef478e06e424eea3329f40af83e23f [0,1,0,1,0,0|1,0,0]=3 23638 B13R1.41 CCCC(C)OC[C@@H]1CC[C@@H](O1)C c20dd2c4548fc886a9133d43d16f7943 [0,1,0,1,0,0|1,0,0]=3 23639 B13R1.41 CCCC(C)OC[C@@H]1CC[C@H](C1)F 95d3d5786a865a89c84ac71368c3afe2 [0,1,0,1,0,0|2,0,0]=4 23640 B13R1.41 CCCC(C)OC[C@H]1CC[C@H](C1)F 8326bd8a3acb0e3ea638a114c32b306f [0,1,0,1,0,0|2,0,0]=4 23641 B13R1.41 COCC(C)NCC1CCC(C1)O d89eeb3a2cd9151cc6e5e4284e4854d9 [0,1,0,1,0,0|2,0,0]=4 23642 B13R1.41 COCC(C)OCC1CCC(O1)C 4cc3ef41452c39317ad2e816dd99d592 [0,1,0,1,0,0|2,0,0]=4 23643 B13R1.41 COCC(C)OC[C@@H]1CC[C@@H](O1)C 173e8435221f2b972fe42d0e40963e9e [0,1,0,1,0,0|2,0,0]=4 23644 B13R1.41 COCC(O)CNC1CCC(C1)O 5c7d74e750014eafd0682d5f6b451766 [0,1,0,1,0,0|2,0,0]=4 23645 B13R1.41 COCC(O)CN[C@@H]1CC[C@@H](C1)O fd43dbb55b08d63cedd8ae920983a637 [0,1,0,1,0,0|2,0,0]=4 23646 B13R1.41 COCC(O)CN[C@@H]1CC[C@H](C1)O 78c7730414b7408d6c7da035535454d0 [0,1,0,1,0,0|2,0,0]=4 23647 B13R1.41 COCC(O)CN[C@H]1CC[C@@H](C1)O 07d08599037ce04d3b81e00ed443f2a1 [0,1,0,1,0,0|2,0,0]=4 23648 B13R1.41 COCC(O)CN[C@H]1CC[C@H](C1)O 05946750a147c0612c606bd74b5df5ec [0,1,0,1,0,0|2,0,0]=4 23649 B13R1.41 OCC[C@H](O)CNC1CCC(C1)O ceee92ebabc628288a66504bef02ef6a [0,1,0,1,0,0|2,0,0]=4 23650 B13R1.41 OCC[C@H](O)CN[C@@H]1CC[C@@H](C1)O af298f52034996f59a892db2ff181f67 [0,1,0,1,0,0|2,0,0]=4 23651 B13R1.41 OCC[C@H](O)CN[C@@H]1CC[C@H](C1)O 45d67f05a0a7d55be366e212c78d22a2 [0,1,0,1,0,0|2,0,0]=4 23652 B13R1.41 OCC[C@H](O)CN[C@H]1CC[C@@H](C1)O 242de63727fe16ca1c952b2f0e439d89 [0,1,0,1,0,0|2,0,0]=4 23653 B13R1.41 OCC[C@H](O)CN[C@H]1CC[C@H](C1)O 593a9a0e8dcf0ba42d8001b7ecbc92d5 [0,1,0,1,0,0|2,0,0]=4 23654 B13R1.115 CC(O)CN1CCCC(C1CO)C 22ea208ae03e88f7a91464b075c1398e [0,1,0,1,0,0|2,0,0]=4 23655 B13R1.115 CC1CCCN(C1CO)C[C@@H](C)O a8ef817ee906eb67dd196d2cf6b8be46 [0,1,0,1,0,0|2,0,0]=4 23656 B13R1.115 CC1CCCN(C1CO)C[C@H](C)O 3ad22286772e06591ba10072dbd93f4e [0,1,0,1,0,0|2,0,0]=4 23657 B13R1.164 CC(C)CCN1CCC(CC1C)C 07e501e8210cb3a886975da8d9b313b8 [0,1,0,1,0,0|2,0,0]=4 23658 B13R1.164 CC(C)CCN1CCC(CC1C)O d7f7d458bd73121321048e1498209ac9 [0,1,0,1,0,0|2,0,0]=4 23659 B13R1.164 CC(C)CCN1CC[C@@H](C[C@@H]1C)C b13af0418e4650b620115a61954fb741 [0,1,0,1,0,0|2,0,0]=4 23660 B13R1.164 CC(C)CCN1CC[C@@H](C[C@H]1C)O 80d5eb27c1092e6d714259d01852e0fc [0,1,0,1,0,0|2,0,0]=4 23661 B13R1.164 CC(C)CCN1CC[C@H](C[C@H]1C)C 9bbb977a1639bb8d4d1b72fc155bb096 [0,1,0,1,0,0|2,0,0]=4 23662 B13R1.164 CC(C)CCN1CC[C@H](C[C@H]1C)O 25acd6fbb5f2cd4069e7e83a28d9462f [0,1,0,1,0,0|2,0,0]=4 23663 B13R1.164 CC(C)COC1CCC(CC1C)C 4c6f6f0cec6e126f84d2653a7962340b [0,1,0,1,0,0|2,0,0]=4 23664 B13R1.164 CC(O)CCN1CCC(CC1C)C 9bfc045e1348416b8441db18689fd59b [0,1,0,1,0,0|1,0,0]=3 23665 B13R1.164 CC(O)CCN1CCC(CC1C)O c3f631b89e81d804028046f43e38d904 [0,1,0,1,0,0|1,0,0]=3 23666 B13R1.164 CC(O)CCN1CCN(CC1C)C 59a789eb57021bbdbc024dde07764302 [0,1,0,1,0,0|2,0,0]=4 23667 B13R1.164 CC(O)CCN1CCN(C[C@@H]1C)C 34d900a691c3665d26ad4bdf3b4668df [0,1,0,1,0,0|2,0,0]=4 23668 B13R1.164 CC(O)CCN1CCN(C[C@H]1C)C 535e9f49f683d264057a99a477240766 [0,1,0,1,0,0|2,0,0]=4 23669 B13R1.164 CC(O)CCN1CC[C@@H](C[C@@H]1C)C dc072d13d3c799e50743c1a0f6a0d98a [0,1,0,1,0,0|1,0,0]=3 23670 B13R1.164 CC(O)CCN1CC[C@@H](C[C@H]1C)O 60af0ce17b8c0016a1f0f4c38733d7c6 [0,1,0,1,0,0|1,0,0]=3 23671 B13R1.164 CC(O)CCN1CC[C@H](C[C@H]1C)C dd304420e28083631c0ec3ed62e2a1c7 [0,1,0,1,0,0|1,0,0]=3 23672 B13R1.164 CC(O)CCN1CC[C@H](C[C@H]1C)O e82af22d1d5a8a885557746d2cb3d5c1 [0,1,0,1,0,0|1,0,0]=3 23673 B13R1.164 CC(O)CN[C@@H]1CCN(C[C@@H]1C)C 5d334f1766b47827062097b161c7d527 [0,1,0,1,0,0|2,0,0]=4 23674 B13R1.164 CC(O)CN[C@@H]1CCN(C[C@H]1C)C 3a5cddfcad8ea783d4704975f940b522 [0,1,0,1,0,0|2,0,0]=4 23675 B13R1.164 C[C@@H](O)CN[C@@H]1CCN(C[C@@H]1C)C 25b965ed93be010d4a5242e4558178c5 [0,1,0,1,0,0|2,0,0]=4 23676 B13R1.164 C[C@@H]1CN(CC[C@H]1NC[C@@H](C)O)C c365d04de577e2bc6dd72f2c0f740425 [0,1,0,1,0,0|2,0,0]=4 23677 B13R1.164 C[C@H](O)CN[C@@H]1CCN(C[C@@H]1C)C 9a2e41da15735bde647a7318d47a73cd [0,1,0,1,0,0|2,0,0]=4 23678 B13R1.164 C[C@H](O)CN[C@@H]1CCN(C[C@H]1C)C 32da42407f3bb542c84ce77161025335 [0,1,0,1,0,0|2,0,0]=4 23679 B13R1.453 CCCC(C)CCCOCC1CC1 808f9de92413402d73008cd3dc9955e7 [0,1,0,1,0,0|2,0,0]=4 23680 B13R1.453 CCCC(C)CCOCCC1CC1 af308b083577fca097a4f604e7d99bd8 [0,1,0,1,0,0|2,0,0]=4 23681 B13R1.453 CCCC(C)COCCCC1CC1 b40ec2cc929772977d637ea6175edfa1 [0,1,0,1,0,0|2,0,0]=4 23682 B13R1.453 CCCC(S)CCOCCC1CC1 d45184e587957344f265667ecb29c0ae [0,1,0,1,0,0|2,0,0]=4 23683 B13R1.462 CC(CCO)CNCC1CC(C1)O c85d700e92cc49280761ba4ae152f6ad [0,1,0,1,0,0|2,0,0]=4 23684 B13R1.462 CCCC(=O)CNCC1CC(C1)O b6962ecf73ae65de43ed18b79956de4e [0,1,0,1,0,0|1,0,1]=4 23685 B13R1.462 CCCC(=O)CNC[C@H]1C[C@@H](C1)O 96ae54aa75363dcddbd754f1027d5a78 [0,1,0,1,0,0|1,0,1]=4 23686 B13R1.462 CCCC(=O)CNC[C@H]1C[C@H](C1)O 01c465500a51dacb71775b1df453b10a [0,1,0,1,0,0|1,0,1]=4 23687 B13R1.462 CCCC(C)CNCC1CC(C1)O f05530c84cb1d8247705826a56d3add2 [0,1,0,1,0,0|1,0,0]=3 23688 B13R1.462 CCCC(C)CNC[C@H]1C[C@@H](C1)O 6c010b3cc26ea82986048393fa1ed067 [0,1,0,1,0,0|1,0,0]=3 23689 B13R1.462 CCCC(C)CNC[C@H]1C[C@H](C1)O 04ba2b591e65a90d32ed4fe2fd62a469 [0,1,0,1,0,0|1,0,0]=3 23690 B13R1.462 CCCC(C)COCC1CC(C1)C b304d36544048c93662cd8308609e589 [0,1,0,1,0,0|2,0,0]=4 23691 B13R1.462 CCCC(C)COCC1CC(C1)F 11f3551082ec06fb5492c252746bcd58 [0,1,0,1,0,0|2,0,0]=4 23692 B13R1.462 CCCC(C)COC[C@H]1C[C@@H](C1)C 484c9d5a28de2e7056c34f6b266439a0 [0,1,0,1,0,0|2,0,0]=4 23693 B13R1.462 CCCC(C)COC[C@H]1C[C@H](C1)F 999fd34248f0b686b875784a1a50d5cf [0,1,0,1,0,0|2,0,0]=4 23694 B13R1.462 CCCC(C)NCCN1CC(C1)O 975fef20cd0029346bc307c49b66104e [0,1,0,1,0,0|2,0,0]=4 23695 B13R1.462 CCCC(O)CNCC1CC(C1)C 49781dd70d4031a83ada595e482992e1 [0,1,0,1,0,0|2,0,0]=4 23696 B13R1.462 CCCC(O)CNCC1CC(C1)O 442be1b15fd4831fa1b812c4956b986a [0,1,0,1,0,0|1,0,0]=3 23697 B13R1.462 CCCC(O)CNC[C@H]1C[C@H](C1)F 89ba03278a5305319a60d8c76f3cf44d [0,1,0,1,0,0|2,0,0]=4 23698 B13R1.462 CCOC(C)CNCC1CC(C1)O c346816c046963332d701df15be33e7e [0,1,0,1,0,0|2,0,0]=4 23699 B13R1.462 COCC(O)CNCC1CC(C1)O d18eb36fae2e334ee84cf07832e33f39 [0,1,0,1,0,0|2,0,0]=4 23700 B13R1.462 COCC(O)CNC[C@H]1C[C@@H](C1)O 8814f216af5d2011d80dbfbb5d36a466 [0,1,0,1,0,0|2,0,0]=4 23701 B13R1.462 COCC(O)CNC[C@H]1C[C@H](C1)O 2e5dbf631f80bf0b37eadd90e7488ec4 [0,1,0,1,0,0|2,0,0]=4 23702 B13R1.462 COC[C@@H](O)CNCC1CC(C1)O 89da81df69127fb0adfd30fb43281fb7 [0,1,0,1,0,0|2,0,0]=4 23703 B13R1.462 OCC[C@H](O)CNCC1CC(C1)O f1973ebefb336d35fd3e40d17a7154b0 [0,1,0,1,0,0|2,0,0]=4 23704 B13R1.462 OCC[C@H](O)CNC[C@H]1C[C@@H](C1)O 01246c59ac310f35d2ec8766d7624615 [0,1,0,1,0,0|2,0,0]=4 23705 B13R1.462 OCC[C@H](O)CNC[C@H]1C[C@H](C1)O cc8539238660b7514f422712bf64dd80 [0,1,0,1,0,0|2,0,0]=4 23706 B13R1.467 CC(CCO)N1CCC[C@H]1[C@H](C)O 8c14abd2f09a0438fc96ebb905669870 [0,1,0,1,0,0|2,0,0]=4 23707 B13R1.467 CC(O)C1CCCN1C(C)CCO 18dc269d123e786e02632169cbbc3fe4 [0,1,0,1,0,0|2,0,0]=4 23708 B13R1.467 CC(O)[C@H]1CCCN1C(C)CCO 5b7830da865268aeb22a0818213d6e5f [0,1,0,1,0,0|2,0,0]=4 23709 B13R1.467 CCCC(=O)N1CCCC1C(C)O bc92a8701a4f4657676a8007ca133165 [0,1,0,1,0,0|1,0,1]=4 23710 B13R1.467 CCCC(=O)N1CCC[C@@H]1C(C)O 048d5894f125e1f244bfe4e25b1e30a9 [0,1,0,1,0,0|1,0,1]=4 23711 B13R1.467 CCCC(=O)N1CCC[C@H]1[C@H](C)O 7dd11d0202e1e1be877d639b1de79ed3 [0,1,0,1,0,0|1,0,1]=4 23712 B13R1.467 CCCC(C)N1CCCC1C(C)C 7f1678adac537d41c9bc2d4386863fd1 [0,1,0,1,0,0|2,0,0]=4 23713 B13R1.467 CCCC(C)N1CCCC1C(C)O 8350d80a6a1163c34813d8ec243c1ec9 [0,1,0,1,0,0|1,0,0]=3 23714 B13R1.467 CCCC(C)N1CCC[C@@H]1C(C)O 6650e1660cd3ae51a0032039625732dd [0,1,0,1,0,0|1,0,0]=3 23715 B13R1.467 CCCC(C)N1CCC[C@H]1C(C)C f3ca8ac978b8e6894293fbaa5c0dd316 [0,1,0,1,0,0|2,0,0]=4 23716 B13R1.467 CCCC(C)N1CCC[C@H]1[C@H](C)O 0cb796eb3ac40cb4ae6a743693bfbbe3 [0,1,0,1,0,0|1,0,0]=3 23717 B13R1.467 COCC(C)N1CCCC1C(C)O 5ce26deb57739a5d026ed54e1ecdd84f [0,1,0,1,0,0|2,0,0]=4 23718 B13R1.467 COCC(C)N1CCC[C@@H]1C(C)O caf0f6e246986e982c01e7e814520d0f [0,1,0,1,0,0|2,0,0]=4 23719 B13R1.467 COCC(C)N1CCC[C@H]1[C@H](C)O 6f6c8199e061eab8bf68f2e968b786dc [0,1,0,1,0,0|2,0,0]=4 23720 B13R1.692 CC(CCO)NC1CCCC1(C)O ba717b200f4361d1b88935e02ad2e888 [0,1,0,1,0,0|2,0,0]=4 23721 B13R1.692 CC(CCO)N[C@@H]1CCC[C@@]1(C)O f8afcbfe7362bcd2c67dd361cb085743 [0,1,0,1,0,0|2,0,0]=4 23722 B13R1.692 CC(CCO)N[C@H]1CCC[C@]1(C)O 3f9310145c44aa90ab01c0351a447838 [0,1,0,1,0,0|2,0,0]=4 23723 B13R1.692 CCCC(=O)NC1CCCC1(C)O ed860ae15fb4d0f73ff6712cc5783320 [0,1,0,1,0,0|1,0,1]=4 23724 B13R1.692 CCCC(=O)N[C@@H]1CCC[C@@]1(C)O c98a1dbffc157b7bc96ae59472ad77ce [0,1,0,1,0,0|1,0,1]=4 23725 B13R1.692 CCCC(=O)N[C@H]1CCC[C@]1(C)O 6b0443d01cc029a320a8c370048eb101 [0,1,0,1,0,0|1,0,1]=4 23726 B13R1.692 CCCC(C)CN1CCCC1(C)C 51a766ec4a9f7fde3fbb7a90bc723e8e [0,1,0,1,0,0|2,0,0]=4 23727 B13R1.692 CCCC(C)NC1CCCC1(C)C d8620bd9c7db9b3769a211bfdd3ce5af [0,1,0,1,0,0|2,0,0]=4 23728 B13R1.692 CCCC(C)NC1CCCC1(C)O a9565fb5489e90287ac2adf7f6209e4d [0,1,0,1,0,0|1,0,0]=3 23729 B13R1.692 CCCC(C)N[C@@H]1CCC[C@@]1(C)O a0f1c0e28d573458ff8d2b7c788acb6c [0,1,0,1,0,0|1,0,0]=3 23730 B13R1.692 CCCC(C)N[C@H]1CCC[C@]1(C)O 531eefdb23c4537a590fe7667c2b9a2d [0,1,0,1,0,0|1,0,0]=3 23731 B13R1.692 COCC(C)NC1CCCC1(C)O c9dc99da36ea9cb6322f76b300a8aa15 [0,1,0,1,0,0|2,0,0]=4 23732 B13R1.692 COCC(C)N[C@@H]1CCC[C@@]1(C)O 22175ff881b123d2bd2a3c4b50eba859 [0,1,0,1,0,0|2,0,0]=4 23733 B13R1.692 COCC(C)N[C@H]1CCC[C@]1(C)O 174835db0c99ec4b4a8858d1efab2d12 [0,1,0,1,0,0|2,0,0]=4 23734 B13R1.1080 CC(C)CCCCCN(C)C1CC1 0136f595dd468a41b1f12449433147d4 [0,1,0,1,0,0|2,0,0]=4 23735 B13R1.1080 CC(C)CCCCN[C@@H](C)C1CC1 c555ba6ad30fdb9b7b72f837290ea801 [0,1,0,1,0,0|2,0,0]=4 23736 B13R1.1080 CC(C)CCCCN[C@H](C)C1CC1 171cffa92f8fe3e1b32b18e55fa40970 [0,1,0,1,0,0|2,0,0]=4 23737 B13R1.1080 CC(C)CCCCOC(C)C1CC1 0f9333abf841d3d724a17ecf7a3ef5f6 [0,1,0,1,0,0|2,0,0]=4 23738 B13R1.1080 CC(C)CCCCO[C@@H](C)C1CC1 dcade3b7cd54a3ce4e73b9e0ccd2f00a [0,1,0,1,0,0|2,0,0]=4 23739 B13R1.1080 CC(C)CCCCO[C@H](C)C1CC1 6e4ddfac792d1daac60562271667a7b1 [0,1,0,1,0,0|2,0,0]=4 23740 B13R1.1080 CC(C)CCCNCC(O)C1CC1 b70998607e7c4845834082fadfe42322 [0,1,0,1,0,0|2,0,0]=4 23741 B13R1.1080 CC(C)CCCOCC(C)C1CC1 0934d3260f95cd9a4954a49931bc4686 [0,1,0,1,0,0|2,0,0]=4 23742 B13R1.1080 CC(O)CCCCN[C@@H](C)C1CC1 a34e6ba8c5c9e2204e53970743e9b5cf [0,1,0,1,0,0|1,0,0]=3 23743 B13R1.1080 CC(O)CCCCN[C@H](C)C1CC1 ba9e84b2ac8f3422a67eaffa2176f2b4 [0,1,0,1,0,0|1,0,0]=3 23744 B13R1.1080 CC(O)CCCNCC(O)C1CC1 9bdf38c808d310911fd0c93ef0711321 [0,1,0,1,0,0|1,0,0]=3 23745 B13R1.1080 C[C@@H](O)CCCCN[C@H](C)C1CC1 164fe0df7843814853f42a0f317aaf85 [0,1,0,1,0,0|1,0,0]=3 23746 B13R1.1080 C[C@H](NCCCC[C@@H](C)O)C1CC1 c90877c32841b7a0208fe8e645f32e48 [0,1,0,1,0,0|1,0,0]=3 23747 B13R1.1462 CC(CCO)N1CCCCC(C1)O d013c48d60d461f2739837c99c8cf7a2 [0,1,0,1,0,0|2,0,0]=4 23748 B13R1.1462 CC(CCO)N1CCCC[C@H](C1)O 9cfabdc2e516cd20b92bbae93160a6e9 [0,1,0,1,0,0|2,0,0]=4 23749 B13R1.1462 CCCC(=O)N1CCCCC(C1)O 8f95193a2839753918175da7181af72e [0,1,0,1,0,0|1,0,1]=4 23750 B13R1.1462 CCCC(=O)N1CCCC[C@H](C1)O f61088bfc69520e2e7a5dc68cd416c62 [0,1,0,1,0,0|1,0,1]=4 23751 B13R1.1462 CCCC(C)N1CCCCC(C1)O a9059a290540f0054e9ec64d922ea87e [0,1,0,1,0,0|1,0,0]=3 23752 B13R1.1462 CCCC(C)N1CCCC[C@H](C1)O 50f38943c6434077acf817e36b7dfd7c [0,1,0,1,0,0|1,0,0]=3 23753 B13R1.1462 CCCC(C)N1CCOCC(C1)O 81e249aa04b901074d7723b271e2ee2b [0,1,0,1,0,0|2,0,0]=4 23754 B13R1.1462 CCCC(C)N1CCOC[C@@H](C1)O 270abd56838c624a5b6143a1e9182e79 [0,1,0,1,0,0|2,0,0]=4 23755 B13R1.1462 CCCC(C)N1CCOC[C@H](C1)O 3425eef4b5863363b77d75102559b0d1 [0,1,0,1,0,0|2,0,0]=4 23756 B13R1.1462 COCC(C)N1CCCCC(C1)O e305f53fddbd5b73c6edb83d2c598871 [0,1,0,1,0,0|2,0,0]=4 23757 B13R1.1462 COCC(C)N1CCCC[C@H](C1)O e69566fd2b61f3e4dea2754cb9654b5e [0,1,0,1,0,0|2,0,0]=4 23758 B13R1.2551 CCCC(C)COC1CCC1(C)C 22779fcc52b44d065807f62304433bb2 [0,1,0,1,0,0|2,0,0]=4 23759 B13R1.2553 CCCC(C)CCOC1CC1(C)C c3a68a9271733c180c086caf5fa96fe1 [0,1,0,1,0,0|2,0,0]=4 23760 B13R1.2553 CCCC(C)CNC[C@@H]1CC1(C)C be6a1354eca77f7a66e7e7f0fba53bec [0,1,0,1,0,0|2,0,0]=4 23761 B13R1.2553 CCCC(C)CNC[C@H]1CC1(C)C 0cd607299fb326ffcb190fbefd6b9dc7 [0,1,0,1,0,0|2,0,0]=4 23762 B13R1.2553 CCCC(C)COCC1CC1(C)C 1de3378a8c31ded9da90f7464307b5d4 [0,1,0,1,0,0|2,0,0]=4 23763 B13R1.2553 CCCC(C)COC[C@@H]1CC1(C)C 23252025d24ac83bd65e88706052266a [0,1,0,1,0,0|2,0,0]=4 23764 B13R1.2553 CCCC(C)COC[C@H]1CC1(C)C bdc76106677362d0efae9c6c00dee418 [0,1,0,1,0,0|2,0,0]=4 23765 B13R1.2553 CCCC(S)CCOC1CC1(C)C 8f7233048aa6a8a869f3cfc3504d8020 [0,1,0,1,0,0|2,0,0]=4 23766 B13R1.3485 CC(C)CCCN1C[C@@H](C[C@@H]1C)F da297e56366e179476b63acaaa4bf9ca [0,1,0,1,0,0|2,0,0]=4 23767 B13R1.3485 CC(C)CCCN1C[C@@H](C[C@@H]1C)O 43ae829caac24f096ac60a25da63276b [0,1,0,1,0,0|2,0,0]=4 23768 B13R1.3485 CC(C)CCCN1C[C@@H](C[C@H]1C)F 09626b776a0bd9f389fe4a24e672c159 [0,1,0,1,0,0|2,0,0]=4 23769 B13R1.3485 CC(C)CCCN1C[C@@H](C[C@H]1C)O f97266144a51edfbe1bf10918403034f [0,1,0,1,0,0|2,0,0]=4 23770 B13R1.3485 CC(C)CCCN1C[C@H](C[C@@H]1C)F 6ae62b5aeb024d9081481a4783290468 [0,1,0,1,0,0|2,0,0]=4 23771 B13R1.3485 CC(C)CCCN1C[C@H](C[C@@H]1C)O 385702f834db030afa3e985531204beb [0,1,0,1,0,0|2,0,0]=4 23772 B13R1.3485 CC(C)CCCN1C[C@H](C[C@H]1C)F 3aff6074f67b728aefca3436eadf459a [0,1,0,1,0,0|2,0,0]=4 23773 B13R1.3485 CC(C)CCCN1C[C@H](C[C@H]1C)O ab3b4ccab261bee2b248f066ee202109 [0,1,0,1,0,0|2,0,0]=4 23774 B13R1.3485 CC(O)CCCN1C[C@@H](C[C@@H]1C)F b904f32a3edcabc04359bba43d717cdb [0,1,0,1,0,0|1,0,0]=3 23775 B13R1.3485 CC(O)CCCN1C[C@@H](C[C@@H]1C)O 75492f83ff5407fe8f1935af2097de0b [0,1,0,1,0,0|1,0,0]=3 23776 B13R1.3485 CC(O)CCCN1C[C@@H](C[C@H]1C)F a922f8f854e19a9d5dab3df1db264d31 [0,1,0,1,0,0|1,0,0]=3 23777 B13R1.3485 CC(O)CCCN1C[C@@H](C[C@H]1C)O b8a68e5f0cc05cd922c3decd597012bc [0,1,0,1,0,0|1,0,0]=3 23778 B13R1.3485 CC(O)CCCN1C[C@H](C[C@@H]1C)F 2bbc2357ac65e3adc8b4590d627993c3 [0,1,0,1,0,0|1,0,0]=3 23779 B13R1.3485 CC(O)CCCN1C[C@H](C[C@@H]1C)O 8f0a8ffc0d31326fdebe0d8175ddc173 [0,1,0,1,0,0|1,0,0]=3 23780 B13R1.3485 CC(O)CCCN1C[C@H](C[C@H]1C)F 91b7c80936306e8bf348d29e0ddc19ce [0,1,0,1,0,0|1,0,0]=3 23781 B13R1.3485 CC(O)CCCN1C[C@H](C[C@H]1C)O 0ca79d3eca32b2955cb3c02788bee3b1 [0,1,0,1,0,0|1,0,0]=3 23782 B13R1.3506 CC(O)CN1CCCN(CC1C)C 5d4ebb6c5743c312c1edeafea196c531 [0,1,0,1,0,0|2,0,0]=4 23783 B13R1.3506 CC(O)CN1CCCN(C[C@@H]1C)C b68aea2725e60dcd499662197e5b1b85 [0,1,0,1,0,0|2,0,0]=4 23784 B13R1.3506 CC(O)CN1CCCN(C[C@H]1C)C c68bdda4d5602ae6639f2bc18846f21a [0,1,0,1,0,0|2,0,0]=4 23785 B13R1.3506 CC1CN(CCCN1C[C@@H](C)O)C 7d8551e9fb8e069509509b76e316642d [0,1,0,1,0,0|2,0,0]=4 23786 B13R1.3506 CC1CN(CCCN1C[C@H](C)O)C 1cb3ea74a3fd4e39785f7ca64d867cce [0,1,0,1,0,0|2,0,0]=4 23787 B13R1.3506 C[C@@H](O)CN1CCCN(C[C@@H]1C)C 5e8b4bc18abc9943132c8ed3cb407183 [0,1,0,1,0,0|2,0,0]=4 23788 B13R1.3506 C[C@@H]1CN(CCCN1C[C@@H](C)O)C 9a337fe7e5d6632121a29a4b7fe39b1c [0,1,0,1,0,0|2,0,0]=4 23789 B13R1.3506 C[C@H](O)CN1CCCN(C[C@@H]1C)C 6364572e3c6c644b1b18e86774232d38 [0,1,0,1,0,0|2,0,0]=4 23790 B13R1.3506 C[C@H](O)CN1CCCN(C[C@H]1C)C dec8a60fb6b0386e554828524a99840e [0,1,0,1,0,0|2,0,0]=4 23791 B13R1.3854 CC(C)CCCCN1C(CC1C)C 6e4fad06f8da79587117a007bb62a2d5 [0,1,0,1,0,0|2,0,0]=4 23792 B13R1.3854 CC(C)CCCCN1[C@@H](C[C@@H]1C)C 1a9638b42e4db6298dbafec49cb1e5c3 [0,1,0,1,0,0|2,0,0]=4 23793 B13R1.3854 CC(C)CCCCN1[C@@H](C[C@H]1C)C 886a28584c7f69ad0459df8cf0193792 [0,1,0,1,0,0|2,0,0]=4 23794 B13R1.3854 CC(C)CCCCN1[C@H](C[C@@H]1C)C 0497638e7dd7d25f8c4f442b38a9cde6 [0,1,0,1,0,0|2,0,0]=4 23795 B13R1.3854 CC(O)CCCCN1C(CC1C)C df060a7b42485163bbdb162f3434ae83 [0,1,0,1,0,0|1,0,0]=3 23796 B13R1.3854 CC(O)CCCCN1[C@@H](C[C@@H]1C)C a9ffd4e877510aa6617e64c189889825 [0,1,0,1,0,0|1,0,0]=3 23797 B13R1.3854 CC(O)CCCCN1[C@@H](C[C@H]1C)C ee47aafd75240bb46b136dbf0c0e62a5 [0,1,0,1,0,0|1,0,0]=3 23798 B13R1.3854 CC(O)CCCCN1[C@H](C[C@@H]1C)C 7c74e2bd689a7541d5f6a18f76b71f22 [0,1,0,1,0,0|1,0,0]=3 23799 B13R1.3854 CC1CC(N1CCCC[C@@H](C)O)C 8d51ca4c2932e8bc8627dd5b4f7e6120 [0,1,0,1,0,0|1,0,0]=3 23800 B13R1.3854 C[C@@H](O)CCCCN1[C@H](C[C@@H]1C)C 35a287d7508b2e1dd177ef9e408a35a3 [0,1,0,1,0,0|1,0,0]=3 23801 B13R1.3854 C[C@@H]1C[C@@H](N1CCCC[C@@H](C)O)C 77e4f325c695ce8deee8782bce50d704 [0,1,0,1,0,0|1,0,0]=3 23802 B13R1.3854 C[C@@H]1C[C@H](N1CCCC[C@@H](C)O)C ba8c1d7d3d6e65a3f5afe5c75db385e2 [0,1,0,1,0,0|1,0,0]=3 23803 B13R1.8670 CC(C)CCCCNC1(CCC1)C 5324fce59b14bbaeefe7cb0bf5de01aa [0,1,0,1,0,0|2,0,0]=4 23804 B13R1.8670 CC(C)CCCNCC1(CCC1)C 2d6f4a2204884f92504cc5111ff11618 [0,1,0,1,0,0|2,0,0]=4 23805 B13R1.8670 CC(C)CCCNCC1(CCC1)O 6b301d195812ec3202a788fb5ccdb3e8 [0,1,0,1,0,0|2,0,0]=4 23806 B13R1.8670 CC(C)CCCOCC1(CCC1)C 38b61e5604ab74164d060ff540e54d7a [0,1,0,1,0,0|2,0,0]=4 23807 B13R1.8670 CC(C)CCCOCC1(CCC1)F 1e225097c9a57d398210940e2f4e0606 [0,1,0,1,0,0|2,0,0]=4 23808 B13R1.8670 CC(C)CCNCCC1(CCC1)O 32ef1493ce607eb4db6673989308e1e1 [0,1,0,1,0,0|2,0,0]=4 23809 B13R1.8670 CC(O)CCCCNC1(CCC1)C 9587a6e4c6d9890881d4e4321634a629 [0,1,0,1,0,0|1,0,0]=3 23810 B13R1.8670 CC(O)CCCCNC1(COC1)C cacc224707f37f5c77794c172ab86737 [0,1,0,1,0,0|2,0,0]=4 23811 B13R1.8670 CC(O)CCCCNC1(CSC1)C 947f989deb1f9d5cb53e17ec6593ad8b [0,1,0,1,0,0|2,0,0]=4 23812 B13R1.8670 CC(O)CCCNCC1(CCC1)O b4496f5f8b7820df27d6a26bb776410d [0,1,0,1,0,0|1,0,0]=3 23813 B13R1.8670 CC(O)CCCNCC1(CCO1)C 9165b40c6f8e7f1248df667ea2b32ce8 [0,1,0,1,0,0|2,0,0]=4 23814 B13R1.8670 CC(O)CCCNCC1(COC1)C dac523b9c26011605428710b6e4c0a5d [0,1,0,1,0,0|2,0,0]=4 23815 B13R1.8670 CC(O)CCCNCC1(COC1)F 5c4fcb5b04ce8ff71f1a05fb4224f7f4 [0,1,0,1,0,0|2,0,0]=4 23816 B13R1.8670 CC(O)CCCNCC1(COC1)O 64106e276d3ea8147fcfca23d9d02d87 [0,1,0,1,0,0|2,0,0]=4 23817 B13R1.8670 CC(O)CCCNC[C@@]1(CCO1)C 254692109aa12922e862b983117ef352 [0,1,0,1,0,0|2,0,0]=4 23818 B13R1.8670 CC(O)CCNCCC1(CCC1)O ba54798b759e540144b99ac39384619c [0,1,0,1,0,0|1,0,0]=3 23819 B13R1.8670 CC(O)CCNCCC1(COC1)O e937c1e1a758ae39caccde21f30042f8 [0,1,0,1,0,0|2,0,0]=4 23820 B13R1.8670 C[C@@H](O)CCCCNC1(CCC1)C 4eb423b178d6e9a6834757b3fc9ae001 [0,1,0,1,0,0|1,0,0]=3 23821 B13R1.8670 C[C@@H](O)CCCCNC1(COC1)C 5c9b2b55bfd7f9db3b94290b548f6321 [0,1,0,1,0,0|2,0,0]=4 23822 B13R1.8670 C[C@@H](O)CCCCNC1(CSC1)C afb5504539f4a35625b08e8beab2a84e [0,1,0,1,0,0|2,0,0]=4 23823 B13R2.10 CC1CCN(C1)C2CCCCC2 1ae23d42f0d68380f66b6402fa45b542 [0,0,0,2,0,0|2,0,0]=4 23824 B13R2.10 FC1CCN(C1)C2CCCCC2 e2fd28f147b27dd82c936db86a20fc53 [0,0,0,2,0,0|2,0,0]=4 23825 B13R2.10 F[C@@H]1CCN(C1)C2CCCCC2 4be65cc12fa8f812d580b81bdc647dee [0,0,0,2,0,0|2,0,0]=4 23826 B13R2.10 F[C@H]1CCN(C1)C2CCCCC2 170fe9dacf040e856025440033bfb80f [0,0,0,2,0,0|2,0,0]=4 23827 B13R2.10 OC1CCN(C1)C2CCCCC2 03c091895cc8147a795941a9156d3c58 [0,0,0,2,0,0|1,0,0]=3 23828 B13R2.10 OC1CCN(C1)C2CCCCO2 fe34f41aaa37dbb19d4ca34a268d14a6 [0,0,0,2,0,0|2,0,0]=4 23829 B13R2.10 OC1CCN(C1)C2CCCOC2 3fa627b2d8fed61d43638826609b4720 [0,0,0,2,0,0|2,0,0]=4 23830 B13R2.10 OC1CCN(C1)C2CCOCC2 efb22477abead8e1839cd65c2ac1df4a [0,0,0,2,0,0|2,0,0]=4 23831 B13R2.10 OC1CCN(C1)C2CCSCC2 74b1668e6435bec56d296e05ebf6637b [0,0,0,2,0,0|2,0,0]=4 23832 B13R2.10 O[C@@H]1CCN(C1)C2CCCCC2 6c28555e5aaf10fd812b0bcca77ae4ea [0,0,0,2,0,0|1,0,0]=3 23833 B13R2.10 O[C@@H]1CCN(C1)C2CCCCO2 40b546bf9ed2d7b06b37ab6b7782c572 [0,0,0,2,0,0|2,0,0]=4 23834 B13R2.10 O[C@@H]1CCN(C1)C2CCCOC2 ff6ec9bd2edd9a521f66cd5baf550a01 [0,0,0,2,0,0|2,0,0]=4 23835 B13R2.10 O[C@@H]1CCN(C1)C2CCOCC2 98b5313f998544170dce8437273199f8 [0,0,0,2,0,0|2,0,0]=4 23836 B13R2.10 O[C@@H]1CCN(C1)C2CCSCC2 4ca09f7c28c9d85efde9d47161e6de56 [0,0,0,2,0,0|2,0,0]=4 23837 B13R2.10 O[C@H]1CCN(C1)C2CCCCC2 ac47326733661125a63ff04fd1587645 [0,0,0,2,0,0|1,0,0]=3 23838 B13R2.10 O[C@H]1CCN(C1)C2CCCCO2 664f6623c7f73d34f88ce3c5c280b7cf [0,0,0,2,0,0|2,0,0]=4 23839 B13R2.10 O[C@H]1CCN(C1)C2CCCOC2 f75160106b05d023315db60dc9592023 [0,0,0,2,0,0|2,0,0]=4 23840 B13R2.10 O[C@H]1CCN(C1)C2CCOCC2 6b6d214513f65e0d4af9dd4bf26fce17 [0,0,0,2,0,0|2,0,0]=4 23841 B13R2.10 O[C@H]1CCN(C1)C2CCSCC2 0985872713ff0fc8166b54eca18881a7 [0,0,0,2,0,0|2,0,0]=4 23842 B13R2.142 CC1CCC(C1)NC2CCCC2 1f0ef1ea7566754c06f6ba57ff1c6261 [0,0,0,2,0,0|2,0,0]=4 23843 B13R2.142 CC1CCC(C1)OC2CCCC2 43058efa78d6152c2fb5738b1b5f47fc [0,0,0,2,0,0|2,0,0]=4 23844 B13R2.142 CC1CCN(C1)CC2CCCC2 e57d5297f6e216403b4441ec86ac1e70 [0,0,0,2,0,0|2,0,0]=4 23845 B13R2.142 FC1CCC(C1)OC2CCCC2 b253bb5a6d3972c80d6201c8c846dc7c [0,0,0,2,0,0|2,0,0]=4 23846 B13R2.142 FC1CCN(C1)CC2CCCC2 a03970516b373f82595b62db37ccf7ef [0,0,0,2,0,0|2,0,0]=4 23847 B13R2.142 F[C@@H]1CCN(C1)CC2CCCC2 d7dcedb505e50375d16f2463a80d5bfc [0,0,0,2,0,0|2,0,0]=4 23848 B13R2.142 F[C@H]1CCN(C1)CC2CCCC2 c48fe762a4d7facb450f923673606230 [0,0,0,2,0,0|2,0,0]=4 23849 B13R2.142 OC1CCC(C1)NC2CCCC2 3bec16fe7cc3bd04a101117079214047 [0,0,0,2,0,0|1,0,0]=3 23850 B13R2.142 OC1CCC(C1)NC2CCOC2 48bcb2458cc30db2bd7d061e66188b1b [0,0,0,2,0,0|2,0,0]=4 23851 B13R2.142 OC1CCC(C1)N[C@@H]2CCOC2 c29dc592f36c7eabcaa95fd080b605b4 [0,0,0,2,0,0|2,0,0]=4 23852 B13R2.142 OC1CCC(C1)N[C@H]2CCOC2 4df4f0edf869a007ee665199f32c8e99 [0,0,0,2,0,0|2,0,0]=4 23853 B13R2.142 OC1CCN(C1)CC2CCCC2 2c457f9e6822b1caabca7aa6b83af033 [0,0,0,2,0,0|1,0,0]=3 23854 B13R2.142 OC1CCN(C1)CC2CCCO2 d25ca6dd3c1b6e5be4b56cdeafd64d2e [0,0,0,2,0,0|2,0,0]=4 23855 B13R2.142 OC1CCN(C1)CC2CCOC2 ca04ea72715d66f48a0f6f0275512fa0 [0,0,0,2,0,0|2,0,0]=4 23856 B13R2.142 O[C@@H]1CCN(C1)CC2CCCC2 584d104d3c91eb800cb50486f604b68b [0,0,0,2,0,0|1,0,0]=3 23857 B13R2.142 O[C@@H]1CCN(C1)CC2CCCO2 4eddc3940adbfaeae9bb6745edabb677 [0,0,0,2,0,0|2,0,0]=4 23858 B13R2.142 O[C@@H]1CCN(C1)CC2CCOC2 e3e8ec7f60f38c04f8dc767bf667e09c [0,0,0,2,0,0|2,0,0]=4 23859 B13R2.142 O[C@@H]1CC[C@@H](C1)NC2CCCC2 4c33378965b75983198e9ed792c327f5 [0,0,0,2,0,0|1,0,0]=3 23860 B13R2.142 O[C@@H]1CC[C@@H](C1)NC2CCOC2 5eb3bf7f78af8f3a70a890d2d2d2e500 [0,0,0,2,0,0|2,0,0]=4 23861 B13R2.142 O[C@@H]1CC[C@@H](C1)N[C@@H]2CCOC2 3163061f88e98835abc3ff69a4cb9eae [0,0,0,2,0,0|2,0,0]=4 23862 B13R2.142 O[C@@H]1CC[C@@H](C1)N[C@H]2CCOC2 1d14f41097fe9bc610126ffd70a36667 [0,0,0,2,0,0|2,0,0]=4 23863 B13R2.142 O[C@@H]1CC[C@H](C1)NC2CCCC2 3e95ee1e9a4270180cb133418deb8d09 [0,0,0,2,0,0|1,0,0]=3 23864 B13R2.142 O[C@@H]1CC[C@H](C1)NC2CCOC2 99647ac4c5455657f84182cb4265b15a [0,0,0,2,0,0|2,0,0]=4 23865 B13R2.142 O[C@@H]1CC[C@H](C1)N[C@@H]2CCOC2 01284896b66d94e357f669967229fd69 [0,0,0,2,0,0|2,0,0]=4 23866 B13R2.142 O[C@@H]1CC[C@H](C1)N[C@H]2CCOC2 cc930f668469a8f426345505201795c2 [0,0,0,2,0,0|2,0,0]=4 23867 B13R2.142 O[C@H]1CCN(C1)CC2CCCC2 8cd52ba5a1f633e86f3c80a74cf3be13 [0,0,0,2,0,0|1,0,0]=3 23868 B13R2.142 O[C@H]1CCN(C1)CC2CCCO2 1b7bb226cf995276a75520626314ed0b [0,0,0,2,0,0|2,0,0]=4 23869 B13R2.142 O[C@H]1CCN(C1)CC2CCOC2 b6c43fa5c18482ab8b2d0e5cd2cd66a1 [0,0,0,2,0,0|2,0,0]=4 23870 B13R2.142 O[C@H]1CC[C@@H](C1)NC2CCCC2 d1cfe084613e986c7b3d6f2e3b3df15c [0,0,0,2,0,0|1,0,0]=3 23871 B13R2.142 O[C@H]1CC[C@@H](C1)NC2CCOC2 7cbe46400c0df3b08a1bae3e5e91f9be [0,0,0,2,0,0|2,0,0]=4 23872 B13R2.142 O[C@H]1CC[C@@H](C1)N[C@@H]2CCOC2 c96de48340d19d11918bb12fae0cefcf [0,0,0,2,0,0|2,0,0]=4 23873 B13R2.142 O[C@H]1CC[C@@H](C1)N[C@H]2CCOC2 7f4d754a9a3671388c01cffe4ea0bf9b [0,0,0,2,0,0|2,0,0]=4 23874 B13R2.142 O[C@H]1CC[C@H](C1)NC2CCCC2 7199e1811c1426f33897e1c620f84b74 [0,0,0,2,0,0|1,0,0]=3 23875 B13R2.142 O[C@H]1CC[C@H](C1)NC2CCOC2 df394ecb415d2b46ebb90a8a9cf0830e [0,0,0,2,0,0|2,0,0]=4 23876 B13R2.142 O[C@H]1CC[C@H](C1)N[C@@H]2CCOC2 7b0bdaff61d32652ab58aee5e47d9ff3 [0,0,0,2,0,0|2,0,0]=4 23877 B13R2.142 O[C@H]1CC[C@H](C1)N[C@H]2CCOC2 246f8a31ecd5f9bdea7e719244ef8bab [0,0,0,2,0,0|2,0,0]=4 23878 B13R2.144 OC1CCN(C1)[C@@H]2CCC[C@H]2O 92fcdffa60d11c592dbded5c21527e1b [0,0,0,2,0,0|2,0,0]=4 23879 B13R2.144 OC1CCN(C1)[C@H]2CCC[C@@H]2O 38529baba1c606ad38b2a71930a50518 [0,0,0,2,0,0|2,0,0]=4 23880 B13R2.144 O[C@@H]1CCN(C1)[C@@H]2CCC[C@H]2O ea2fb741511e85fd052743f091344a65 [0,0,0,2,0,0|2,0,0]=4 23881 B13R2.144 O[C@@H]1CCN(C1)[C@H]2CCC[C@@H]2O efef0a234d21873e80ce53bd7b308901 [0,0,0,2,0,0|2,0,0]=4 23882 B13R2.144 O[C@H]1CCN(C1)[C@@H]2CCC[C@H]2O 978718994f1787c870a85a4f15a1d831 [0,0,0,2,0,0|2,0,0]=4 23883 B13R2.144 O[C@H]1CCN(C1)[C@H]2CCC[C@@H]2O 9110e6124302a3f7df3e3821add25256 [0,0,0,2,0,0|2,0,0]=4 23884 B13R2.165 CCCCN1CC2CCC(C1)O2 bc7d1f71c837a9aeb3c172b3f2860295 [0,0,0,2,0,0|1,0,0]=3 23885 B13R2.165 CCCCN1CC2CCC(C1)S2 8abfdd85681403c8d2d6163494dda403 [0,0,0,2,0,0|1,1,0]=4 23886 B13R2.165 CCCCN1CC2CCC(C2)C1 1d109cd0b558959e388a750ed1f1858e [0,0,0,2,0,0|2,0,0]=4 23887 B13R2.165 CCCCN1C[C@H]2CC[C@@H](C1)O2 b0f25853e88303371c47f2b10ab5477e [0,0,0,2,0,0|1,0,0]=3 23888 B13R2.165 CCCNC1CC2CCC(C1)O2 4fb63232131bec35f37c42e8a534433e [0,0,0,2,0,0|1,0,0]=3 23889 B13R2.165 CCCN[C@H]1C[C@H]2CC[C@@H](C1)O2 413e551d247fb049ff56a1b64c212c59 [0,0,0,2,0,0|1,0,0]=3 23890 B13R2.165 CCCOC1CC2CCC(C1)O2 2ec338462c7ccab00096bfbc08dee5b1 [0,0,0,2,0,0|1,0,0]=3 23891 B13R2.165 CCCOC1C[C@H]2CC[C@@H](C1)O2 e3fe4552a4324dd6bc185416bffab8f9 [0,0,0,2,0,0|1,0,0]=3 23892 B13R2.165 CCCO[C@@H]1C[C@H]2CC[C@@H](C1)O2 527fa5adfe5d5911c62853e824642b18 [0,0,0,2,0,0|1,0,0]=3 23893 B13R2.165 CCCO[C@H]1C[C@H]2CC[C@@H](C1)O2 e36249dd31ed31ac4822ed19a6a18010 [0,0,0,2,0,0|1,0,0]=3 23894 B13R2.165 CCNCC1CC2CCC(C1)O2 9c4ebc8f84c2a86988772088cce25a51 [0,0,0,2,0,0|1,0,0]=3 23895 B13R2.165 CCOCC1CC2CCC(C1)O2 2ce2a258becc87a1451adb5dcf4a33cd [0,0,0,2,0,0|1,0,0]=3 23896 B13R2.165 CCOCN1CC2CCC(C1)O2 7f0593c3c3608039f8b1f4b75aa39098 [0,0,0,2,0,0|2,0,0]=4 23897 B13R2.165 CCOCN1C[C@H]2CC[C@@H](C1)O2 7d3e0bbe16a8738eccefd55f457beb92 [0,0,0,2,0,0|2,0,0]=4 23898 B13R2.165 COCCN1CC2CCC(C1)O2 28da35a92d5d3e1a64f72abd260407e2 [0,0,0,2,0,0|2,0,0]=4 23899 B13R2.165 COCCN1C[C@H]2CC[C@@H](C1)O2 753eb50d37e9e510811dcd66b73e24f9 [0,0,0,2,0,0|2,0,0]=4 23900 B13R2.165 COCNC1CC2CCC(C1)O2 2be2e228887a9c180a9d3f827d29dba9 [0,0,0,2,0,0|2,0,0]=4 23901 B13R2.165 COCN[C@H]1C[C@H]2CC[C@@H](C1)O2 f290989e9854ac6b58298fa21df0da2e [0,0,0,2,0,0|2,0,0]=4 23902 B13R2.165 COCOC1CC2CCC(C1)O2 ced9f452f5148edc574f5c5b27a7d7dc [0,0,0,2,0,0|2,0,0]=4 23903 B13R2.165 COCOC1C[C@H]2CC[C@@H](C1)O2 5daaadb320fa5fd10663b2dba01f5dc8 [0,0,0,2,0,0|2,0,0]=4 23904 B13R2.165 COCO[C@@H]1C[C@H]2CC[C@@H](C1)O2 62dffa4164863590154e2733b5ea1e46 [0,0,0,2,0,0|2,0,0]=4 23905 B13R2.165 COCO[C@H]1C[C@H]2CC[C@@H](C1)O2 64604d9469598a8c63e30836f76605bc [0,0,0,2,0,0|2,0,0]=4 23906 B13R2.165 CSCCN1CC2CCC(C1)O2 a2b7e0e95a5cb5a7ed640400c0f266d7 [0,0,0,2,0,0|2,0,0]=4 23907 B13R2.165 CSCCN1C[C@H]2CC[C@@H](C1)O2 0c8cbbfd0683299a335fbd800abf0f90 [0,0,0,2,0,0|2,0,0]=4 23908 B13R2.165 CSCNC1CC2CCC(C1)O2 4c1db91f1b2696a430b36aa753eaca90 [0,0,0,2,0,0|2,0,0]=4 23909 B13R2.165 CSCN[C@H]1C[C@H]2CC[C@@H](C1)O2 14de0b4b23b40b1411814b45172136ec [0,0,0,2,0,0|2,0,0]=4 23910 B13R2.165 CSCOC1CC2CCC(C1)O2 db728f30e88ad3f6e4fafaf3faf836a2 [0,0,0,2,0,0|2,0,0]=4 23911 B13R2.165 CSCOC1C[C@H]2CC[C@@H](C1)O2 de8bc702a5a935dd682fa098ab55adf4 [0,0,0,2,0,0|2,0,0]=4 23912 B13R2.165 CSCO[C@@H]1C[C@H]2CC[C@@H](C1)O2 64b15f56a4d3901d51a2a1889860cc44 [0,0,0,2,0,0|2,0,0]=4 23913 B13R2.165 CSCO[C@H]1C[C@H]2CC[C@@H](C1)O2 f7d1f1941eb98789abe95fb66e8bf08f [0,0,0,2,0,0|2,0,0]=4 23914 B13R2.165 FCCCN1CC2CCC(C1)O2 4db7e4dd1db95201c3fa5d3bc6026247 [0,0,0,2,0,0|2,0,0]=4 23915 B13R2.165 FCCCN1C[C@H]2CC[C@@H](C1)O2 7495bab1d94bc9eb9ce1fa7f4ad030a9 [0,0,0,2,0,0|2,0,0]=4 23916 B13R2.165 FCCNC1CC2CCC(C1)O2 dcf23266bc24f180db68837a7dcabc33 [0,0,0,2,0,0|2,0,0]=4 23917 B13R2.165 FCCN[C@H]1C[C@H]2CC[C@@H](C1)O2 63988efda734553f3beb807d3e7c97db [0,0,0,2,0,0|2,0,0]=4 23918 B13R2.165 FCCOC1CC2CCC(C1)O2 647f53937f4c14e214cd33e48601ddb0 [0,0,0,2,0,0|2,0,0]=4 23919 B13R2.165 FCCOC1C[C@H]2CC[C@@H](C1)O2 40e5fefd5b51f1710c424b2d8dd1e919 [0,0,0,2,0,0|2,0,0]=4 23920 B13R2.165 FCCO[C@@H]1C[C@H]2CC[C@@H](C1)O2 ed34be8602f8dd29872ac142ff35da7b [0,0,0,2,0,0|2,0,0]=4 23921 B13R2.165 FCCO[C@H]1C[C@H]2CC[C@@H](C1)O2 a304ac08f495143201afa3813dca3e6f [0,0,0,2,0,0|2,0,0]=4 23922 B13R2.165 FCNCC1CC2CCC(C1)O2 9d88cb67abdb6c1f24db6ac7984e2b73 [0,0,0,2,0,0|2,0,0]=4 23923 B13R2.165 FCOCC1CC2CCC(C1)O2 f44a01ff9427aa79a00aeec973f4ac6c [0,0,0,2,0,0|2,0,0]=4 23924 B13R2.165 OCCCN1CC2CCC(C1)O2 551e1ed76f7fa1eca77fd5792561f551 [0,0,0,2,0,0|2,0,0]=4 23925 B13R2.165 OCCCN1C[C@H]2CC[C@@H](C1)O2 b7f219259fb08fb422afd2629dfbc7fb [0,0,0,2,0,0|2,0,0]=4 23926 B13R2.165 OCCNC1CC2CCC(C1)O2 1edcb70524d2a44b498a9c7c458e70bd [0,0,0,2,0,0|2,0,0]=4 23927 B13R2.165 OCCN[C@H]1C[C@H]2CC[C@@H](C1)O2 8cab8229f48e6eefcbb167af1cea8e8e [0,0,0,2,0,0|2,0,0]=4 23928 B13R2.165 OCNCC1CC2CCC(C1)O2 4ea1ccd2bfdb95589bdbaa4c17ab410e [0,0,0,2,0,0|2,0,0]=4 23929 B13R2.165 SCCCN1CC2CCC(C1)O2 ceab19a2f42d4df8fe29bc0d1c1f345a [0,0,0,2,0,0|2,0,0]=4 23930 B13R2.165 SCCCN1C[C@H]2CC[C@@H](C1)O2 b99c696952c8934a8a6791a86305b542 [0,0,0,2,0,0|2,0,0]=4 23931 B13R2.165 SCCNC1CC2CCC(C1)O2 583e1e9b63e602c28e4033efdf89f232 [0,0,0,2,0,0|2,0,0]=4 23932 B13R2.165 SCCN[C@H]1C[C@H]2CC[C@@H](C1)O2 f55703e4c3689df6fff40649ed025688 [0,0,0,2,0,0|2,0,0]=4 23933 B13R2.165 SCCOC1CC2CCC(C1)O2 ca509804e2669fe552578637a9802193 [0,0,0,2,0,0|2,0,0]=4 23934 B13R2.165 SCCOC1C[C@H]2CC[C@@H](C1)O2 e52f4eada3bf3fe345141c4fcb2421b0 [0,0,0,2,0,0|2,0,0]=4 23935 B13R2.165 SCCO[C@@H]1C[C@H]2CC[C@@H](C1)O2 cd1f1a280a5464d2db478c43a9501b74 [0,0,0,2,0,0|2,0,0]=4 23936 B13R2.165 SCCO[C@H]1C[C@H]2CC[C@@H](C1)O2 fe8b7c673899ff6b53efb5cf250a7bdc [0,0,0,2,0,0|2,0,0]=4 23937 B13R2.745 CCCCCCN1CC2CC2C1 d990e53bfb140b6f91fdc571fc8f45e2 [0,0,0,2,0,0|2,0,0]=4 23938 B13R2.745 CCCCCOC1CC2CC2C1 e233aee49b367dfbc976dd73cd50227c [0,0,0,2,0,0|2,0,0]=4 23939 B13R2.745 CCCCCOC1C[C@@H]2C[C@@H]2C1 fb35b8cece4e3fc21bfd56eb7cf9bc18 [0,0,0,2,0,0|2,0,0]=4 23940 B13R2.745 CCCCCO[C@@H]1C[C@@H]2C[C@@H]2C1 c33d77a536ef9f16a6d3237429ff9259 [0,0,0,2,0,0|2,0,0]=4 23941 B13R2.745 CCCCCO[C@H]1C[C@@H]2C[C@@H]2C1 128c18c28bb2f96d64bb6ca05d985790 [0,0,0,2,0,0|2,0,0]=4 23942 B13R2.1227 CCCCCCN1CC2CC1C2 3d3393ceec03d05e74d3df04929e95d2 [0,0,0,2,0,0|2,0,0]=4 23943 B13R2.2520 BrCCNC[C@@H]1C[C@@H]2CC[C@H]1O2 c6bd05aeece164041c368435e9c5ad50 [0,0,0,2,0,0|2,0,0]=4 23944 B13R2.2520 BrCCNC[C@H]1C[C@@H]2CC[C@H]1O2 631f9fda7142bd4854d1a625b90c2d7b [0,0,0,2,0,0|2,0,0]=4 23945 B13R2.2520 CCCCCN1CC2CCC1C2 44e9c42b4f01cb606e2d076a1a40f36f [0,0,0,2,0,0|2,0,0]=4 23946 B13R2.2520 CCCCCN1C[C@@H]2CC[C@H]1C2 7efb37937bbc55036081461ef171e039 [0,0,0,2,0,0|2,0,0]=4 23947 B13R2.2520 CCCCCN1C[C@H]2CC[C@@H]1C2 afbdf509fda006d0194c20b4534599ec [0,0,0,2,0,0|2,0,0]=4 23948 B13R2.2520 CCCCNC1CC2CCC1C2 c78d9616f05ca20dce3dda9fe802807c [0,0,0,2,0,0|2,0,0]=4 23949 B13R2.2520 CCCCNC1C[C@@H]2CC[C@H]1C2 3eb244aadc0f14770ed98f6946fe4cad [0,0,0,2,0,0|2,0,0]=4 23950 B13R2.2520 CCCCNC1C[C@H]2CC[C@@H]1C2 711f5d01f5d36e873ab72f901f9e528d [0,0,0,2,0,0|2,0,0]=4 23951 B13R2.2520 CCCCN[C@@H]1C[C@H]2CC[C@@H]1C2 b86be36cfb0db2116b56555788375373 [0,0,0,2,0,0|2,0,0]=4 23952 B13R2.2520 CCCCN[C@H]1C[C@@H]2CC[C@H]1C2 88d262c5c16b8893000a0f590a91cdbd [0,0,0,2,0,0|2,0,0]=4 23953 B13R2.2520 CCCCN[C@H]1C[C@H]2CC[C@@H]1C2 adaf6d4f315615778f43fde60a3c17d9 [0,0,0,2,0,0|2,0,0]=4 23954 B13R2.2520 CCCCOC1CC2CCC1C2 22126ee259d78c5e98472d3eb503e43e [0,0,0,2,0,0|2,0,0]=4 23955 B13R2.2520 CCCCOC1C[C@@H]2CC[C@H]1C2 47fe3957e2802ae09334777285176c17 [0,0,0,2,0,0|2,0,0]=4 23956 B13R2.2520 CCCCOC1C[C@H]2CC[C@@H]1C2 90ae2a54dd6ffba446767c63fbfbf0b6 [0,0,0,2,0,0|2,0,0]=4 23957 B13R2.2520 CCCCO[C@@H]1C[C@H]2CC[C@@H]1C2 d0c4add19963683862a974a7fc4dee4e [0,0,0,2,0,0|2,0,0]=4 23958 B13R2.2520 CCCCO[C@H]1C[C@@H]2CC[C@H]1C2 fcde4134b3f4db3c97ab8e0d10f03cef [0,0,0,2,0,0|2,0,0]=4 23959 B13R2.2520 CCCCO[C@H]1C[C@H]2CC[C@@H]1C2 3a5c7f7790672a25ae11fc85dce30a40 [0,0,0,2,0,0|2,0,0]=4 23960 B13R2.2520 CCCNCC1CC2CCC1C2 c4f50414bccfe29483ded0298a5e334e [0,0,0,2,0,0|2,0,0]=4 23961 B13R2.2520 CCCNC[C@@H]1C[C@@H]2CC[C@H]1O2 cbd4b2769a1c303f2b3cdab286d59aa9 [0,0,0,2,0,0|1,0,0]=3 23962 B13R2.2520 CCCNC[C@H]1C[C@@H]2CC[C@H]1O2 94c1aeaef5aa1ed229aaca7c74e9b47c [0,0,0,2,0,0|1,0,0]=3 23963 B13R2.2520 CCCOCC1CC2CCC1C2 e273604928cb6cdf46cfd1066ff87b55 [0,0,0,2,0,0|2,0,0]=4 23964 B13R2.2520 CCCOCC1CC2CCC1O2 4a6e10186a5f218330167587734a5114 [0,0,0,2,0,0|1,0,0]=3 23965 B13R2.2520 CCCOC[C@@H]1C[C@@H]2CC[C@H]1O2 5eb7867d4078ff1fb1d245e521417cc9 [0,0,0,2,0,0|1,0,0]=3 23966 B13R2.2520 CCCOC[C@H]1C[C@@H]2CC[C@H]1O2 0e4f8f95886d1400ea82e5feab3019e2 [0,0,0,2,0,0|1,0,0]=3 23967 B13R2.2520 CCNCCC1CC2CCC1C2 3e824008262c1973bdf48af5508ddf26 [0,0,0,2,0,0|2,0,0]=4 23968 B13R2.2520 COCNC[C@@H]1C[C@@H]2CC[C@H]1O2 811c52d1e34e794e962904c6261a7711 [0,0,0,2,0,0|2,0,0]=4 23969 B13R2.2520 COCNC[C@H]1C[C@@H]2CC[C@H]1O2 d56c86e0dc1e94b1bf3b76d577168e6e [0,0,0,2,0,0|2,0,0]=4 23970 B13R2.2520 COCOCC1CC2CCC1O2 e63602726488d0061d1197cde8ad1d53 [0,0,0,2,0,0|2,0,0]=4 23971 B13R2.2520 COCOC[C@@H]1C[C@@H]2CC[C@H]1O2 e6bca63c9713bf3e033e01ae91215142 [0,0,0,2,0,0|2,0,0]=4 23972 B13R2.2520 COCOC[C@H]1C[C@@H]2CC[C@H]1O2 fe48199203004209a69aeeb334d70355 [0,0,0,2,0,0|2,0,0]=4 23973 B13R2.2520 CSCNC[C@@H]1C[C@@H]2CC[C@H]1O2 9a23a28dfcb83f8df88dd7f585289b12 [0,0,0,2,0,0|2,0,0]=4 23974 B13R2.2520 CSCNC[C@H]1C[C@@H]2CC[C@H]1O2 bb75e39de697d2a3d23e505db8b68d4a [0,0,0,2,0,0|2,0,0]=4 23975 B13R2.2520 CSCOCC1CC2CCC1O2 d3d4f2fd4ccc28a11083e539c63c2d72 [0,0,0,2,0,0|2,0,0]=4 23976 B13R2.2520 CSCOC[C@@H]1C[C@@H]2CC[C@H]1O2 5a48c8029e212a60175f684d0df5d94e [0,0,0,2,0,0|2,0,0]=4 23977 B13R2.2520 CSCOC[C@H]1C[C@@H]2CC[C@H]1O2 32edd83842e19757ededa12943ce5f7a [0,0,0,2,0,0|2,0,0]=4 23978 B13R2.2520 FCCNC[C@@H]1C[C@@H]2CC[C@H]1O2 b313e1653060e38fad10cb5fd656efe6 [0,0,0,2,0,0|2,0,0]=4 23979 B13R2.2520 FCCNC[C@H]1C[C@@H]2CC[C@H]1O2 00b0ec324c283f5f6ea6f652b47599c1 [0,0,0,2,0,0|2,0,0]=4 23980 B13R2.2520 FCCOCC1CC2CCC1O2 b9f1cbd0cbebb4c3a6c47a132eb17738 [0,0,0,2,0,0|2,0,0]=4 23981 B13R2.2520 FCCOC[C@@H]1C[C@@H]2CC[C@H]1O2 00658c6bd782e6c8235edab240687ed4 [0,0,0,2,0,0|2,0,0]=4 23982 B13R2.2520 FCCOC[C@H]1C[C@@H]2CC[C@H]1O2 0a5d4a683c6a865eb5ace56ded38017c [0,0,0,2,0,0|2,0,0]=4 23983 B13R2.2520 ICCNC[C@@H]1C[C@@H]2CC[C@H]1O2 abc377a440a9116542db099abb3cd5eb [0,0,0,2,0,0|2,0,0]=4 23984 B13R2.2520 ICCNC[C@H]1C[C@@H]2CC[C@H]1O2 b0778a4fca51383e1bd8b26d79dcea3a [0,0,0,2,0,0|2,0,0]=4 23985 B13R2.2520 OCCNC[C@@H]1C[C@@H]2CC[C@H]1O2 aff2c29cbb99190db3cb18edfd2dcce8 [0,0,0,2,0,0|2,0,0]=4 23986 B13R2.2520 OCCNC[C@H]1C[C@@H]2CC[C@H]1O2 67fa0ed77ff04fcc6b7824e49d3d8039 [0,0,0,2,0,0|2,0,0]=4 23987 B13R2.2520 SCCNC[C@@H]1C[C@@H]2CC[C@H]1O2 59810891d4dc567a482137332e0208cf [0,0,0,2,0,0|2,0,0]=4 23988 B13R2.2520 SCCNC[C@H]1C[C@@H]2CC[C@H]1O2 611aac288dba794eb6d58406f99819da [0,0,0,2,0,0|2,0,0]=4 23989 B13R2.2520 SCCOCC1CC2CCC1O2 72f0207f4aade9ffbbeb0906dc2e5966 [0,0,0,2,0,0|2,0,0]=4 23990 B13R2.2520 SCCOC[C@@H]1C[C@@H]2CC[C@H]1O2 872c3e1079d43893cccb13137d96af4d [0,0,0,2,0,0|2,0,0]=4 23991 B13R2.2520 SCCOC[C@H]1C[C@@H]2CC[C@H]1O2 bf1e8978c8296eb1f37e8b087157877f [0,0,0,2,0,0|2,0,0]=4 23992 B13R2.2973 CC1CCC(C1)COCC2CC2 0679879c3378a273f7657b536681fdf3 [0,0,0,2,0,0|2,0,0]=4 23993 B13R2.2973 CC1CCC(C1)NCCC2CC2 dc7562f34b7a888987b2e652323ab5e9 [0,0,0,2,0,0|2,0,0]=4 23994 B13R2.2973 CC1CCC(C1)OCCC2CC2 a15c60a7cd80b1c78c4f2f990aaac4fd [0,0,0,2,0,0|2,0,0]=4 23995 B13R2.2973 CC1CCC(O1)COCC2CC2 51b9c4c92c1c3c91a95f857b907da9e1 [0,0,0,2,0,0|1,0,0]=3 23996 B13R2.2973 C[C@H]1CC[C@H](O1)COCC2CC2 45e6d549c3b0de4079e305297e212cde [0,0,0,2,0,0|1,0,0]=3 23997 B13R2.2973 FC1CCC(C1)COCC2CC2 f60e8385d1695666429760970cd02ba3 [0,0,0,2,0,0|2,0,0]=4 23998 B13R2.2973 FC1CCC(C1)OCCC2CC2 0c566e821922a523a3dcece0d2c02869 [0,0,0,2,0,0|2,0,0]=4 23999 B13R2.2973 F[C@@H]1CC[C@@H](C1)COCC2CC2 145c6685a1518be46bec1fc7f477079d [0,0,0,2,0,0|2,0,0]=4 24000 B13R2.2973 F[C@@H]1CC[C@H](C1)COCC2CC2 1860d1c4af03a1b54789c652125331f6 [0,0,0,2,0,0|2,0,0]=4 24001 B13R2.2973 OC1CCC(C1)CNCC2CC2 70bf1d50c30e288e514d5558964c47f4 [0,0,0,2,0,0|1,0,0]=3 24002 B13R2.2973 OC1CCC(C1)NCCC2CC2 46cff0134256459d016d0115b4187142 [0,0,0,2,0,0|1,0,0]=3 24003 B13R2.2973 OC1CCN(C1)CCNC2CC2 eb405931ab3bb647fc60bd13319d009b [0,0,0,2,0,0|2,0,0]=4 24004 B13R2.2973 OC1CCN(C1)CCOC2CC2 5e09665ceecf403f4dca040b3431f6d1 [0,0,0,2,0,0|2,0,0]=4 24005 B13R2.2973 O[C@@H]1CCN(C1)CCOC2CC2 cc37c713272dad734b0b29a62a3387c9 [0,0,0,2,0,0|2,0,0]=4 24006 B13R2.2973 O[C@@H]1CC[C@@H](C1)NCCC2CC2 b9e162cff3ae2a067811a5231dcfca8e [0,0,0,2,0,0|1,0,0]=3 24007 B13R2.2973 O[C@@H]1CC[C@H](C1)NCCC2CC2 ec49845ab13c5c9eadb61c9fe59b603b [0,0,0,2,0,0|1,0,0]=3 24008 B13R2.2973 O[C@H]1CCN(C1)CCNC2CC2 09fc372f057063287f56eebcd592505d [0,0,0,2,0,0|2,0,0]=4 24009 B13R2.2973 O[C@H]1CCN(C1)CCOC2CC2 0fddd31356cad8039875b1306fafb58e [0,0,0,2,0,0|2,0,0]=4 24010 B13R2.2973 O[C@H]1CC[C@@H](C1)NCCC2CC2 44a9712571c6c061f1cf1a875573a64f [0,0,0,2,0,0|1,0,0]=3 24011 B13R2.2973 O[C@H]1CC[C@H](C1)NCCC2CC2 523abcf52db53241d1e015249a0d3c22 [0,0,0,2,0,0|1,0,0]=3 24012 B13R2.2974 CC1CCC(C1)COC2CCC2 7232b047da73e82dbe3be353818613f2 [0,0,0,2,0,0|2,0,0]=4 24013 B13R2.2974 CC1CCC(C1)NCC2CCC2 684e8bd4a9180a2a93a73a77c6b76929 [0,0,0,2,0,0|2,0,0]=4 24014 B13R2.2974 CC1CCC(C1)OCC2CCC2 101da014012b1ec1c7e047dcd7fd29bd [0,0,0,2,0,0|2,0,0]=4 24015 B13R2.2974 CC1CCC(O1)COC2CCC2 3ec348d36d92406268c33f0f0dbda4c7 [0,0,0,2,0,0|1,0,0]=3 24016 B13R2.2974 CC1CCC(O1)COC2COC2 d7f3426cda53304362f7a44391c772ee [0,0,0,2,0,0|2,0,0]=4 24017 B13R2.2974 CC1CCN(C1)CCC2CCC2 7d319a9958c3c4a93295049d762e5109 [0,0,0,2,0,0|2,0,0]=4 24018 B13R2.2974 C[C@H]1CC[C@H](O1)COC2CCC2 78f67382eca21b5fb5f6eaa79baf3d81 [0,0,0,2,0,0|1,0,0]=3 24019 B13R2.2974 C[C@H]1CC[C@H](O1)COC2COC2 f61403a0ed1378d5278fe1b96b5579d6 [0,0,0,2,0,0|2,0,0]=4 24020 B13R2.2974 FC1CCC(C1)COC2CCC2 e411269f4b547babac89319f191c08a0 [0,0,0,2,0,0|2,0,0]=4 24021 B13R2.2974 FC1CCC(C1)OCC2CCC2 f1b86bcbd6d1842bfd0ab06f1ea11969 [0,0,0,2,0,0|2,0,0]=4 24022 B13R2.2974 FC1CCN(C1)CCC2CCC2 95ad961b4ce64a52605a8eaa8628702c [0,0,0,2,0,0|2,0,0]=4 24023 B13R2.2974 F[C@@H]1CCN(C1)CCC2CCC2 ef933761db87befe8fa9be6c72a0e690 [0,0,0,2,0,0|2,0,0]=4 24024 B13R2.2974 F[C@@H]1CC[C@@H](C1)COC2CCC2 d8a41da2fc23fcb62bf6cead1cf1d80f [0,0,0,2,0,0|2,0,0]=4 24025 B13R2.2974 F[C@@H]1CC[C@H](C1)COC2CCC2 27cb0e4fc8a42fb1f2dbe52f2a990468 [0,0,0,2,0,0|2,0,0]=4 24026 B13R2.2974 F[C@H]1CCN(C1)CCC2CCC2 b56c3f18da9012998c3dac98bd889b07 [0,0,0,2,0,0|2,0,0]=4 24027 B13R2.2974 OC1CCC(C1)CNC2CCC2 80488f6fa228a3c81e6cc1061dd91e12 [0,0,0,2,0,0|1,0,0]=3 24028 B13R2.2974 OC1CCC(C1)CNC2COC2 ba551dd3f8b349034ac7daeade786045 [0,0,0,2,0,0|2,0,0]=4 24029 B13R2.2974 OC1CCC(C1)NCC2CCC2 de665c3e06a90bf1195d1d97f8588967 [0,0,0,2,0,0|1,0,0]=3 24030 B13R2.2974 OC1CCC(C1)NCC2CCO2 28c56ede09fe59f5c1606607c0d55784 [0,0,0,2,0,0|2,0,0]=4 24031 B13R2.2974 OC1CCC(C1)NCC2COC2 3fc720cb033963adfcf896a0f9a62b39 [0,0,0,2,0,0|2,0,0]=4 24032 B13R2.2974 OC1CCC(C1)NC[C@@H]2CCO2 a0f8b75713aa401792d4ab79f0336196 [0,0,0,2,0,0|2,0,0]=4 24033 B13R2.2974 OC1CCC(C1)NC[C@H]2CCO2 6e8f7f8972145c22926aa63e32158a79 [0,0,0,2,0,0|2,0,0]=4 24034 B13R2.2974 OC1CCN(C1)CCC2CCC2 1d5fbdc136fe846fa96547f938d14922 [0,0,0,2,0,0|1,0,0]=3 24035 B13R2.2974 OC1CCN(C1)CCC2CCO2 b618a0d62a213d744e1cb32e9da479bd [0,0,0,2,0,0|2,0,0]=4 24036 B13R2.2974 OC1CCN(C1)CCC2COC2 98fc3bd59c4e1022c0e1c794a90575fa [0,0,0,2,0,0|2,0,0]=4 24037 B13R2.2974 O[C@@H]1CCN(C1)CCC2CCC2 20851c299cd0e5b973302a267b82da24 [0,0,0,2,0,0|1,0,0]=3 24038 B13R2.2974 O[C@@H]1CCN(C1)CCC2CCO2 095946cbf3fd56d2d1ca0e3b638a14f8 [0,0,0,2,0,0|2,0,0]=4 24039 B13R2.2974 O[C@@H]1CCN(C1)CCC2COC2 d75a18c9bf7cab37c8eed85bfd73a60f [0,0,0,2,0,0|2,0,0]=4 24040 B13R2.2974 O[C@@H]1CC[C@@H](C1)NCC2CCC2 404e491323f622ddb8006f58673bdbde [0,0,0,2,0,0|1,0,0]=3 24041 B13R2.2974 O[C@@H]1CC[C@@H](C1)NCC2CCO2 b6b8435a720e3c7157dad3fa8ed7110c [0,0,0,2,0,0|2,0,0]=4 24042 B13R2.2974 O[C@@H]1CC[C@@H](C1)NCC2COC2 cf00cebc26ec5cbe57791fba25c2ec11 [0,0,0,2,0,0|2,0,0]=4 24043 B13R2.2974 O[C@@H]1CC[C@@H](C1)NC[C@@H]2CCO2 ec6d1088b76b0051e132e0a57844842b [0,0,0,2,0,0|2,0,0]=4 24044 B13R2.2974 O[C@@H]1CC[C@@H](C1)NC[C@H]2CCO2 0095c2a60fe5568e012a58193fae702c [0,0,0,2,0,0|2,0,0]=4 24045 B13R2.2974 O[C@@H]1CC[C@H](C1)NCC2CCC2 63eead8b9a59b859f6311f508decf3e9 [0,0,0,2,0,0|1,0,0]=3 24046 B13R2.2974 O[C@@H]1CC[C@H](C1)NCC2CCO2 9415f2a8841850d990151561de38aae9 [0,0,0,2,0,0|2,0,0]=4 24047 B13R2.2974 O[C@@H]1CC[C@H](C1)NCC2COC2 2169bccc0e22a36887826bbcc72d3d61 [0,0,0,2,0,0|2,0,0]=4 24048 B13R2.2974 O[C@@H]1CC[C@H](C1)NC[C@@H]2CCO2 b67ff374ea56ee78dec9b30820e826d6 [0,0,0,2,0,0|2,0,0]=4 24049 B13R2.2974 O[C@@H]1CC[C@H](C1)NC[C@H]2CCO2 2495e7a4ee1929c506cfcbf79f8df5d3 [0,0,0,2,0,0|2,0,0]=4 24050 B13R2.2974 O[C@H]1CCN(C1)CCC2CCC2 78e873c4d8cde35f432b8a2f8e44c026 [0,0,0,2,0,0|1,0,0]=3 24051 B13R2.2974 O[C@H]1CCN(C1)CCC2CCO2 f7339ae92b55abc390d589d23d7efb01 [0,0,0,2,0,0|2,0,0]=4 24052 B13R2.2974 O[C@H]1CCN(C1)CCC2COC2 da8c4df4014a2820281693f1df344ec3 [0,0,0,2,0,0|2,0,0]=4 24053 B13R2.2974 O[C@H]1CC[C@@H](C1)NCC2CCC2 7ea0788f498305f01be46d670a9ad4f8 [0,0,0,2,0,0|1,0,0]=3 24054 B13R2.2974 O[C@H]1CC[C@@H](C1)NCC2CCO2 5d021d2c9cc87bce2762dd2e5f44794f [0,0,0,2,0,0|2,0,0]=4 24055 B13R2.2974 O[C@H]1CC[C@@H](C1)NCC2COC2 ce98421333744a5b44d2a2fc90d3e170 [0,0,0,2,0,0|2,0,0]=4 24056 B13R2.2974 O[C@H]1CC[C@@H](C1)NC[C@@H]2CCO2 88ccf8efbb8d9c29fde70385401cfbac [0,0,0,2,0,0|2,0,0]=4 24057 B13R2.2974 O[C@H]1CC[C@@H](C1)NC[C@H]2CCO2 3c5ab957bfd8a9a79f061d56c51c045e [0,0,0,2,0,0|2,0,0]=4 24058 B13R2.2974 O[C@H]1CC[C@H](C1)NCC2CCC2 fc5a5740063c3ee8c8a23964944457b7 [0,0,0,2,0,0|1,0,0]=3 24059 B13R2.2974 O[C@H]1CC[C@H](C1)NCC2CCO2 d804b93cc99c4f207cd7c8b7e0efac0f [0,0,0,2,0,0|2,0,0]=4 24060 B13R2.2974 O[C@H]1CC[C@H](C1)NCC2COC2 495f43a4a2b49d3e63f8c444333760d6 [0,0,0,2,0,0|2,0,0]=4 24061 B13R2.2974 O[C@H]1CC[C@H](C1)NC[C@@H]2CCO2 4b1c0d82a087b95a0d4c66b89f761ff3 [0,0,0,2,0,0|2,0,0]=4 24062 B13R2.2974 O[C@H]1CC[C@H](C1)NC[C@H]2CCO2 67e628f9257986e7df36f07eafcdf584 [0,0,0,2,0,0|2,0,0]=4 24063 B13R2.3194 CCCCCCN1CCC2C1C2 530d4bd1eff71d04c9ce34c49030d276 [0,0,0,2,0,0|2,0,0]=4 24064 B13R2.3194 CCCCCOC1CCC2C1C2 11a7cdac0ec3070c5b8d20108542ba95 [0,0,0,2,0,0|2,0,0]=4 24065 B13R2.3194 CCCCCO[C@@H]1CC[C@@H]2[C@H]1C2 27dca2186b20b634bc26a98dd3c45329 [0,0,0,2,0,0|2,0,0]=4 24066 B13R2.13 CC1CCCN(C1)C2CCCC2 07ffad4b7677bac4a7336a4f03c6340b [0,0,0,2,0,0|2,0,0]=4 24067 B13R2.13 C[C@@H]1CCCN(C1)C2CCCC2 2c7c158b54fc3710e4d74307aa035196 [0,0,0,2,0,0|2,0,0]=4 24068 B13R2.13 C[C@H]1CCCN(C1)C2CCCC2 5245be574d8596776af5e742c4f855e6 [0,0,0,2,0,0|2,0,0]=4 24069 B13R2.13 FC1CCCN(C1)C2CCCC2 66ac44c3307b1d4f237dff00d24abc69 [0,0,0,2,0,0|2,0,0]=4 24070 B13R2.13 F[C@@H]1CCCN(C1)C2CCCC2 bcf85d6faa8e0ffb261058f8c4a3b798 [0,0,0,2,0,0|2,0,0]=4 24071 B13R2.13 F[C@H]1CCCN(C1)C2CCCC2 1fb8b2666b589f7a00bbaa02bd2290e9 [0,0,0,2,0,0|2,0,0]=4 24072 B13R2.13 OC1CCCN(C1)C2CCCC2 c530f2182f248751d39ec8626f4fe46a [0,0,0,2,0,0|1,0,0]=3 24073 B13R2.13 OC1CCCN(C1)C2CCOC2 cbc395e15c06bc5b3ea8d992d1809407 [0,0,0,2,0,0|2,0,0]=4 24074 B13R2.13 OC1CCCN(C1)[C@@H]2CCOC2 dc329f47a31d377810537a631201e9b8 [0,0,0,2,0,0|2,0,0]=4 24075 B13R2.13 OC1CCCN(C1)[C@H]2CCOC2 bcf653987e59dbae5f672ed2121637c3 [0,0,0,2,0,0|2,0,0]=4 24076 B13R2.13 O[C@@H]1CCCN(C1)C2CCCC2 e82932a46affd9248f2261ce1f1f3a88 [0,0,0,2,0,0|1,0,0]=3 24077 B13R2.13 O[C@@H]1CCCN(C1)C2CCOC2 ae7660605194f91d2317f232433af2fa [0,0,0,2,0,0|2,0,0]=4 24078 B13R2.13 O[C@@H]1CCCN(C1)[C@@H]2CCOC2 c2368f81741a3aee26d955cc206f59cc [0,0,0,2,0,0|2,0,0]=4 24079 B13R2.13 O[C@@H]1CCCN(C1)[C@H]2CCOC2 2adedb44fe6eb62e329f6bd29cb1c1b4 [0,0,0,2,0,0|2,0,0]=4 24080 B13R2.13 O[C@H]1CCCN(C1)C2CCCC2 d789359715f8e9e85fde12ee4fb805d9 [0,0,0,2,0,0|1,0,0]=3 24081 B13R2.13 O[C@H]1CCCN(C1)C2CCOC2 f8d7c66731b2125e5f230e06facf2178 [0,0,0,2,0,0|2,0,0]=4 24082 B13R2.13 O[C@H]1CCCN(C1)[C@@H]2CCOC2 d5866890ca9f93665c3713eb70adc89c [0,0,0,2,0,0|2,0,0]=4 24083 B13R2.13 O[C@H]1CCCN(C1)[C@H]2CCOC2 ac569d9ec64c3cc08f31969deae1a6a6 [0,0,0,2,0,0|2,0,0]=4 24084 B13R2.2188 CCCCCN1CCC2CC2C1 d0881814f89531d0feea9dd43288db94 [0,0,0,2,0,0|2,0,0]=4 24085 B13R2.2188 CCCCNC1CCC2CC2C1 b29eb7c17722e12f6e645e5d0dbb22d8 [0,0,0,2,0,0|2,0,0]=4 24086 B13R2.2188 CCCCN[C@@H]1CCC2CC2C1 0ac5b7a0a301ef8cbecf9760b2fdf82a [0,0,0,2,0,0|2,0,0]=4 24087 B13R2.2188 CCCCN[C@H]1CCC2CC2C1 170d3baabc27ae2b19994dbde713d6c7 [0,0,0,2,0,0|2,0,0]=4 24088 B13R2.2521 CCCCCN1CC2CC(C1)O2 fd837684f3ff9d69d899decbe06dc727 [0,0,0,2,0,0|1,0,0]=3 24089 B13R2.2521 CCCCCN1C[C@H]2C[C@@H](C1)O2 88f856e49869a1e77a1ca81b39ef074b [0,0,0,2,0,0|1,0,0]=3 24090 B13R2.2521 CCCCOC1CC2CC(C2)C1 3af3b9f08566fd916646cbbc25521b29 [0,0,0,2,0,0|2,0,0]=4 24091 B13R2.2521 CCOCCN1CC2CC(C1)O2 c79225208bffc4addc99fd67fb7495d4 [0,0,0,2,0,0|2,0,0]=4 24092 B13R2.2521 CCOCCN1C[C@H]2C[C@@H](C1)O2 1216d360d504a2d1350c62d29585dc3d [0,0,0,2,0,0|2,0,0]=4 24093 B13R2.2521 CCSCCN1CC2CC(C1)O2 418b755b55cfc623b83924eeffc9a73f [0,0,0,2,0,0|2,0,0]=4 24094 B13R2.2521 CCSCCN1C[C@H]2C[C@@H](C1)O2 313c31bb75898949657c175c31e8a06c [0,0,0,2,0,0|2,0,0]=4 24095 B13R2.2521 COCCCN1CC2CC(C1)O2 83674bcd6c4c7bf4ac6f9fde1ce3bf68 [0,0,0,2,0,0|2,0,0]=4 24096 B13R2.2521 COCCCN1C[C@H]2C[C@@H](C1)O2 2a0baecba8f33a9eaf41bc8e83042a01 [0,0,0,2,0,0|2,0,0]=4 24097 B13R2.2521 CSCCCN1CC2CC(C1)O2 7a640540aa95f567c9a0294d0b13c093 [0,0,0,2,0,0|2,0,0]=4 24098 B13R2.2521 CSCCCN1C[C@H]2C[C@@H](C1)O2 a24074dd8b6f59ef0dcd762aeda5273d [0,0,0,2,0,0|2,0,0]=4 24099 B13R2.2521 FCCCCN1CC2CC(C1)O2 f0f95ff347623b5413611339f62531e0 [0,0,0,2,0,0|2,0,0]=4 24100 B13R2.2521 FCCCCN1C[C@H]2C[C@@H](C1)O2 1f512bca9ef1375c179e953b69b618f6 [0,0,0,2,0,0|2,0,0]=4 24101 B13R2.2521 OCCCCN1CC2CC(C1)O2 af9e17f5e1678448a2462d5069995d83 [0,0,0,2,0,0|2,0,0]=4 24102 B13R2.2521 OCCCCN1C[C@H]2C[C@@H](C1)O2 d583e5954acc372df84aa3f8ceaf18bf [0,0,0,2,0,0|2,0,0]=4 24103 B13R2.3021 CC1CCCC(C1)NC2CCC2 c3200535facdb66506772e4caa1f89b4 [0,0,0,2,0,0|2,0,0]=4 24104 B13R2.3021 CC1CCCC(C1)OC2CCC2 62ca13a634428c1cc4a00c714f0dce4c [0,0,0,2,0,0|2,0,0]=4 24105 B13R2.3021 CC1CCCN(C1)CC2CCC2 8ea4590fdb67c59d47c13a7d001432f9 [0,0,0,2,0,0|2,0,0]=4 24106 B13R2.3021 C[C@@H]1CCCN(C1)CC2CCC2 b9d1fc42c0cc6ee68a25c1a5d5e93e6f [0,0,0,2,0,0|2,0,0]=4 24107 B13R2.3021 C[C@@H]1CCC[C@@H](C1)OC2CCC2 145e279ba3eaa91be6a0ea59de452a27 [0,0,0,2,0,0|2,0,0]=4 24108 B13R2.3021 C[C@@H]1CCC[C@H](C1)NC2CCC2 db20c01292c46bf5b62cceadf37dd23e [0,0,0,2,0,0|2,0,0]=4 24109 B13R2.3021 C[C@H]1CCCN(C1)CC2CCC2 a1b0bb41c5d280e7491a98b0e14458dd [0,0,0,2,0,0|2,0,0]=4 24110 B13R2.3021 C[C@H]1CCC[C@@H](C1)OC2CCC2 6a22ac02d233e26b868fbb77edbd66c9 [0,0,0,2,0,0|2,0,0]=4 24111 B13R2.3021 C[C@H]1CCC[C@H](C1)OC2CCC2 725e90cd2f01fe0054e91d771b76afef [0,0,0,2,0,0|2,0,0]=4 24112 B13R2.3021 FC1CCCN(C1)CC2CCC2 86cb2f4e5ec05465327cd464a211a849 [0,0,0,2,0,0|2,0,0]=4 24113 B13R2.3021 F[C@@H]1CCCN(C1)CC2CCC2 444c795f3c25db140bc91b70dcb7a8cb [0,0,0,2,0,0|2,0,0]=4 24114 B13R2.3021 F[C@H]1CCCN(C1)CC2CCC2 c45e52092df0d9e338312e1338adb43f [0,0,0,2,0,0|2,0,0]=4 24115 B13R2.3021 OC1CCCC(C1)NC2CCC2 b67f18b4e554bee7dc6ecad4a12913a9 [0,0,0,2,0,0|1,0,0]=3 24116 B13R2.3021 OC1CCCC(C1)NC2COC2 1579d4a7202f8c74d7d96ec731045c9a [0,0,0,2,0,0|2,0,0]=4 24117 B13R2.3021 OC1CCCN(C1)CC2CCC2 7d9f471f0feed3adba9fbdb6646f068b [0,0,0,2,0,0|1,0,0]=3 24118 B13R2.3021 OC1CCCN(C1)CC2CCO2 504db2c9d6e75c8bb94ec100b0af92f7 [0,0,0,2,0,0|2,0,0]=4 24119 B13R2.3021 OC1CCCN(C1)CC2COC2 02afa05b1849ee1df21963fe2e41a790 [0,0,0,2,0,0|2,0,0]=4 24120 B13R2.3021 OC1CCCN(C1)C[C@@H]2CCO2 3fecb0c3340c4e151f9a8d29a606dd68 [0,0,0,2,0,0|2,0,0]=4 24121 B13R2.3021 OC1CCCN(C1)C[C@H]2CCO2 84eee36bd80d643a48ad78d6a27df046 [0,0,0,2,0,0|2,0,0]=4 24122 B13R2.3021 OC1COCC(C1)NC2CCC2 fa4855e1a2b6cb45dbd8af6b1352c374 [0,0,0,2,0,0|2,0,0]=4 24123 B13R2.3021 O[C@@H]1CCCN(C1)CC2CCC2 f2c584d1375aab730067600bed4c97b8 [0,0,0,2,0,0|1,0,0]=3 24124 B13R2.3021 O[C@@H]1CCCN(C1)CC2CCO2 afe13166876a877fa4113840bd8ecf15 [0,0,0,2,0,0|2,0,0]=4 24125 B13R2.3021 O[C@@H]1CCCN(C1)CC2COC2 4c36224b36428800e16c2ee3bd339f13 [0,0,0,2,0,0|2,0,0]=4 24126 B13R2.3021 O[C@@H]1CCCN(C1)C[C@@H]2CCO2 cee1d328ab93c4ce42fd670a3afb9b75 [0,0,0,2,0,0|2,0,0]=4 24127 B13R2.3021 O[C@@H]1CCCN(C1)C[C@H]2CCO2 9dd3c12f1b11d996f8aadd169efab3ef [0,0,0,2,0,0|2,0,0]=4 24128 B13R2.3021 O[C@@H]1CCC[C@@H](C1)NC2CCC2 9d7812bdcf5cfe200713ab3485ae6200 [0,0,0,2,0,0|1,0,0]=3 24129 B13R2.3021 O[C@@H]1CCC[C@@H](C1)NC2COC2 4acc598e085fe571c024631219a79fc8 [0,0,0,2,0,0|2,0,0]=4 24130 B13R2.3021 O[C@@H]1CCC[C@H](C1)NC2CCC2 e95babd4e02a584d764156955361c891 [0,0,0,2,0,0|1,0,0]=3 24131 B13R2.3021 O[C@@H]1CCC[C@H](C1)NC2COC2 2aa30cf128aa4a5deff2914e292e519b [0,0,0,2,0,0|2,0,0]=4 24132 B13R2.3021 O[C@@H]1COC[C@@H](C1)NC2CCC2 9ea9f9667aca7c8e53660dad8341c450 [0,0,0,2,0,0|2,0,0]=4 24133 B13R2.3021 O[C@H]1CCCN(C1)CC2CCC2 c206cc637df04093c2fc818d92b4fb9b [0,0,0,2,0,0|1,0,0]=3 24134 B13R2.3021 O[C@H]1CCCN(C1)CC2CCO2 a3f6982881dc14b6b5cd3a500634cb30 [0,0,0,2,0,0|2,0,0]=4 24135 B13R2.3021 O[C@H]1CCCN(C1)CC2COC2 be05b1505bb799a562bc6ea48da23301 [0,0,0,2,0,0|2,0,0]=4 24136 B13R2.3021 O[C@H]1CCCN(C1)C[C@@H]2CCO2 e494528ab883777f669d66fa257d14e2 [0,0,0,2,0,0|2,0,0]=4 24137 B13R2.3021 O[C@H]1CCCN(C1)C[C@H]2CCO2 6f1425fed65bd11c9bb1bfd2e7276497 [0,0,0,2,0,0|2,0,0]=4 24138 B13R2.3021 O[C@H]1CCC[C@@H](C1)NC2CCC2 abeb2a618351a3d686c1985eea61526c [0,0,0,2,0,0|1,0,0]=3 24139 B13R2.3021 O[C@H]1CCC[C@@H](C1)NC2COC2 dfd3cb5557c5d9be96a27ccd160ad930 [0,0,0,2,0,0|2,0,0]=4 24140 B13R2.3021 O[C@H]1CCC[C@H](C1)NC2CCC2 f25c364ec75a75429199a47fa2e335dc [0,0,0,2,0,0|1,0,0]=3 24141 B13R2.3021 O[C@H]1CCC[C@H](C1)NC2COC2 00d29c3771ef7ae066f8fb48b3f88ce5 [0,0,0,2,0,0|2,0,0]=4 24142 B13R2.3021 O[C@H]1COC[C@H](C1)NC2CCC2 c3a124fc94e2bdf1d952cff3ba21cd6f [0,0,0,2,0,0|2,0,0]=4 24143 B13R2.3058 CCCCN1CC2CCCC1C2 0e7605101fe65d6a062fdb93a5ef19fc [0,0,0,2,0,0|2,0,0]=4 24144 B13R2.5331 CC1CCCC(C1)CNC2CC2 847dbf471b4ec5e466928b24fd377700 [0,0,0,2,0,0|2,0,0]=4 24145 B13R2.5331 CC1CCCC(C1)COC2CC2 88275a55ed0c59930646dc7d8c613b4d [0,0,0,2,0,0|2,0,0]=4 24146 B13R2.5331 CC1CCCC(C1)NCC2CC2 40a83741290b2d4b0582fb6119e68764 [0,0,0,2,0,0|2,0,0]=4 24147 B13R2.5331 CC1CCCC(C1)OCC2CC2 18d1f332eb2e5aa37567e94c37e199e9 [0,0,0,2,0,0|2,0,0]=4 24148 B13R2.5331 CC1CCCN(C1)CCC2CC2 022ad78d0f3614b420e6f391646dba12 [0,0,0,2,0,0|2,0,0]=4 24149 B13R2.5331 C[C@@H]1CCCN(C1)CCC2CC2 ced26ffe6f52cff1f51ce1466427996b [0,0,0,2,0,0|2,0,0]=4 24150 B13R2.5331 C[C@@H]1CCC[C@@H](C1)OCC2CC2 3d98147bdba7ac5f2c17d3cfaa10fa72 [0,0,0,2,0,0|2,0,0]=4 24151 B13R2.5331 C[C@@H]1CCC[C@H](C1)NCC2CC2 1d5a7b790acb245e5a04e084a3842abc [0,0,0,2,0,0|2,0,0]=4 24152 B13R2.5331 C[C@H]1CCCN(C1)CCC2CC2 99c54188f3778ee28116cf9ebda32a73 [0,0,0,2,0,0|2,0,0]=4 24153 B13R2.5331 C[C@H]1CCC[C@@H](C1)OCC2CC2 5ae3f1c91979104e52d2cd051af5f3b9 [0,0,0,2,0,0|2,0,0]=4 24154 B13R2.5331 C[C@H]1CCC[C@H](C1)OCC2CC2 28ae605769aab17c0579c80450b48a96 [0,0,0,2,0,0|2,0,0]=4 24155 B13R2.5331 FC1CCCN(C1)CCC2CC2 3333bae07a2dc9128d0fee10e815cf3d [0,0,0,2,0,0|2,0,0]=4 24156 B13R2.5331 F[C@@H]1CCCN(C1)CCC2CC2 52c842be6df5b5d5aad816e27f5bfbf7 [0,0,0,2,0,0|2,0,0]=4 24157 B13R2.5331 F[C@H]1CCCN(C1)CCC2CC2 ba8b0d1c5780ce0d0b91ddbfedcd52ff [0,0,0,2,0,0|2,0,0]=4 24158 B13R2.5331 OC1CCCC(C1)CNC2CC2 38175388cb62fb6472fcb1cd43619f18 [0,0,0,2,0,0|1,0,0]=3 24159 B13R2.5331 OC1CCCC(C1)NCC2CC2 8b5714fd060c3a332f445e2a690d78c2 [0,0,0,2,0,0|1,0,0]=3 24160 B13R2.5331 OC1CCCN(C1)CCC2CC2 87c44121964f7e4d73687b099c1cb8e9 [0,0,0,2,0,0|1,0,0]=3 24161 B13R2.5331 OC1COCC(C1)NCC2CC2 5e8cf813be04d53ffecada6a7a74b9e5 [0,0,0,2,0,0|2,0,0]=4 24162 B13R2.5331 O[C@@H]1CCCN(C1)CCC2CC2 eb93d1a1e43e657c8a6603948985ab08 [0,0,0,2,0,0|1,0,0]=3 24163 B13R2.5331 O[C@@H]1CCC[C@@H](C1)CNC2CC2 cb6467326a4ac1a5f0d2727c6d5a5608 [0,0,0,2,0,0|1,0,0]=3 24164 B13R2.5331 O[C@@H]1CCC[C@@H](C1)NCC2CC2 063deed7ccd70e38ae6b2e1b871bf59f [0,0,0,2,0,0|1,0,0]=3 24165 B13R2.5331 O[C@@H]1CCC[C@H](C1)NCC2CC2 1bd55e55eb0b9b887f4fd3f0720f96a9 [0,0,0,2,0,0|1,0,0]=3 24166 B13R2.5331 O[C@@H]1COC[C@@H](C1)NCC2CC2 eceaf26991fcede2daec32561b169639 [0,0,0,2,0,0|2,0,0]=4 24167 B13R2.5331 O[C@H]1CCCN(C1)CCC2CC2 17f876ae23737f1262d054852e7feb51 [0,0,0,2,0,0|1,0,0]=3 24168 B13R2.5331 O[C@H]1CCC[C@@H](C1)NCC2CC2 588ab4c460caada4888d7d2e22e2bee4 [0,0,0,2,0,0|1,0,0]=3 24169 B13R2.5331 O[C@H]1CCC[C@H](C1)NCC2CC2 b3f535a396cd4c2b3bab8b8cbe3e422e [0,0,0,2,0,0|1,0,0]=3 24170 B13R2.5331 O[C@H]1COC[C@H](C1)NCC2CC2 1f680cd8745897dee6eb3ad8932d4ec8 [0,0,0,2,0,0|2,0,0]=4 24171 B13R2.31 CC1CC(C1)OC2CCCCC2 75ebf5291c31076e7844135b77bde22d [0,0,0,2,0,0|2,0,0]=4 24172 B13R2.31 FC1CC(C1)NC2CCCCC2 81a8c62b7f5b20db1cdd4eefd6f19a50 [0,0,0,2,0,0|2,0,0]=4 24173 B13R2.31 FC1CC(C1)OC2CCCCC2 88dff836ffcd6f58d12b6b9cd0e2102e [0,0,0,2,0,0|2,0,0]=4 24174 B13R2.31 FC1CN(C1)CC2CCCCC2 66ed56e510cb5d37aaa5d5a40a25adb9 [0,0,0,2,0,0|2,0,0]=4 24175 B13R2.31 F[C@H]1C[C@@H](C1)NC2CCCCC2 fb1956bd613862a8ef1daba9db35f057 [0,0,0,2,0,0|2,0,0]=4 24176 B13R2.31 F[C@H]1C[C@@H](C1)OC2CCCCC2 ee1ecd125c83a6489a6b65c819f881e2 [0,0,0,2,0,0|2,0,0]=4 24177 B13R2.31 F[C@H]1C[C@H](C1)NC2CCCCC2 199370bae63bd6f240b6ddb7c66c90f3 [0,0,0,2,0,0|2,0,0]=4 24178 B13R2.31 F[C@H]1C[C@H](C1)OC2CCCCC2 3dfe3fbe4bdc2caba053d5fa365b1e33 [0,0,0,2,0,0|2,0,0]=4 24179 B13R2.31 OC1CC(C1)CN2CCCOC2 2b391b982629002deb2772ff0a9b37b2 [0,0,0,2,0,0|2,0,0]=4 24180 B13R2.31 OC1CC(C1)CN2CCCSC2 a847918340d5bdbe1b9ede277834fab9 [0,0,0,2,0,0|2,0,0]=4 24181 B13R2.31 OC1CC(C1)CN2CCOCC2 62a0508e885941118264ea36b061d10e [0,0,0,2,0,0|2,0,0]=4 24182 B13R2.31 OC1CC(C1)CN2CCSCC2 80a54c347b3b46602bb64982ba80ec7e [0,0,0,2,0,0|2,0,0]=4 24183 B13R2.31 OC1CC(C1)NC2CCCCC2 8d1f1ed5193b04ed9bc3bb4c6763772f [0,0,0,2,0,0|1,0,0]=3 24184 B13R2.31 OC1CC(C1)NC2CCCCO2 cf3114550278f494839bd4f3c73ec308 [0,0,0,2,0,0|2,0,0]=4 24185 B13R2.31 OC1CC(C1)NC2CCCOC2 12c0c3e37d3659c932a438a2942de32b [0,0,0,2,0,0|2,0,0]=4 24186 B13R2.31 OC1CC(C1)NC2CCOCC2 ab04677f011b0d6497eabb2f289b1e0d [0,0,0,2,0,0|2,0,0]=4 24187 B13R2.31 OC1CC(C1)NC2CCSCC2 74beaf7df481722de1cf26c4ccc32249 [0,0,0,2,0,0|2,0,0]=4 24188 B13R2.31 OC1CN(C1)CC2CCCCC2 103fb4d66840ca7a4cf12f0840e6241f [0,0,0,2,0,0|1,0,0]=3 24189 B13R2.31 OC1CN(C1)CC2CCCCO2 2e266f9a00227001c6e8830f60ba317b [0,0,0,2,0,0|2,0,0]=4 24190 B13R2.31 OC1CN(C1)CC2CCCOC2 ce50c61dcf24cb859de75f8778bf9857 [0,0,0,2,0,0|2,0,0]=4 24191 B13R2.31 OC1CN(C1)CC2CCOCC2 732a3704eb9b7c0089d8b33a743dc382 [0,0,0,2,0,0|2,0,0]=4 24192 B13R2.31 OC1CN(C1)CC2CCSCC2 e111d1c3114f93dfe22f1db82bc03c01 [0,0,0,2,0,0|2,0,0]=4 24193 B13R2.31 O[C@H]1C[C@@H](C1)NC2CCCCC2 fd59a488edb5006c3a0b86abcf149287 [0,0,0,2,0,0|1,0,0]=3 24194 B13R2.31 O[C@H]1C[C@@H](C1)NC2CCCCO2 46cb03c81605a83180146b7afafdaec6 [0,0,0,2,0,0|2,0,0]=4 24195 B13R2.31 O[C@H]1C[C@@H](C1)NC2CCCOC2 960b63a74a85a97c63aa9c3e1f611832 [0,0,0,2,0,0|2,0,0]=4 24196 B13R2.31 O[C@H]1C[C@@H](C1)NC2CCOCC2 85f7f0d12ae8cf50386f77d0db6feda9 [0,0,0,2,0,0|2,0,0]=4 24197 B13R2.31 O[C@H]1C[C@@H](C1)NC2CCSCC2 6ed56f19c57595642cf508e6923d2835 [0,0,0,2,0,0|2,0,0]=4 24198 B13R2.31 O[C@H]1C[C@H](C1)NC2CCCCC2 376e39356197859f616f4faa780257bf [0,0,0,2,0,0|1,0,0]=3 24199 B13R2.31 O[C@H]1C[C@H](C1)NC2CCCCO2 60d3bb5d62ea5b41ea06589053eaba0e [0,0,0,2,0,0|2,0,0]=4 24200 B13R2.31 O[C@H]1C[C@H](C1)NC2CCCOC2 a7c753b782b297c6cc560645beb1f9e9 [0,0,0,2,0,0|2,0,0]=4 24201 B13R2.31 O[C@H]1C[C@H](C1)NC2CCOCC2 08ecc197afd698c856db905ad7052ed5 [0,0,0,2,0,0|2,0,0]=4 24202 B13R2.31 O[C@H]1C[C@H](C1)NC2CCSCC2 b8fa6ba69fcb9f6cddb93339bbfa50b9 [0,0,0,2,0,0|2,0,0]=4 24203 B13R2.216 C[C@@H]1CCCC[C@@H]1N2CC(C2)F d3e92844544c2bdc8fc21742bf07241a [0,0,0,2,0,0|2,0,0]=4 24204 B13R2.216 C[C@@H]1CCCC[C@@H]1N2CC(C2)O 192c181bdc247cd9a4cd5e02a35df0e8 [0,0,0,2,0,0|1,0,0]=3 24205 B13R2.216 OC1CN(C1)C2CCCCC2F e48b62cce7bb2d7af324d523cce0353e [0,0,0,2,0,0|2,0,0]=4 24206 B13R2.216 OC1CN(C1)C2CCCCC2O 54b7e3d15c05cc1b64ecf915850c0774 [0,0,0,2,0,0|2,0,0]=4 24207 B13R2.216 OC1CN(C1)[C@H]2CCCC[C@@H]2O 755b02f940a74ec113de9533c6b98154 [0,0,0,2,0,0|2,0,0]=4 24208 B13R2.241 CC1CC(C1)CNC2CCCC2 1ac114c199f92fe4abe6c458c76168d7 [0,0,0,2,0,0|2,0,0]=4 24209 B13R2.241 CC1CC(C1)COC2CCCC2 a8e13a72decf715627472e6d47d31422 [0,0,0,2,0,0|2,0,0]=4 24210 B13R2.241 CC1CC(C1)OCC2CCCC2 1e79aa30f83616c41aa475eefd4e3eb1 [0,0,0,2,0,0|2,0,0]=4 24211 B13R2.241 C[C@H]1C[C@@H](C1)COC2CCCC2 8cd6efcc320c56badf6f0b0c636e660c [0,0,0,2,0,0|2,0,0]=4 24212 B13R2.241 FC1CC(C1)COC2CCCC2 7b3635290c75083c13fec26fb922809e [0,0,0,2,0,0|2,0,0]=4 24213 B13R2.241 FC1CC(C1)NCC2CCCC2 56885e80df2e2339b8306fea4750b9eb [0,0,0,2,0,0|2,0,0]=4 24214 B13R2.241 FC1CC(C1)OCC2CCCC2 810a17dc6f260867494bbde0d478df73 [0,0,0,2,0,0|2,0,0]=4 24215 B13R2.241 FC1CN(C1)CCC2CCCC2 8d5106ddc12c6229e3478a4a82dbe4f8 [0,0,0,2,0,0|2,0,0]=4 24216 B13R2.241 F[C@H]1C[C@@H](C1)NCC2CCCC2 6f5d7439b55cb6db037a0c238a896ce5 [0,0,0,2,0,0|2,0,0]=4 24217 B13R2.241 F[C@H]1C[C@@H](C1)OCC2CCCC2 be95029f95ea180948dd368484de8a81 [0,0,0,2,0,0|2,0,0]=4 24218 B13R2.241 F[C@H]1C[C@H](C1)CNC2CCCC2 8593ba59e45533cc79f1ec09544b6bb5 [0,0,0,2,0,0|2,0,0]=4 24219 B13R2.241 F[C@H]1C[C@H](C1)COC2CCCC2 6fe4c71f04651a0b1143559fb7ada342 [0,0,0,2,0,0|2,0,0]=4 24220 B13R2.241 F[C@H]1C[C@H](C1)NCC2CCCC2 67f53a30b347e0b3a0c6e5b614ab3b77 [0,0,0,2,0,0|2,0,0]=4 24221 B13R2.241 F[C@H]1C[C@H](C1)OCC2CCCC2 8b4186880bbb834225ca7600ad609556 [0,0,0,2,0,0|2,0,0]=4 24222 B13R2.241 OC1CC(C1)CNC2CCCC2 08f7c9059af37b8b328c8f3e56a4676e [0,0,0,2,0,0|1,0,0]=3 24223 B13R2.241 OC1CC(C1)CNC2CCOC2 7d70800b1cbfc8f65821676a11578767 [0,0,0,2,0,0|2,0,0]=4 24224 B13R2.241 OC1CC(C1)CNC2CCSC2 7c72ba955128001b26e434e948a1834d [0,0,0,2,0,0|2,0,0]=4 24225 B13R2.241 OC1CC(C1)CN[C@@H]2CCOC2 8d71c98f21f18c61c61a0dbc0c41f205 [0,0,0,2,0,0|2,0,0]=4 24226 B13R2.241 OC1CC(C1)CN[C@H]2CCOC2 7870794b82a07b9e62c7069b6f92b7a2 [0,0,0,2,0,0|2,0,0]=4 24227 B13R2.241 OC1CC(C1)NCC2CCCC2 a03a3dbd92347c2579fefd08af6da2bc [0,0,0,2,0,0|1,0,0]=3 24228 B13R2.241 OC1CC(C1)NCC2CCCO2 b54a230d25d1cfd5c17ac1377810864a [0,0,0,2,0,0|2,0,0]=4 24229 B13R2.241 OC1CC(C1)NCC2CCOC2 00059a98c61e49cfc1ac723df52ae543 [0,0,0,2,0,0|2,0,0]=4 24230 B13R2.241 OC1CC(C1)NC[C@@H]2CCCO2 ebf7b02b5554dcc20fad7dc4e12fad7b [0,0,0,2,0,0|2,0,0]=4 24231 B13R2.241 OC1CC(C1)NC[C@@H]2CCOC2 2987f450d67d05d0e1ea71cff2556255 [0,0,0,2,0,0|2,0,0]=4 24232 B13R2.241 OC1CC(C1)NC[C@H]2CCCO2 f4bcc1665a0d1970307531479c66c898 [0,0,0,2,0,0|2,0,0]=4 24233 B13R2.241 OC1CC(C1)NC[C@H]2CCOC2 b510dc4649dbab28028e28d8cd7ba925 [0,0,0,2,0,0|2,0,0]=4 24234 B13R2.241 OC1CN(C1)CCC2CCCC2 7a376fa827dc972b02abd2825aa9c748 [0,0,0,2,0,0|1,0,0]=3 24235 B13R2.241 OC1CN(C1)CCC2CCCO2 1f0d70024a66146eee1699d54844068b [0,0,0,2,0,0|2,0,0]=4 24236 B13R2.241 OC1CN(C1)CCC2CCOC2 1d413af5ab26fc7b2caa6a5d6d177929 [0,0,0,2,0,0|2,0,0]=4 24237 B13R2.241 OC1CN(C1)CCN2CCCC2 85e51e8f71eb69e0ab356f955c520961 [0,0,0,2,0,0|2,0,0]=4 24238 B13R2.241 O[C@H]1C[C@@H](C1)CNC2CCCC2 f523842362b242c1ac86ee7f406a1acc [0,0,0,2,0,0|1,0,0]=3 24239 B13R2.241 O[C@H]1C[C@@H](C1)CNC2CCOC2 952ff875570ab82356b2b307d890c0b0 [0,0,0,2,0,0|2,0,0]=4 24240 B13R2.241 O[C@H]1C[C@@H](C1)CN[C@@H]2CCOC2 a77b6101a92293956f3a46a647f74a0f [0,0,0,2,0,0|2,0,0]=4 24241 B13R2.241 O[C@H]1C[C@@H](C1)CN[C@H]2CCOC2 a4a1ef4c9210765914d1d81bbdfa2929 [0,0,0,2,0,0|2,0,0]=4 24242 B13R2.241 O[C@H]1C[C@@H](C1)NCC2CCCC2 01d02ae699c6e803fad67a569af119a4 [0,0,0,2,0,0|1,0,0]=3 24243 B13R2.241 O[C@H]1C[C@@H](C1)NCC2CCCO2 d0bdaf486954b507294aeb9cf8c27c19 [0,0,0,2,0,0|2,0,0]=4 24244 B13R2.241 O[C@H]1C[C@@H](C1)NCC2CCOC2 1d9355882802cc5eb9d9f614f006902b [0,0,0,2,0,0|2,0,0]=4 24245 B13R2.241 O[C@H]1C[C@H](C1)CNC2CCCC2 a1e3ad606721020cce5e94f982f4257e [0,0,0,2,0,0|1,0,0]=3 24246 B13R2.241 O[C@H]1C[C@H](C1)CNC2CCOC2 a1b54f3cb47c593d50ffefdba7a03d33 [0,0,0,2,0,0|2,0,0]=4 24247 B13R2.241 O[C@H]1C[C@H](C1)CN[C@@H]2CCOC2 876d1566af6a0b153137a0adc288e6cc [0,0,0,2,0,0|2,0,0]=4 24248 B13R2.241 O[C@H]1C[C@H](C1)CN[C@H]2CCOC2 9d840fd85915740c16f6cc85c3f70323 [0,0,0,2,0,0|2,0,0]=4 24249 B13R2.241 O[C@H]1C[C@H](C1)NCC2CCCC2 fbbfc3a1067d3c5a6309a4a1f9951a57 [0,0,0,2,0,0|1,0,0]=3 24250 B13R2.241 O[C@H]1C[C@H](C1)NCC2CCCO2 a2f8b618351b827f0c193e948bb40091 [0,0,0,2,0,0|2,0,0]=4 24251 B13R2.241 O[C@H]1C[C@H](C1)NCC2CCOC2 757bc81451752659172ebd974f707f42 [0,0,0,2,0,0|2,0,0]=4 24252 B13R2.361 CC1CC(C1)CN2CCCC2C 6b50d551592a3675c5a705647cd443a6 [0,0,0,2,0,0|2,0,0]=4 24253 B13R2.361 CC1CC(C1)CN2CCC[C@@H]2C 9a23b783cea41a659613acd9b5b88676 [0,0,0,2,0,0|2,0,0]=4 24254 B13R2.361 CC1CC(C1)CN2CCC[C@H]2C dc3df6865c2a5907bc11cd677db1b931 [0,0,0,2,0,0|2,0,0]=4 24255 B13R2.361 CC1CCCN1CC2CC(C2)O cd5c13dd8cdb7894c635a2191db3043a [0,0,0,2,0,0|1,0,0]=3 24256 B13R2.361 CC1CCCN1C[C@H]2C[C@H](C2)F 121ece853650a1d10ba51543ba0b9b8c [0,0,0,2,0,0|2,0,0]=4 24257 B13R2.361 CC1COCC1CN2CC(C2)O da14c6c3d8bdffa23e81f776d5d8930c [0,0,0,2,0,0|2,0,0]=4 24258 B13R2.361 C[C@@H]1CCCN1CC2CC(C2)O d99bef11bea5dd4727756caaf1ff9e26 [0,0,0,2,0,0|1,0,0]=3 24259 B13R2.361 C[C@@H]1CCCN1C[C@H]2C[C@H](C2)F 9558896d2620fc121061a98040c88187 [0,0,0,2,0,0|2,0,0]=4 24260 B13R2.361 C[C@H]1CCCN1CC2CC(C2)O cb6c12d4177dfb2a4f53db84c1429928 [0,0,0,2,0,0|1,0,0]=3 24261 B13R2.361 C[C@H]1CCCN1C[C@H]2C[C@H](C2)F 76a08e6640cd5b4a1e1e09526cd4a7af [0,0,0,2,0,0|2,0,0]=4 24262 B13R2.361 OC1CC(C1)CN2CCCC2O 4563893bbcb40dced8ed5dbf1f4fb0cf [0,0,0,2,0,0|2,0,0]=4 24263 B13R2.361 OC1CC(C1)NC2CCCC2O eb147073b116f737669b3d7364b5f344 [0,0,0,2,0,0|2,0,0]=4 24264 B13R2.361 OC1CC(C1)N[C@@H]2CCC[C@@H]2O 88660203f6850df3fa263bef819642b8 [0,0,0,2,0,0|2,0,0]=4 24265 B13R2.361 OC1CC(C1)N[C@@H]2CCC[C@H]2O 7fc743958a30dcf434070ec4d8d85a90 [0,0,0,2,0,0|2,0,0]=4 24266 B13R2.361 OC1CC(C1)N[C@H]2CCC[C@@H]2O b8105c3511ea1519e4f3af268b93f43f [0,0,0,2,0,0|2,0,0]=4 24267 B13R2.361 OC1CC(C1)N[C@H]2CCC[C@H]2O 522b82d96df62387617247b6fe68d0b4 [0,0,0,2,0,0|2,0,0]=4 24268 B13R2.361 OC1CCCC1N[C@H]2C[C@@H](C2)O 2947dbca7de2279a4cd94f72a65e3977 [0,0,0,2,0,0|2,0,0]=4 24269 B13R2.361 OC1CCCC1N[C@H]2C[C@H](C2)O 79803e6f82e7c72265bca1d2eb530f0b [0,0,0,2,0,0|2,0,0]=4 24270 B13R2.361 O[C@@H]1CCC[C@H]1N[C@H]2C[C@@H](C2)O d27360fa14eb74a572fa00849bf4db46 [0,0,0,2,0,0|2,0,0]=4 24271 B13R2.361 O[C@@H]1CCC[C@H]1N[C@H]2C[C@H](C2)O 598505055fa8fdc1a0847ce2a9a6b070 [0,0,0,2,0,0|2,0,0]=4 24272 B13R2.361 O[C@H]1CCC[C@@H]1N[C@H]2C[C@@H](C2)O debc809181b7f8db45482e403d6f7f48 [0,0,0,2,0,0|2,0,0]=4 24273 B13R2.361 O[C@H]1CCC[C@@H]1N[C@H]2C[C@H](C2)O debdfd4155f6b0b24fc668ddc7645c14 [0,0,0,2,0,0|2,0,0]=4 24274 B13R2.399 CC1CC(C1)COCC2CC2C 58f7cbe1e030bb73ece64045dabb57b4 [0,0,0,2,0,0|2,0,0]=4 24275 B13R2.399 CC1CC(C1)COC[C@@H]2C[C@@H]2C f84f50783db24e9fc1978eb374bb05a1 [0,0,0,2,0,0|2,0,0]=4 24276 B13R2.399 CC1CC(C1)COC[C@@H]2C[C@H]2C c485a1b692ffe67f0cad201a247ec8df [0,0,0,2,0,0|2,0,0]=4 24277 B13R2.399 CC1CC(C1)COC[C@H]2C[C@@H]2C f87a235da3160715ff00e4db586ad0ed [0,0,0,2,0,0|2,0,0]=4 24278 B13R2.399 CC1CC1COC[C@H]2C[C@H](C2)F b3cda18f4d65f2f537fe22967830180d [0,0,0,2,0,0|2,0,0]=4 24279 B13R2.399 C[C@@H]1C[C@H]1COC[C@H]2C[C@H](C2)F 722e0249f3c5da3d837fe9e9b9e6d313 [0,0,0,2,0,0|2,0,0]=4 24280 B13R2.399 C[C@H]1C[C@@H]1COC[C@H]2C[C@H](C2)F b001fd12b9f3b9899227e83d8ecd15ae [0,0,0,2,0,0|2,0,0]=4 24281 B13R2.399 C[C@H]1C[C@H]1COC[C@H]2C[C@H](C2)F 965bc4e6cd0c85b893d9f432f777e72c [0,0,0,2,0,0|2,0,0]=4 24282 B13R2.619 CO[C@H]1C[C@H]1NCC2CC(C2)O aee10ff51f482a68fa0811fd710cc790 [0,0,0,2,0,0|2,0,0]=4 24283 B13R2.619 OCC1CC1CNC2CC(C2)O 4a6ab20328778c603cc577eb06a20020 [0,0,0,2,0,0|2,0,0]=4 24284 B13R2.619 OC[C@@H]1C[C@@H]1NCC2CC(C2)O 4be852e4165948329d8e2c397bb354d3 [0,0,0,2,0,0|2,0,0]=4 24285 B13R2.619 OC[C@@H]1C[C@H]1NCC2CC(C2)O 5cbd1b2cb7deb8e424a131d03fcd4926 [0,0,0,2,0,0|2,0,0]=4 24286 B13R2.619 OC[C@H]1C[C@@H]1NCC2CC(C2)O fce94a22edf31badf6acdccb35b0c9b1 [0,0,0,2,0,0|2,0,0]=4 24287 B13R2.1238 CCCCN1CCC2C1C(C2)O 31a83c548e8a19fef2dcec6b9cfa6c68 [0,0,0,2,0,0|1,0,0]=3 24288 B13R2.1238 CCOCN1CCC2C1C(C2)O c0d39af5def754b801fd77bafa3953fc [0,0,0,2,0,0|2,0,0]=4 24289 B13R2.1238 COCCN1CCC2C1C(C2)O ad46d6e8aa54a8aee2a301d807cfc0d3 [0,0,0,2,0,0|2,0,0]=4 24290 B13R2.1238 CSCCN1CCC2C1C(C2)O 5e23eee0c1b2a8d619185420707abf2c [0,0,0,2,0,0|2,0,0]=4 24291 B13R2.1238 OC1CC2C1N(CC2)CCCF a03b812a294fafb1f252586cae5b0eaa [0,0,0,2,0,0|2,0,0]=4 24292 B13R2.1238 OC1CC2C1N(CC2)CCCS ca1ab10c84d4d736d61b9e29971961ec [0,0,0,2,0,0|2,0,0]=4 24293 B13R2.1238 OCCCN1CCC2C1C(C2)O 4637b5576eaf90fef877b3fb95137c47 [0,0,0,2,0,0|2,0,0]=4 24294 B13R2.2182 CCCCCNCC12CC(C1)C2 50752970ae445099ea9dee9597ff79a3 [0,0,0,2,0,0|2,0,0]=4 24295 B13R2.2182 CCCCCOCC12CC(C1)C2 55056cf1949ce1b33c73655adf2ab8e3 [0,0,0,2,0,0|2,0,0]=4 24296 B13R2.2357 CCC1CCCN1C2CC(C2)O d060820225b89db301268de61aa261a9 [0,0,0,2,0,0|1,0,0]=3 24297 B13R2.2357 CC[C@@H]1CCCN1C2CC(C2)O b817c8b380a8a8e863f5ff30f39ce8d8 [0,0,0,2,0,0|1,0,0]=3 24298 B13R2.2357 OC1CC(C1)N2CCC[C@@H]2CF d2e7eeb1d1fe5b7cb0eb2f45b7217445 [0,0,0,2,0,0|2,0,0]=4 24299 B13R2.2357 OC1CC(C1)N2CCC[C@H]2CF 7d6bac82ae0ae505e09a04067e25dea9 [0,0,0,2,0,0|2,0,0]=4 24300 B13R2.2357 OCC1CCCN1C2CC(C2)O e22989e75effabe81fb7ab894c529903 [0,0,0,2,0,0|2,0,0]=4 24301 B13R2.2357 OC[C@@H]1CCCN1C2CC(C2)O 9a57d6dfbf575a754d39b23f27c171a8 [0,0,0,2,0,0|2,0,0]=4 24302 B13R2.2357 OC[C@H]1CCCN1C2CC(C2)O 6a119435653e47f23ee6ea1137ee07e6 [0,0,0,2,0,0|2,0,0]=4 24303 B13R2.2367 CCC1CCN1CC2CC(C2)C 149b499b02849c67bde43fa7028a902e [0,0,0,2,0,0|2,0,0]=4 24304 B13R2.2367 CCC1CCN1CC2CC(C2)O 51111732c5aa9e7c5ba751dcf888db03 [0,0,0,2,0,0|1,0,0]=3 24305 B13R2.2367 CCC1CCN1C[C@H]2C[C@H](C2)F c192aea3b2354a502f01d4707b07b33e [0,0,0,2,0,0|2,0,0]=4 24306 B13R2.2367 COC1CCC1NC2CC(C2)O 8cf5e0cbbc3d48b2221039da8012acd9 [0,0,0,2,0,0|2,0,0]=4 24307 B13R2.2367 CO[C@@H]1CC[C@@H]1NC2CC(C2)O 58012649a389bf41c8edab611e416118 [0,0,0,2,0,0|2,0,0]=4 24308 B13R2.2367 CO[C@@H]1CC[C@H]1NC2CC(C2)O cf5faf755d6ac9f00325d49b05af33d3 [0,0,0,2,0,0|2,0,0]=4 24309 B13R2.2367 CO[C@H]1CC[C@@H]1NC2CC(C2)O e01104052023198c4d7c56d68837f9f5 [0,0,0,2,0,0|2,0,0]=4 24310 B13R2.2367 CO[C@H]1CC[C@H]1NC2CC(C2)O 95a69cba0bf2a03bde97ea0133eefda1 [0,0,0,2,0,0|2,0,0]=4 24311 B13R2.2367 OCC1CCN1CC2CC(C2)O 2793cfac33a6cd61ffb48143cb79695c [0,0,0,2,0,0|2,0,0]=4 24312 B13R2.2367 OC[C@@H]1CCN1CC2CC(C2)O 664ae809af105fd02aeb06c5501acbc6 [0,0,0,2,0,0|2,0,0]=4 24313 B13R2.2367 OC[C@H]1CCN1CC2CC(C2)O 0dd1359c16a5db0dafb17228d7be51ff [0,0,0,2,0,0|2,0,0]=4 24314 B13R2.2404 COCC1CCN1C2CC(C2)O f16a8d5e0da03ae9fb3638f1dd2ba5d2 [0,0,0,2,0,0|2,0,0]=4 24315 B13R2.2404 COC[C@@H]1CCN1C2CC(C2)O 767abbb6a19763891aa3b694049b89c7 [0,0,0,2,0,0|2,0,0]=4 24316 B13R2.2404 COC[C@H]1CCN1C2CC(C2)O 5e0b4c5fff5f9403f8e83cb804209eeb [0,0,0,2,0,0|2,0,0]=4 24317 B13R2.2947 COC[C@@H]1C[C@@H]1NC2CC(C2)O 7d381d3a466154495110fea86a811eb4 [0,0,0,2,0,0|2,0,0]=4 24318 B13R2.2947 COC[C@H]1C[C@@H]1NC2CC(C2)O 24d0c36ff8b50a85b20a9d8d2c1763fc [0,0,0,2,0,0|2,0,0]=4 24319 B13R2.3043 CC1CC(C1)CN[C@@H]2CC[C@H]2C 4ce5bf01e75bb60e44c88aa40323d8a0 [0,0,0,2,0,0|2,0,0]=4 24320 B13R2.3043 CC1CC(C1)CN[C@H]2CC[C@H]2C 25cf87120b062d8d3a629c945bf70cee [0,0,0,2,0,0|2,0,0]=4 24321 B13R2.3043 CC1OCC1NCC2CC(C2)O 958b6f017967763e8388a86c481f5ab8 [0,0,0,2,0,0|2,0,0]=4 24322 B13R2.3043 CN1CCC1CNC2CC(C2)O a4da2b91e506cf667cac7fc476a85e05 [0,0,0,2,0,0|2,0,0]=4 24323 B13R2.3043 C[C@@H]1CC[C@@H]1NCC2CC(C2)O ccac5f545dfe9479c20603d27f602a0b [0,0,0,2,0,0|1,0,0]=3 24324 B13R2.3043 C[C@@H]1CC[C@@H]1NC[C@H]2C[C@H](C2)F 62b88f4def82eeb0c4cb19cdc6952681 [0,0,0,2,0,0|2,0,0]=4 24325 B13R2.3043 C[C@@H]1CC[C@H]1NCC2CC(C2)O 2f8a6675afaf2c7c0fe5d810a8192f5d [0,0,0,2,0,0|1,0,0]=3 24326 B13R2.3043 C[C@@H]1CC[C@H]1NC[C@H]2C[C@H](C2)F 4cd07cb3191dfc4f98efc043a94d8b03 [0,0,0,2,0,0|2,0,0]=4 24327 B13R2.3043 OC1CC(C1)CNC2CCC2F eb1a4b0fa3c7ddb0b0a68f1895a8275f [0,0,0,2,0,0|2,0,0]=4 24328 B13R2.3043 OC1CC(C1)CNC2CCC2O 57166cce6634914157b71a017ece2720 [0,0,0,2,0,0|2,0,0]=4 24329 B13R2.3043 OC1CC(C1)CN[C@@H]2CC[C@@H]2O a116337d728c4ffcde4fda270786a1a1 [0,0,0,2,0,0|2,0,0]=4 24330 B13R2.3043 OC1CC(C1)CN[C@@H]2CC[C@H]2O 4f5ff7e1ee39547442885a09e3eb8dc5 [0,0,0,2,0,0|2,0,0]=4 24331 B13R2.3043 OC1CC(C1)CN[C@H]2CC[C@@H]2O 2e6e4a03bf6b81fa9e001237b2731ca7 [0,0,0,2,0,0|2,0,0]=4 24332 B13R2.3043 OC1CC(C1)CN[C@H]2CC[C@H]2O 994af9c612535c3425fc36c576d16225 [0,0,0,2,0,0|2,0,0]=4 24333 B13R2.5283 FC1CN(C1)C2CCCCCC2 36e1fa4a7e83b0f2fb3a949e7d19a6ec [0,0,0,2,0,0|2,0,0]=4 24334 B13R2.5283 OC1CC(C1)N2CCCCCC2 cb216e834a4f19e09cf5867da39ec35c [0,0,0,2,0,0|1,0,0]=3 24335 B13R2.5283 OC1CC(C1)N2CCCOCC2 2c0e6aaafb472f738eb46e3a8503ba00 [0,0,0,2,0,0|2,0,0]=4 24336 B13R2.5283 OC1CN(C1)C2CCCCCC2 fd5ac730b5e8e4c99f464c39d1bfa4be [0,0,0,2,0,0|1,0,0]=3 24337 B13R2.5283 OC1CN(C1)C2CCCOCC2 bfcbf77ab4ff9f87283e9e276a197933 [0,0,0,2,0,0|2,0,0]=4 24338 B13R2.5292 CC1CC(C1)CNCCC2CC2 98fabaa9400dc05066cc53091fa1b99d [0,0,0,2,0,0|2,0,0]=4 24339 B13R2.5292 CC1CC(C1)COCCC2CC2 fcdf607ef7170cde464142f82b393d47 [0,0,0,2,0,0|2,0,0]=4 24340 B13R2.5292 C[C@H]1C[C@@H](C1)COCCC2CC2 5b8fd41917729d63c8109f889d8d08f4 [0,0,0,2,0,0|2,0,0]=4 24341 B13R2.5292 FC1CC(C1)COCCC2CC2 04edb78ab3540eded3cfac1e385e5927 [0,0,0,2,0,0|2,0,0]=4 24342 B13R2.5292 F[C@H]1C[C@H](C1)CNCCC2CC2 022571a74969aedaaae7e76c7248cdb6 [0,0,0,2,0,0|2,0,0]=4 24343 B13R2.5292 F[C@H]1C[C@H](C1)COCCC2CC2 8d5c4a0a7273fe5b6ac270e995531a70 [0,0,0,2,0,0|2,0,0]=4 24344 B13R2.5292 OC1CC(C1)CNCCC2CC2 631946cada09c2db4dd04cd6363be638 [0,0,0,2,0,0|1,0,0]=3 24345 B13R2.5292 OC1CC(C1)CNCCN2CC2 03961f1d3c3e1719dda238023e761226 [0,0,0,2,0,0|2,0,0]=4 24346 B13R2.5292 OC1CC(C1)NCCOC2CC2 99fcc692dc2230e4b5b638a458b3a4aa [0,0,0,2,0,0|2,0,0]=4 24347 B13R2.5292 OC1CN(C1)CCCNC2CC2 8fcdbdfa0d2f99e1ef85f9b46f4d667f [0,0,0,2,0,0|2,0,0]=4 24348 B13R2.5292 OC1CN(C1)CCNCC2CC2 6433100d84785f104230a0e21758ccd9 [0,0,0,2,0,0|2,0,0]=4 24349 B13R2.5292 O[C@H]1C[C@@H](C1)CNCCC2CC2 8c2cca4b9503c92d5be0042efb8b9e98 [0,0,0,2,0,0|1,0,0]=3 24350 B13R2.5292 O[C@H]1C[C@@H](C1)NCCOC2CC2 2b98fbf28573169a25c4a4ef6b9aabc5 [0,0,0,2,0,0|2,0,0]=4 24351 B13R2.5292 O[C@H]1C[C@H](C1)CNCCC2CC2 0436b8a132c129d02bf00f9d7e7cf753 [0,0,0,2,0,0|1,0,0]=3 24352 B13R2.5292 O[C@H]1C[C@H](C1)NCCOC2CC2 18fb10c3d2d7312937f1131b1e11498b [0,0,0,2,0,0|2,0,0]=4 24353 B13R2.5303 CC1CC(C1)CNCC2CCC2 738ddecc2ee325692eac01bd0dc3f53a [0,0,0,2,0,0|2,0,0]=4 24354 B13R2.5303 CC1CC(C1)COCC2CCC2 4db61b312084e156ca8bb3a1acc354fb [0,0,0,2,0,0|2,0,0]=4 24355 B13R2.5303 CC1CC(C1)OCCC2CCC2 7e4398fd95bd887db43ba4ca9f54b115 [0,0,0,2,0,0|2,0,0]=4 24356 B13R2.5303 C[C@H]1C[C@@H](C1)COCC2CCC2 e633b970098d020787c58028baeb00d5 [0,0,0,2,0,0|2,0,0]=4 24357 B13R2.5303 FC1CC(C1)COCC2CCC2 a782d5fa31d021f048f4f07703f5c3b6 [0,0,0,2,0,0|2,0,0]=4 24358 B13R2.5303 FC1CC(C1)NCCC2CCC2 37dffdc73ae0bcead3a96447068cb71b [0,0,0,2,0,0|2,0,0]=4 24359 B13R2.5303 FC1CC(C1)OCCC2CCC2 de8f8175adfa3acf091368249b1d4817 [0,0,0,2,0,0|2,0,0]=4 24360 B13R2.5303 F[C@H]1C[C@@H](C1)NCCC2CCC2 0e5ad1846deeec22ce4e653f3a03d708 [0,0,0,2,0,0|2,0,0]=4 24361 B13R2.5303 F[C@H]1C[C@@H](C1)OCCC2CCC2 fc58c0a385d08a714c25f494173b32b4 [0,0,0,2,0,0|2,0,0]=4 24362 B13R2.5303 F[C@H]1C[C@H](C1)CNCC2CCC2 6044817d6d554150e1dce0b19700d80a [0,0,0,2,0,0|2,0,0]=4 24363 B13R2.5303 F[C@H]1C[C@H](C1)COCC2CCC2 fd2ef0f2bf1c4fe93c31d3c73b20aecd [0,0,0,2,0,0|2,0,0]=4 24364 B13R2.5303 F[C@H]1C[C@H](C1)NCCC2CCC2 d06b5b58188b7d3fe6591105929ed683 [0,0,0,2,0,0|2,0,0]=4 24365 B13R2.5303 F[C@H]1C[C@H](C1)OCCC2CCC2 2d7a403d9fec3be1203ea32203d30e82 [0,0,0,2,0,0|2,0,0]=4 24366 B13R2.5303 OC1CC(C1)CNCC2CCC2 9d2f1435ed9ffcf95b91bcf3b29111d6 [0,0,0,2,0,0|1,0,0]=3 24367 B13R2.5303 OC1CC(C1)CNCC2CCO2 9a469e8261d196ba92a2a4201ced343e [0,0,0,2,0,0|2,0,0]=4 24368 B13R2.5303 OC1CC(C1)CNCC2COC2 34281c07519d6c35b09a81cc17ee4e31 [0,0,0,2,0,0|2,0,0]=4 24369 B13R2.5303 OC1CC(C1)CNC[C@@H]2CCO2 da5a89ae3707a1e12194e54cc9588457 [0,0,0,2,0,0|2,0,0]=4 24370 B13R2.5303 OC1CC(C1)CNC[C@H]2CCO2 2a78c2b92a10253edf9041ff3d816961 [0,0,0,2,0,0|2,0,0]=4 24371 B13R2.5303 OC1CC(C1)NCCC2CCC2 b3d134e8c367f942a92cc1c400c4f494 [0,0,0,2,0,0|1,0,0]=3 24372 B13R2.5303 OC1CC(C1)NCCC2CCO2 f3c9e564575d8c7ad1d29c005f92e4af [0,0,0,2,0,0|2,0,0]=4 24373 B13R2.5303 OC1CC(C1)NCCC2COC2 f7c62c8b4c5019f15f9bf74e1e40d7fc [0,0,0,2,0,0|2,0,0]=4 24374 B13R2.5303 OC1CC(C1)NCCN2CCC2 d60015a8d0eb9f90fd6e24892d0900e9 [0,0,0,2,0,0|2,0,0]=4 24375 B13R2.5303 OC1CC(C1)NCC[C@@H]2CCO2 d7e51d93beeaac5ab897a374f28080f4 [0,0,0,2,0,0|2,0,0]=4 24376 B13R2.5303 OC1CN(C1)CCNC2CCC2 68a23d9c62f097f2e8ac1e98699eabc6 [0,0,0,2,0,0|2,0,0]=4 24377 B13R2.5303 OC1CN(C1)CCOC2CCC2 6a0094184d9a3e50d0f9eac47f56628b [0,0,0,2,0,0|2,0,0]=4 24378 B13R2.5303 O[C@H]1C[C@@H](C1)CNCC2CCC2 3a97d25e4205363dd3d00541786e5442 [0,0,0,2,0,0|1,0,0]=3 24379 B13R2.5303 O[C@H]1C[C@@H](C1)CNCC2CCO2 370e39809ad881acd196262b25d973e2 [0,0,0,2,0,0|2,0,0]=4 24380 B13R2.5303 O[C@H]1C[C@@H](C1)CNCC2COC2 57cb1fa80eaaa4c27b9e8112309b7253 [0,0,0,2,0,0|2,0,0]=4 24381 B13R2.5303 O[C@H]1C[C@@H](C1)CNC[C@@H]2CCO2 5000a0705700386cb8d7f1b7dd6f0dfe [0,0,0,2,0,0|2,0,0]=4 24382 B13R2.5303 O[C@H]1C[C@@H](C1)CNC[C@H]2CCO2 406d79fcfb12e2a4d361e9651efa82d5 [0,0,0,2,0,0|2,0,0]=4 24383 B13R2.5303 O[C@H]1C[C@@H](C1)NCCC2CCC2 c3d339312cc17e0ebcb112ac17a88305 [0,0,0,2,0,0|1,0,0]=3 24384 B13R2.5303 O[C@H]1C[C@@H](C1)NCCC2CCO2 357b972c89031f4b81d1258b4fffb4b6 [0,0,0,2,0,0|2,0,0]=4 24385 B13R2.5303 O[C@H]1C[C@@H](C1)NCCC2COC2 d72e965d01664ea8e377031161e6ab6c [0,0,0,2,0,0|2,0,0]=4 24386 B13R2.5303 O[C@H]1C[C@H](C1)CNCC2CCC2 bf51f9c52315396bc8e2097a0bfc5cd8 [0,0,0,2,0,0|1,0,0]=3 24387 B13R2.5303 O[C@H]1C[C@H](C1)CNCC2CCO2 35023feaeaf4378ad226e7214f759d03 [0,0,0,2,0,0|2,0,0]=4 24388 B13R2.5303 O[C@H]1C[C@H](C1)CNCC2COC2 dd5104ea33f7bff17546fe5320bd6355 [0,0,0,2,0,0|2,0,0]=4 24389 B13R2.5303 O[C@H]1C[C@H](C1)CNC[C@@H]2CCO2 8d8cfba9614a4091a27acda59bae7ceb [0,0,0,2,0,0|2,0,0]=4 24390 B13R2.5303 O[C@H]1C[C@H](C1)CNC[C@H]2CCO2 1227a9914c6cc04541064024661e525f [0,0,0,2,0,0|2,0,0]=4 24391 B13R2.5303 O[C@H]1C[C@H](C1)NCCC2CCC2 e0084189ee0579bc42fbb5eb96af1473 [0,0,0,2,0,0|1,0,0]=3 24392 B13R2.5303 O[C@H]1C[C@H](C1)NCCC2CCO2 cdae7289a30f5b9a28cb503851f22af2 [0,0,0,2,0,0|2,0,0]=4 24393 B13R2.5303 O[C@H]1C[C@H](C1)NCCC2COC2 6bb73fa0e69d0565b078d0ad6e3c5cd4 [0,0,0,2,0,0|2,0,0]=4 24394 B13R2.72 CC(C)N1CCC2C1CCCC2 f4bcdeaa88f655355713c0edb9e4206b [0,0,0,2,0,0|2,0,0]=4 24395 B13R2.545 CC(C)NC1CCCCC12CC2 cf944f144402536a833a1097dd19c0bd [0,0,0,2,0,0|2,0,0]=4 24396 B13R2.545 CC(C)OC1CCCCC12CC2 31f566d9ae8174229cccc93f16857e00 [0,0,0,2,0,0|2,0,0]=4 24397 B13R2.545 CC(O)CN1CCOCC12CC2 0a77c464fa2e39761350c6036c01227e [0,0,0,2,0,0|2,0,0]=4 24398 B13R2.545 C[C@@H](O)CN1CCOCC12CC2 ea20f85dd978127d4aebd10b321795a3 [0,0,0,2,0,0|2,0,0]=4 24399 B13R2.545 C[C@H](O)CN1CCOCC12CC2 4b5b3b17ba13966e266962a43325c9d8 [0,0,0,2,0,0|2,0,0]=4 24400 B13R2.621 CCC1CCCCC1OC2CC2 8c65d1661f09e8c07c3b311f3bcca2e1 [0,0,0,2,0,0|2,0,0]=4 24401 B13R2.621 CCC1CCCCN1CC2CC2 ab406c769338a461f213b7ff636abc88 [0,0,0,2,0,0|2,0,0]=4 24402 B13R2.621 CC[C@@H]1CCCCN1CC2CC2 30ae990104976421399ac2eb6976a16f [0,0,0,2,0,0|2,0,0]=4 24403 B13R2.621 CC[C@H]1CCCCN1CC2CC2 e8550779b63c66e8e5d4e91e008c7f2b [0,0,0,2,0,0|2,0,0]=4 24404 B13R2.689 CC(C)CN1C2CCCC1CC2 3d52283a00370bee3e700be1e8b47d3f [0,0,0,2,0,0|2,0,0]=4 24405 B13R2.689 CC(C)CN1[C@@H]2CCC[C@H]1CC2 794b7dc595964b3ba9b6754284d5ec9c [0,0,0,2,0,0|2,0,0]=4 24406 B13R2.689 CC(O)CN1C2CCC1COC2 7210d87f1784d66e9687e4371f00b314 [0,0,0,2,0,0|2,0,0]=4 24407 B13R2.689 CC(O)CN1C2CCCC1CC2 92558ffbcbbeaeeda90ae4d2777b4e65 [0,0,0,2,0,0|1,0,0]=3 24408 B13R2.689 CC(O)CN1[C@@H]2CCC[C@H]1CC2 5fdc163bb206575cccd4894a02f4a77a [0,0,0,2,0,0|1,0,0]=3 24409 B13R2.689 CC(O)CN1[C@@H]2CC[C@H]1COC2 3926f82d015cd76eb8c27743d450e532 [0,0,0,2,0,0|2,0,0]=4 24410 B13R2.689 C[C@@H](O)CN1C2CCC1COC2 bd36940a9c41f6d4bfc1452603b601d7 [0,0,0,2,0,0|2,0,0]=4 24411 B13R2.689 C[C@@H](O)CN1C2CCCC1CC2 30114c5cc2eee6afb7fa088c15cb9591 [0,0,0,2,0,0|1,0,0]=3 24412 B13R2.689 C[C@@H](O)CN1[C@@H]2CCC[C@H]1CC2 65dfb0d22ef1b14821caae24db5d8e38 [0,0,0,2,0,0|1,0,0]=3 24413 B13R2.689 C[C@@H](O)CN1[C@@H]2CC[C@H]1COC2 7fefed5b8354552aeacd3daac8f2bcc2 [0,0,0,2,0,0|2,0,0]=4 24414 B13R2.689 C[C@H](O)CN1C2CCC1COC2 a1ef69dd8613c80feb8beb5807748c0e [0,0,0,2,0,0|2,0,0]=4 24415 B13R2.689 C[C@H](O)CN1C2CCCC1CC2 b46bef2907ce84dee7506ca8bdc69c3d [0,0,0,2,0,0|1,0,0]=3 24416 B13R2.689 C[C@H](O)CN1[C@@H]2CCC[C@H]1CC2 2dd49fbfae44e7eae67b6d59fbc7665f [0,0,0,2,0,0|1,0,0]=3 24417 B13R2.689 C[C@H](O)CN1[C@@H]2CC[C@H]1COC2 2124bb6c746376945dbc98bf62bbdeb8 [0,0,0,2,0,0|2,0,0]=4 24418 B13R2.1282 CC(C)CN1CCC2CCC1C2 a820fdfda7031d0e1504d16538501db9 [0,0,0,2,0,0|2,0,0]=4 24419 B13R2.1282 CC(C)CN1CC[C@@H]2CC[C@H]1C2 dc3a071bcade715d34a5e0be9fed8348 [0,0,0,2,0,0|2,0,0]=4 24420 B13R2.1282 CC(O)CN1CCC2CCC1C2 3253df480bb6a54ed3ca69afdc25cf43 [0,0,0,2,0,0|1,0,0]=3 24421 B13R2.1282 CC(O)CN1CCN2CCC1C2 5082eb9fe6dc4c15300ba1f62cccfe96 [0,0,0,2,0,0|2,0,0]=4 24422 B13R2.1282 CC(O)CN1CCN2CC[C@@H]1C2 5e983125aa988da292354da748747036 [0,0,0,2,0,0|2,0,0]=4 24423 B13R2.1282 CC(O)CN1CC[C@@H]2CC[C@H]1C2 cf7bbc503aa4ef5fc868073e4092ff60 [0,0,0,2,0,0|1,0,0]=3 24424 B13R2.1282 C[C@@H](O)CN1CCC2CCC1C2 4aa4b41dbbd2c18cef9deebd1bc71ce9 [0,0,0,2,0,0|1,0,0]=3 24425 B13R2.1282 C[C@@H](O)CN1CCN2CCC1C2 1ffafa08f11f2050d5d0b8ca283a54eb [0,0,0,2,0,0|2,0,0]=4 24426 B13R2.1282 C[C@@H](O)CN1CCN2CC[C@@H]1C2 05f68c52f98f073378183b7467a72f01 [0,0,0,2,0,0|2,0,0]=4 24427 B13R2.1282 C[C@@H](O)CN1CC[C@@H]2CC[C@H]1C2 3fcecaca8fc7590ca8e77eb5bccf791b [0,0,0,2,0,0|1,0,0]=3 24428 B13R2.1282 C[C@H](O)CN1CCC2CCC1C2 7f3c9faa35210bc93f20556fe8d07e5b [0,0,0,2,0,0|1,0,0]=3 24429 B13R2.1282 C[C@H](O)CN1CCN2CCC1C2 74f68be8c56f3993ddb2ed3eec8a1d48 [0,0,0,2,0,0|2,0,0]=4 24430 B13R2.1282 C[C@H](O)CN1CCN2CC[C@@H]1C2 3421581c521d0f5043c5cbda656537e3 [0,0,0,2,0,0|2,0,0]=4 24431 B13R2.1282 C[C@H](O)CN1CC[C@@H]2CC[C@H]1C2 4bd428b6b6b28662958060e9c9a10758 [0,0,0,2,0,0|1,0,0]=3 24432 B13R2.1287 CC(C)CN1CC2CCC1CC2 9bfe81a2449e8ba39b23d3618350a753 [0,0,0,2,0,0|2,0,0]=4 24433 B13R2.1287 CC(C)CN1C[C@H]2CC[C@@H]1CC2 44a5765deb84a9a84c8b9ba0fe36cd9c [0,0,0,2,0,0|2,0,0]=4 24434 B13R2.1287 CC(C)OC1CC2CCC1CC2 875177cff134f836df7ea922ac9e6688 [0,0,0,2,0,0|2,0,0]=4 24435 B13R2.1287 CC(O)CN1CC2CCC1CC2 18c45cc7c59722c1bda37af339ce1fdf [0,0,0,2,0,0|1,0,0]=3 24436 B13R2.1287 CC(O)CN1C[C@H]2CC[C@@H]1CC2 dbb678279704d4d6d1271794531c419d [0,0,0,2,0,0|1,0,0]=3 24437 B13R2.1287 C[C@@H](O)CN1CC2CCC1CC2 e010e7fc5bdc5ea5acc422a5b328d20f [0,0,0,2,0,0|1,0,0]=3 24438 B13R2.1287 C[C@@H](O)CN1C[C@H]2CC[C@@H]1CC2 3084d1a646eff2ff1e80865bba0a0cc8 [0,0,0,2,0,0|1,0,0]=3 24439 B13R2.1287 C[C@H](O)CN1CC2CCC1CC2 31bfdd08e8b99a5ac2b72257938e9f9a [0,0,0,2,0,0|1,0,0]=3 24440 B13R2.1287 C[C@H](O)CN1C[C@H]2CC[C@@H]1CC2 4f159764ab3d2514c73391c4b6907a85 [0,0,0,2,0,0|1,0,0]=3 24441 B13R2.2377 CCN1C2CCCC1CC(C2)O f01447be626a52a2f2b5526aac1d8ee9 [0,0,0,2,0,0|1,0,0]=3 24442 B13R2.2377 CCN1[C@@H]2CCC[C@H]1C[C@@H](C2)O 5442c07c08a5243fdf657a4b39da3639 [0,0,0,2,0,0|1,0,0]=3 24443 B13R2.2377 CCN1[C@@H]2CCC[C@H]1C[C@H](C2)O 0e05baf85e7c0d1ab51ad36fee9e29f3 [0,0,0,2,0,0|1,0,0]=3 24444 B13R2.2377 OC1CC2CCCC(C1)N2CF d23de58bfe091c62a9d4ab7d7c96a9ca [0,0,0,2,0,0|2,0,0]=4 24445 B13R2.2377 OCN1C2CCCC1CC(C2)O d494827f5ba4feee1f7674219e4b22c0 [0,0,0,2,0,0|2,0,0]=4 24446 B13R2.2377 OCN1[C@@H]2CCC[C@H]1C[C@@H](C2)O 3f7d86cae2663cd83860996af782ce01 [0,0,0,2,0,0|2,0,0]=4 24447 B13R2.2377 OCN1[C@@H]2CCC[C@H]1C[C@H](C2)O c3c271c6c9fecdd8a73106244c883d7c [0,0,0,2,0,0|2,0,0]=4 24448 B13R2.2377 O[C@@H]1C[C@H]2CCC[C@@H](C1)N2CF 2adf32606c140530d62dea80a9628ad5 [0,0,0,2,0,0|2,0,0]=4 24449 B13R2.2377 O[C@H]1C[C@H]2CCC[C@@H](C1)N2CF 9af545c71d665e1bd1008cb2d8101285 [0,0,0,2,0,0|2,0,0]=4 24450 B13R2.2887 CC(O)CN1C[C@H]2C[C@H]2[C@H]1CO 5ebe7226d737d00e5baa3402fe867aaa [0,0,0,2,0,0|2,0,0]=4 24451 B13R2.2887 C[C@@H](O)CN1C[C@H]2C[C@H]2[C@H]1CO b2d57b25d63f4f605fc0d5a039fe5a67 [0,0,0,2,0,0|2,0,0]=4 24452 B13R2.2887 C[C@H](O)CN1C[C@H]2C[C@H]2[C@H]1CO c15b13a8ff1f3e2079f5c3c1764e44a3 [0,0,0,2,0,0|2,0,0]=4 24453 B13R2.430 CC(C)N1CC[C@H]2CCC[C@H]2C1 d974a712a83bbab9e6c66ea294edc1c5 [0,0,0,2,0,0|2,0,0]=4 24454 B13R2.687 CC(C)N[C@@H]1CC[C@@H]2[C@H]1CCC2 0f0f392f5e1929839f4c38b0cb4c9070 [0,0,0,2,0,0|2,0,0]=4 24455 B13R2.687 CC(C)N[C@H]1CC[C@H]2[C@@H]1CCC2 28a5d92b5355d52863b4ea8a40918dc5 [0,0,0,2,0,0|2,0,0]=4 24456 B13R2.1264 CC(C)CCN1C2CCC1CC2 43178155234b659f2480b54dcc4bd10b [0,0,0,2,0,0|2,0,0]=4 24457 B13R2.1264 CC(C)CCN1[C@H]2CC[C@@H]1CC2 42c7d4191a70ccd53988760025dc3334 [0,0,0,2,0,0|2,0,0]=4 24458 B13R2.1264 CC(C)CNC1C2CCC1CC2 8cb99f2209057f3721858df724add3c2 [0,0,0,2,0,0|2,0,0]=4 24459 B13R2.1264 CC(C)COC1C2CCC1CC2 6b36d54672d2f71c997c2c7672500283 [0,0,0,2,0,0|2,0,0]=4 24460 B13R2.1264 CC(F)COC1C2CCC1CC2 6ea448c1abc8b7b050e1cc111c147592 [0,0,0,2,0,0|2,0,0]=4 24461 B13R2.1264 CC(O)CCN1C2CCC1CC2 5a97b9ce97cfe4a655c815aeb4184e55 [0,0,0,2,0,0|1,0,0]=3 24462 B13R2.1264 CC(O)CCN1[C@H]2CC[C@@H]1CC2 18f9f7fd5baccee6fe1e8698c5118482 [0,0,0,2,0,0|1,0,0]=3 24463 B13R2.1264 CC(O)CNC1C2CCC1CC2 387a6d7f9497a784da557eddb1f96a77 [0,0,0,2,0,0|1,0,0]=3 24464 B13R2.1264 CC(S)COC1C2CCC1CC2 b03c6a388186a96dc5c953e1b3cf2db1 [0,0,0,2,0,0|1,1,0]=4 24465 B13R2.1264 C[C@@H](F)COC1C2CCC1CC2 1f234e5614f24a7175919d8b3a3386af [0,0,0,2,0,0|2,0,0]=4 24466 B13R2.1264 C[C@@H](O)CNC1C2CCC1CC2 35f0eb1a9b9b4e12c80b80d77a26a9cf [0,0,0,2,0,0|1,0,0]=3 24467 B13R2.1264 C[C@H](F)COC1C2CCC1CC2 d5ce7de780b482d244ea0ce4653ef7d5 [0,0,0,2,0,0|2,0,0]=4 24468 B13R2.1264 C[C@H](O)CNC1C2CCC1CC2 ef9fef3a9641c1ad3abcdca6f3892398 [0,0,0,2,0,0|1,0,0]=3 24469 B13R2.1650 CCC1CCCN1CCC2CC2 8589038d643bfca0a14bb3fdf5f44b22 [0,0,0,2,0,0|2,0,0]=4 24470 B13R2.1650 CC[C@@H]1CCCN1CCC2CC2 7e11c787e7eb6bb30259390bcf8a1211 [0,0,0,2,0,0|2,0,0]=4 24471 B13R2.1650 CC[C@@H]1CCC[C@H]1NCC2CC2 d7fa53360fb10fbe2c3aec868fbb99a6 [0,0,0,2,0,0|2,0,0]=4 24472 B13R2.2612 CCC1CCCN1C2CC2(C)C 8eb89ba6cb826e1628aa2f4745053b07 [0,0,0,2,0,0|2,0,0]=4 24473 B13R2.2612 CC[C@@H]1CCCN1C2CC2(C)C 803720793e0f69b46d6a47c80445dae4 [0,0,0,2,0,0|2,0,0]=4 24474 B13R2.3156 CC(C)COC1CCCC12CC2 5a1250caaac57b99d5bdc81f9d425382 [0,0,0,2,0,0|2,0,0]=4 24475 B13R2.3156 CC(C)CO[C@@H]1CCCC12CC2 db27795f160f2ec3c265e1f3b54976a9 [0,0,0,2,0,0|2,0,0]=4 24476 B13R2.5551 CC(C)CCN1CC2CCC1C2 3d5b0f5b42a6f9e713263cbfe47431c9 [0,0,0,2,0,0|2,0,0]=4 24477 B13R2.5551 CC(C)CCN1C[C@@H]2CC[C@H]1C2 6fc743c7978869f84c7b6a90e3327e72 [0,0,0,2,0,0|2,0,0]=4 24478 B13R2.5551 CC(C)CCN1C[C@H]2CC[C@@H]1C2 0d9c730f8947480e26d42a37e715cb14 [0,0,0,2,0,0|2,0,0]=4 24479 B13R2.5551 CC(C)CNC1CC2CCC1C2 39da1c4dc6ac1447607431fd0831151b [0,0,0,2,0,0|2,0,0]=4 24480 B13R2.5551 CC(C)CNC1C[C@@H]2CC[C@H]1C2 5bcf0717fa9cfbff9968a9343bf618c4 [0,0,0,2,0,0|2,0,0]=4 24481 B13R2.5551 CC(C)CNC1C[C@H]2CC[C@@H]1C2 5befc431c1de5ca67430f22b9b338b83 [0,0,0,2,0,0|2,0,0]=4 24482 B13R2.5551 CC(C)CN[C@@H]1C[C@H]2CC[C@@H]1C2 fdb62bf09ca7a234c2276535e79d6609 [0,0,0,2,0,0|2,0,0]=4 24483 B13R2.5551 CC(C)CN[C@H]1C[C@@H]2CC[C@H]1C2 735d475755b523431fb616a2397d10b6 [0,0,0,2,0,0|2,0,0]=4 24484 B13R2.5551 CC(C)CN[C@H]1C[C@H]2CC[C@@H]1C2 1225189531974f3719c1dd8523101f89 [0,0,0,2,0,0|2,0,0]=4 24485 B13R2.5551 CC(C)COC1CC2CCC1C2 f45a5ff150fc7c813578189fce0216a5 [0,0,0,2,0,0|2,0,0]=4 24486 B13R2.5551 CC(C)COC1C[C@@H]2CC[C@H]1C2 c30c2adbcd6a7768290a268df1bd47f9 [0,0,0,2,0,0|2,0,0]=4 24487 B13R2.5551 CC(C)COC1C[C@H]2CC[C@@H]1C2 f8a21680d1bf6760a5dff06150837aec [0,0,0,2,0,0|2,0,0]=4 24488 B13R2.5551 CC(C)CO[C@@H]1C[C@H]2CC[C@@H]1C2 5dcd6d0534968a325f80a0b313a677fa [0,0,0,2,0,0|2,0,0]=4 24489 B13R2.5551 CC(C)CO[C@H]1C[C@@H]2CC[C@H]1C2 3ebb3672d97c59c2dbf101bdf44b7999 [0,0,0,2,0,0|2,0,0]=4 24490 B13R2.5551 CC(C)CO[C@H]1C[C@H]2CC[C@@H]1C2 cfd90dc24ed59b667d50bcacec66fcde [0,0,0,2,0,0|2,0,0]=4 24491 B13R2.5551 CC(C)OCC1CC2CCC1C2 20850afdea698def4ea5b7f4ca9c0a60 [0,0,0,2,0,0|2,0,0]=4 24492 B13R2.5551 CC(F)COC1CC2CCC1C2 c82f3889ae275435ab5bec96c6ffc581 [0,0,0,2,0,0|2,0,0]=4 24493 B13R2.5551 CC(F)COC1C[C@H]2CC[C@@H]1C2 50ca00307d403efd778b09856c8a68a4 [0,0,0,2,0,0|2,0,0]=4 24494 B13R2.5551 CC(F)CO[C@H]1C[C@@H]2CC[C@H]1C2 c192f5becc5c9448271ec2c14f1eff5d [0,0,0,2,0,0|2,0,0]=4 24495 B13R2.5551 CC(O)CCN1CC2CC1CO2 8eeb902f918426ae94365a61dab689c4 [0,0,0,2,0,0|2,0,0]=4 24496 B13R2.5551 CC(O)CCN1CC2CCC1C2 6fdb0b2925702e41eb89262692103dcd [0,0,0,2,0,0|1,0,0]=3 24497 B13R2.5551 CC(O)CCN1C[C@@H]2CC[C@H]1C2 cbaf7be21b90bc181f5d625357e5044e [0,0,0,2,0,0|1,0,0]=3 24498 B13R2.5551 CC(O)CCN1C[C@@H]2C[C@H]1CO2 2a92b60fa454dc4635fb205cd0dade7d [0,0,0,2,0,0|2,0,0]=4 24499 B13R2.5551 CC(O)CCN1C[C@H]2CC[C@@H]1C2 289d640b781e3c2844b2f30e36340195 [0,0,0,2,0,0|1,0,0]=3 24500 B13R2.5551 CC(O)CCN1C[C@H]2C[C@@H]1CO2 2315f260626ede2d90919ff66969b45e [0,0,0,2,0,0|2,0,0]=4 24501 B13R2.5551 CC(O)CNC1CC2CCC1C2 8eddc09b2fcc0c1dbebf96c8babc25a7 [0,0,0,2,0,0|1,0,0]=3 24502 B13R2.5551 CC(O)CNC1C[C@@H]2CC[C@H]1C2 f6e8c3cb1f6447efd55fcf136af8fea5 [0,0,0,2,0,0|1,0,0]=3 24503 B13R2.5551 CC(O)CNC1C[C@H]2CC[C@@H]1C2 6b7c634c396c38191db3635d4f8ce1cd [0,0,0,2,0,0|1,0,0]=3 24504 B13R2.5551 CC(O)CN[C@@H]1CN2CC[C@H]1C2 c8040b6d85ad44aeb5417bfa922aa1cc [0,0,0,2,0,0|2,0,0]=4 24505 B13R2.5551 CC(O)CN[C@@H]1C[C@H]2CC[C@@H]1C2 8b6e7216639c2d3b65bd99eb76d5c874 [0,0,0,2,0,0|1,0,0]=3 24506 B13R2.5551 CC(O)CN[C@@H]1C[N@]2CC[C@@H]1C2 3e533228770b78d07aab72452869583e [0,0,0,2,0,0|2,0,0]=4 24507 B13R2.5551 CC(O)CN[C@H]1CN2CC[C@H]1C2 f16d81a9cdc30b1690388fd958941a24 [0,0,0,2,0,0|2,0,0]=4 24508 B13R2.5551 CC(O)CN[C@H]1C[C@@H]2CC[C@H]1C2 6d2edbf391d3a4c868c9b56c18b8456c [0,0,0,2,0,0|1,0,0]=3 24509 B13R2.5551 CC(O)CN[C@H]1C[C@H]2CC[C@@H]1C2 d6705f429652224f756dc2a5995d1f7c [0,0,0,2,0,0|1,0,0]=3 24510 B13R2.5551 CC(O)CN[C@H]1C[N@]2CC[C@@H]1C2 3a2b496ac526f4262fd2fadf6c4daa09 [0,0,0,2,0,0|2,0,0]=4 24511 B13R2.5551 CC(S)COC1CC2CCC1C2 f8cb892852c8a8134cc2be65978a4949 [0,0,0,2,0,0|1,1,0]=4 24512 B13R2.5551 CC(S)COC1C[C@H]2CC[C@@H]1C2 6474af6b6b81b286e44d0d0a96b8c95b [0,0,0,2,0,0|1,1,0]=4 24513 B13R2.5551 CC(S)CO[C@H]1C[C@@H]2CC[C@H]1C2 cd7fcafa7a3476353fb1809f48dcc586 [0,0,0,2,0,0|1,1,0]=4 24514 B13R2.5551 C[C@@H](F)COC1CC2CCC1C2 36fac83c5ae22e3c9b80d542ce427ec2 [0,0,0,2,0,0|2,0,0]=4 24515 B13R2.5551 C[C@@H](F)COC1C[C@H]2CC[C@@H]1C2 c2ef0a3724a654e06b8ee011bad704a8 [0,0,0,2,0,0|2,0,0]=4 24516 B13R2.5551 C[C@@H](F)CO[C@H]1C[C@@H]2CC[C@H]1C2 0de868c23d965948113e4e585d3f79ed [0,0,0,2,0,0|2,0,0]=4 24517 B13R2.5551 C[C@@H](O)CNC1CC2CCC1C2 dab46720f27d5e0dc0473539c2210769 [0,0,0,2,0,0|1,0,0]=3 24518 B13R2.5551 C[C@@H](O)CNC1C[C@@H]2CC[C@H]1C2 8501c61cad722eb246f4af066fbdf9b5 [0,0,0,2,0,0|1,0,0]=3 24519 B13R2.5551 C[C@@H](O)CNC1C[C@H]2CC[C@@H]1C2 465584cb5f8f14809f528e5ae865aa0d [0,0,0,2,0,0|1,0,0]=3 24520 B13R2.5551 C[C@@H](O)CN[C@@H]1CN2CC[C@H]1C2 902fe1e3b32c2e5df4e7c05dce49b145 [0,0,0,2,0,0|2,0,0]=4 24521 B13R2.5551 C[C@@H](O)CN[C@@H]1C[C@H]2CC[C@@H]1C2 ac4d67582afee0a37bb286c9408ea473 [0,0,0,2,0,0|1,0,0]=3 24522 B13R2.5551 C[C@@H](O)CN[C@@H]1C[N@]2CC[C@@H]1C2 acc4b5e827131036203c87e0fdd645fe [0,0,0,2,0,0|2,0,0]=4 24523 B13R2.5551 C[C@@H](O)CN[C@H]1CN2CC[C@H]1C2 9bcc04ebff23988cf9e56485720f4526 [0,0,0,2,0,0|2,0,0]=4 24524 B13R2.5551 C[C@@H](O)CN[C@H]1C[C@@H]2CC[C@H]1C2 35464f8ff5b7611b5bd45bea0c836f10 [0,0,0,2,0,0|1,0,0]=3 24525 B13R2.5551 C[C@@H](O)CN[C@H]1C[C@H]2CC[C@@H]1C2 f8b5fcf8e2d0ab0d9165f58fd7eaf6f2 [0,0,0,2,0,0|1,0,0]=3 24526 B13R2.5551 C[C@@H](O)CN[C@H]1C[N@]2CC[C@@H]1C2 c68f883206d88d63585c4bb3783e2b36 [0,0,0,2,0,0|2,0,0]=4 24527 B13R2.5551 C[C@H](F)COC1CC2CCC1C2 a8dd0d3ada83e8b724ef11be3758da2c [0,0,0,2,0,0|2,0,0]=4 24528 B13R2.5551 C[C@H](F)COC1C[C@H]2CC[C@@H]1C2 29d334ce435a2ed541325b9d55e3ac2c [0,0,0,2,0,0|2,0,0]=4 24529 B13R2.5551 C[C@H](F)CO[C@H]1C[C@@H]2CC[C@H]1C2 c8abab2ecdf12769baa6e2f465ba2b4d [0,0,0,2,0,0|2,0,0]=4 24530 B13R2.5551 C[C@H](O)CNC1CC2CCC1C2 8ed2461ea79d01e7988874a870871c1e [0,0,0,2,0,0|1,0,0]=3 24531 B13R2.5551 C[C@H](O)CNC1C[C@@H]2CC[C@H]1C2 624575dbae6deb21b0aad0b1e73affaf [0,0,0,2,0,0|1,0,0]=3 24532 B13R2.5551 C[C@H](O)CNC1C[C@H]2CC[C@@H]1C2 d4d35e9a785acd558ab0a8461eaddb6c [0,0,0,2,0,0|1,0,0]=3 24533 B13R2.5551 C[C@H](O)CN[C@@H]1CN2CC[C@H]1C2 28434fc4f2729ee9258635c6989560a6 [0,0,0,2,0,0|2,0,0]=4 24534 B13R2.5551 C[C@H](O)CN[C@@H]1C[C@H]2CC[C@@H]1C2 5af665898439f1b0724be393c4d9f7cc [0,0,0,2,0,0|1,0,0]=3 24535 B13R2.5551 C[C@H](O)CN[C@@H]1C[N@]2CC[C@@H]1C2 304caf94505f26fa74fe9721dc51255b [0,0,0,2,0,0|2,0,0]=4 24536 B13R2.5551 C[C@H](O)CN[C@H]1CN2CC[C@H]1C2 710bb786e4f6bc20f0d0097d4b0517b2 [0,0,0,2,0,0|2,0,0]=4 24537 B13R2.5551 C[C@H](O)CN[C@H]1C[C@@H]2CC[C@H]1C2 289ea7af30ef43df662e03b20717af8d [0,0,0,2,0,0|1,0,0]=3 24538 B13R2.5551 C[C@H](O)CN[C@H]1C[C@H]2CC[C@@H]1C2 6d2ffd835063c39f9ef9291902409cca [0,0,0,2,0,0|1,0,0]=3 24539 B13R2.5551 C[C@H](O)CN[C@H]1C[N@]2CC[C@@H]1C2 fafb732d1b75c8ed8aeb96a6b004e4ec [0,0,0,2,0,0|2,0,0]=4 24540 B13R2.377 CC1CC1N[C@H]2CCCC[C@H]2C f143e637d95392ac0c1baae50347e51a [0,0,0,2,0,0|2,0,0]=4 24541 B13R2.377 C[C@@H]1CCCC[C@@H]1N[C@@H]2C[C@H]2F 11b6edf304ada02749fe7e49976ea52e [0,0,0,2,0,0|2,0,0]=4 24542 B13R2.377 C[C@@H]1CCCC[C@@H]1N[C@H]2C[C@@H]2F f83dafe4c7765b89b5dc0c1c35ec5651 [0,0,0,2,0,0|2,0,0]=4 24543 B13R2.377 C[C@@H]1CCCC[C@@H]1N[C@H]2C[C@H]2F 8d34a4c0f2d92702e8b3d7530aa31803 [0,0,0,2,0,0|2,0,0]=4 24544 B13R2.435 CC(C)N1CC2CCCCC2C1 daa1d585a0231e50aebc5f2d5ad2cec0 [0,0,0,2,0,0|2,0,0]=4 24545 B13R2.435 CC(C)N1C[C@H]2CCCC[C@H]2C1 6134706e678a8be02164ad3b045a4d1d [0,0,0,2,0,0|2,0,0]=4 24546 B13R2.1263 CC(O)CCN1C2COCC1C2 a584fe2aa521d77723df5cae8659b539 [0,0,0,2,0,0|2,0,0]=4 24547 B13R2.3571 C[C@@H]1CCCC[C@@H]1N2CC2(C)C e4bb1d4196509abc5612db03ee9b2953 [0,0,0,2,0,0|2,0,0]=4 24548 B13R2.3587 CC1CCCCC1CNC2CC2 2a27bc76b537009a513ed95fa118cec2 [0,0,0,2,0,0|2,0,0]=4 24549 B13R2.3587 CC1CCCCC1NCC2CC2 53bc7ef8e75adf7922c6bf9f0b9556d5 [0,0,0,2,0,0|2,0,0]=4 24550 B13R2.3587 CC1CCCCC1OCC2CC2 ae4ff6cc3fde7fb6288adfee1037e585 [0,0,0,2,0,0|2,0,0]=4 24551 B13R2.3587 CC1CCCCN1CCC2CC2 797308c215a997012693bfefebefe391 [0,0,0,2,0,0|2,0,0]=4 24552 B13R2.3587 C[C@@H]1CCCCN1CCC2CC2 12be181f75c6980723cdb81f9e63ea95 [0,0,0,2,0,0|2,0,0]=4 24553 B13R2.3587 C[C@@H]1CCCC[C@@H]1NCC2CC2 85a665bb6f7d049b421a3d05be23dbd8 [0,0,0,2,0,0|2,0,0]=4 24554 B13R2.3587 C[C@@H]1CCCC[C@@H]1OCC2CC2 5114bb1957331def012d046dc2fa0655 [0,0,0,2,0,0|2,0,0]=4 24555 B13R2.3587 C[C@@H]1CCCC[C@H]1NCC2CC2 9fc9283b98ec9bad06d944d4d193b6d3 [0,0,0,2,0,0|2,0,0]=4 24556 B13R2.3587 C[C@H]1CCCCN1CCC2CC2 5d7b354962f8b010911a9d164ac687b7 [0,0,0,2,0,0|2,0,0]=4 24557 B13R2.3587 C[C@H]1CCCC[C@@H]1NCC2CC2 16654a174a5ffcce392208b5a71a1f75 [0,0,0,2,0,0|2,0,0]=4 24558 B13R2.3587 C[C@H]1CCCC[C@@H]1OCC2CC2 0a93aa2d5435145d1a109e72aeb64d9e [0,0,0,2,0,0|2,0,0]=4 24559 B13R2.3587 C[C@H]1CCCC[C@H]1NCC2CC2 c6ed32f9eb005aff66cbdf9dd4272d61 [0,0,0,2,0,0|2,0,0]=4 24560 B13R2.3587 C[C@H]1CCCC[C@H]1OCC2CC2 8a5c444bcc57d38e578e810698b21b13 [0,0,0,2,0,0|2,0,0]=4 24561 B13R2.5881 CC(C)CN1CC2C1CCCC2 3de10c30bf79e71b470a048bc927d888 [0,0,0,2,0,0|2,0,0]=4 24562 B13R2.5881 CC(C)CN1C[C@@H]2[C@H]1CCCC2 1a7b2c8a24522cf7013f6ea82b5dc118 [0,0,0,2,0,0|2,0,0]=4 24563 B13R2.5881 CC(O)CN1CC2C1CCCC2 c3be39d0e7244f33803248f258d14161 [0,0,0,2,0,0|1,0,0]=3 24564 B13R2.5881 CC(O)CN1C[C@@H]2[C@H]1CCCC2 9184be6451954eac11fa5ea71d236c08 [0,0,0,2,0,0|1,0,0]=3 24565 B13R2.5881 C[C@@H](O)CN1CC2C1CCCC2 36db9075f1eaf1db17572f8791adfba8 [0,0,0,2,0,0|1,0,0]=3 24566 B13R2.5881 C[C@@H](O)CN1C[C@@H]2[C@H]1CCCC2 abdace7fd17923028e55c7300aba9f3b [0,0,0,2,0,0|1,0,0]=3 24567 B13R2.5881 C[C@H](O)CN1CC2C1CCCC2 0266603300a65e2d77718eeed3f7f3f9 [0,0,0,2,0,0|1,0,0]=3 24568 B13R2.5881 C[C@H](O)CN1C[C@@H]2[C@H]1CCCC2 f1bd36d1cde649b116d29c183e2b220a [0,0,0,2,0,0|1,0,0]=3 24569 B13R2.13856 CC(O)CCN1CCOC2C1C2 5dd78693e81e576fa75ebb8c617b409d [0,0,0,2,0,0|2,0,0]=4 24570 B13R2.543 CC(C)CN1CC2CCCC2C1 0ca3ef9a15dbbfad8cb01bfbe6720b4a [0,0,0,2,0,0|2,0,0]=4 24571 B13R2.543 CC(C)CN1C[C@H]2CCC[C@H]2C1 6fa332a6afa0f35c5f6a34644bb2bb95 [0,0,0,2,0,0|2,0,0]=4 24572 B13R2.543 CC(O)CN1CC2CCCC2C1 3e46c2122d3909da9ce59943a75e8b51 [0,0,0,2,0,0|1,0,0]=3 24573 B13R2.543 CC(O)CN1CC2CCOC2C1 66d3a0da41d68ef7649a40defa092601 [0,0,0,2,0,0|2,0,0]=4 24574 B13R2.543 CC(O)CN1CC2COCC2C1 e0756c8d0fb1daed1cf37e9ded27605b [0,0,0,2,0,0|2,0,0]=4 24575 B13R2.543 CC(O)CN1C[C@@H]2COC[C@H]2C1 c1cc789c345b8f8121f4b25f8abadbe2 [0,0,0,2,0,0|2,0,0]=4 24576 B13R2.543 CC(O)CN1C[C@H]2CCC[C@H]2C1 f585b34151c2b38ff78e4650e182f857 [0,0,0,2,0,0|1,0,0]=3 24577 B13R2.543 CC(O)CN1C[C@H]2COC[C@@H]2C1 541bdfcfdc9b83fdd891516d02daa5ab [0,0,0,2,0,0|2,0,0]=4 24578 B13R2.543 CC(O)CN1C[C@H]2COC[C@H]2C1 56a42b2b64dded8c0ce0955ee8937a76 [0,0,0,2,0,0|2,0,0]=4 24579 B13R2.543 C[C@@H](O)CN1CC2CCCC2C1 95bb2015030ed2258f5e53c71a31bf31 [0,0,0,2,0,0|1,0,0]=3 24580 B13R2.543 C[C@@H](O)CN1CC2CCOC2C1 8b8a2280bcfea9fc5bc2b358655daffa [0,0,0,2,0,0|2,0,0]=4 24581 B13R2.543 C[C@@H](O)CN1CC2COCC2C1 44d112ce36df2fa78f4bbf22a125b81b [0,0,0,2,0,0|2,0,0]=4 24582 B13R2.543 C[C@@H](O)CN1C[C@@H]2COC[C@H]2C1 c15ce719926c363918058bf50e5b0965 [0,0,0,2,0,0|2,0,0]=4 24583 B13R2.543 C[C@@H](O)CN1C[C@H]2CCC[C@H]2C1 f848d5f193b759b3d32b62e913edab27 [0,0,0,2,0,0|1,0,0]=3 24584 B13R2.543 C[C@@H](O)CN1C[C@H]2COC[C@@H]2C1 c28d9f22761375fbc084fe70fd6b91e4 [0,0,0,2,0,0|2,0,0]=4 24585 B13R2.543 C[C@@H](O)CN1C[C@H]2COC[C@H]2C1 3948ba233fa7868328906b24705070f1 [0,0,0,2,0,0|2,0,0]=4 24586 B13R2.543 C[C@H](O)CN1CC2CCCC2C1 9b16a4e3f21d74b84d44bd03fc459418 [0,0,0,2,0,0|1,0,0]=3 24587 B13R2.543 C[C@H](O)CN1CC2CCOC2C1 9f1b5018cc29c2b7621c1c690d77870d [0,0,0,2,0,0|2,0,0]=4 24588 B13R2.543 C[C@H](O)CN1CC2COCC2C1 ad3097ff3cb39e49ca7e0e00768a080e [0,0,0,2,0,0|2,0,0]=4 24589 B13R2.543 C[C@H](O)CN1C[C@@H]2COC[C@H]2C1 8d37bdbc0d05c343c7046be1607a7451 [0,0,0,2,0,0|2,0,0]=4 24590 B13R2.543 C[C@H](O)CN1C[C@H]2CCC[C@H]2C1 5462bcfffed7ca4aaea4975156420dc8 [0,0,0,2,0,0|1,0,0]=3 24591 B13R2.543 C[C@H](O)CN1C[C@H]2COC[C@@H]2C1 24efcc66d9b02bdc3ad14932342e96bb [0,0,0,2,0,0|2,0,0]=4 24592 B13R2.543 C[C@H](O)CN1C[C@H]2COC[C@H]2C1 2521fc4530ee1d939156333359ed702d [0,0,0,2,0,0|2,0,0]=4 24593 B13R2.1269 CC(C)CCCN1CC2CC1C2 2079f4e49861b0200877e7a026bc8f19 [0,0,0,2,0,0|2,0,0]=4 24594 B13R2.1269 CC(O)CCCN1CC2CC1C2 7ecbcbcf56d8d5d644452497fd7f9d44 [0,0,0,2,0,0|1,0,0]=3 24595 B13R2.3140 CC1CCCC1COCC2CC2 dd28e3c014a520d6dfabc9dda0fe16ef [0,0,0,2,0,0|2,0,0]=4 24596 B13R2.3140 CC1CCCC1OCCC2CC2 09e4b9d4704a00276083b7c6674c63a0 [0,0,0,2,0,0|2,0,0]=4 24597 B13R2.3140 C[C@@H]1CCC[C@@H]1OCCC2CC2 b7fd73d9b3c18785aefffe09583a31cf [0,0,0,2,0,0|2,0,0]=4 24598 B13R2.3140 C[C@@H]1CCC[C@H]1OCCC2CC2 6714306fa166b9803e72d4c4f688beed [0,0,0,2,0,0|2,0,0]=4 24599 B13R2.3140 C[C@H]1CCC[C@@H]1OCCC2CC2 8107275de677e392c8fd0e163e6f7581 [0,0,0,2,0,0|2,0,0]=4 24600 B13R2.3140 C[C@H]1CCC[C@H]1OCCC2CC2 39b4d1743e37b2880d85e2a85da0aa9f [0,0,0,2,0,0|2,0,0]=4 24601 B13R2.4701 CC(O)CN1CC2CC1CC2O b8e38dd40c86531ee4365bed21a2df57 [0,0,0,2,0,0|2,0,0]=4 24602 B13R2.4701 CC(O)CN1CC2C[C@@H]1C[C@@H]2O 70cef0d75502aeacf48b5159a0acea4b [0,0,0,2,0,0|2,0,0]=4 24603 B13R2.4701 CC(O)CN1C[C@H]2C[C@@H]1CN2C 844b4ef7a0ec312ca816788d05bf11b3 [0,0,0,2,0,0|2,0,0]=4 24604 B13R2.4701 C[C@@H](O)CN1CC2CC1CC2O 0f8eed0dc42d3e25b86e1c2e14a07a78 [0,0,0,2,0,0|2,0,0]=4 24605 B13R2.4701 C[C@@H](O)CN1CC2C[C@@H]1C[C@@H]2O 7753bf6dbf0f88ccff13e9b71c2ba1bf [0,0,0,2,0,0|2,0,0]=4 24606 B13R2.4701 C[C@@H](O)CN1C[C@H]2C[C@@H]1CN2C cd83d357ff52035df1c1f61191761cac [0,0,0,2,0,0|2,0,0]=4 24607 B13R2.4701 C[C@H](O)CN1CC2CC1CC2O 4decbc6902f6273761d36e5daeaad6fb [0,0,0,2,0,0|2,0,0]=4 24608 B13R2.4701 C[C@H](O)CN1CC2C[C@@H]1C[C@@H]2O 2ca26b4c0e3349e3b3da402ac4d6ad35 [0,0,0,2,0,0|2,0,0]=4 24609 B13R2.4701 C[C@H](O)CN1C[C@H]2C[C@@H]1CN2C 73d96cc96d20fe10a82ee9e344ad8a1a [0,0,0,2,0,0|2,0,0]=4 24610 B13R2.4916 CC1CCCC1OC2CC2(C)C 8ad31112ac77e5410aa040a8664c301d [0,0,0,2,0,0|2,0,0]=4 24611 B13R2.4916 C[C@@H]1CCC[C@@H]1OC2CC2(C)C b7098102ef25b07b7c8d016ed4394f9c [0,0,0,2,0,0|2,0,0]=4 24612 B13R2.4916 C[C@@H]1CCC[C@H]1OC2CC2(C)C f0c0a6b25410fe5a96f059f08382a94e [0,0,0,2,0,0|2,0,0]=4 24613 B13R2.4916 C[C@H]1CCC[C@@H]1OC2CC2(C)C 6dea05e2e5cd1bbe49d61fa760a10f0d [0,0,0,2,0,0|2,0,0]=4 24614 B13R2.4916 C[C@H]1CCC[C@H]1OC2CC2(C)C 903ee24bcdc974d0fb36f6f67e3f7dfd [0,0,0,2,0,0|2,0,0]=4 24615 B13R2.5532 CC(C)CCN1CC2C1CCC2 415c174b573942f8970cafb6d24625b4 [0,0,0,2,0,0|2,0,0]=4 24616 B13R2.5532 CC(C)CCN1C[C@H]2[C@@H]1CCC2 a4fe1fa064aea5f536728346a53df85b [0,0,0,2,0,0|2,0,0]=4 24617 B13R2.5532 CC(O)CCN1CC2C1CCC2 3fe1021d7608a2aab7d43fdfa260f122 [0,0,0,2,0,0|1,0,0]=3 24618 B13R2.5532 CC(O)CCN1C[C@H]2[C@@H]1CCC2 1e3501090d8459c111032422e6a56711 [0,0,0,2,0,0|1,0,0]=3 24619 B13R2.13806 CC(C)CCCN1CCC2C1C2 3b0bfbdb2e096858c68d2221b69b9705 [0,0,0,2,0,0|2,0,0]=4 24620 B13R2.13806 CC(C)CCOC1CCC2C1C2 6989f8b7ceb585fb2e414b526eca1e47 [0,0,0,2,0,0|2,0,0]=4 24621 B13R2.13806 CC(C)CCO[C@@H]1CC[C@@H]2[C@H]1C2 44edf602b80cdd8dd65213f9720a6676 [0,0,0,2,0,0|2,0,0]=4 24622 B13R2.13806 CC(O)CCCN1CCC2C1C2 2ede7a5383af78a6e6719bfb4bdc3ece [0,0,0,2,0,0|1,0,0]=3 24623 B13R2.5542 CC(C)CCN1CCC2CC2C1 f38cc61e8500b59a97805a91f52066b0 [0,0,0,2,0,0|2,0,0]=4 24624 B13R2.5542 CC(C)CNC1CCC2CC2C1 c206d34a0bdd0e1a04418d5b0ec6f6d7 [0,0,0,2,0,0|2,0,0]=4 24625 B13R2.5542 CC(C)CN[C@@H]1CCC2CC2C1 f6cae6975463d69f09fda8785930d63f [0,0,0,2,0,0|2,0,0]=4 24626 B13R2.5542 CC(C)CN[C@H]1CCC2CC2C1 306cb296a192252bc5d2daa6585c5384 [0,0,0,2,0,0|2,0,0]=4 24627 B13R2.5542 CC(O)CCN1CCC2CC2C1 0c9f73a347a364b1657b0112c8f1863a [0,0,0,2,0,0|1,0,0]=3 24628 B13R2.5542 CC(O)CNC1CCC2CC2C1 1eca0a694f086ac52320e8885dc74882 [0,0,0,2,0,0|1,0,0]=3 24629 B13R2.5542 CC(O)CN[C@@H]1CCC2CC2C1 c8cafd18dc2aeffe6fb1f13aa1c79051 [0,0,0,2,0,0|1,0,0]=3 24630 B13R2.5542 CC(O)CN[C@H]1CCC2CC2C1 fd0e378bf9e1f3aa7a6fdc85441ce0a8 [0,0,0,2,0,0|1,0,0]=3 24631 B13R2.5542 C[C@@H](O)CNC1CCC2CC2C1 8459c4bb963bd929a514e94b57966ddc [0,0,0,2,0,0|1,0,0]=3 24632 B13R2.5542 C[C@@H](O)CN[C@@H]1CCC2CC2C1 df7f866ee5ffb15bf293b794aa739f1c [0,0,0,2,0,0|1,0,0]=3 24633 B13R2.5542 C[C@@H](O)CN[C@H]1CCC2CC2C1 0b8764abfb4b3f6ab99ba9b21d4aa5bd [0,0,0,2,0,0|1,0,0]=3 24634 B13R2.5542 C[C@H](O)CNC1CCC2CC2C1 5e6d0e52af43a8dd1a7d9f9cae3e21d4 [0,0,0,2,0,0|1,0,0]=3 24635 B13R2.5542 C[C@H](O)CN[C@@H]1CCC2CC2C1 5641b6da21a75276f62b774ad95114a2 [0,0,0,2,0,0|1,0,0]=3 24636 B13R2.5542 C[C@H](O)CN[C@H]1CCC2CC2C1 81d5fb28c5fc0b1cb3c43bb20bbf1c15 [0,0,0,2,0,0|1,0,0]=3 24637 B13R2.5565 CC(C)CCCN1CC2CC2C1 a3bde30d4e3f2e7229198d28d06a3ef2 [0,0,0,2,0,0|2,0,0]=4 24638 B13R2.5565 CC(C)CCOC1CC2CC2C1 e54892def6d8e3d12836aa17ad896891 [0,0,0,2,0,0|2,0,0]=4 24639 B13R2.5565 CC(C)CCOC1C[C@@H]2C[C@@H]2C1 89f7a43e63745801d6bb408a227e4bfc [0,0,0,2,0,0|2,0,0]=4 24640 B13R2.5565 CC(C)CCO[C@@H]1C[C@@H]2C[C@@H]2C1 dc261449e21281aa025373092ae715a0 [0,0,0,2,0,0|2,0,0]=4 24641 B13R2.5565 CC(C)CCO[C@H]1C[C@@H]2C[C@@H]2C1 47f394532fbe6e8852b5a1290a350445 [0,0,0,2,0,0|2,0,0]=4 24642 B13R2.5565 CC(O)CCCN1CC2CC2C1 81a266c6c35edcda7d1a00fc64e4905e [0,0,0,2,0,0|1,0,0]=3 24643 B13R2.5549 CC(C)COC1CCC1C2CC2 b0d6cc7e1b2e0a6b55b98268b8e8325b [0,0,0,2,0,0|2,0,0]=4 24644 B13R2.5852 CC(C)COC1CCC12CCC2 c49b13331b3f72bfe2419c810cc68b61 [0,0,0,2,0,0|2,0,0]=4 24645 B13R2.5852 CC(O)CCN1CCC12COC2 3fbb57b640729a5f7de127fbe89c35cb [0,0,0,2,0,0|2,0,0]=4 24646 B13R2.1274 CC(C)CCCN1C2C1CCC2 c32a491f439348f2b659e849d7249fbb [0,0,0,2,0,0|2,0,0]=4 24647 B13R2.1274 CC(O)CCCN1C2C1CCC2 2850abad05ed573ecadd51814c962126 [0,0,0,2,0,0|1,0,0]=3 24648 B13R2.5862 CC(C)CCNC1CC12CCC2 7222a4a9e2dc5e5fa92c7bd245028b14 [0,0,0,2,0,0|2,0,0]=4 24649 B13R2.5862 CC(C)CCOC1CC12CCC2 89d63bd630a3a8ede85e8e069bf9a5a5 [0,0,0,2,0,0|2,0,0]=4 24650 B13R2.5862 CC(O)CCNC1CC12CCC2 0988443096d30b84a195e513303aa606 [0,0,0,2,0,0|1,0,0]=3 24651 B13R2.5862 C[C@@H](O)CCNC1CC12CCC2 33e3df9cf4136bfb97a1f3890f6481b9 [0,0,0,2,0,0|1,0,0]=3 24652 B13R2.5862 C[C@H](O)CCNC1CC12CCC2 b78867bec55e4a5d1c9a7175275c033e [0,0,0,2,0,0|1,0,0]=3 24653 B13R2.10574 CC(C)COC[C@H]1C[C@@H]1C2CC2 8e3c185f1968256cd24d48d6da486b0b [0,0,0,2,0,0|2,0,0]=4 24654 B13R2.1286 CC(C)CN1CC2CCCC1C2 8728a4449f989b79cefc4f8095f6c77f [0,0,0,2,0,0|2,0,0]=4 24655 B13R2.1286 CC(O)CN1CC2CCCC1C2 42a7752a93ca80e0bfcc8948c3c60120 [0,0,0,2,0,0|1,0,0]=3 24656 B13R2.1286 C[C@@H](O)CN1CC2CCCC1C2 cb69734c44db0c71b820b3cfa14d7d0c [0,0,0,2,0,0|1,0,0]=3 24657 B13R2.1286 C[C@H](O)CN1CC2CCCC1C2 50fa7f14b6baf70a807bda8bd7fd5373 [0,0,0,2,0,0|1,0,0]=3 24658 B13R2.3045 CC1CCCCCN1CC2CC2 19f7283ce514ead2b365684578153eef [0,0,0,2,0,0|2,0,0]=4 24659 B13R2.5521 CC(C)CN1C2CCCCC1C2 3a8e9ae28b5c1519713e201a0fa4806c [0,0,0,2,0,0|2,0,0]=4 24660 B13R2.5521 CC(O)CN1C2CCCCC1C2 686dcd5f7e3932320f486a950918cc35 [0,0,0,2,0,0|1,0,0]=3 24661 B13R2.5521 C[C@@H](O)CN1C2CCCCC1C2 bef57df6f5dddcc65b0d0c1362a5d335 [0,0,0,2,0,0|1,0,0]=3 24662 B13R2.5521 C[C@H](O)CN1C2CCCCC1C2 dd8f91332439a3c5a2d1464881b8ee0b [0,0,0,2,0,0|1,0,0]=3 24663 B13R2.1279 CC(O)CN1CCN2CCC2C1 d5fb8558819fe22a6d6bf4887ec0951b [0,0,0,2,0,0|2,0,0]=4 24664 B13R2.1279 C[C@@H](O)CN1CCN2CCC2C1 38648c61c37443148764a570ea1e932c [0,0,0,2,0,0|2,0,0]=4 24665 B13R2.1279 C[C@H](O)CN1CCN2CCC2C1 eefdd02b532cd93b0fda181bbaf4fb28 [0,0,0,2,0,0|2,0,0]=4 24666 B13R2.5548 CC(C)CCN1CC2CCC2C1 1a2fa6531adbafbfaeaf14cfbbb4d0be [0,0,0,2,0,0|2,0,0]=4 24667 B13R2.5548 CC(O)CCN1CC2CCC2C1 21b6db59bf988cdf7dc883d1d428c0d0 [0,0,0,2,0,0|1,0,0]=3 24668 B13R2.10577 CC(C)CCOCC12CCC1C2 d4386cab454b35847646bbc743d4b562 [0,0,0,2,0,0|2,0,0]=4 24669 B13R2.17 CC1CC1COC2CCCCC2 c6c3401ad4387d0e6220d111576cb9bd [0,0,0,2,0,0|2,0,0]=4 24670 B13R2.17 CC1CC1NCC2CCCCC2 bd7ea894710280f6a08cb7bce145fbcf [0,0,0,2,0,0|2,0,0]=4 24671 B13R2.17 C[C@@H]1C[C@H]1COC2CCCCC2 5d223a176bf3060b04eace7ba24664a5 [0,0,0,2,0,0|2,0,0]=4 24672 B13R2.17 C[C@H]1C[C@@H]1COC2CCCCC2 2676018f439503319569f3f9abce52c6 [0,0,0,2,0,0|2,0,0]=4 24673 B13R2.17 C[C@H]1C[C@H]1COC2CCCCC2 2c823cd288b37f2685cb17d0f84daac7 [0,0,0,2,0,0|2,0,0]=4 24674 B13R2.17 F[C@@H]1C[C@@H]1COC2CCCCC2 88aa0884e8f1d13861b374b07c6767b8 [0,0,0,2,0,0|2,0,0]=4 24675 B13R2.17 F[C@@H]1C[C@@H]1NCC2CCCCC2 e898761c87ec3f4c58de24db62cc7b18 [0,0,0,2,0,0|2,0,0]=4 24676 B13R2.17 F[C@@H]1C[C@H]1COC2CCCCC2 8dc8ed6f35b85632a278f5459cf3ee7e [0,0,0,2,0,0|2,0,0]=4 24677 B13R2.17 F[C@@H]1C[C@H]1NCC2CCCCC2 94d8a6fd2b7a7f9e63a8576145a717e3 [0,0,0,2,0,0|2,0,0]=4 24678 B13R2.17 F[C@H]1C[C@@H]1COC2CCCCC2 bb7732c623113a566be7014dfe3c77bd [0,0,0,2,0,0|2,0,0]=4 24679 B13R2.17 F[C@H]1C[C@@H]1NCC2CCCCC2 7972cc9c74bc97cf3540bf55bc200b14 [0,0,0,2,0,0|2,0,0]=4 24680 B13R2.17 F[C@H]1C[C@H]1COC2CCCCC2 f05eb29d7821f3e5893d92f46719f073 [0,0,0,2,0,0|2,0,0]=4 24681 B13R2.187 CC1(CC1NC2CCCCC2)C 4b2d64e89f60d1891c2c5715cbcf4720 [0,0,0,2,0,0|2,0,0]=4 24682 B13R2.187 CC1(CC1OC2CCCCC2)C eeccf25e658a617528a323ad30d77334 [0,0,0,2,0,0|2,0,0]=4 24683 B13R2.187 CC1(CN1CC2CCCCC2)C 49349e2191ad70111111f81f9e89e13b [0,0,0,2,0,0|2,0,0]=4 24684 B13R2.187 CC1(C[C@@H]1NC2CCCCC2)C a4566fd6a331223810cb8142eae96ae2 [0,0,0,2,0,0|2,0,0]=4 24685 B13R2.187 CC1(C[C@H]1NC2CCCCC2)C 6e890a9a0705509272a73bdb38ff7a82 [0,0,0,2,0,0|2,0,0]=4 24686 B13R2.437 CC(C)N1CCC12CCCCC2 1561d9db04c79313a77a72802550212e [0,0,0,2,0,0|2,0,0]=4 24687 B13R2.2382 C1CCC(CC1)CCNC2CC2 22e816f770614dd1a8f6684e4eee72a3 [0,0,0,2,0,0|2,0,0]=4 24688 B13R2.2382 C1CCC(CC1)CCOC2CC2 7d7e07aaa9384c274cd5fddb213624f2 [0,0,0,2,0,0|2,0,0]=4 24689 B13R2.2382 C1CCC(CC1)CNCC2CC2 d6544448e1ccada8acccfb08fdcda041 [0,0,0,2,0,0|2,0,0]=4 24690 B13R2.2382 C1CCC(CC1)COCC2CC2 c3d07e9be9ad7b8a630132ab506b52fe [0,0,0,2,0,0|2,0,0]=4 24691 B13R2.2382 C1CCC(CC1)NCCC2CC2 3c9c92de00152d4e23fd4916a7739d47 [0,0,0,2,0,0|2,0,0]=4 24692 B13R2.2382 C1CCC(CC1)OCCC2CC2 6153c98ed307f188212cfb98e7177ad1 [0,0,0,2,0,0|2,0,0]=4 24693 B13R2.5849 CC(C)CCN1C2C1CCCC2 18c0a173371922a07ec698f71d47df30 [0,0,0,2,0,0|2,0,0]=4 24694 B13R2.5849 CC(O)CCN1C2C1CCCC2 588af44bf429478d1e3b1bb52c126eb8 [0,0,0,2,0,0|1,0,0]=3 24695 B13R2.35 CC(C)N1CCCC12CCCC2 590593c93efb294a8a678986c3309ca5 [0,0,0,2,0,0|2,0,0]=4 24696 B13R2.196 CC1CC1COCC2CCCC2 5d563e5527de8dd674edf303c8a4dd63 [0,0,0,2,0,0|2,0,0]=4 24697 B13R2.196 CC1CC1NCCC2CCCC2 d62a7633c9aef96c5f3385fbeb42ae60 [0,0,0,2,0,0|2,0,0]=4 24698 B13R2.196 C[C@@H]1C[C@H]1COCC2CCCC2 c4605bd1270c8db217b76819b0d4232b [0,0,0,2,0,0|2,0,0]=4 24699 B13R2.196 C[C@H]1C[C@@H]1COCC2CCCC2 07d09de0c0df43abe47a1034b4df300a [0,0,0,2,0,0|2,0,0]=4 24700 B13R2.196 C[C@H]1C[C@H]1COCC2CCCC2 07ab3f2c747861085d628a4a5ebbc075 [0,0,0,2,0,0|2,0,0]=4 24701 B13R2.196 F[C@@H]1C[C@@H]1COCC2CCCC2 5591c0b6c4bfe331f4c70112e5c7efeb [0,0,0,2,0,0|2,0,0]=4 24702 B13R2.196 F[C@@H]1C[C@@H]1NCCC2CCCC2 02bdccc2c5fbd97912b71ddcb36b8e7c [0,0,0,2,0,0|2,0,0]=4 24703 B13R2.196 F[C@@H]1C[C@H]1COCC2CCCC2 ffeba8e598597e662af9d59610e9af86 [0,0,0,2,0,0|2,0,0]=4 24704 B13R2.196 F[C@@H]1C[C@H]1NCCC2CCCC2 06f21e490f93b3f13c4b96546cff9f80 [0,0,0,2,0,0|2,0,0]=4 24705 B13R2.196 F[C@H]1C[C@@H]1COCC2CCCC2 fa780f82c1dd3c5cbddff563df36422d [0,0,0,2,0,0|2,0,0]=4 24706 B13R2.196 F[C@H]1C[C@@H]1NCCC2CCCC2 9d7b8773ff0bc1f91dbc6326a40ecb75 [0,0,0,2,0,0|2,0,0]=4 24707 B13R2.196 F[C@H]1C[C@H]1COCC2CCCC2 c0dc9851af4f7e6d701cf3c6f43dc704 [0,0,0,2,0,0|2,0,0]=4 24708 B13R2.426 CC(C)CN1CCC12CCCC2 bb95bb01a219454839d3df6d5e1f84c4 [0,0,0,2,0,0|2,0,0]=4 24709 B13R2.426 CC(C)NC1CCC12CCCC2 b8b958543c3d7ea5e3cac08b84f4252d [0,0,0,2,0,0|2,0,0]=4 24710 B13R2.426 CC(C)OC1CCC12CCCC2 fed5b5c778a7062277ab9dec28c7502c [0,0,0,2,0,0|2,0,0]=4 24711 B13R2.426 CC(O)CN1CCC12CCCC2 1ddeb9320ae5db47995f55e6c4209657 [0,0,0,2,0,0|1,0,0]=3 24712 B13R2.426 CC(O)CN1CCC12CCOC2 74b8abff75602de565f2370aa15835a7 [0,0,0,2,0,0|2,0,0]=4 24713 B13R2.426 C[C@@H](O)CN1CCC12CCCC2 7e4c5e41459ae573d68fcb4d5a7f0361 [0,0,0,2,0,0|1,0,0]=3 24714 B13R2.426 C[C@@H](O)CN1CCC12CCOC2 18e4be7a253460128a8d10c7c76ccb4f [0,0,0,2,0,0|2,0,0]=4 24715 B13R2.426 C[C@H](O)CN1CCC12CCCC2 ef7aa8bcb54f66e43e1e1bba63a3f7b6 [0,0,0,2,0,0|1,0,0]=3 24716 B13R2.426 C[C@H](O)CN1CCC12CCOC2 b11398df8844467c328b1dea71a74207 [0,0,0,2,0,0|2,0,0]=4 24717 B13R2.427 CC(C)CNC1CC12CCCC2 da4a9d998a69391c2c5b127617e9e4a1 [0,0,0,2,0,0|2,0,0]=4 24718 B13R2.427 CC(C)OCC1CC12CCCC2 e14bd5bbf456fbeb5b80dab4274e083c [0,0,0,2,0,0|2,0,0]=4 24719 B13R2.427 CC(O)CNC1CC12CCCC2 cfdb005c1cdcc6161c16446126c06c9c [0,0,0,2,0,0|1,0,0]=3 24720 B13R2.427 C[C@@H](O)CNC1CC12CCCC2 557ca6f752ce4ea11c85950eceacb1e2 [0,0,0,2,0,0|1,0,0]=3 24721 B13R2.427 C[C@H](O)CNC1CC12CCCC2 32089bebca1396306eabc07e147038e1 [0,0,0,2,0,0|1,0,0]=3 24722 B13R2.2380 C(COC1CCCC1)CC2CC2 b073ab15b75e4c1246661068a0d9f257 [0,0,0,2,0,0|2,0,0]=4 24723 B13R2.2380 C1CCC(C1)CCCNC2CC2 4cfca92e1c97c3ab39dd8e74c28279fa [0,0,0,2,0,0|2,0,0]=4 24724 B13R2.2380 C1CCC(C1)CCCOC2CC2 07142e3bcbf59d5d77986c0699b3cd10 [0,0,0,2,0,0|2,0,0]=4 24725 B13R2.2380 C1CCC(C1)CCNCC2CC2 f2d8045802062fa2bb07b6e60becafd0 [0,0,0,2,0,0|2,0,0]=4 24726 B13R2.2380 C1CCC(C1)CCOCC2CC2 a485ce0d049a1b39e3e051b1ca5b9a37 [0,0,0,2,0,0|2,0,0]=4 24727 B13R2.2380 C1CCC(C1)CNCCC2CC2 f1946e7a3d227bd7576c997367bd4b96 [0,0,0,2,0,0|2,0,0]=4 24728 B13R2.2380 C1CCC(C1)COCCC2CC2 a61fab18a459992d88fde0dd99126a83 [0,0,0,2,0,0|2,0,0]=4 24729 B13R2.3207 CC1(CCCN1C2CCCC2)C 753ba46f1042625c08cec645ff25972e [0,0,0,2,0,0|2,0,0]=4 24730 B13R2.3213 CC1(CCC1OC2CCCC2)C 147af8a50a98da64b03380701bd4ddaf [0,0,0,2,0,0|2,0,0]=4 24731 B13R2.3598 CC1(CC1COC2CCCC2)C 3b837bb57de69fecf02216bedc441673 [0,0,0,2,0,0|2,0,0]=4 24732 B13R2.3598 CC1(CC1NCC2CCCC2)C cb9d8dc7d5dcae91cfdfe3572813aa23 [0,0,0,2,0,0|2,0,0]=4 24733 B13R2.3598 CC1(CC1OCC2CCCC2)C 3dd1a3b48a5a1ea4ccd19d35b088ae67 [0,0,0,2,0,0|2,0,0]=4 24734 B13R2.3598 CC1(CN1CCC2CCCC2)C bcaf58515130c31c87e4d32f0879e41c [0,0,0,2,0,0|2,0,0]=4 24735 B13R2.3598 CC1(C[C@@H]1CNC2CCCC2)C 303e4a6d366b1d7e54f9eb3d147eeb14 [0,0,0,2,0,0|2,0,0]=4 24736 B13R2.3598 CC1(C[C@@H]1COC2CCCC2)C 2c70f09269bf43fcf391950548f53c71 [0,0,0,2,0,0|2,0,0]=4 24737 B13R2.3598 CC1(C[C@@H]1NCC2CCCC2)C b7a0840036c95f5ae0c8422cb1b47846 [0,0,0,2,0,0|2,0,0]=4 24738 B13R2.3598 CC1(C[C@H]1CNC2CCCC2)C e4fd3dde9bb60acf033dfbdc757d38d6 [0,0,0,2,0,0|2,0,0]=4 24739 B13R2.3598 CC1(C[C@H]1COC2CCCC2)C 3f499d0c21a7abf16704cb512ef61ed8 [0,0,0,2,0,0|2,0,0]=4 24740 B13R2.3598 CC1(C[C@H]1NCC2CCCC2)C 7a7df809db2d94a0d5a06f57598b08f1 [0,0,0,2,0,0|2,0,0]=4 24741 B13R2.5569 CC(C)N1CCCC2C1CCC2 32f824f44c8992320a6592784f38d31b [0,0,0,2,0,0|2,0,0]=4 24742 B13R2.3117 CC1(CCCC1NC2CCC2)C c712498661f057d1272ff96eb8d098b5 [0,0,0,2,0,0|2,0,0]=4 24743 B13R2.3117 CC1(CCCC1NC2CCC2)O 854729a880858439716179f6b63f9812 [0,0,0,2,0,0|1,0,0]=3 24744 B13R2.3117 CC1(CCCC1NC2COC2)O 330bf8ebd7942a27d1594bb591f012f5 [0,0,0,2,0,0|2,0,0]=4 24745 B13R2.3117 CC1(CCCC1OC2CCC2)C a616653f5e1667e5b91c94b9ea0ea073 [0,0,0,2,0,0|2,0,0]=4 24746 B13R2.3117 CC1(CCCN1CC2CCC2)C db0c14cb7a64ec8c8cb8d750f0324b17 [0,0,0,2,0,0|2,0,0]=4 24747 B13R2.3117 CC1(CCC[C@@H]1OC2CCC2)C 3fb2a06da6c55135fd255cae06bb5286 [0,0,0,2,0,0|2,0,0]=4 24748 B13R2.3117 CC1(CCC[C@H]1OC2CCC2)C 748087155949a1bf548f6f1758bcfcb5 [0,0,0,2,0,0|2,0,0]=4 24749 B13R2.3117 C[C@@]1(CCC[C@@H]1NC2CCC2)O 8504f8691b1f994a881eb23e9d554578 [0,0,0,2,0,0|1,0,0]=3 24750 B13R2.3117 C[C@@]1(CCC[C@@H]1NC2COC2)O 5a38c3622b3ecd3f41248a427c04bedc [0,0,0,2,0,0|2,0,0]=4 24751 B13R2.3117 C[C@]1(CCC[C@H]1NC2CCC2)O e9bce4c85a44f5a78d771f219e4459f7 [0,0,0,2,0,0|1,0,0]=3 24752 B13R2.3117 C[C@]1(CCC[C@H]1NC2COC2)O fd29c8bb06b0392fd66fa19005e52596 [0,0,0,2,0,0|2,0,0]=4 24753 B13R2.3159 C(COCC1CC1)CC2CCC2 043d81123dd42ec19534dacfe9d3f2ff [0,0,0,2,0,0|2,0,0]=4 24754 B13R2.3159 C(COCC1CCC1)CC2CC2 3112453ac02d99b94c672ef03bb6afc4 [0,0,0,2,0,0|2,0,0]=4 24755 B13R2.3159 C1CC(C1)CCNCCC2CC2 1360bc4b00e041f0b1ac3d58508582cc [0,0,0,2,0,0|2,0,0]=4 24756 B13R2.3159 C1CC(C1)CCOCCC2CC2 078eeed53a0d383bb7ea1dc1f880d346 [0,0,0,2,0,0|2,0,0]=4 24757 B13R2.3212 CC1(CCCCN1C2CCC2)C 16b97545d29a27c24dd7374f6874b82e [0,0,0,2,0,0|2,0,0]=4 24758 B13R2.3458 CC1CC1COCCC2CCC2 05bb8a30500a1c85645c86afb28505b5 [0,0,0,2,0,0|2,0,0]=4 24759 B13R2.3458 C[C@@H]1C[C@H]1COCCC2CCC2 5d80ec3f1ca053c1ec8300fda75e12c7 [0,0,0,2,0,0|2,0,0]=4 24760 B13R2.3458 C[C@H]1C[C@@H]1COCCC2CCC2 4fd84835609a18c89d95495314f7096f [0,0,0,2,0,0|2,0,0]=4 24761 B13R2.3458 C[C@H]1C[C@H]1COCCC2CCC2 49a27f2b5368e57e4e72dbc20d46cef3 [0,0,0,2,0,0|2,0,0]=4 24762 B13R2.3458 F[C@@H]1C[C@@H]1COCCC2CCC2 2b7487527768390a4b991345d30cc4b6 [0,0,0,2,0,0|2,0,0]=4 24763 B13R2.3458 F[C@@H]1C[C@H]1COCCC2CCC2 3a9d54625af0941636029b7290646013 [0,0,0,2,0,0|2,0,0]=4 24764 B13R2.3458 F[C@H]1C[C@@H]1COCCC2CCC2 8c4b53033aa9553400336f506fa9e356 [0,0,0,2,0,0|2,0,0]=4 24765 B13R2.3458 F[C@H]1C[C@H]1COCCC2CCC2 a07f361879999db30dbe633583126544 [0,0,0,2,0,0|2,0,0]=4 24766 B13R2.3637 CC1(CCC1OCC2CCC2)C 73f46ff6dec37cd3d03cfa9fd0feb84a [0,0,0,2,0,0|2,0,0]=4 24767 B13R2.5602 CC(O)C1CCCN1C2COC2 0463469e5ffffd80a7c609c144551faa [0,0,0,2,0,0|2,0,0]=4 24768 B13R2.5602 CC(O)[C@H]1CCCN1C2COC2 51fa2d85962654d7b71b060f5710166f [0,0,0,2,0,0|2,0,0]=4 24769 B13R2.5602 C[C@H](O)[C@@H]1CCCN1C2COC2 7da90ca7a8c9b4ecd8ca5660b00cd6f5 [0,0,0,2,0,0|2,0,0]=4 24770 B13R2.10631 CC1(CC1COCC2CCC2)C ead4d99ee9965d27fbc43c85868f2fa1 [0,0,0,2,0,0|2,0,0]=4 24771 B13R2.10631 CC1(CC1NCCC2CCC2)C f7f5c56a934beec5ab3e455c0ae2451c [0,0,0,2,0,0|2,0,0]=4 24772 B13R2.10631 CC1(CC1OCCC2CCC2)C 4dc362821162d2eedd96feb0ce67dc4a [0,0,0,2,0,0|2,0,0]=4 24773 B13R2.10631 CC1(C[C@@H]1CNCC2CCC2)C ed785e3d100e476458ad3db4ff3d5214 [0,0,0,2,0,0|2,0,0]=4 24774 B13R2.10631 CC1(C[C@@H]1COCC2CCC2)C f7345cd9746c3d57130c9cd0a0c4f061 [0,0,0,2,0,0|2,0,0]=4 24775 B13R2.10631 CC1(C[C@@H]1NCCC2CCC2)C 1723ba3f5f256bef800042bd39b365da [0,0,0,2,0,0|2,0,0]=4 24776 B13R2.10631 CC1(C[C@H]1CNCC2CCC2)C 93cc353e4ce919584987cfa84afbe284 [0,0,0,2,0,0|2,0,0]=4 24777 B13R2.10631 CC1(C[C@H]1COCC2CCC2)C 68bfb85dea7a34dacdd2907e75274081 [0,0,0,2,0,0|2,0,0]=4 24778 B13R2.10631 CC1(C[C@H]1NCCC2CCC2)C 1c058dd2facd486a08636f1a030c3c46 [0,0,0,2,0,0|2,0,0]=4 24779 B13R2.11169 OC1CCCCN(C1)C2CCC2 a90315b4100a9441ebf539f6ded584e3 [0,0,0,2,0,0|1,0,0]=3 24780 B13R2.11169 OC1CCCCN(C1)C2COC2 f9d54dd053afe65f7c9c6ad17044661d [0,0,0,2,0,0|2,0,0]=4 24781 B13R2.11169 OC1COCCN(C1)C2CCC2 2a51a71be45b7e76a8c4665387fe752d [0,0,0,2,0,0|2,0,0]=4 24782 B13R2.11169 O[C@@H]1CCCCN(C1)C2CCC2 d5effbaef919f593f9f8222500443b0d [0,0,0,2,0,0|1,0,0]=3 24783 B13R2.11169 O[C@@H]1CCCCN(C1)C2COC2 8a012a6eab1f7506288c68a4bc5464e0 [0,0,0,2,0,0|2,0,0]=4 24784 B13R2.11169 O[C@@H]1COCCN(C1)C2CCC2 6f8b26932442db95957f359a0b055842 [0,0,0,2,0,0|2,0,0]=4 24785 B13R2.11169 O[C@H]1COCCN(C1)C2CCC2 0a30aabd2c36310a31776956d0449944 [0,0,0,2,0,0|2,0,0]=4 24786 B13R2.3443 CC1CC1NC2CCCCCC2 17288056010831239c6d5e87ee189064 [0,0,0,2,0,0|2,0,0]=4 24787 B13R2.3443 F[C@@H]1C[C@@H]1NC2CCCCCC2 5739b10db6d4ac9f3bfb989f80cba3ab [0,0,0,2,0,0|2,0,0]=4 24788 B13R2.3443 F[C@@H]1C[C@H]1NC2CCCCCC2 625cf82adc65feee73d7fa6d328e8264 [0,0,0,2,0,0|2,0,0]=4 24789 B13R2.3443 F[C@H]1C[C@@H]1NC2CCCCCC2 8a4c9e16ff2e36c67a64cd8c3a4d142f [0,0,0,2,0,0|2,0,0]=4 24790 B13R2.13779 CC(C)N1[C@H]2CCC[C@@H]1CCC2 677d3d5d7bc14918756a2c911a5de8d4 [0,0,0,2,0,0|2,0,0]=4 24791 B13R2.249 CCCN1C2CCC1CC(C2)O 5a140222e3ed333ef4d1099ec020ab9a [0,0,0,2,0,0|1,0,0]=3 24792 B13R2.249 CCCN1[C@@H]2CC[C@H]1CC(C2)O 26bbefaff0860e0edff88f80fdb9c1d0 [0,0,0,2,0,0|1,0,0]=3 24793 B13R2.249 CCCN1[C@@H]2CC[C@H]1C[C@@H](C2)F 878428027997ef60a98958b29c199ecc [0,0,0,2,0,0|2,0,0]=4 24794 B13R2.249 CCCN1[C@@H]2CC[C@H]1C[C@@H](C2)O 14a5cac105fc96b93b1da0a5d8af2502 [0,0,0,2,0,0|1,0,0]=3 24795 B13R2.249 CCCN1[C@@H]2CC[C@H]1C[C@H](C2)O 7bce71b1fda2a4390cc732bde1986750 [0,0,0,2,0,0|1,0,0]=3 24796 B13R2.249 COCN1C2CCC1CC(C2)O 8c4b1b87b7a400e7c76ffde218fc21a9 [0,0,0,2,0,0|2,0,0]=4 24797 B13R2.249 COCN1[C@@H]2CC[C@H]1CC(C2)O 7eecef42f3e6d643f9e685129ecf9a57 [0,0,0,2,0,0|2,0,0]=4 24798 B13R2.249 COCN1[C@@H]2CC[C@H]1C[C@@H](C2)O 9722589a917299e5740afdb05344b5e7 [0,0,0,2,0,0|2,0,0]=4 24799 B13R2.249 COCN1[C@@H]2CC[C@H]1C[C@H](C2)O 0ba29247584d51abc19486688955cdbe [0,0,0,2,0,0|2,0,0]=4 24800 B13R2.249 CSCN1C2CCC1CC(C2)O ebf925963513e60c406f51e10083dac8 [0,0,0,2,0,0|2,0,0]=4 24801 B13R2.249 CSCN1[C@@H]2CC[C@H]1CC(C2)O c77bf74269febedf877d670288184864 [0,0,0,2,0,0|2,0,0]=4 24802 B13R2.249 CSCN1[C@@H]2CC[C@H]1C[C@@H](C2)O a5f9c862b786bfd3e8e3244d1d06d7d9 [0,0,0,2,0,0|2,0,0]=4 24803 B13R2.249 CSCN1[C@@H]2CC[C@H]1C[C@H](C2)O c948a30a013b12e798d22fe0829033f8 [0,0,0,2,0,0|2,0,0]=4 24804 B13R2.249 OC1CC2CCC(C1)N2CCF 0ea453d664a18e78ef87082949769e3b [0,0,0,2,0,0|2,0,0]=4 24805 B13R2.249 OC1CC2CCC(C1)N2CCS 4cb2f0d6cac16300a4d5e16b5fac7f70 [0,0,0,2,0,0|2,0,0]=4 24806 B13R2.249 OC1C[C@H]2CC[C@@H](C1)N2CCF 1078c50757e850b2ed6a517cde6a3a43 [0,0,0,2,0,0|2,0,0]=4 24807 B13R2.249 OC1C[C@H]2CC[C@@H](C1)N2CCS e5ea9525e0db0143468f4b0c65433c8e [0,0,0,2,0,0|2,0,0]=4 24808 B13R2.249 OCCN1C2CCC1CC(C2)O a0561cfe99df955f476d6b0e6adbad0d [0,0,0,2,0,0|2,0,0]=4 24809 B13R2.249 OCCN1[C@@H]2CC[C@H]1CC(C2)O 74b167b842fafee05761b6975a0681d7 [0,0,0,2,0,0|2,0,0]=4 24810 B13R2.249 OCCN1[C@@H]2CC[C@H]1C[C@@H](C2)O 775d83e1ce15668efb45756c82d9d72a [0,0,0,2,0,0|2,0,0]=4 24811 B13R2.249 OCCN1[C@@H]2CC[C@H]1C[C@H](C2)O 96d5b09a41375db1da38fff5eaf27ff8 [0,0,0,2,0,0|2,0,0]=4 24812 B13R2.249 O[C@@H]1C[C@H]2CC[C@@H](C1)N2CCF 048ada2c9f959b22d129496773c61c36 [0,0,0,2,0,0|2,0,0]=4 24813 B13R2.249 O[C@@H]1C[C@H]2CC[C@@H](C1)N2CCS cfe3557dad93727b16694ba38c614edd [0,0,0,2,0,0|2,0,0]=4 24814 B13R2.249 O[C@H]1C[C@H]2CC[C@@H](C1)N2CCF 188a5ea9550a533de772d653f01d5ebc [0,0,0,2,0,0|2,0,0]=4 24815 B13R2.249 O[C@H]1C[C@H]2CC[C@@H](C1)N2CCS 8f4c857a39e398b90ff14e5f39272d69 [0,0,0,2,0,0|2,0,0]=4 24816 B13R2.5604 CC(C)CC1CCCN1C2CC2 5acbaa3f07b52a0048bdc858237a3566 [0,0,0,2,0,0|2,0,0]=4 24817 B13R2.5604 CC(C)CN1CCCC1C2CC2 8d91d7b0c76d54ee1075880f14afdac8 [0,0,0,2,0,0|2,0,0]=4 24818 B13R2.5604 CC(C)CN1CCC[C@@H]1C2CC2 fb14b0150451f534bc043cd9565a55d9 [0,0,0,2,0,0|2,0,0]=4 24819 B13R2.5604 CC(O)CN1CCCC1C2CC2 82a74fc258ba13dd5bdc56a70fa86763 [0,0,0,2,0,0|1,0,0]=3 24820 B13R2.5604 CC(O)CN1CCC[C@@H]1C2CC2 802d8b430c5012d127f269dc98b86b09 [0,0,0,2,0,0|1,0,0]=3 24821 B13R2.5604 C[C@@H](O)CN1CCCC1C2CC2 f284ee9e163d45a8b58cde1260c60c13 [0,0,0,2,0,0|1,0,0]=3 24822 B13R2.5604 C[C@@H](O)CN1CCC[C@@H]1C2CC2 b0ae9de55917becd5530b1b0f26792e8 [0,0,0,2,0,0|1,0,0]=3 24823 B13R2.5604 C[C@H](O)CN1CCCC1C2CC2 22631d7ee1f42b613c57b097df4ab487 [0,0,0,2,0,0|1,0,0]=3 24824 B13R2.5604 C[C@H](O)CN1CCC[C@@H]1C2CC2 75829bc1c9b5cef5c3bda90a5df9c113 [0,0,0,2,0,0|1,0,0]=3 24825 B13R2.1056 CCCCN1C[C@H]2C[C@H]2[C@@H](C1)O fb0fbb5f718f72aa73d8fee148b78413 [0,0,0,2,0,0|1,0,0]=3 24826 B13R2.1056 CCCCN1C[C@H]2C[C@H]2[C@H](C1)O 318e18b492bff9748017fb22b93a4cc4 [0,0,0,2,0,0|1,0,0]=3 24827 B13R2.1056 CCOCN1C[C@H]2C[C@H]2[C@@H](C1)O 8c698d00be1192633ff4e3551889ef0a [0,0,0,2,0,0|2,0,0]=4 24828 B13R2.1056 CCOCN1C[C@H]2C[C@H]2[C@H](C1)O 0bec501bb3aeab0e0a312dca39bd47ab [0,0,0,2,0,0|2,0,0]=4 24829 B13R2.1056 COCCN1C[C@H]2C[C@H]2[C@@H](C1)O e4ed4a5ad427810b06e8a413467c955d [0,0,0,2,0,0|2,0,0]=4 24830 B13R2.1056 COCCN1C[C@H]2C[C@H]2[C@H](C1)O 06cf0a6d8cb8cfef3bb8192b51461dcf [0,0,0,2,0,0|2,0,0]=4 24831 B13R2.1056 CSCCN1C[C@H]2C[C@H]2[C@@H](C1)O d3a93ef0c94fbb20bf28de40842c54c6 [0,0,0,2,0,0|2,0,0]=4 24832 B13R2.1056 CSCCN1C[C@H]2C[C@H]2[C@H](C1)O 1a06ee24c3c7b05428d61a7e0878cda5 [0,0,0,2,0,0|2,0,0]=4 24833 B13R2.1056 OCCCN1C[C@H]2C[C@H]2[C@@H](C1)O 3aeed798e6125b270293c478faf032c7 [0,0,0,2,0,0|2,0,0]=4 24834 B13R2.1056 OCCCN1C[C@H]2C[C@H]2[C@H](C1)O 4624b33b232f79f86e96451daf752aab [0,0,0,2,0,0|2,0,0]=4 24835 B13R2.1056 O[C@@H]1CN(C[C@@H]2[C@H]1C2)CCCF 3cfdb86531ba82abc5f233ceeb2e6623 [0,0,0,2,0,0|2,0,0]=4 24836 B13R2.1056 O[C@@H]1CN(C[C@@H]2[C@H]1C2)CCCS e6fd805f423702409836e39474dacd78 [0,0,0,2,0,0|2,0,0]=4 24837 B13R2.1056 O[C@H]1CN(C[C@@H]2[C@H]1C2)CCCF c1aaa307459aa68e71686825753c4d51 [0,0,0,2,0,0|2,0,0]=4 24838 B13R2.1056 O[C@H]1CN(C[C@@H]2[C@H]1C2)CCCS 40e11ba0b252a9cac89f09c7ca618bbe [0,0,0,2,0,0|2,0,0]=4 24839 B13R2.10288 OC1CCCCN(C1)CC2CC2 4c1a205d0c5a9949de326120bd386dd1 [0,0,0,2,0,0|1,0,0]=3 24840 B13R2.10288 OC1COCCN(C1)CC2CC2 136517259bc4825e7c85cbfa445a728f [0,0,0,2,0,0|2,0,0]=4 24841 B13R2.10288 O[C@@H]1CCCCN(C1)CC2CC2 d844d88d233966fecf7120916477476c [0,0,0,2,0,0|1,0,0]=3 24842 B13R2.10288 O[C@@H]1COCCN(C1)CC2CC2 056c95933462e96b8abe622432670261 [0,0,0,2,0,0|2,0,0]=4 24843 B13R2.10288 O[C@H]1COCCN(C1)CC2CC2 65077792f01814f6768c6436a0755234 [0,0,0,2,0,0|2,0,0]=4 24844 B13R2.539 CCCNC1CCCCC12CC2 421dee406670576957cda86216472532 [0,0,0,2,0,0|2,0,0]=4 24845 B13R2.539 CCCOC1CCCCC12CC2 077ba78b79fe7bee0c5b3f76130d2420 [0,0,0,2,0,0|2,0,0]=4 24846 B13R2.673 CCCCOC1CCCC12CC2 604d19401204914537561a695de2341d [0,0,0,2,0,0|2,0,0]=4 24847 B13R2.673 CCCCO[C@@H]1CCCC12CC2 9d8c2fc09a0e341c248eeabaeea9fdb4 [0,0,0,2,0,0|2,0,0]=4 24848 B13R2.2180 CCCCCNCC1CC12CC2 a28196b6ad40227fbc07d231ffb081a9 [0,0,0,2,0,0|2,0,0]=4 24849 B13R2.2180 CCCCCOCC1CC12CC2 d40a445d8cd3711fe01ef76eac99a1c3 [0,0,0,2,0,0|2,0,0]=4 24850 B13R2.2180 CCCCOCCC1CC12CC2 283efb55c6ab95ea2d22f774cc467a17 [0,0,0,2,0,0|2,0,0]=4 24851 B13R2.2290 C(COCCC1CC1)CC2CC2 5199878d298f06144eb101a44188cd73 [0,0,0,2,0,0|2,0,0]=4 24852 B13R2.2441 CCCCN1CCCC1C2CC2 b8d1b8bb17639977f5bfb883148c62c1 [0,0,0,2,0,0|2,0,0]=4 24853 B13R2.2441 CCCCN1CCC[C@@H]1C2CC2 2e0f3a2aab81d7efe586f2f88fbe37ef [0,0,0,2,0,0|2,0,0]=4 24854 B13R2.2517 CCCCOC1CCC1C2CC2 5812e84921e1ba911b194274b9f6e459 [0,0,0,2,0,0|2,0,0]=4 24855 B13R2.2993 CCCCOC[C@H]1C[C@@H]1C2CC2 1f06c1ac41f62a8e8db2a8d1e299b2d8 [0,0,0,2,0,0|2,0,0]=4 24856 B13R2.2994 CCCCCOC1CCC12CC2 045cb6d1c5efe47e10852797c93b43a0 [0,0,0,2,0,0|2,0,0]=4 24857 B13R2.3160 C1CCCCN(CCC1)C2CC2 96008dd8c8318d33c448ebb700e884fc [0,0,0,2,0,0|2,0,0]=4 24858 B13R2.6839 C1CCCC(CCC1)NC2CC2 185ed5ff479c7dfc6e09bf5c580e9767 [0,0,0,2,0,0|2,0,0]=4 24859 B13R2.6839 C1CCCC(CCC1)OC2CC2 9071c60f90fc016b5ce75a1a93cd2b1f [0,0,0,2,0,0|2,0,0]=4 24860 B13R2.6839 C1CCCN(CCC1)CC2CC2 10ed5cf2b6a1912743d69943de764083 [0,0,0,2,0,0|2,0,0]=4 24861 B13R2.6841 C1CCCC(CC1)CNC2CC2 c87d2c1851ee6657426ddd023da7189a [0,0,0,2,0,0|2,0,0]=4 24862 B13R2.6841 C1CCCC(CC1)COC2CC2 9b0ead3d509d9ab426f037fcf3021bd5 [0,0,0,2,0,0|2,0,0]=4 24863 B13R2.6841 C1CCCC(CC1)NCC2CC2 4b6b0c52a34a0a9e685878fd33a8875a [0,0,0,2,0,0|2,0,0]=4 24864 B13R2.6841 C1CCCC(CC1)OCC2CC2 4159977835a4cf5ea1b80e786d37d029 [0,0,0,2,0,0|2,0,0]=4 24865 B13R2.6841 C1CCCN(CC1)CCC2CC2 3613102d0d1c9b2fa8f65f94e2fadda3 [0,0,0,2,0,0|2,0,0]=4 24866 B13R2.3632 CC1(CCCCC1NC2CC2)C 9a2450e9f5faa3e8fe22dbed84be7cef [0,0,0,2,0,0|2,0,0]=4 24867 B13R2.3632 CC1(CCCCC1NC2CC2)O 21a0d88f5ac8ab65d00d11a05a973154 [0,0,0,2,0,0|1,0,0]=3 24868 B13R2.3632 CC1(CCCCC1OC2CC2)C 5b402eee8431d9d2c35323431c3d7f3c [0,0,0,2,0,0|2,0,0]=4 24869 B13R2.3632 CC1(CCCCN1CC2CC2)C 731c9ee222b18f90583285508b59d479 [0,0,0,2,0,0|2,0,0]=4 24870 B13R2.5574 CC(C)C1CCCC1OC2CC2 24f85e80b833f04778037bf444c1cd21 [0,0,0,2,0,0|2,0,0]=4 24871 B13R2.5574 CC(C)C1CCCN1CC2CC2 c41bee3d58649114f13c6ab6f280822a [0,0,0,2,0,0|2,0,0]=4 24872 B13R2.5574 CC(C)[C@@H]1CCCN1CC2CC2 afb46f3fc1a20f0fcb304431609cf2c1 [0,0,0,2,0,0|2,0,0]=4 24873 B13R2.5574 CC(O)C1CCCN1CC2CC2 3b8ca0d5d8c511513beb65a599f27d0c [0,0,0,2,0,0|1,0,0]=3 24874 B13R2.5574 CC(O)[C@H]1CCCN1CC2CC2 37e40653a152494f9fb33e63cc615e2f [0,0,0,2,0,0|1,0,0]=3 24875 B13R2.5574 C[C@H](O)[C@@H]1CCCN1CC2CC2 7a625e0012a2af17d721a1b46b9fc521 [0,0,0,2,0,0|1,0,0]=3 24876 B13R2.3209 CC1(CC1COCCC2CC2)C 60df79826c83d1733911b346cc7924ae [0,0,0,2,0,0|2,0,0]=4 24877 B13R2.3209 CC1(CC1OCCCC2CC2)C d896f03b421f75b2c5ad770975a16293 [0,0,0,2,0,0|2,0,0]=4 24878 B13R2.3209 CC1(C[C@@H]1CNCCC2CC2)C 549382a9bbafa4dd49e9ff3e74d02abf [0,0,0,2,0,0|2,0,0]=4 24879 B13R2.3209 CC1(C[C@@H]1COCCC2CC2)C 8799de30b05244c8a1d5d583991ef20f [0,0,0,2,0,0|2,0,0]=4 24880 B13R2.3209 CC1(C[C@H]1CNCCC2CC2)C ca3628edc7e18e63c541044609671abd [0,0,0,2,0,0|2,0,0]=4 24881 B13R2.3209 CC1(C[C@H]1COCCC2CC2)C f489a15b0f4dc6a84dd08d5fadf0555a [0,0,0,2,0,0|2,0,0]=4 24882 B13R2.3591 CC1(CCC1OCCC2CC2)C e818834cffd16707923a4408074ec1cb [0,0,0,2,0,0|2,0,0]=4 24883 B13R2.3595 CC1(CCCC1NCC2CC2)C 712f867b35c53cf20016628f7cf39d5d [0,0,0,2,0,0|2,0,0]=4 24884 B13R2.3595 CC1(CCCC1NCC2CC2)O 82003e9a82e45a0f31e4f366265a443d [0,0,0,2,0,0|1,0,0]=3 24885 B13R2.3595 CC1(CCCC1OCC2CC2)C 134f31a9d5c38b9b8c8ea02d25331cf4 [0,0,0,2,0,0|2,0,0]=4 24886 B13R2.3595 CC1(CCCN1CCC2CC2)C e489dffc2372e29a530f19dde5638742 [0,0,0,2,0,0|2,0,0]=4 24887 B13R2.3595 CC1(CCC[C@@H]1OCC2CC2)C 5fdfd3798d5e67b6b6a2480871afb229 [0,0,0,2,0,0|2,0,0]=4 24888 B13R2.3595 CC1(CCC[C@H]1OCC2CC2)C b96bc1fc564bfbea574c2a9ae027983e [0,0,0,2,0,0|2,0,0]=4 24889 B13R2.3595 C[C@@]1(CCC[C@@H]1NCC2CC2)O 1d134f1e4507230f08e6cf143a75f93e [0,0,0,2,0,0|1,0,0]=3 24890 B13R2.3595 C[C@]1(CCC[C@H]1NCC2CC2)O 673087d348de2c96f8870c7ad83af62c [0,0,0,2,0,0|1,0,0]=3 24891 B13R2.5545 CC(C)CCNCC1CC12CC2 e87503416f7e22024074e6188aba6d30 [0,0,0,2,0,0|2,0,0]=4 24892 B13R2.5545 CC(C)CCOCC1CC12CC2 ae01ec9cb971ca115dad6160936581da [0,0,0,2,0,0|2,0,0]=4 24893 B13R2.5545 CC(C)COCCC1CC12CC2 5ee70d39ee56b8d5c6953efeed1a92f6 [0,0,0,2,0,0|2,0,0]=4 24894 B13R2.5545 CC(O)CCNCC1CC12CC2 192100f1d3efcc54f5ae11a0bb295e7d [0,0,0,2,0,0|1,0,0]=3 24895 B13R2.5545 C[C@@H](O)CCNCC1CC12CC2 fe79a718f11f885e07add672e93353b1 [0,0,0,2,0,0|1,0,0]=3 24896 B13R2.5545 C[C@H](O)CCNCC1CC12CC2 ecf607b768567bed60b885f5bda28dc7 [0,0,0,2,0,0|1,0,0]=3 24897 B13R2.5566 CC(C)CCOC1CCC12CC2 e0c077a1deb04c0cf0bb2935d83e9134 [0,0,0,2,0,0|2,0,0]=4 24898 B13R2.1280 CC(C)NC1CCC2CC2CC1 2b97359bc4a50cdc6f19aedf2aa0c483 [0,0,0,2,0,0|2,0,0]=4 24899 B13R2.10465 CC1(CC1N2CCCCCC2)C ca5eb3a6fb16fd1213fec3c8bf16fb5b [0,0,0,2,0,0|2,0,0]=4 24900 B13R2.10465 CC1(CN1C2CCCCCC2)C 30a707270e5b681f9e56ba85234e8d78 [0,0,0,2,0,0|2,0,0]=4