0 B8R0.8 C#CCNC(C)C(=O)O 4b99b7020e460036fc14906401430936 [0,0,0,0,0,0|3,0,1]=4 1 B8R0.8 C#CCNC(O)C(=O)O c2f87445089f25c4b184d132413f8006 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.8 C#CCN[C@@H](C)C(=O)O 10bbfb92e2c549f58f291f130d16578f [0,0,0,0,0,0|3,0,1]=4 3 B8R0.8 C#CCN[C@H](C)C(=O)O c45ede9d1e43611c768a8090380c1868 [0,0,0,0,0,0|3,0,1]=4 4 B8R0.8 C#CCOC(C)C(=O)O 1adaa60fa476d6dc220f161b33abd609 [0,0,0,0,0,0|3,0,1]=4 5 B8R0.8 C#CCO[C@@H](C)C(=O)O 79781b9b2e6b822211278354159e2687 [0,0,0,0,0,0|3,0,1]=4 6 B8R0.8 C#CCO[C@H](C)C(=O)O 19885536196a71978196625cd8e9f2d3 [0,0,0,0,0,0|3,0,1]=4 7 B8R0.8 C=C(COCC)C(=O)O b3208edc35f04bc3c761d3282605ef24 [0,0,0,0,0,0|3,0,1]=4 8 B8R0.8 C=CCNC(C)C(=O)O 4027c27acb0fdf3aaf8b355f1a408423 [0,0,0,0,0,0|3,0,1]=4 9 B8R0.8 C=CCNC(O)C(=O)O 0ecf31d72e8de05d5ba28c50354b10f9 [0,0,0,0,0,0|3,0,1]=4 10 B8R0.8 C=CCN[C@@H](C)C(=O)O a2a3215161cedaeb69cecc40398800bc [0,0,0,0,0,0|3,0,1]=4 11 B8R0.8 C=CCN[C@H](C)C(=O)O 9c9e167784ec1fd5265aa094a42d05d8 [0,0,0,0,0,0|3,0,1]=4 12 B8R0.8 C=CCOC(C)C(=O)O 950b3a8c28d6da5c53fb492d3fdc807b [0,0,0,0,0,0|3,0,1]=4 13 B8R0.8 C=CCO[C@@H](C)C(=O)O 25467a59582a2906ce4ce45146ee1287 [0,0,0,0,0,0|3,0,1]=4 14 B8R0.8 C=CCO[C@H](C)C(=O)O 0b91c4aaff97cd63715f015c1d0c9e20 [0,0,0,0,0,0|3,0,1]=4 15 B8R0.8 CC(CNC#N)C(=O)O bf116ef387bf30d93fcd9d2397a5d029 [0,0,0,0,0,0|4,0,0]=4 16 B8R0.8 CC(CNCF)C(=O)O 81c40ac360e7f6cce7aa3313199a6d5d [0,0,0,0,0,0|4,0,0]=4 17 B8R0.8 CC(CNCO)C(=O)O e22ad5b294faf2e87974a8321cb31821 [0,0,0,0,0,0|4,0,0]=4 18 B8R0.8 CC(COCF)C(=O)O 415e8d45727d24f32c3b9f930225f08d [0,0,0,0,0,0|4,0,0]=4 19 B8R0.8 CC(NCC#N)C(=O)O 7e0caa8ab91252d82a8f6abf878f244d [0,0,0,0,0,0|4,0,0]=4 20 B8R0.8 CC(NCC=O)C(=O)O 68b69b45ee2126dd65ee50d2916637e9 [0,0,0,0,0,0|4,0,0]=4 21 B8R0.8 CC(NCCF)C(=O)O 826059aa4ee48cb4b37668249087cac6 [0,0,0,0,0,0|4,0,0]=4 22 B8R0.8 CC(NCCI)C(=O)O dee732c464e42a2d1492bb4c77f9d546 [0,0,0,0,0,0|4,0,0]=4 23 B8R0.8 CC(NCCO)C(=O)O d02ed597872d2f4c546187db89f2f220 [0,0,0,0,0,0|4,0,0]=4 24 B8R0.8 CC(NCCS)C(=O)O c86172ae088a1a89a361e8a05cbb9a1a [0,0,0,0,0,0|4,0,0]=4 25 B8R0.8 CC(OCC#N)C(=O)O 9e60d39e5d4e06a279fadb11fff707cb [0,0,0,0,0,0|4,0,0]=4 26 B8R0.8 CC(OCC=O)C(=O)O f7d574d73325531577cc3be3ba579ff3 [0,0,0,0,0,0|4,0,0]=4 27 B8R0.8 CC(OCCF)C(=O)O 6fd5e9a19867c7867b238e7d51a1feb1 [0,0,0,0,0,0|4,0,0]=4 28 B8R0.8 CC(OCCS)C(=O)O c6314cdd016da9ce267602a4c2560a24 [0,0,0,0,0,0|4,0,0]=4 29 B8R0.8 CCCCN(C)C(=O)C 88d1b3a05bc92700007f7660d5b84e56 [0,0,0,0,0,0|4,0,0]=4 30 B8R0.8 CCCNC(C)C(=O)C 6c20f55484fcd603f7867a7e61cb3d7e [0,0,0,0,0,0|4,0,0]=4 31 B8R0.8 CCCNC(C)C(=O)N b2fc625c38ab8c709841d5c7372d4adf [0,0,0,0,0,0|4,0,0]=4 32 B8R0.8 CCCNC(C)C(=O)O 0bb3e38e8c1f88931a7fe4405f55b48f [0,0,0,0,0,0|3,0,0]=3 33 B8R0.8 CCCNC(F)C(=O)N 887433dddf04b7504891cb2e153136a8 [0,0,0,0,0,0|4,0,0]=4 34 B8R0.8 CCCNC(O)C(=O)O cc97d4d167b9765bc7e9641f2f876d2e [0,0,0,0,0,0|3,0,0]=3 35 B8R0.8 CCCN[C@@H](C)C(=O)N 02dd18b86b56ba975cc40a36af64e278 [0,0,0,0,0,0|4,0,0]=4 36 B8R0.8 CCCN[C@@H](C)C(=O)O ef0370d06100564dc30ac92abf332f2f [0,0,0,0,0,0|3,0,0]=3 37 B8R0.8 CCCN[C@H](C)C(=O)N 99c67abc53ca408bd7a07e11216e0931 [0,0,0,0,0,0|4,0,0]=4 38 B8R0.8 CCCN[C@H](C)C(=O)O a8f2478751dbbc6b16132b4c2221ee6f [0,0,0,0,0,0|3,0,0]=3 39 B8R0.8 CCCOC(C)C(=O)C f2ac291285b506c3aa995ed18a49b95f [0,0,0,0,0,0|4,0,0]=4 40 B8R0.8 CCCOC(C)C(=O)N 960017c2975c35a65e9a919d09986bae [0,0,0,0,0,0|4,0,0]=4 41 B8R0.8 CCCOC(C)C(=O)O 1322f7b5e7c49e969524d97c6c86e731 [0,0,0,0,0,0|3,0,0]=3 42 B8R0.8 CCCOC(F)C(=O)N e307f7bcd27dd26468887c129da73e20 [0,0,0,0,0,0|4,0,0]=4 43 B8R0.8 CCCO[C@@H](C)C(=O)N b8c1d5a3f29f788c88f92112d4a6c2ab [0,0,0,0,0,0|4,0,0]=4 44 B8R0.8 CCCO[C@@H](C)C(=O)O 6d34f6dc5dea70a72e909784584aa3d0 [0,0,0,0,0,0|3,0,0]=3 45 B8R0.8 CCCO[C@H](C)C(=O)N ca342d08f32f80afdbcc627d7b3ff5e4 [0,0,0,0,0,0|4,0,0]=4 46 B8R0.8 CCCO[C@H](C)C(=O)O c80966cb853c5464154df7c1b20e2fad [0,0,0,0,0,0|3,0,0]=3 47 B8R0.8 CCNCC(C)C(=O)O f1d53d3e850c3e5f7eacfd1722a00821 [0,0,0,0,0,0|3,0,0]=3 48 B8R0.8 CCNCC(F)C(=O)O 3b295cc4c966015ef89d181bb2cf0fd1 [0,0,0,0,0,0|3,0,0]=3 49 B8R0.8 CCNCC(O)C(=O)O 199a2ff9ee4d2808377aac2de3a1300d [0,0,0,0,0,0|3,0,0]=3 50 B8R0.8 CCNC[C@@H](C)C(=O)O c248e05b45d9e657c31f93c9072982c9 [0,0,0,0,0,0|3,0,0]=3 51 B8R0.8 CCNC[C@@H](O)C(=O)O 0b3a1c0d41c6b74588ef5eb637fd0fb0 [0,0,0,0,0,0|3,0,0]=3 52 B8R0.8 CCNC[C@H](C)C(=O)O 0c2e6d5b0da6964440e6e3ec89c9de07 [0,0,0,0,0,0|3,0,0]=3 53 B8R0.8 CCNC[C@H](O)C(=O)O 8f48edbc7af4278b5a62e9966729660b [0,0,0,0,0,0|3,0,0]=3 54 B8R0.8 CCOCC(C)C(=O)C 7ed02ca7a024702f528cad10b88a8859 [0,0,0,0,0,0|4,0,0]=4 55 B8R0.8 CCOCC(C)C(=O)O c058fb39790cebd08b409e3f0067a53c [0,0,0,0,0,0|3,0,0]=3 56 B8R0.8 CCOC[C@@H](C)C(=O)O caa5ba1722b2330e21dcd6c456bf8574 [0,0,0,0,0,0|3,0,0]=3 57 B8R0.8 CCOC[C@H](C)C(=O)O 3f7f39bbd0ce3dcf45d784eca89b738a [0,0,0,0,0,0|3,0,0]=3 58 B8R0.8 COCCN(C)C(=O)C 1c56ee19503977f51009b726340315a1 [0,0,0,0,0,0|3,1,0]=4 59 B8R0.8 COCNC(C)C(=O)N b4b2ce7b06452726f40d29c12e1e2d45 [0,0,0,0,0,0|3,1,0]=4 60 B8R0.8 COCNC(C)C(=O)O e8a36179375a090804a3295d43a4edc8 [0,0,0,0,0,0|2,1,0]=3 61 B8R0.8 COCNC(O)C(=O)O c63f3dcbd9e54c8057b6fa82b7adfdd8 [0,0,0,0,0,0|2,1,0]=3 62 B8R0.8 COCN[C@@H](C)C(=O)N 8b55f42ca22daaaacb13727c1eeadb78 [0,0,0,0,0,0|3,1,0]=4 63 B8R0.8 COCN[C@@H](C)C(=O)O 97f34448d198c44b13a9de86cde207b4 [0,0,0,0,0,0|2,1,0]=3 64 B8R0.8 COCN[C@H](C)C(=O)N eb2e7ecb7d7c9931c4aafa21b2d3cf84 [0,0,0,0,0,0|3,1,0]=4 65 B8R0.8 COCN[C@H](C)C(=O)O aa63150e151b1d92e3b97d3faa08a6a0 [0,0,0,0,0,0|2,1,0]=3 66 B8R0.8 COCOC(C)C(=O)C 9af88437e924837e1175779254d8725f [0,0,0,0,0,0|3,1,0]=4 67 B8R0.8 COCOC(C)C(=O)N 6aefe489f48a65cd7d148c440618ab78 [0,0,0,0,0,0|3,1,0]=4 68 B8R0.8 COCOC(F)C(=O)N 98a6ca63ec0ae5ce3f5f79ce7b3d2ebf [0,0,0,0,0,0|3,1,0]=4 69 B8R0.8 COCO[C@@H](C)C(=O)N 49acefa7331c8c6665c0cba142f65a5a [0,0,0,0,0,0|3,1,0]=4 70 B8R0.8 COCO[C@H](C)C(=O)N 3b246b4b4317637d3b566960fa55f353 [0,0,0,0,0,0|3,1,0]=4 71 B8R0.8 CSCCN(C)C(=O)C f3dc0247d8f8741adf15cb67ead23b7f [0,0,0,0,0,0|3,0,0]=3 72 B8R0.8 CSCNC(C)C(=O)N 09e6b1dc62b63e7473b01cdc2aa52418 [0,0,0,0,0,0|3,0,0]=3 73 B8R0.8 CSCNC(C)C(=O)O ea815da10516e5245f4fabfad2c1e236 [0,0,0,0,0,0|2,0,0]=2 74 B8R0.8 CSCNC(C)C(C)O ef3911d562ab7b6e3e64e8a81fc52be6 [0,0,0,0,0,0|3,0,1]=4 75 B8R0.8 CSCNC(O)C(=O)O 1719d5d27357fbe544a3b6bde16529a0 [0,0,0,0,0,0|2,0,0]=2 76 B8R0.8 CSCN[C@@H](C)C(=O)N b433645c30d8ea8eea7e0c7ef027def3 [0,0,0,0,0,0|3,0,0]=3 77 B8R0.8 CSCN[C@@H](C)C(=O)O 7e48161f385aeb967c83dfdd3dbc82ac [0,0,0,0,0,0|2,0,0]=2 78 B8R0.8 CSCN[C@H](C)C(=O)N c7892432661f557a4875bbc0c66dca2f [0,0,0,0,0,0|3,0,0]=3 79 B8R0.8 CSCN[C@H](C)C(=O)O b9423e8ae3b110bd616b166a6c8e3236 [0,0,0,0,0,0|2,0,0]=2 80 B8R0.8 CSCOC(C)C(=O)C c95aac72a50d87c47012f14e7a8068b2 [0,0,0,0,0,0|3,0,0]=3 81 B8R0.8 CSCOC(C)C(=O)N 635f1a0e17addb469496239feb26d434 [0,0,0,0,0,0|3,0,0]=3 82 B8R0.8 CSCOC(C)C(=O)O 57d7ce1dd854a328c5975793704ea7b1 [0,0,0,0,0,0|2,0,0]=2 83 B8R0.8 CSCO[C@@H](C)C(=O)N d697806df06282cb5644132872e9ee59 [0,0,0,0,0,0|3,0,0]=3 84 B8R0.8 CSCO[C@@H](C)C(=O)O 864b5a29ecb73704069778c9f0e179d1 [0,0,0,0,0,0|2,0,0]=2 85 B8R0.8 CSCO[C@H](C)C(=O)N 52e95303bdf45ec980659949a87a26d8 [0,0,0,0,0,0|3,0,0]=3 86 B8R0.8 CSCO[C@H](C)C(=O)O f7ab39fe068e7fa68aead9a01d1128af [0,0,0,0,0,0|2,0,0]=2 87 B8R0.8 C[C@@H](CNCF)C(=O)O 4d9173719fc4f49e4611760c33799bb2 [0,0,0,0,0,0|4,0,0]=4 88 B8R0.8 C[C@@H](CNCO)C(=O)O 129419d76dc5f85eaf247a7f67fc6cef [0,0,0,0,0,0|4,0,0]=4 89 B8R0.8 C[C@@H](COCF)C(=O)O aa505f32f4e5eedb1609c9fa6ceb286b [0,0,0,0,0,0|4,0,0]=4 90 B8R0.8 C[C@@H](NCC#N)C(=O)O 972d08b332f352aa44c3e39d4ac17eb7 [0,0,0,0,0,0|4,0,0]=4 91 B8R0.8 C[C@@H](NCC=O)C(=O)O a9f70b757fe4612e75dea21e3835d008 [0,0,0,0,0,0|4,0,0]=4 92 B8R0.8 C[C@@H](NCCF)C(=O)O c985c930a75dd7ef32b597383fbe6b60 [0,0,0,0,0,0|4,0,0]=4 93 B8R0.8 C[C@@H](NCCI)C(=O)O 8a10c2dc2b0ccfee702f35e3cbddbf0d [0,0,0,0,0,0|4,0,0]=4 94 B8R0.8 C[C@@H](NCCO)C(=O)O 773cefab23e4277c3fec27f25db9fd3e [0,0,0,0,0,0|4,0,0]=4 95 B8R0.8 C[C@@H](NCCS)C(=O)O 19d484937376b7d19ec4ad31c032ffd8 [0,0,0,0,0,0|4,0,0]=4 96 B8R0.8 C[C@@H](OCC#N)C(=O)O c705a7a20d6bb82ff2eff911b8d9b552 [0,0,0,0,0,0|4,0,0]=4 97 B8R0.8 C[C@@H](OCC=O)C(=O)O ec661864679508fe308079c34ba0d948 [0,0,0,0,0,0|4,0,0]=4 98 B8R0.8 C[C@@H](OCCF)C(=O)O c9253212131f04406411165ed9fada60 [0,0,0,0,0,0|4,0,0]=4 99 B8R0.8 C[C@@H](OCCS)C(=O)O ac3bfc55d41f7a030484bfd593511e60 [0,0,0,0,0,0|4,0,0]=4 100 B8R0.8 C[C@H](CNCF)C(=O)O 9d81b94206f75ee21b4db163708e8702 [0,0,0,0,0,0|4,0,0]=4 101 B8R0.8 C[C@H](CNCO)C(=O)O 722d39fe0a80aec373909ca981cc2ac2 [0,0,0,0,0,0|4,0,0]=4 102 B8R0.8 C[C@H](COCF)C(=O)O 45766ea01c28bb0aca00c5be08dc9be3 [0,0,0,0,0,0|4,0,0]=4 103 B8R0.8 C[C@H](NCC#N)C(=O)O e4147ba99646ec3a91b79b66bb7623a1 [0,0,0,0,0,0|4,0,0]=4 104 B8R0.8 C[C@H](NCC=O)C(=O)O 8f3e3a2e655b122b5dbf67e5312baae9 [0,0,0,0,0,0|4,0,0]=4 105 B8R0.8 C[C@H](NCCF)C(=O)O fd1f98b23619529732be37e8295a849a [0,0,0,0,0,0|4,0,0]=4 106 B8R0.8 C[C@H](NCCI)C(=O)O 14879b70406900d3b9c0aef15c8804ba [0,0,0,0,0,0|4,0,0]=4 107 B8R0.8 C[C@H](NCCO)C(=O)O 76808623850f5a1065c978caf5c977ca [0,0,0,0,0,0|4,0,0]=4 108 B8R0.8 C[C@H](NCCS)C(=O)O f9c7d821f3499388f2c0c427911263cd [0,0,0,0,0,0|4,0,0]=4 109 B8R0.8 C[C@H](OCC#N)C(=O)O ba12b08c57ed09456d47d6e99832077b [0,0,0,0,0,0|4,0,0]=4 110 B8R0.8 C[C@H](OCC=O)C(=O)O 4ebe59700e459820040abe9c03f70752 [0,0,0,0,0,0|4,0,0]=4 111 B8R0.8 C[C@H](OCCF)C(=O)O 743b16156cee7adc3f15423098970a5c [0,0,0,0,0,0|4,0,0]=4 112 B8R0.8 C[C@H](OCCS)C(=O)O b485ed5c5773edd40292f7e36c453e29 [0,0,0,0,0,0|4,0,0]=4 113 B8R0.8 N#CCNC(O)C(=O)O eec7ef83cf88af6ac7f289ccc2020fe0 [0,0,0,0,0,0|4,0,0]=4 114 B8R0.8 N#CNCC(O)C(=O)O 0943bc10363ee8c75700054dcf2c9843 [0,0,0,0,0,0|4,0,0]=4 115 B8R0.8 N#CNC[C@H](O)C(=O)O c374ceb0d5a55141801d235bcfbf9087 [0,0,0,0,0,0|4,0,0]=4 116 B8R0.8 O=C(O)C(F)CNCF f1a9030b4e84b2808ed1cc96323a1748 [0,0,0,0,0,0|4,0,0]=4 117 B8R0.8 O=C(O)C(F)CNCO c5cb63252e280c78105d540035d06dac [0,0,0,0,0,0|4,0,0]=4 118 B8R0.8 O=C(O)C(O)CNCF b50e1442b5c6266934863854576a8d3d [0,0,0,0,0,0|4,0,0]=4 119 B8R0.8 O=C(O)C(O)CNCO 898dc7e3ebc74408e9fbb99b51d98f75 [0,0,0,0,0,0|4,0,0]=4 120 B8R0.8 O=C(O)C(O)NCCF f448ef4ffbf11843dbee1bb8436d2a0c [0,0,0,0,0,0|4,0,0]=4 121 B8R0.8 O=C(O)C(O)NCCO 698911e1d3457f5b9e37a340d950957a [0,0,0,0,0,0|4,0,0]=4 122 B8R0.8 O=C(O)C(O)NCCS 5346421c4abaa0529702e1282d1c5a95 [0,0,0,0,0,0|4,0,0]=4 123 B8R0.8 O=C(O)[C@@H](O)CNCF dfc3ee5c735555d7aca49144f695826d [0,0,0,0,0,0|4,0,0]=4 124 B8R0.8 O=C(O)[C@@H](O)CNCO cdd1082cc3946b226b2ffbc1066fef89 [0,0,0,0,0,0|4,0,0]=4 125 B8R0.8 O=C(O)[C@H](O)CNCF 5dbad60ab052faf0f2f5f615bfe59344 [0,0,0,0,0,0|4,0,0]=4 126 B8R0.8 O=C(O)[C@H](O)CNCO 71211b0d7c7b20837b97e49988848369 [0,0,0,0,0,0|4,0,0]=4 127 B8R0.8 O=CCNC(O)C(=O)O 8520717b1a1e11d4c35b09a14aaf7e93 [0,0,0,0,0,0|4,0,0]=4 128 B7R0.3 C=C(C=O)OCSC c329dc66e0c8ef5c815429253c081723 [1,0,0,0,0,0|2,0,1]=4 129 B7R0.3 C=CC(C)NCSC 00b0f67e17f5d1856f1ea6c73d24d2b6 [1,0,0,0,0,0|3,0,0]=4 130 B7R0.3 C=CC(C)OCSC 359f7f1d84b7f76c37b0f03448dae423 [1,0,0,0,0,0|3,0,0]=4 131 B7R0.3 C=C[C@H](C)OCSC 542e0c94386f5c75ff061222cd69cc9b [1,0,0,0,0,0|3,0,0]=4 132 B7R0.3 CCCCN(C)C=O 9e1fd6b74517af7f400dd8faea413d3e [1,0,0,0,0,0|3,0,0]=4 133 B7R0.3 CCCNC(C)C=O 7e933d948c2e669e598ddc3c695365b5 [1,0,0,0,0,0|3,0,0]=4 134 B7R0.3 CCCN[C@H](C)C=O 7a63958ebc59429c5dcc5f06d2683ced [1,0,0,0,0,0|3,0,0]=4 135 B7R0.3 CCCOC(C)C=O 64f7abc1e62101b123e23f4c74164a7e [1,0,0,0,0,0|3,0,0]=4 136 B7R0.3 CCCO[C@H](C)C=O 08508c09bba0136bf81083f7b07956d8 [1,0,0,0,0,0|3,0,0]=4 137 B7R0.3 COCCN(C)C=O 31e1cd7ac14afa72fee2870fbd09d003 [1,0,0,0,0,0|2,1,0]=4 138 B7R0.3 COCOC(C)C=O 3707afff98f056c5534ccbc658911b1f [1,0,0,0,0,0|2,1,0]=4 139 B7R0.3 COCO[C@H](C)C=O 34de2462dae77151365395b9e28ef026 [1,0,0,0,0,0|2,1,0]=4 140 B7R0.3 CSCCN(C)C=O a6a4e8ea5b94212ce62d31147e5f4a78 [1,0,0,0,0,0|2,0,0]=3 141 B7R0.3 CSCCN(C)CO 3bce2c59e540fe3e66c7fb7a4d29cc3f [1,0,0,0,0,0|2,0,1]=4 142 B7R0.3 CSCNC(C)CO 6d4e5438054fc7d727ab269c682f1f18 [1,0,0,0,0,0|2,0,1]=4 143 B7R0.3 CSCN[C@@H](C)CO 902809602258c785ac8e71bdd59c992c [1,0,0,0,0,0|2,0,1]=4 144 B7R0.3 CSCN[C@H](C)CO a6e9f797fabfba51a16375762c3c5872 [1,0,0,0,0,0|2,0,1]=4 145 B7R0.3 CSCOC(C)C=O f3e4026b3b027885c21fad548f08eb1c [1,0,0,0,0,0|2,0,0]=3 146 B7R0.4 C#CCNCC(=O)O 343eb4150e1f97e741a1efc40a4c68ea [1,0,0,0,0,0|2,0,1]=4 147 B7R0.4 C#CCOCC(=O)O 3bcfd2fb505271f199367374d77863ed [1,0,0,0,0,0|2,0,1]=4 148 B7R0.4 C=C(Br)CNCSC 8a13c2330490e029e1472b0879913501 [1,0,0,0,0,0|3,0,0]=4 149 B7R0.4 C=C(Br)COCSC 1fb9c4d52ec09b3be6dd4d44e06087d7 [1,0,0,0,0,0|3,0,0]=4 150 B7R0.4 C=C(C)CNCSC 16720dfae312e14188787cb1eaf510d4 [1,0,0,0,0,0|3,0,0]=4 151 B7R0.4 C=C(C)COCSC 57a3672b412662e92be8fefea10a5b74 [1,0,0,0,0,0|3,0,0]=4 152 B7R0.4 C=C(Cl)COCSC f2ac685eefd0e0729fecd3be397ecd57 [1,0,0,0,0,0|3,0,0]=4 153 B7R0.4 C=C(F)COCSC 6bbf4e89090e6cc7310e72037a53b255 [1,0,0,0,0,0|3,0,0]=4 154 B7R0.4 C=C(I)COCSC 906afa6cb0cbbbf887a55678cd7cf860 [1,0,0,0,0,0|3,0,0]=4 155 B7R0.4 C=CCNCC(=O)O 6133d6411223a422a790fc62a49552d6 [1,0,0,0,0,0|2,0,1]=4 156 B7R0.4 C=CCOCC(=O)O 7136a2a50022493c85115a32aa055df0 [1,0,0,0,0,0|2,0,1]=4 157 B7R0.4 CCCCNC(=O)C 0949c76abd7904d01e0aead7cd919e16 [1,0,0,0,0,0|3,0,0]=4 158 B7R0.4 CCCNCC(=O)C 99413200ab301de7320a2958deb213a6 [1,0,0,0,0,0|3,0,0]=4 159 B7R0.4 CCCNCC(=O)N c6bdb30f5ce304ac84a3a29975920160 [1,0,0,0,0,0|3,0,0]=4 160 B7R0.4 CCCNCC(=O)O 1172f6559bfe8e46309ea809f909cc38 [1,0,0,0,0,0|2,0,0]=3 161 B7R0.4 CCCOCC(=O)C 96075066d7d27bc87eaacf968c44bcad [1,0,0,0,0,0|3,0,0]=4 162 B7R0.4 CCCOCC(=O)N 96a8c77dd39980465075569d7697e39d [1,0,0,0,0,0|3,0,0]=4 163 B7R0.4 CCCOCC(=O)O 23aff310a77cf1d0723d729060ccc5ab [1,0,0,0,0,0|2,0,0]=3 164 B7R0.4 CCCOCS(=O)O 0f12db2563a680e281a3900efd4625e1 [1,0,0,0,0,0|3,0,0]=4 165 B7R0.4 CCNCCC(=O)N 41bbba81e733b9d1286775aca2565c1c [1,0,0,0,0,0|3,0,0]=4 166 B7R0.4 CCNCCC(=O)O 88c0515bc1747e6ea081f59eb14f48f3 [1,0,0,0,0,0|2,0,0]=3 167 B7R0.4 CCNCCS(=O)O 128b1e77080fe0113eae546bdfad2510 [1,0,0,0,0,0|3,0,0]=4 168 B7R0.4 CCOCCC(=O)C cbf951a39aabdc9cae79b2b81520e5d8 [1,0,0,0,0,0|3,0,0]=4 169 B7R0.4 CCOCCC(=O)N 6008011299c8bcf06da6d1d485db82cf [1,0,0,0,0,0|3,0,0]=4 170 B7R0.4 CCOCCC(=O)O b43dd4fe6d8527741fde301ee2762516 [1,0,0,0,0,0|2,0,0]=3 171 B7R0.4 COCCNC(=O)C e9eb3353d96003a03a149314e2f5662c [1,0,0,0,0,0|2,1,0]=4 172 B7R0.4 COCNCC(=O)C 1d22e2faae89557d184e6b77c70e18b9 [1,0,0,0,0,0|2,1,0]=4 173 B7R0.4 COCNCC(=O)N 5eb60c0a5f3dc108975679a2e84d9e64 [1,0,0,0,0,0|2,1,0]=4 174 B7R0.4 COCNCC(=O)O 63e693e6a6943d7d076b731aa43d021d [1,0,0,0,0,0|1,1,0]=3 175 B7R0.4 COCOCC(=O)C 6ffd083eff8647662229227253b2a8dc [1,0,0,0,0,0|2,1,0]=4 176 B7R0.4 COCOCC(=O)N a86a9c95c6a98739f4d98d0cd39ad842 [1,0,0,0,0,0|2,1,0]=4 177 B7R0.4 COCOCC(=O)O a468e60279d972337d82cd5f7b4a85c0 [1,0,0,0,0,0|1,1,0]=3 178 B7R0.4 COCOCS(=O)O 5b78f1d6000a1c6ff13d9dbfa3cb959d [1,0,0,0,0,0|2,1,0]=4 179 B7R0.4 CSCCNC(=O)C d94327ff4326745067a7a93e58177af9 [1,0,0,0,0,0|2,0,0]=3 180 B7R0.4 CSCNCC(=O)C 45bb082b9a0036036408483af8cc43e5 [1,0,0,0,0,0|2,0,0]=3 181 B7R0.4 CSCNCC(=O)N 25bde4292d4cdcaec203d3d8eb65b798 [1,0,0,0,0,0|2,0,0]=3 182 B7R0.4 CSCNCC(=O)O 5c5440b473179a79f0a0bde7f261b934 [1,0,0,0,0,0|1,0,0]=2 183 B7R0.4 CSCNCC(C)O 50c1b0ff20ccca0fd478dfcc8b4f1dd9 [1,0,0,0,0,0|2,0,1]=4 184 B7R0.4 CSCNC[C@@H](C)O 8109ab425e83ef9eeeaf7082857cd6a2 [1,0,0,0,0,0|2,0,1]=4 185 B7R0.4 CSCNC[C@H](C)O d2099554b3b9b6b9132d0066d20c97d5 [1,0,0,0,0,0|2,0,1]=4 186 B7R0.4 CSCOCC(=O)C a99e30955cce4bbe9c0c1e4d13a22534 [1,0,0,0,0,0|2,0,0]=3 187 B7R0.4 CSCOCC(=O)N 26834a3c15e8ab4b1f28f8e0ba47eea5 [1,0,0,0,0,0|2,0,0]=3 188 B7R0.4 CSCOCC(=O)O bc53fc5d2082b4879e00ca1b9daacd0d [1,0,0,0,0,0|1,0,0]=2 189 B7R0.4 CSCOCC(=S)N 96e836b78f31f1ad4b44d4ed57e66856 [1,0,0,0,0,0|2,1,0]=4 190 B7R0.4 CSCOCS(=O)O 10c14278cf265246d24f329a9e0b0189 [1,0,0,0,0,0|2,0,0]=3 191 B7R0.4 N#CCNCC(=O)O 809e9a9d58d178eb22e9b3ea8c029b46 [1,0,0,0,0,0|3,0,0]=4 192 B7R0.4 N#CCOCC(=O)O f440efea3522112d8965a680edd84309 [1,0,0,0,0,0|3,0,0]=4 193 B7R0.4 N#CNCCC(=O)O aa8f36504cb81f27d3e027833d30b74a [1,0,0,0,0,0|3,0,0]=4 194 B7R0.4 O=C(O)CCNCF 05f9560a9c5090f2158d127e76253bb5 [1,0,0,0,0,0|3,0,0]=4 195 B7R0.4 O=C(O)CCNCO 4eda81a5ddb9ef19630be70331f35e71 [1,0,0,0,0,0|3,0,0]=4 196 B7R0.4 O=C(O)CCOCF 47a2f1a64d70f1fd70ee05dd145bf666 [1,0,0,0,0,0|3,0,0]=4 197 B7R0.4 O=C(O)CNCCBr 8130f29cad0df7ca3ee5b483ea3f0ae7 [1,0,0,0,0,0|3,0,0]=4 198 B7R0.4 O=C(O)CNCCF 6ae595578428cb8e8437866b629b8546 [1,0,0,0,0,0|3,0,0]=4 199 B7R0.4 O=C(O)CNCCI b126f2904311dc397f067e9011020ab9 [1,0,0,0,0,0|3,0,0]=4 200 B7R0.4 O=C(O)CNCCO 8a2a254c2a92a8e0b0d875df2fbb7a98 [1,0,0,0,0,0|3,0,0]=4 201 B7R0.4 O=C(O)CNCCS a3afb9ba49fa1ab4342d38d48d1d7ee5 [1,0,0,0,0,0|3,0,0]=4 202 B7R0.4 O=C(O)COCCF 0bf6b93a21a854bfb19752b49752a6aa [1,0,0,0,0,0|3,0,0]=4 203 B7R0.4 O=C(O)COCCS d255bc31bb2be8a37fe42b47fabd36dd [1,0,0,0,0,0|3,0,0]=4 204 B7R0.4 O=CCNCC(=O)O 08ed280de66551066677a6ffd3df2c93 [1,0,0,0,0,0|3,0,0]=4 205 B7R0.4 O=CCOCC(=O)O af4627a358303a05a36059ce17b001ba [1,0,0,0,0,0|3,0,0]=4 206 B7R0.5 CC(NCF)C(=O)O 678d57d218e04263cf06f7d55d31cd1d [1,0,0,0,0,0|3,0,0]=4 207 B7R0.5 CC(NCO)C(=O)O fe4a7856b889669392c300fb3cd4873c [1,0,0,0,0,0|2,1,0]=4 208 B7R0.5 CC(OCF)C(=O)O 98938b6366d5b1644ffb60bc89cae3d5 [1,0,0,0,0,0|3,0,0]=4 209 B7R0.5 CCCN(C)C(=O)C 2d9bc06e064dcb0b82800ab570f2482e [1,0,0,0,0,0|3,0,0]=4 210 B7R0.5 CCNC(C)C(=O)N 7d9101ed45213ee882e4c1680fbf78d8 [1,0,0,0,0,0|3,0,0]=4 211 B7R0.5 CCNC(C)C(=O)O a9b19181316f90f96751c71a39f085a0 [1,0,0,0,0,0|2,0,0]=3 212 B7R0.5 CCNC(O)C(=O)O e57bdce4aa01317f2f019ff8528e5629 [1,0,0,0,0,0|2,0,0]=3 213 B7R0.5 CCN[C@@H](C)C(=O)N d3ef0fda784c6fd3be35dd07570fe081 [1,0,0,0,0,0|3,0,0]=4 214 B7R0.5 CCN[C@@H](C)C(=O)O fcc04b18ffb8702755c5613065d53d85 [1,0,0,0,0,0|2,0,0]=3 215 B7R0.5 CCN[C@H](C)C(=O)N ced1ae1ac0990c4f7a1ff4ddde70a04d [1,0,0,0,0,0|3,0,0]=4 216 B7R0.5 CCN[C@H](C)C(=O)O 461a17ce9e067f5c1d30933bc07d8775 [1,0,0,0,0,0|2,0,0]=3 217 B7R0.5 CCOC(C)C(=O)C 04432572fe22b740e86ca5259d0a3bbf [1,0,0,0,0,0|3,0,0]=4 218 B7R0.5 CCOC(C)C(=O)N 3ce53fe24b247e6bbc8d0161ba8adc8b [1,0,0,0,0,0|3,0,0]=4 219 B7R0.5 CCOC(C)C(=O)O 1968a3bf4eb23bbce80f27001c40e3aa [1,0,0,0,0,0|2,0,0]=3 220 B7R0.5 CCO[C@@H](C)C(=O)N 886b096e99d61dadf66cd020bfb7d1de [1,0,0,0,0,0|3,0,0]=4 221 B7R0.5 CCO[C@@H](C)C(=O)O f2b03ca68b0ab7d2700716b8fff09b6d [1,0,0,0,0,0|2,0,0]=3 222 B7R0.5 CCO[C@H](C)C(=O)N 8689cd95b03a5d9ff73691cd92fc4b07 [1,0,0,0,0,0|3,0,0]=4 223 B7R0.5 CCO[C@H](C)C(=O)O 156314018bee2c048aecc9ba30245a68 [1,0,0,0,0,0|2,0,0]=3 224 B7R0.5 C[C@@H](NCF)C(=O)O 17fa37c81497338871dce635035053b9 [1,0,0,0,0,0|3,0,0]=4 225 B7R0.5 C[C@@H](NCO)C(=O)O a97b9962f90d67259e383605fc714644 [1,0,0,0,0,0|2,1,0]=4 226 B7R0.5 C[C@@H](OCF)C(=O)O eca3562769119aefebca30b8cb46ef3d [1,0,0,0,0,0|3,0,0]=4 227 B7R0.5 C[C@H](NCF)C(=O)O 8f95fb8302879a9840726de50eb63034 [1,0,0,0,0,0|3,0,0]=4 228 B7R0.5 C[C@H](NCO)C(=O)O 22dff04db3c7b130eddc4a545a3e505d [1,0,0,0,0,0|2,1,0]=4 229 B7R0.5 C[C@H](OCF)C(=O)O 3b1dcb29a34b79a18541896ae618cad0 [1,0,0,0,0,0|3,0,0]=4 230 B7R0.5 O=C(O)C(O)NCF debbdbf9e1d3d8838357ca1b62835c9a [1,0,0,0,0,0|3,0,0]=4 231 B7R0.5 O=C(O)C(O)NCO 6aca03582d286fba98508921a1d70ae3 [1,0,0,0,0,0|2,1,0]=4 232 B9R0.6 CCCN(C)C(C)C(=O)O f70fec3653f8caa91c122702576f4a6d [0,1,0,0,0,0|3,0,0]=4 233 B9R0.6 CCCN(C)[C@@H](C)C(=O)O 33f2c0d3908618aac995bd4430161391 [0,1,0,0,0,0|3,0,0]=4 234 B9R0.6 CCCN(C)[C@H](C)C(=O)O 5c8b184c0ab62c90ff99df884739207b [0,1,0,0,0,0|3,0,0]=4 235 B9R0.6 CCOC(C)C(C)C(=O)O 0340fa6b71e090f1b398080bd25b7143 [0,1,0,0,0,0|3,0,0]=4 236 B9R0.6 COCN(C)C(C)C(=O)O 58493b6e50645657ba85e8c482465391 [0,1,0,0,0,0|2,1,0]=4 237 B9R0.6 COCN(C)[C@@H](C)C(=O)O 73a054d8912c72cb95dce991aab29537 [0,1,0,0,0,0|2,1,0]=4 238 B9R0.6 COCN(C)[C@H](C)C(=O)O f51663443e14d28b46b54ec9d30f1173 [0,1,0,0,0,0|2,1,0]=4 239 B9R0.6 CSCN(C)C(C)C(=O)N 477bb6c1bb0eb59e6658f73583218db3 [0,1,0,0,0,0|3,0,0]=4 240 B9R0.6 CSCN(C)C(C)C(=O)O 614a73aead9c5ac8d865975d6529b701 [0,1,0,0,0,0|2,0,0]=3 241 B9R0.6 CSCN(C)[C@@H](C)C(=O)N ec3ecd8d681e7e2afdbe9b21148e5259 [0,1,0,0,0,0|3,0,0]=4 242 B9R0.6 CSCN(C)[C@@H](C)C(=O)O b9e680512af92360df7a1d0bb832e1bf [0,1,0,0,0,0|2,0,0]=3 243 B9R0.6 CSCN(C)[C@H](C)C(=O)O 97ca591a395fb45fb0d3c825d20c81ac [0,1,0,0,0,0|2,0,0]=3 244 B9R0.7 C=C(C)CNC(C)C(=O)O 71c7739e8b991e4abf0435840a700d0a [0,1,0,0,0,0|3,0,0]=4 245 B9R0.7 C=C(C)CNC(O)C(=O)O 94b0a208e5c50adf06a4627f23c6b8af [0,1,0,0,0,0|3,0,0]=4 246 B9R0.7 C=C(C)CN[C@@H](C)C(=O)O e7bfbf33da3040405841b806d36ec309 [0,1,0,0,0,0|3,0,0]=4 247 B9R0.7 C=C(C)CN[C@H](C)C(=O)O cd53bb67574651329e24959a91da937e [0,1,0,0,0,0|3,0,0]=4 248 B9R0.7 C=C(C)COC(C)C(=O)O ed04993e273c116d7e5f18b49ab43ad1 [0,1,0,0,0,0|3,0,0]=4 249 B9R0.7 C=C(C)CO[C@@H](C)C(=O)O a50f171d31d69d7b32f91370f5a6fc24 [0,1,0,0,0,0|3,0,0]=4 250 B9R0.7 C=C(C)CO[C@H](C)C(=O)O c708914884c2538adc7cf2cddac67a9b [0,1,0,0,0,0|3,0,0]=4 251 B9R0.7 CC(C)CNC(C)C(=O)O 95f3f70da5c52d8fcff64d575b644cc6 [0,1,0,0,0,0|3,0,0]=4 252 B9R0.7 CC(C)CNC(F)C(=O)O 3711a9670c069b61c1c67d7849298242 [0,1,0,0,0,0|3,0,0]=4 253 B9R0.7 CC(C)CNC(O)C(=O)O 56c2775cf664a9536ae56c2e0f8fb5b9 [0,1,0,0,0,0|3,0,0]=4 254 B9R0.7 CC(C)CN[C@@H](C)C(=O)O 8a76b9132fa71c37af073ea71f14d908 [0,1,0,0,0,0|3,0,0]=4 255 B9R0.7 CC(C)CN[C@@H](F)C(=O)O ce55718c38f59931fe6cf543c7b3ebcf [0,1,0,0,0,0|3,0,0]=4 256 B9R0.7 CC(C)CN[C@H](C)C(=O)O 3f45bea020626ccc8ec99438f12126a4 [0,1,0,0,0,0|3,0,0]=4 257 B9R0.7 CC(C)COC(C)C(=O)O 9c7c1c3df2d77d8f248ac9d91af8f53d [0,1,0,0,0,0|3,0,0]=4 258 B9R0.7 CC(C)CO[C@@H](C)C(=O)O fd5777f1e2b1dc60074ed75e7679298b [0,1,0,0,0,0|3,0,0]=4 259 B9R0.7 CC(C)CO[C@H](C)C(=O)O a69c599a7201e956cef10d92e6f06c1a [0,1,0,0,0,0|3,0,0]=4 260 B9R0.7 CC(C)NCC(C)C(=O)O 48514b1b15d268c29686084b8a8d2d09 [0,1,0,0,0,0|3,0,0]=4 261 B9R0.7 CC(C)NCC(F)C(=O)O 861691fa5d69b6285a7fb70768f89e36 [0,1,0,0,0,0|3,0,0]=4 262 B9R0.7 CC(C)NCC(O)C(=O)O 3c07f41ba869fad28628ce0e0eb9eb4d [0,1,0,0,0,0|3,0,0]=4 263 B9R0.7 CC(C)NC[C@@H](C)C(=O)O eeb01880b97f7b36610e05c2883a075b [0,1,0,0,0,0|3,0,0]=4 264 B9R0.7 CC(C)NC[C@@H](O)C(=O)O eb6cf8a2e9cb3af443f150092edec970 [0,1,0,0,0,0|3,0,0]=4 265 B9R0.7 CC(C)NC[C@H](C)C(=O)O 5780cd753c39f96a6d86de7929d8156a [0,1,0,0,0,0|3,0,0]=4 266 B9R0.7 CC(C)NC[C@H](O)C(=O)O 84ab021a3398610ee2c835c2429ab0e4 [0,1,0,0,0,0|3,0,0]=4 267 B9R0.7 CC(C)OCC(C)C(=O)O c21654bda41cff34c31217652ae24bef [0,1,0,0,0,0|3,0,0]=4 268 B9R0.7 CC(C)OC[C@@H](C)C(=O)O 2e5187b7924c997fdbb6d21d5f5bf05b [0,1,0,0,0,0|3,0,0]=4 269 B9R0.7 CC(C)OC[C@H](C)C(=O)O ea6a1b5296e92549506a331182057b42 [0,1,0,0,0,0|3,0,0]=4 270 B9R0.7 CC(NCN(C)C)C(=O)O e058f611a7944b54a8e4a69fa3d68dff [0,1,0,0,0,0|3,0,0]=4 271 B9R0.7 CC(NC[C@@H](C)O)C(=O)O e809ce2c26bcb016686927f7b1c7a395 [0,1,0,0,0,0|3,0,0]=4 272 B9R0.7 CC(NC[C@H](C)O)C(=O)O d508d1661713f75e41ed860ce7457545 [0,1,0,0,0,0|3,0,0]=4 273 B9R0.7 CC(O)CNC(C)C(=O)O 8f378c3b2577a664e81978bed6d085ad [0,1,0,0,0,0|3,0,0]=4 274 B9R0.7 CC(O)CNC(O)C(=O)O 5e6094d83c3524909868e222ec813376 [0,1,0,0,0,0|3,0,0]=4 275 B9R0.7 CC(O)CN[C@@H](C)C(=O)O 5ddc35dc14ba5aa589c4aa25f6e3299a [0,1,0,0,0,0|3,0,0]=4 276 B9R0.7 CC(O)CN[C@H](C)C(=O)O 4d91ad475557f6f0126eddf20ec91d26 [0,1,0,0,0,0|3,0,0]=4 277 B9R0.7 CC(OCN(C)C)C(=O)O 830922da04f3fb2cfe42d9f413964017 [0,1,0,0,0,0|3,0,0]=4 278 B9R0.7 CN(C)CNC(O)C(=O)O 514e27cf974abcb81fa8750ea67f9650 [0,1,0,0,0,0|3,0,0]=4 279 B9R0.7 C[C@@H](NCN(C)C)C(=O)O b71bf2ae1b9b1319ba65f4a4616917da [0,1,0,0,0,0|3,0,0]=4 280 B9R0.7 C[C@@H](O)CNC(O)C(=O)O 53522750083f40c42a75c8d1a51d10e1 [0,1,0,0,0,0|3,0,0]=4 281 B9R0.7 C[C@@H](O)CN[C@H](C)C(=O)O 6c09363025908b429c9f6a9c87360a44 [0,1,0,0,0,0|3,0,0]=4 282 B9R0.7 C[C@@H](OCN(C)C)C(=O)O 11c670991f4825d9b999539a20aaf0a4 [0,1,0,0,0,0|3,0,0]=4 283 B9R0.7 C[C@H](NCN(C)C)C(=O)O 890cc561e2705dfd45b43ad18d204e90 [0,1,0,0,0,0|3,0,0]=4 284 B9R0.7 C[C@H](NC[C@@H](C)O)C(=O)O e4a79b78aaf76db8d949999ecfcb00bc [0,1,0,0,0,0|3,0,0]=4 285 B9R0.7 C[C@H](O)CNC(O)C(=O)O 2718c7b8bbc967e12d5b2f298426a47e [0,1,0,0,0,0|3,0,0]=4 286 B9R0.7 C[C@H](O)CN[C@@H](C)C(=O)O 6a6c67ca6662759fc2db97e0c2faf3d9 [0,1,0,0,0,0|3,0,0]=4 287 B9R0.7 C[C@H](O)CN[C@H](C)C(=O)O 43b98191e964d18ae40cd9f3d82f80ac [0,1,0,0,0,0|3,0,0]=4 288 B9R0.7 C[C@H](OCN(C)C)C(=O)O 9b0ce417c0ddb18430edfd9d891dd393 [0,1,0,0,0,0|3,0,0]=4 289 B9R0.8 C#CC(=O)N(C)CCSC 9c1c34841cb6008fc5131a358e0d48f5 [0,1,0,0,0,0|3,0,0]=4 290 B9R0.8 C=CC(=O)N(C)CCSC 678c2a94ed9ef7a615308b14c2ecd056 [0,1,0,0,0,0|3,0,0]=4 291 B9R0.8 CCC(=O)N(C)CCSC aab6c2a6f5f967173dcbf121b5f2b04a [0,1,0,0,0,0|3,0,0]=4 292 B9R0.8 CCCCN(C)C(=O)CO 4ba88839945a674ab9ac3fbe8c51fb1c [0,1,0,0,0,0|3,0,0]=4 293 B9R0.8 CCCNC(C)C(=O)OC 31247040e57fcd82f8a5006ea35f44b3 [0,1,0,0,0,0|3,0,0]=4 294 B9R0.8 CCCN[C@@H](C)C(=O)OC 59d491ac2868b6f8a0c3d1e8728d0ebe [0,1,0,0,0,0|3,0,0]=4 295 B9R0.8 CCCN[C@H](C)C(=O)OC 341714f23671a6f279f2ba9d2fc394e9 [0,1,0,0,0,0|3,0,0]=4 296 B9R0.8 CCCOC(C)C(=O)OC 6aeb6cf87a11cad68a57c617fd4dd6b3 [0,1,0,0,0,0|3,0,0]=4 297 B9R0.8 CCCO[C@@H](C)C(=O)OC 74882931e69b82142f87fd9cd5771d40 [0,1,0,0,0,0|3,0,0]=4 298 B9R0.8 CCCO[C@H](C)C(=O)OC df7cac25b325230b3fd4729465a84aae [0,1,0,0,0,0|3,0,0]=4 299 B9R0.8 CCNCC(C)C(=O)OC 23788628878427ebf06f8ab1848fc209 [0,1,0,0,0,0|3,0,0]=4 300 B9R0.8 CCOCC(C)C(=O)OC 80236c9332b15389a08a7441e9591cd6 [0,1,0,0,0,0|3,0,0]=4 301 B9R0.8 CCOCC(F)C(=O)OC 293289f16cf9b946a849bc2001cde08d [0,1,0,0,0,0|3,0,0]=4 302 B9R0.8 CCOC[C@@H](C)C(=O)OC 906e0220267f0d94eef2fb7d2be7e97d [0,1,0,0,0,0|3,0,0]=4 303 B9R0.8 CCOC[C@H](C)C(=O)OC d76376f8be763bf61f075f3cd3189478 [0,1,0,0,0,0|3,0,0]=4 304 B9R0.8 CNC(=O)C(C)NCSC ea1716faf340f1818806a7abcc0c6840 [0,1,0,0,0,0|3,0,0]=4 305 B9R0.8 COC(=O)C(C)OCSC ebd918713d697a3d130a3e5b592f95ea [0,1,0,0,0,0|2,0,0]=3 306 B9R0.8 COC(=O)[C@@H](C)OCSC 28e79a44863d047cc528276a78c0c9cd [0,1,0,0,0,0|2,0,0]=3 307 B9R0.8 COC(=O)[C@H](C)OCSC 18a62ed2db31e4b687bb63a6d3283424 [0,1,0,0,0,0|2,0,0]=3 308 B9R0.8 COCCN(C)C(=O)CO b05ec1e125c3dab3c2c7c0e1019757c0 [0,1,0,0,0,0|2,1,0]=4 309 B9R0.8 COCOC(C)C(=O)OC 9848f05d221db1285aa396c5cdb54009 [0,1,0,0,0,0|2,1,0]=4 310 B9R0.8 COCO[C@@H](C)C(=O)OC d3164128e1fe62adbc450c7289f3cf7d [0,1,0,0,0,0|2,1,0]=4 311 B9R0.8 COCO[C@H](C)C(=O)OC 17521579f3e79d24afec0b769bf2889d [0,1,0,0,0,0|2,1,0]=4 312 B9R0.8 CSCCN(C)C(=O)C=O b6062168d5c130d510edba05705a19b6 [0,1,0,0,0,0|2,0,1]=4 313 B9R0.8 CSCCN(C)C(=O)CF 30138cc738fe153c7dc4905c7992f55d [0,1,0,0,0,0|3,0,0]=4 314 B9R0.8 CSCCN(C)C(=O)CO 82f74320f315c444aa3bc2b7091c9fd8 [0,1,0,0,0,0|2,0,0]=3 315 B9R0.8 CSCCN(C)C(=O)CS 3b3e818ac6200d69e4af12be898541f0 [0,1,0,0,0,0|2,1,0]=4 316 B9R0.13 C#CC(OCCC)C(=O)O dd15e5c0f35b2a3183ad7ea7f1abbd0f [0,1,0,0,0,0|3,0,0]=4 317 B9R0.13 C#CC(OCOC)C(=O)O b51a68b0f2ba429ffbc7c625fd3a4334 [0,1,0,0,0,0|2,1,0]=4 318 B9R0.13 C#CC(OCSC)C(=O)O 01344e113df06301e50e38b0d289844d [0,1,0,0,0,0|2,0,0]=3 319 B9R0.13 C/C=C(\OCSC)/C(=O)O 9c894bfd9598c733e4f3bb22ad8e947c [0,1,0,0,0,0|2,0,1]=4 320 B9R0.13 C=CC(NCCC)C(=O)O a2cd77405add7f9bda10928ee4ee78ab [0,1,0,0,0,0|3,0,0]=4 321 B9R0.13 C=CC(NCOC)C(=O)O 925eb70f3b3184ff26582e650163f37b [0,1,0,0,0,0|2,1,0]=4 322 B9R0.13 C=CC(NCSC)C(=O)O 42b13b1d6b85d5c40bef45753bd0f82d [0,1,0,0,0,0|2,0,0]=3 323 B9R0.13 C=C[C@H](NCCC)C(=O)O 9277832a0fa493055dd9f58c3067ce63 [0,1,0,0,0,0|3,0,0]=4 324 B9R0.13 C=C[C@H](NCOC)C(=O)O 94fc09154eaa55a3d1e41fb09517ffef [0,1,0,0,0,0|2,1,0]=4 325 B9R0.13 C=C[C@H](NCSC)C(=O)O d81e78bcd81ed207e1ffa22caf957f20 [0,1,0,0,0,0|2,0,0]=3 326 B9R0.13 CCC(NCOC)C(=O)O 29bdf399d9540f3750b5dbde7f57f2de [0,1,0,0,0,0|2,1,0]=4 327 B9R0.13 CCC(NCSC)C(=O)N 6d3a975d8c330495737ae1e2b78ace1f [0,1,0,0,0,0|3,0,0]=4 328 B9R0.13 CCC(NCSC)C(=O)O d79342730ef2d3fa4148bd4194f0c1b1 [0,1,0,0,0,0|2,0,0]=3 329 B9R0.13 CCC(OCOC)C(=O)O e6b9c845d6bb5735a4f158a19827bbda [0,1,0,0,0,0|2,1,0]=4 330 B9R0.13 CCC(OCSC)C(=O)N 1b463fc2a4b5915ea8e737397216a65d [0,1,0,0,0,0|3,0,0]=4 331 B9R0.13 CCC(OCSC)C(=O)O ccd4ff15a6e6eec5f462ba7c168ece60 [0,1,0,0,0,0|2,0,0]=3 332 B9R0.13 CCCNC(CC)C(=O)O f069c353f507c75e209c8348074371d9 [0,1,0,0,0,0|3,0,0]=4 333 B9R0.13 CCCNC(CCl)C(=O)O 83d744b2a78bac7ef1fc1246b7f75153 [0,1,0,0,0,0|3,0,0]=4 334 B9R0.13 CCCNC(CF)C(=O)O 2674f23278ea23c1a3fd9e79cc64f417 [0,1,0,0,0,0|3,0,0]=4 335 B9R0.13 CCCNC(CO)C(=O)O f78fc4da322d7ff361a6dd4f22023970 [0,1,0,0,0,0|3,0,0]=4 336 B9R0.13 CCCNC(CS)C(=O)O 7ab935d1954160e0fa48d269e73468b7 [0,1,0,0,0,0|3,0,0]=4 337 B9R0.13 CCCN[C@@H](CC)C(=O)O 4af529648ddb980425c401ff5a4b13f1 [0,1,0,0,0,0|3,0,0]=4 338 B9R0.13 CCCN[C@@H](CCl)C(=O)O dab0665f81f97191818ff25180caa069 [0,1,0,0,0,0|3,0,0]=4 339 B9R0.13 CCCN[C@@H](CO)C(=O)O ddf3b03c8510fbc5ca4e2daff87a28f4 [0,1,0,0,0,0|3,0,0]=4 340 B9R0.13 CCCN[C@@H](CS)C(=O)O e3a74b3aff5bc12b4b6807001695fe2d [0,1,0,0,0,0|3,0,0]=4 341 B9R0.13 CCCN[C@H](CC)C(=O)O 61d39a4878aa39f0678d7acfbc68cb8c [0,1,0,0,0,0|3,0,0]=4 342 B9R0.13 CCCN[C@H](CCl)C(=O)O 4dc35c1012b0d0bb7903731dd1c16a51 [0,1,0,0,0,0|3,0,0]=4 343 B9R0.13 CCCN[C@H](CO)C(=O)O 8cf55344ec2a8ea73259764a0785501b [0,1,0,0,0,0|3,0,0]=4 344 B9R0.13 CCCN[C@H](CS)C(=O)O a0487dcbe4739001e1f7043af5abb830 [0,1,0,0,0,0|3,0,0]=4 345 B9R0.13 CCCOC(CC)C(=O)O 3313398866cda9d19c5a77c88cc36eb1 [0,1,0,0,0,0|3,0,0]=4 346 B9R0.13 CCCO[C@@H](CC)C(=O)O cc9a140b3b6be041090ec10f8ce0cd25 [0,1,0,0,0,0|3,0,0]=4 347 B9R0.13 CCCO[C@H](CC)C(=O)O 8d217e6f2224fafe55f85fa98a7934d5 [0,1,0,0,0,0|3,0,0]=4 348 B9R0.13 CCCO[C@H](CF)C(=O)O 29086d9c9cd694f8fc4088578e463f2a [0,1,0,0,0,0|3,0,0]=4 349 B9R0.13 CCNCC(C#N)C(=O)O ed3bc2e351117cd0351a1e7f1428a95d [0,1,0,0,0,0|2,0,1]=4 350 B9R0.13 CCNC[C@H](CC)C(=O)O cffe2fea12875251a32367199af5f540 [0,1,0,0,0,0|3,0,0]=4 351 B9R0.13 CCNC[C@H](CO)C(=O)O a286bd4559b6a8b5982e2ab8701c93f1 [0,1,0,0,0,0|3,0,0]=4 352 B9R0.13 CC[C@@H](NCOC)C(=O)O afdab15192460f324c62f62289f5efe2 [0,1,0,0,0,0|2,1,0]=4 353 B9R0.13 CC[C@@H](NCSC)C(=O)O 5454d4f202e581954955a2783886044d [0,1,0,0,0,0|2,0,0]=3 354 B9R0.13 CC[C@@H](OCOC)C(=O)O eaf672c9caead4abfc19e8f6a11051c8 [0,1,0,0,0,0|2,1,0]=4 355 B9R0.13 CC[C@@H](OCSC)C(=O)O f1b1aa50116639e72a339c9ead522291 [0,1,0,0,0,0|2,0,0]=3 356 B9R0.13 CC[C@H](NCOC)C(=O)O 8ff3b44341478cbcc46f6485e982ee40 [0,1,0,0,0,0|2,1,0]=4 357 B9R0.13 CC[C@H](NCSC)C(=O)N c506a023b16717655fa19ccbb8c02389 [0,1,0,0,0,0|3,0,0]=4 358 B9R0.13 CC[C@H](NCSC)C(=O)O 215e8fc56b12daa5ff5365fc69da45a2 [0,1,0,0,0,0|2,0,0]=3 359 B9R0.13 CC[C@H](OCOC)C(=O)O 986ecf86f31a1bbe015cd3e780e6ebfd [0,1,0,0,0,0|2,1,0]=4 360 B9R0.13 CC[C@H](OCSC)C(=O)O f2917a5a83a3472b302dcc248b0acae0 [0,1,0,0,0,0|2,0,0]=3 361 B9R0.13 COCNC(CCl)C(=O)O bc2b7911e3ffc38a92b959db45b56fcb [0,1,0,0,0,0|2,1,0]=4 362 B9R0.13 COCNC(CF)C(=O)O 17ec9c581488b2178360a6bce64540b8 [0,1,0,0,0,0|2,1,0]=4 363 B9R0.13 COCNC(CO)C(=O)O 1874cc910ed4120aa974979dfc2178b5 [0,1,0,0,0,0|2,1,0]=4 364 B9R0.13 COCNC(CS)C(=O)O 41e8540589127498359276d1b0f8c4ba [0,1,0,0,0,0|2,1,0]=4 365 B9R0.13 COCN[C@@H](CCl)C(=O)O 93b9c2b6ee76ff370f501f28f0ac1d50 [0,1,0,0,0,0|2,1,0]=4 366 B9R0.13 COCN[C@@H](CO)C(=O)O f3f941c7e24dfb49cce56dee2c18d303 [0,1,0,0,0,0|2,1,0]=4 367 B9R0.13 COCN[C@@H](CS)C(=O)O 8da3d51ce198a49de27ff81351b0b750 [0,1,0,0,0,0|2,1,0]=4 368 B9R0.13 COCN[C@H](CCl)C(=O)O dbb070c5669c8a55f00439f1bd0b8b35 [0,1,0,0,0,0|2,1,0]=4 369 B9R0.13 COCN[C@H](CO)C(=O)O 0f9a5cca444ea82fb1e59bae4feb5296 [0,1,0,0,0,0|2,1,0]=4 370 B9R0.13 COCN[C@H](CS)C(=O)O d62af15c7a5bd0b261774146bb080d2c [0,1,0,0,0,0|2,1,0]=4 371 B9R0.13 COCOC(CF)C(=O)O 94e92cfb4c12fe57f8acc7ee6e110092 [0,1,0,0,0,0|2,1,0]=4 372 B9R0.13 COCO[C@H](CF)C(=O)O 2f275ecca5c84160a3ea0d26836161b7 [0,1,0,0,0,0|2,1,0]=4 373 B9R0.13 CSCNC(C#N)C(=O)N 99dad2144ee95faa6cec9f2ddce18238 [0,1,0,0,0,0|2,0,1]=4 374 B9R0.13 CSCNC(CCl)C(=O)O 8b432fd4d7ab94eb2fef292cec2f8574 [0,1,0,0,0,0|2,0,0]=3 375 B9R0.13 CSCNC(CF)C(=O)O 87551dde60a2852bcfabb1f782c8f400 [0,1,0,0,0,0|2,0,0]=3 376 B9R0.13 CSCNC(CO)C(=O)N 8c7e3d8bb02c322a83fc1226d55fa537 [0,1,0,0,0,0|3,0,0]=4 377 B9R0.13 CSCNC(CO)C(=O)O 26eca2ee3edb87492e36d46cf8f563c3 [0,1,0,0,0,0|2,0,0]=3 378 B9R0.13 CSCNC(CS)C(=O)O 432d322a6e29321faf1a7699f31504fc [0,1,0,0,0,0|2,0,0]=3 379 B9R0.13 CSCN[C@@H](CCl)C(=O)O 4605fb1c2c2e1fd8b9ba8a49da9e5191 [0,1,0,0,0,0|2,0,0]=3 380 B9R0.13 CSCN[C@@H](CO)C(=O)N e86e764ef6118b7c59776a625e9ad5a8 [0,1,0,0,0,0|3,0,0]=4 381 B9R0.13 CSCN[C@@H](CO)C(=O)O e37d633930a82736e21ad053cf8e946e [0,1,0,0,0,0|2,0,0]=3 382 B9R0.13 CSCN[C@@H](CS)C(=O)O 215b1839987bf53e53872012d9450e77 [0,1,0,0,0,0|2,0,0]=3 383 B9R0.13 CSCN[C@H](CCl)C(=O)O be9e78e0fd6beb1acc74e9f9a31792b1 [0,1,0,0,0,0|2,0,0]=3 384 B9R0.13 CSCN[C@H](CO)C(=O)O 6102b7530d697e4e2c526f3c409a0740 [0,1,0,0,0,0|2,0,0]=3 385 B9R0.13 CSCN[C@H](CS)C(=O)O bbfe372e1340b90367d8d9611995aed6 [0,1,0,0,0,0|2,0,0]=3 386 B9R0.13 CSCO[C@H](CF)C(=O)O 76403544799d82ad1e367aa1ebec3c9c [0,1,0,0,0,0|2,0,0]=3 387 B9R0.42 CCC(C)NC(C)C(=O)O 68a75686848679943d96baf18ea4cee6 [0,1,0,0,0,0|3,0,0]=4 388 B9R0.42 CCC(C)NC(O)C(=O)O 9226770c00565a8ac46c992bcd3694a8 [0,1,0,0,0,0|3,0,0]=4 389 B9R0.42 CCC(C)N[C@@H](C)C(=O)O 2ecfa90d128261ce7b1c7103e35d9ce8 [0,1,0,0,0,0|3,0,0]=4 390 B9R0.42 CCC(C)N[C@H](C)C(=O)O 40879e478dcbab889582ba97d8fc0492 [0,1,0,0,0,0|3,0,0]=4 391 B9R0.42 CCC(C)OC(C)C(=O)O 124614e7fe674beb5798a733650d9db8 [0,1,0,0,0,0|3,0,0]=4 392 B9R0.42 CCC(C)O[C@@H](C)C(=O)O 4cdb93fe73d7b9d6910c28e3abff04ff [0,1,0,0,0,0|3,0,0]=4 393 B9R0.42 CCC(C)O[C@H](C)C(=O)O 29e87848881bd076c640e1d0afced7c0 [0,1,0,0,0,0|3,0,0]=4 394 B9R0.42 CCN(C)CC(C)C(=O)O 723a209640bd6d7906fe24890b9f1ec8 [0,1,0,0,0,0|3,0,0]=4 395 B9R0.42 CCN(C)C[C@H](O)C(=O)O d81aaee6aea514de5f389834648d53b5 [0,1,0,0,0,0|3,0,0]=4 396 B9R0.42 CC[C@@H](C)NC(C)C(=O)O b10403595c42ff62f6fe5c7181982ab6 [0,1,0,0,0,0|3,0,0]=4 397 B9R0.42 CC[C@@H](C)N[C@@H](C)C(=O)O 7da5357cd3fbd25609a74bf0c0d329bf [0,1,0,0,0,0|3,0,0]=4 398 B9R0.42 CC[C@@H](C)N[C@H](C)C(=O)O 11638d0e7a79520c4b085e7a2df35de8 [0,1,0,0,0,0|3,0,0]=4 399 B9R0.42 CC[C@@H](C)OC(C)C(=O)O f33ef1abedccd793f28629c961ce3fe5 [0,1,0,0,0,0|3,0,0]=4 400 B9R0.42 CC[C@@H](C)O[C@@H](C)C(=O)O e84999afa124bc3d9ca0c696f1b8d831 [0,1,0,0,0,0|3,0,0]=4 401 B9R0.42 CC[C@@H](C)O[C@H](C)C(=O)O ea5ac1487807f841b2f36b90ff247b7d [0,1,0,0,0,0|3,0,0]=4 402 B9R0.42 CC[C@H](C)NC(C)C(=O)O 826392e01ce3eb4af77b0b39d0fe978a [0,1,0,0,0,0|3,0,0]=4 403 B9R0.42 CC[C@H](C)N[C@@H](C)C(=O)O 7ef37b4a0a1e068d8a9f2b6ad87edcbb [0,1,0,0,0,0|3,0,0]=4 404 B9R0.42 CC[C@H](C)N[C@H](C)C(=O)O 22d220b0a815a9ac8aea710ad5f73c11 [0,1,0,0,0,0|3,0,0]=4 405 B9R0.42 CC[C@H](C)OC(C)C(=O)O c4f6fe4fdd240638d0083650541f09fc [0,1,0,0,0,0|3,0,0]=4 406 B9R0.42 CC[C@H](C)O[C@@H](C)C(=O)O 8169e39c983146464221b38b3e9be7ca [0,1,0,0,0,0|3,0,0]=4 407 B9R0.42 CC[C@H](C)O[C@H](C)C(=O)O ed9f7b940047fd9a74f5f18223d105e3 [0,1,0,0,0,0|3,0,0]=4 408 B9R0.47 C#CCCNC(C)C(=O)O 9aaa9dadddc01d7cdb8f8e2c8d986b27 [0,1,0,0,0,0|2,0,1]=4 409 B9R0.47 C#CCCNC(O)C(=O)O 109ec6eda65abad1293fcc919d4d7a92 [0,1,0,0,0,0|2,0,1]=4 410 B9R0.47 C#CCCN[C@@H](C)C(=O)O afd99d4f9db357367e37be65820a2b29 [0,1,0,0,0,0|2,0,1]=4 411 B9R0.47 C#CCCN[C@H](C)C(=O)O 718243880ab8ba95b403bf84b6041a37 [0,1,0,0,0,0|2,0,1]=4 412 B9R0.47 C#CCCOC(C)C(=O)O 898491ad8210f7be07c5afa1f6463fcf [0,1,0,0,0,0|2,0,1]=4 413 B9R0.47 C#CCCO[C@@H](C)C(=O)O bbd710a107fb609c4433029533930bee [0,1,0,0,0,0|2,0,1]=4 414 B9R0.47 C#CCCO[C@H](C)C(=O)O 1abf9ee6720697c0f129fc8d4a16cc10 [0,1,0,0,0,0|2,0,1]=4 415 B9R0.47 C#CCNCC(C)C(=O)O 90e0174315539ffb569ac2b80174cdeb [0,1,0,0,0,0|2,0,1]=4 416 B9R0.47 C#CCNCC(O)C(=O)O 874554e0df6bee205f45fa9c0a8b663a [0,1,0,0,0,0|2,0,1]=4 417 B9R0.47 C#CCNC[C@@H](C)C(=O)O f02fac291329f32ef1bb82cee8a06ba7 [0,1,0,0,0,0|2,0,1]=4 418 B9R0.47 C#CCNC[C@@H](O)C(=O)O 1172e2b8a2de9524405128b6c8081259 [0,1,0,0,0,0|2,0,1]=4 419 B9R0.47 C#CCNC[C@H](C)C(=O)O e4e4df47115bfc173701fcf2d2d726ec [0,1,0,0,0,0|2,0,1]=4 420 B9R0.47 C#CCNC[C@H](O)C(=O)O 8be99a98c5a9c23088f910be465afe31 [0,1,0,0,0,0|2,0,1]=4 421 B9R0.47 C#CCOCC(C)C(=O)O b5b09a1e77bd736a716257214144c14e [0,1,0,0,0,0|2,0,1]=4 422 B9R0.47 C#CCOC[C@@H](C)C(=O)O 057cf510f51a5a5b504ef12414d5cbe4 [0,1,0,0,0,0|2,0,1]=4 423 B9R0.47 C#CCOC[C@H](C)C(=O)O ba3131f84b75d2c458743ee41e60d676 [0,1,0,0,0,0|2,0,1]=4 424 B9R0.47 C/C=C/CNC(C)C(=O)O 4aa46a6a5b61d83e51c186b50e9ba54a [0,1,0,0,0,0|2,0,1]=4 425 B9R0.47 C/C=C/CNC(O)C(=O)O 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bc27c59f49d09f14551c721c4213d464 [0,1,0,0,0,0|3,0,0]=4 633 B9R0.47 O=C(O)C(F)CNCCO 597c59dba8debc3a750f38fb05b95366 [0,1,0,0,0,0|3,0,0]=4 634 B9R0.47 O=C(O)C(F)CNCCS 256baf77c4e810fe87f77ab9eb17e3a1 [0,1,0,0,0,0|3,0,0]=4 635 B9R0.47 O=C(O)C(O)CCNCF 978e7a242bdd10f5361f85f00f74a696 [0,1,0,0,0,0|2,0,0]=3 636 B9R0.47 O=C(O)C(O)CCNCO 2ba2720a3da106e551885ac55efe3c3c [0,1,0,0,0,0|2,0,0]=3 637 B9R0.47 O=C(O)C(O)CNCCF 892296d858aed3a8b2bdced17cb03706 [0,1,0,0,0,0|3,0,0]=4 638 B9R0.47 O=C(O)C(O)CNCCI 551ce46f1a6c4059d0ddf6cb67a2a002 [0,1,0,0,0,0|3,0,0]=4 639 B9R0.47 O=C(O)C(O)CNCCO d2bf09f48377f15f821580767e3429b2 [0,1,0,0,0,0|3,0,0]=4 640 B9R0.47 O=C(O)C(O)CNCCS 7a001e29e68c999b97b9febbdf61354a [0,1,0,0,0,0|3,0,0]=4 641 B9R0.47 O=C(O)C(O)NCCCF d198fc87f8a140da8525b1f899a1d113 [0,1,0,0,0,0|3,0,0]=4 642 B9R0.47 O=C(O)C(O)NCCCO 1964c40dd265d0751cbf6e9db2c18a82 [0,1,0,0,0,0|3,0,0]=4 643 B9R0.47 O=C(O)C(O)NCCCS 280cf89800f0c0fb2f6939e643e90d8e [0,1,0,0,0,0|3,0,0]=4 644 B9R0.47 O=C(O)[C@@H](O)CCNCF 752ab70d2be40a9c9af5bd04c1064498 [0,1,0,0,0,0|2,0,0]=3 645 B9R0.47 O=C(O)[C@@H](O)CCNCO 6291bbc1a4f2e1ea1f5c3bc5f4667f5f [0,1,0,0,0,0|2,0,0]=3 646 B9R0.47 O=C(O)[C@@H](O)CNCCF 1f722cb60445ae222b0c65467451da98 [0,1,0,0,0,0|3,0,0]=4 647 B9R0.47 O=C(O)[C@@H](O)CNCCI 10f6f5e94768506bcf731ced65012583 [0,1,0,0,0,0|3,0,0]=4 648 B9R0.47 O=C(O)[C@@H](O)CNCCO cb0c725a39540e509a82a31572e081bf [0,1,0,0,0,0|3,0,0]=4 649 B9R0.47 O=C(O)[C@@H](O)CNCCS 3c37a51c4462b5737c9d42367d0b82fa [0,1,0,0,0,0|3,0,0]=4 650 B9R0.47 O=C(O)[C@H](O)CNCCF ffdf19b8b8a4a72db66db50281457bde [0,1,0,0,0,0|3,0,0]=4 651 B9R0.47 O=C(O)[C@H](O)CNCCO ffc079c1bb43161077e31f96585637b4 [0,1,0,0,0,0|3,0,0]=4 652 B9R0.47 O=C(O)[C@H](O)CNCCS aac0d2989cac0e7da0faa02ccf107405 [0,1,0,0,0,0|3,0,0]=4 653 B9R0.47 O=CCCNC(O)C(=O)O 4e588261d8c718aec57a1325859dcc05 [0,1,0,0,0,0|3,0,0]=4 654 B9R0.47 O=CCNCC(F)C(=O)O 3f0bf8fcf5035a43a4afc58572288589 [0,1,0,0,0,0|3,0,0]=4 655 B9R0.47 O=CCNCC(O)C(=O)O 6d274d8b5f82feb8a38e2005a642350d [0,1,0,0,0,0|3,0,0]=4 656 B9R0.47 O=CCNC[C@@H](O)C(=O)O 927801bc9fed5ca554f9ee4c79b9bd46 [0,1,0,0,0,0|3,0,0]=4 657 B9R0.47 O=CCNC[C@H](O)C(=O)O c9237b4f784ae2a0bbd471ccfc266b51 [0,1,0,0,0,0|3,0,0]=4 658 B9R0.51 CCCNC(C)(C)C(=O)O 5af6ccb529bc268255165812ab7324f1 [0,1,0,0,0,0|3,0,0]=4 659 B9R0.51 CCNCC(C)(C)C(=O)O ec9fd4af8b3d116e68bab4c15c62de3c [0,1,0,0,0,0|3,0,0]=4 660 B9R0.51 CCNCC(F)(F)C(=O)O 64da67e8dea468f2a939a1316cacc786 [0,1,0,0,0,0|3,0,0]=4 661 B9R0.51 CCOCC(C)(C)C(=O)O 582231cebb5c80114745be067d5573aa [0,1,0,0,0,0|3,0,0]=4 662 B9R0.51 COCNC(C)(C)C(=O)O bffdcd9b4e3f205ec7e6c81839334980 [0,1,0,0,0,0|2,1,0]=4 663 B9R0.51 CSCNC(C)(C)C(=O)C 8e990eb4b112084dc6f4a12849d937a7 [0,1,0,0,0,0|3,0,0]=4 664 B9R0.51 CSCNC(C)(C)C(=O)N 51dc488f2967e4ad6e82db838e2e4695 [0,1,0,0,0,0|3,0,0]=4 665 B9R0.51 CSCNC(C)(C)C(=O)O 7f6c76c68e77ead055e537b3ec9fcb93 [0,1,0,0,0,0|2,0,0]=3 666 B9R1.6 CC(=O)N1CCSCC1 a2a73cc62f318cd0138a717f4c94c193 [0,0,0,1,0,0|3,0,0]=4 667 B9R1.39 CSCN[C@H]1CNC1=O 13ab6649debaba6c049234ac9c541a81 [0,0,0,1,0,0|3,0,0]=4 668 B9R1.39 CSCOC1CCC1=O 7048061bc11cd0d22a524721b970ff41 [0,0,0,1,0,0|3,0,0]=4 669 B9R1.95 CCN1CC(C1)C(=O)O 081311d3c14b920e24630a696a7ba3f7 [0,0,0,1,0,0|3,0,0]=4 670 B9R1.95 CSC1CN(C1)C(=O)C 2894d9912f5f4ff944df13b23e87b7f5 [0,0,0,1,0,0|3,0,0]=4 671 B9R1.110 CC(C(=O)O)N1CCC1 ec88a5e0123d5408898cf9e078ab2e9b [0,0,0,1,0,0|3,0,0]=4 672 B9R1.110 C[C@@H](C(=O)O)N1CCC1 6d9f8aa04608a34debfa26472baad0e1 [0,0,0,1,0,0|3,0,0]=4 673 B9R1.110 C[C@H](C(=O)O)N1CCC1 b83116f410ba3b08b132985605530e43 [0,0,0,1,0,0|3,0,0]=4 674 B9R1.112 CC(NC1CC1)C(=O)O 9f16a679f53d1b6a7c598414dcc647c1 [0,0,0,1,0,0|3,0,0]=4 675 B9R1.112 CC(OC1CC1)C(=O)O c571a164b07a3b0ff7a8556f8699f4a3 [0,0,0,1,0,0|3,0,0]=4 676 B9R1.112 C[C@@H](NC1CC1)C(=O)O 0af862409a6887d25e25f4a186199a51 [0,0,0,1,0,0|3,0,0]=4 677 B9R1.112 C[C@@H](OC1CC1)C(=O)O 02a1dfde219281849e31ed75d43f36ac [0,0,0,1,0,0|3,0,0]=4 678 B9R1.112 C[C@H](NC1CC1)C(=O)O 8f50576c81c731defbf87059fbc2bbc5 [0,0,0,1,0,0|3,0,0]=4 679 B9R1.112 C[C@H](OC1CC1)C(=O)O 3ff101290c7cafe95c2fba539b32018c [0,0,0,1,0,0|3,0,0]=4 680 B9R1.112 O=C(O)C(F)NC1CC1 ab0cb5dbff8f96a53d4ab238afd2e5b2 [0,0,0,1,0,0|3,0,0]=4 681 B9R1.112 O=C(O)C(O)NC1CC1 5879b8d2b4559669899973f84acbc223 [0,0,0,1,0,0|3,0,0]=4 682 B9R1.112 O=C(O)[C@H](F)NC1CC1 2357739b82c4749fceebf72401d17ad2 [0,0,0,1,0,0|3,0,0]=4 683 B9R0.4 CCCCC(C)NC(=O)C 8c6d1ed0c215b53ce5178d84ca54f179 [0,0,0,0,0,1|3,0,0]=4 684 B9R0.4 CCCCN(C)CC(=O)O 2ab0d2e55fe8aec010bf103a963bc69a [0,0,0,0,0,1|3,0,0]=4 685 B9R0.4 CCCC[C@@H](C)NC(=O)C 438042d33778c53023e503021e96ec24 [0,0,0,0,0,1|3,0,0]=4 686 B9R0.4 CCCNC(C)CC(=O)O 2d5bf9ae8b9d33e8e5f89637131f543d [0,0,0,0,0,1|3,0,0]=4 687 B9R0.4 CCCN[C@@H](C)CC(=O)O 7dd12827a70b6d0f3eb1d105dd87e0f1 [0,0,0,0,0,1|3,0,0]=4 688 B9R0.4 CCCN[C@H](C)CC(=O)O 49558fe427823d5af7fc8494312831dd [0,0,0,0,0,1|3,0,0]=4 689 B9R0.4 CCCOC(C)CC(=O)O 464f5b57c4d27de1c96f770591eff582 [0,0,0,0,0,1|3,0,0]=4 690 B9R0.4 CCCO[C@@H](C)CC(=O)O 672c62b3f5b285724de30ca7be3b4175 [0,0,0,0,0,1|3,0,0]=4 691 B9R0.4 CCCO[C@H](C)CC(=O)O 78d34951f815792f2a0561852a75d7ea [0,0,0,0,0,1|3,0,0]=4 692 B9R0.4 CCNCC(O)CC(=O)O 02bb2a3b8bce33db43c21894720f909a [0,0,0,0,0,1|3,0,0]=4 693 B9R0.4 CCNC[C@@H](O)CC(=O)O 54b4ddf2085c3305103a3bf1339d420e [0,0,0,0,0,1|3,0,0]=4 694 B9R0.4 CCNC[C@H](O)CC(=O)O 4584b045ec61df30c14bf052bebdc4b7 [0,0,0,0,0,1|3,0,0]=4 695 B9R0.4 COCCN(C)CC(=O)O 3ec55bcb2ffdbac5ba2cd2153b901598 [0,0,0,0,0,1|2,1,0]=4 696 B9R0.4 COCNC(C)CC(=O)O bdd3c4ac12ec667d560eb5ade66eadf9 [0,0,0,0,0,1|2,1,0]=4 697 B9R0.4 COCN[C@@H](C)CC(=O)O 4b81306ee6db218e1b372a75a0b0c2f0 [0,0,0,0,0,1|2,1,0]=4 698 B9R0.4 COCN[C@H](C)CC(=O)O 818aa4572c41952106f807fa5cf3ab38 [0,0,0,0,0,1|2,1,0]=4 699 B9R0.4 COCOC(C)CC(=O)O e4795a30f6180746c828b10734be8c74 [0,0,0,0,0,1|2,1,0]=4 700 B9R0.4 COCO[C@@H](C)CC(=O)O 49833e6f04b5f2fdf75e458c967a7948 [0,0,0,0,0,1|2,1,0]=4 701 B9R0.4 COCO[C@H](C)CC(=O)O 765396246824776e46490c64897c4638 [0,0,0,0,0,1|2,1,0]=4 702 B9R0.4 CSCCN(C)CC(=O)N 8e2d1a7102cd8411ae44c2d7e50835dd [0,0,0,0,0,1|3,0,0]=4 703 B9R0.4 CSCCN(C)CC(=O)O 0f0cc55bdca109b4ba7871c4d09278eb [0,0,0,0,0,1|2,0,0]=3 704 B9R0.4 CSCNC(C)CC(=O)O 4241a9c2ff111280db351016191e8370 [0,0,0,0,0,1|2,0,0]=3 705 B9R0.4 CSCN[C@@H](C)CC(=O)O 726b4fd612fce34bc66b4c1104c65f69 [0,0,0,0,0,1|2,0,0]=3 706 B9R0.4 CSCN[C@H](C)CC(=O)O 93bb6ece58999a9701d836c8d56af5da [0,0,0,0,0,1|2,0,0]=3 707 B9R0.4 CSCOC(C)CC(=O)N af4c2afd288a15ee14238dc19e02472e [0,0,0,0,0,1|3,0,0]=4 708 B9R0.4 CSCOC(C)CC(=O)O 8960316d76a52d36cff0632f6a8a6a82 [0,0,0,0,0,1|2,0,0]=3 709 B9R0.4 CSCO[C@@H](C)CC(=O)O 950648eb7385f49e6308659ead0c2a76 [0,0,0,0,0,1|2,0,0]=3 710 B9R0.4 CSCO[C@H](C)CC(=O)O e5cb5d5e67dbe01167902ba3b365c14b [0,0,0,0,0,1|2,0,0]=3 711 B6R0.1 CCCN(C)C=O f55d615150194d8a2881f113e75957ad [2,0,0,0,0,0|2,0,0]=4 712 B6R0.1 CCOC(C)C=O 4021b7076259f80e1751543881198165 [2,0,0,0,0,0|2,0,0]=4 713 B6R0.4 CC(=O)NCCS 3cdd66626928bc1a9bac11e682b344a1 [2,0,0,0,0,0|2,0,0]=4 714 B6R0.4 CCCNC(=O)C 2a730f252c249036b45b0d2d9cd73ca4 [2,0,0,0,0,0|2,0,0]=4 715 B6R0.4 CCNCC(=O)C f174d94c45d739e3b909d0bcb7f774b6 [2,0,0,0,0,0|2,0,0]=4 716 B6R0.4 CCNCC(=O)N 9af72e08b410c4df60bd96241a267974 [2,0,0,0,0,0|2,0,0]=4 717 B6R0.4 CCNCC(=O)O 4ff54ca579c6d0dc364629f4b9806db8 [2,0,0,0,0,0|1,0,0]=3 718 B6R0.4 CCOCC(=O)C 810b545b1a0c4af358d406c93928b4de [2,0,0,0,0,0|2,0,0]=4 719 B6R0.4 CCOCC(=O)N 8c3995d7bbe4bbb5793da2590cf6473e [2,0,0,0,0,0|2,0,0]=4 720 B6R0.4 CCOCC(=O)O ebe16b0612391447f19756491b2bd7a3 [2,0,0,0,0,0|1,0,0]=3 721 B6R0.4 CCOCS(=O)O 631a28bb34068ba6343c83c466f36b33 [2,0,0,0,0,0|2,0,0]=4 722 B6R0.4 O=C(O)CNCF d8e91f69db1ad3140a3502718cd0d10f [2,0,0,0,0,0|2,0,0]=4 723 B6R0.4 O=C(O)CNCO 03950869097643d435459ad5a0985e95 [2,0,0,0,0,0|1,1,0]=4 724 B6R0.4 O=C(O)COCF 7c32fa44d83e7ce6c73842137b12fe20 [2,0,0,0,0,0|2,0,0]=4 725 B6R0.6 CCCCNC=O 1d6cf15c52b7bdddc1e5bbdb0b9deb3d [2,0,0,0,0,0|2,0,0]=4 726 B6R0.6 CCCNCC=O 6f90aab08cc8a4799f8c9819fe03dcf0 [2,0,0,0,0,0|2,0,0]=4 727 B6R0.6 CCCOCC=O a311990c6ea11edb5945b3bbc64330c1 [2,0,0,0,0,0|2,0,0]=4 728 B6R0.6 CCOCCC=O d3b853feb6192f624a9d6e96cbf29efa [2,0,0,0,0,0|2,0,0]=4 729 B6R0.6 COCCNC=O a492c5e448492de86be811dda47a14fa [2,0,0,0,0,0|1,1,0]=4 730 B6R0.6 COCOCC=O 8fbd0ca4cabb5e823c04e12302889616 [2,0,0,0,0,0|1,1,0]=4 731 B6R0.6 CSCCNC=O 64c5f2b7b4373c36dc6e266bf8eaef67 [2,0,0,0,0,0|1,0,0]=3 732 B6R0.6 CSCCNCO d257ffa86b2e710c05d83eea0cd201f0 [2,0,0,0,0,0|1,0,1]=4 733 B6R0.6 CSCNCCO e6ff3afea97e31bf42a862cf845047cf [2,0,0,0,0,0|1,0,1]=4 734 B8R0.1 CCCCC(C)NC=O 203907a44368850c8dee59ecad001a1f [1,1,0,0,0,0|2,0,0]=4 735 B8R0.1 CCCC[C@@H](C)NC=O 85ae0f7eb97c9ecc6858b3133cc13253 [1,1,0,0,0,0|2,0,0]=4 736 B8R0.1 CSCCN(C)CC=O 89a7838ed9276e35ce7d12178b247609 [1,1,0,0,0,0|2,0,0]=4 737 B8R0.6 C=C(C=O)OCCSC bcf62c6c6fadd7ac5b12dbbe58c89f04 [1,1,0,0,0,0|1,0,1]=4 738 B8R0.6 C=CC(C)COCSC d60c37c9b8b9544a4942aa0b359a9dd7 [1,1,0,0,0,0|2,0,0]=4 739 B8R0.6 C=CC(C)NCCSC 8425f511f44ba9a1b0ec38b4e3fde6ae [1,1,0,0,0,0|2,0,0]=4 740 B8R0.6 C=CC(C)OCCSC c47a8adc31b21580a72d0c35a8639530 [1,1,0,0,0,0|2,0,0]=4 741 B8R0.6 C=CC(O)CNCSC ccd36626b3942410e77d689a28d70952 [1,1,0,0,0,0|2,0,0]=4 742 B8R0.6 C=C[C@H](C)OCCSC 8f4acec3cd799969e87a449279b388d4 [1,1,0,0,0,0|2,0,0]=4 743 B8R0.6 CCCCNC(C)C=O c990dbf02cb6f8344eb0c4b5b1c5bf1a [1,1,0,0,0,0|2,0,0]=4 744 B8R0.6 CCCCN[C@H](C)C=O a8c57992d16bbaafdc8ecce6752aa20e [1,1,0,0,0,0|2,0,0]=4 745 B8R0.6 CCCCOC(C)C=O 3da272a8eb2eb108a59ce2b6af2c590a [1,1,0,0,0,0|2,0,0]=4 746 B8R0.6 CCCCO[C@H](C)C=O e407b3f8d89671debf616b7fa7dc0ddb [1,1,0,0,0,0|2,0,0]=4 747 B8R0.6 COCCNC(C)C=O b04cbb0a4cdf90a8659326a2cf39eb2e [1,1,0,0,0,0|1,1,0]=4 748 B8R0.6 COCCN[C@H](C)C=O 07f0113f3333cc700db2bdba012dc811 [1,1,0,0,0,0|1,1,0]=4 749 B8R0.6 COCCOC(C)C=O 2a67c0ff4cec0a7502a789fa42942c5d [1,1,0,0,0,0|1,1,0]=4 750 B8R0.6 COCCO[C@H](C)C=O 0298f0978f907e5e704651f508aa22b0 [1,1,0,0,0,0|1,1,0]=4 751 B8R0.6 CSCCNC(=O)C=O 7c8e4143d4355f24a51fc16bfc32d9a1 [1,1,0,0,0,0|1,0,1]=4 752 B8R0.6 CSCCNC(C)C=O 286c4e550db8cb5119661e7962d8357e [1,1,0,0,0,0|1,0,0]=3 753 B8R0.6 CSCCNC(C)CO eb710b0198f2b39e52336e903ad250ef [1,1,0,0,0,0|1,0,1]=4 754 B8R0.6 CSCCN[C@@H](C)CO cfc28bd1fda6abe13c274ff1bd20f592 [1,1,0,0,0,0|1,0,1]=4 755 B8R0.6 CSCCN[C@H](C)C=O 768bae1d4934c91a34c8e3922ada33b7 [1,1,0,0,0,0|1,0,0]=3 756 B8R0.6 CSCCN[C@H](C)CO c317f5fd9170c648d9158d4d47f133a4 [1,1,0,0,0,0|1,0,1]=4 757 B8R0.6 CSCCOC(C)C=O 8eef5310c6a16cef75ae44a0d99083e0 [1,1,0,0,0,0|1,0,0]=3 758 B8R0.6 CSCCO[C@H](C)C=O 9648e4c84642a1c7a6b140c2bb515679 [1,1,0,0,0,0|1,0,0]=3 759 B8R0.6 CSCNCC(C)CO 30d6810084fc22efb1676f23075f8fd5 [1,1,0,0,0,0|1,0,1]=4 760 B8R0.6 CSCNCC(F)CO 7c8ae59ece6cccaad32a73bf245162dc [1,1,0,0,0,0|1,0,1]=4 761 B8R0.6 CSCNCC(O)CO cb05f125dcbccb30b28b53900d8a0755 [1,1,0,0,0,0|1,0,1]=4 762 B8R0.6 CSCNC[C@@H](F)CO 945cfabea34ce3fc06a0f0438d225517 [1,1,0,0,0,0|1,0,1]=4 763 B8R0.6 CSCNC[C@@H](O)CO d50aeb52d7e9e038cf848ed9329fb9af [1,1,0,0,0,0|1,0,1]=4 764 B8R0.6 CSCNC[C@H](C)CO 76e60afc5906be27708da6c5f83715d2 [1,1,0,0,0,0|1,0,1]=4 765 B8R0.6 CSCNC[C@H](F)CO a75eed4278b72ce58be4019b98472b0d [1,1,0,0,0,0|1,0,1]=4 766 B8R0.6 CSCNC[C@H](O)CO 543435a3cd29a0d217aec1eaeca7cd36 [1,1,0,0,0,0|1,0,1]=4 767 B8R0.5 CCCN(C)CC(=O)O afce971a9549e09777d29f9620e7b765 [1,1,0,0,0,0|2,0,0]=4 768 B8R0.5 CCNC(C)CC(=O)O 29ac9bd89e468a34801bb550215ba942 [1,1,0,0,0,0|2,0,0]=4 769 B8R0.5 CCN[C@@H](C)CC(=O)O 40a529d5929c8901c8f2b9599ed898cd [1,1,0,0,0,0|2,0,0]=4 770 B8R0.5 CCN[C@H](C)CC(=O)O 2f28d4f7bc57f1ad1bf5a4eebcdf11f3 [1,1,0,0,0,0|2,0,0]=4 771 B8R0.5 CCOC(C)CC(=O)O 20f52735b4f115013d658aa30fd851a1 [1,1,0,0,0,0|2,0,0]=4 772 B8R0.5 CCO[C@@H](C)CC(=O)O 2297bbd28bfec2b7a3315f1a1eca242e [1,1,0,0,0,0|2,0,0]=4 773 B8R0.5 CCO[C@H](C)CC(=O)O ccc8e46cafa360247330bb81a3001d13 [1,1,0,0,0,0|2,0,0]=4 774 B8R0.5 COCN(C)CC(=O)O 38182438be3a4fb938d35352c6bcaa17 [1,1,0,0,0,0|1,1,0]=4 775 B8R0.5 CSCN(C)CC(=O)N 95b0cce82a1be92513ca60f76f2c4e94 [1,1,0,0,0,0|2,0,0]=4 776 B8R0.5 CSCN(C)CC(=O)O f4126c72edd8ab40e4f0e1149e0c0772 [1,1,0,0,0,0|1,0,0]=3 777 B8R0.7 C#CCCNCC(=O)O a62cfb736e7f82a3494237514cacf08e [1,1,0,0,0,0|1,0,1]=4 778 B8R0.7 C#CCCOCC(=O)O 7b766f5b88fb0ecd599c5abf9efbeabf [1,1,0,0,0,0|1,0,1]=4 779 B8R0.7 C#CCNCCC(=O)O 6efd5e85084acab9c542105691239e32 [1,1,0,0,0,0|1,0,1]=4 780 B8R0.7 C#CCOCCC(=O)O 4db8817d78a49abe243c505f5b6fbd25 [1,1,0,0,0,0|1,0,1]=4 781 B8R0.7 C/C=C/CNCC(=O)O c42f2b1a73316da9e67d3841e3bba390 [1,1,0,0,0,0|1,0,1]=4 782 B8R0.7 C/C=C/COCC(=O)O 226b10d27bfff6e38810e52e502a3510 [1,1,0,0,0,0|1,0,1]=4 783 B8R0.7 C/C=C\CNCC(=O)O f297a0a2509c5e78c48c40fb1dbd770d [1,1,0,0,0,0|1,0,1]=4 784 B8R0.7 C/C=C\COCC(=O)O e58cd13c0ed7a7febac3a76fdbabc6bc [1,1,0,0,0,0|1,0,1]=4 785 B8R0.7 C=C(Br)CCOCSC dc07dbda02c200711970a954014d26e1 [1,1,0,0,0,0|2,0,0]=4 786 B8R0.7 C=C(Br)CNCCSC 5b1a1ae0f5347cb228c1a769729a44d5 [1,1,0,0,0,0|2,0,0]=4 787 B8R0.7 C=C(Br)COCCSC 8115612421b5124e936093469c623be0 [1,1,0,0,0,0|2,0,0]=4 788 B8R0.7 C=C(C)CCNCSC 0537b76f67ce88918e3939b8c0661738 [1,1,0,0,0,0|2,0,0]=4 789 B8R0.7 C=C(C)CCOCSC 8b354d12fad36f04225eaa7c7e6282c1 [1,1,0,0,0,0|2,0,0]=4 790 B8R0.7 C=C(C)CNCCSC 3f20f05b0e16d23c2ebfc029ac4818f9 [1,1,0,0,0,0|2,0,0]=4 791 B8R0.7 C=C(C)COCCSC f6054d02b49bf489f798212392eec68c [1,1,0,0,0,0|2,0,0]=4 792 B8R0.7 C=C(Cl)CNCCSC 510ed02e52d250f4e3877597d05cc565 [1,1,0,0,0,0|2,0,0]=4 793 B8R0.7 C=C(Cl)COCCSC f3861298614a897487da4435e963ef56 [1,1,0,0,0,0|2,0,0]=4 794 B8R0.7 C=C(F)CNCCSC d0c31b69c02ec918e82a738748803c26 [1,1,0,0,0,0|2,0,0]=4 795 B8R0.7 C=C(F)COCCSC e51737a42dec5b58b92e49d087c27bec [1,1,0,0,0,0|2,0,0]=4 796 B8R0.7 C=C(I)COCCSC c966d9f86e479c95cf6527498693e642 [1,1,0,0,0,0|2,0,0]=4 797 B8R0.7 C=CCCNCC(=O)O 76a631439fa66be5cf3013ae0e834c6c [1,1,0,0,0,0|1,0,1]=4 798 B8R0.7 C=CCCOCC(=O)O 0512617a8ef9955ac95bbc007cf463ba [1,1,0,0,0,0|1,0,1]=4 799 B8R0.7 C=CCNCCC(=O)O 4a5debfd45f8c7320860717744993f2a [1,1,0,0,0,0|1,0,1]=4 800 B8R0.7 C=CCOCCC(=O)O 9ce82e4dfa256c2803f66fd7129065f2 [1,1,0,0,0,0|1,0,1]=4 801 B8R0.7 CC#CCNCC(=O)O 839a83969460cb5276f0ce2f33e20420 [1,1,0,0,0,0|1,0,1]=4 802 B8R0.7 CC#CCOCC(=O)O fcec6ff15e4ba99fb579eff8ab750539 [1,1,0,0,0,0|1,0,1]=4 803 B8R0.7 CC(=O)CCCOCF c94204172541830dae5131095b16871b [1,1,0,0,0,0|1,1,0]=4 804 B8R0.7 CC=CCNCC(=O)O ca4b4f47c78da4f7c20abbf90afdb294 [1,1,0,0,0,0|1,0,1]=4 805 B8R0.7 CC=CCOCC(=O)O c8d8ca65cbc2c5e4d49fda8c8e6e7f5b [1,1,0,0,0,0|1,0,1]=4 806 B8R0.7 CCCCCNC(=O)C da50d5d5f7d2f7c8f9763330c7139773 [1,1,0,0,0,0|2,0,0]=4 807 B8R0.7 CCCCNCC(=O)C 8dbf7bfa43a4d98486dbc3615b11d498 [1,1,0,0,0,0|2,0,0]=4 808 B8R0.7 CCCCNCC(=O)N 69585f0b9c8687120ac53dbaccd84fc0 [1,1,0,0,0,0|2,0,0]=4 809 B8R0.7 CCCCNCC(=O)O a8de0a477de91420770c0a272ef6f881 [1,1,0,0,0,0|1,0,0]=3 810 B8R0.7 CCCCOCC(=O)C badc4ff846862f74785a1abd49004213 [1,1,0,0,0,0|2,0,0]=4 811 B8R0.7 CCCCOCC(=O)N 34eb6fb5b7f360ec9fe33699fca54d51 [1,1,0,0,0,0|2,0,0]=4 812 B8R0.7 CCCCOCC(=O)O a087235172e11e6141c3e38f9ce4e4ce [1,1,0,0,0,0|1,0,0]=3 813 B8R0.7 CCCCOCS(=O)O 6325931987c0950b79bb089ebdc78c41 [1,1,0,0,0,0|2,0,0]=4 814 B8R0.7 CCCNCCC(=O)C d627d93187ac3c2b4a5879a831f73b21 [1,1,0,0,0,0|2,0,0]=4 815 B8R0.7 CCCNCCC(=O)N 8a2306560cfefa8994234df81900436d [1,1,0,0,0,0|2,0,0]=4 816 B8R0.7 CCCNCCC(=O)O 47226423aa5b665923516680070294a2 [1,1,0,0,0,0|1,0,0]=3 817 B8R0.7 CCCNCCS(=O)O 9ce87a12381c4b5cfe3ec1783a75d72a [1,1,0,0,0,0|2,0,0]=4 818 B8R0.7 CCCOCCC(=O)C 8597bbc8bbaf08f1a613a7aab0165313 [1,1,0,0,0,0|2,0,0]=4 819 B8R0.7 CCCOCCC(=O)N c20536b6c03bcadb1169aacd62e340d9 [1,1,0,0,0,0|2,0,0]=4 820 B8R0.7 CCCOCCC(=O)O 65883243788987d42449403fa915dd7d [1,1,0,0,0,0|1,0,0]=3 821 B8R0.7 CCNCCCC(=O)N d2cce21c7501504eb75a33266b0e5999 [1,1,0,0,0,0|2,0,0]=4 822 B8R0.7 CCNCCCC(=O)O 9ad241b55443dd68da66ff4694ff3500 [1,1,0,0,0,0|1,0,0]=3 823 B8R0.7 CCOCCCC(=O)C d3d73835b0002e0a803c11778e6c42f8 [1,1,0,0,0,0|1,1,0]=4 824 B8R0.7 CCOCCCC(=O)N 32b0b6c66e42630050975d53410c1100 [1,1,0,0,0,0|1,1,0]=4 825 B8R0.7 CCOCNCC(=O)O 0cadae74986469dc80946ca8e9bb1b07 [1,1,0,0,0,0|1,1,0]=4 826 B8R0.7 CCSCCNC(=O)C 8c3ea9957cae597313583e7951afded4 [1,1,0,0,0,0|2,0,0]=4 827 B8R0.7 COCCCNC(=O)C 526fcf80a030c8c3912a63af41d08c51 [1,1,0,0,0,0|1,1,0]=4 828 B8R0.7 COCCNCC(=O)C 961ddbf961717199cb7ccbe5fdba9647 [1,1,0,0,0,0|1,1,0]=4 829 B8R0.7 COCCNCC(=O)N 137fcc310030132af81430a136880512 [1,1,0,0,0,0|1,1,0]=4 830 B8R0.7 COCCNCC(=O)O 5ce813bb3dda5e9060aa6f61548b6a1a [1,1,0,0,0,0|0,1,0]=3 831 B8R0.7 COCCOCC(=O)C c43dd4e6beb50da293ecb7edbd68b366 [1,1,0,0,0,0|1,1,0]=4 832 B8R0.7 COCCOCC(=O)N 52e3a5cb41b7881a4ace23e25a8bc04a [1,1,0,0,0,0|1,1,0]=4 833 B8R0.7 COCCOCC(=O)O 003ae303058ace8e592ced58cf4e05e5 [1,1,0,0,0,0|0,1,0]=3 834 B8R0.7 COCCOCS(=O)O 9425fd968f35d546d46a8c1e3b670b55 [1,1,0,0,0,0|1,1,0]=4 835 B8R0.7 COCNCCC(=O)N 75a34d6a21e65f0fa9c3ab03a203332a [1,1,0,0,0,0|1,1,0]=4 836 B8R0.7 COCNCCC(=O)O 6cfc61f9f7468a99c69b381c4067bdfb [1,1,0,0,0,0|0,1,0]=3 837 B8R0.7 COCNCCS(=O)O 9b0f09c32fdad7545dd3373c6db4845f [1,1,0,0,0,0|1,1,0]=4 838 B8R0.7 COCOCCC(=O)C 85ebfe45bbace861b367f83c75d33358 [1,1,0,0,0,0|1,1,0]=4 839 B8R0.7 COCOCCC(=O)N dacd263a3e35c03bcd8f525b496ade95 [1,1,0,0,0,0|1,1,0]=4 840 B8R0.7 COCOCCC(=O)O 1302d1ad564a958c9ef097b350c13897 [1,1,0,0,0,0|0,1,0]=3 841 B8R0.7 CSCCCNC(=O)C f4b4c7d4d652abb45039c5639b312853 [1,1,0,0,0,0|1,0,0]=3 842 B8R0.7 CSCCNCC(=O)C 8b0311856afbb6796c6aad3a263d628d [1,1,0,0,0,0|1,0,0]=3 843 B8R0.7 CSCCNCC(=O)N 4e8fca086c3faa7db23a74b3dfff0f2f [1,1,0,0,0,0|1,0,0]=3 844 B8R0.7 CSCCNCC(=O)O f1b95c9de1a925845087f31bd4bae7df [1,1,0,0,0,0|0,0,0]=2 845 B8R0.7 CSCCNCC(C)O 684b1705ba2238f55a9db5f4eaf48d67 [1,1,0,0,0,0|1,0,1]=4 846 B8R0.7 CSCCNC[C@@H](C)O bc0fd1dc506166a7fd0edef563d937ce [1,1,0,0,0,0|1,0,1]=4 847 B8R0.7 CSCCNC[C@H](C)O db068fc33901ed1895a5d7d51bc4242d [1,1,0,0,0,0|1,0,1]=4 848 B8R0.7 CSCCNC[N+](=O)[O-] 4e94b2e61054a620ea96c1c59120e88c [1,1,0,0,0,0|1,0,1]=4 849 B8R0.7 CSCCOCC(=O)C fd4e693f71d7966351ba22f8108e19ff [1,1,0,0,0,0|1,0,0]=3 850 B8R0.7 CSCCOCC(=O)N c731f0739b7e1ef13acc36f6574a92da [1,1,0,0,0,0|1,0,0]=3 851 B8R0.7 CSCCOCC(=O)O db65161c67ff612db3780dea90f2a2f8 [1,1,0,0,0,0|0,0,0]=2 852 B8R0.7 CSCCOCC(=S)N 8e53e76a280366e5d6cfa827b0973738 [1,1,0,0,0,0|1,1,0]=4 853 B8R0.7 CSCCOCS(=O)O 15541620354d70e96c81747abb1141b3 [1,1,0,0,0,0|1,0,0]=3 854 B8R0.7 CSCCOC[N+](=O)[O-] 2bf267c3fb5b82c38f2e976f242beca6 [1,1,0,0,0,0|1,0,1]=4 855 B8R0.7 CSCNCCC(=O)N 2c9d140685046003cf9f9ad555d9359d [1,1,0,0,0,0|1,0,0]=3 856 B8R0.7 CSCNCCC(=O)O 098fcb068b20e260bdec4c343b4671e9 [1,1,0,0,0,0|0,0,0]=2 857 B8R0.7 CSCNCCC(=S)N 07fc989e9e3a9aa655f41a9b936a37d9 [1,1,0,0,0,0|1,1,0]=4 858 B8R0.7 CSCNCCC(C)O 8079af77e795db5c9b76b0339e48e07c [1,1,0,0,0,0|1,0,1]=4 859 B8R0.7 CSCNCCS(=O)C 584a2850b756fa8cc87b9ef394dad8f0 [1,1,0,0,0,0|2,0,0]=4 860 B8R0.7 CSCNCCS(=O)O 14787ffddc12e16cb93df9154674fbee [1,1,0,0,0,0|1,0,0]=3 861 B8R0.7 CSCNCC[C@@H](C)O 40afe2c009067bdceded9420a01d83c2 [1,1,0,0,0,0|1,0,1]=4 862 B8R0.7 CSCNCC[C@H](C)O f099555ead223e55238d1cd9c176fd2a [1,1,0,0,0,0|1,0,1]=4 863 B8R0.7 CSCOCCC(=O)C b844a3f3dbea733d811f327fadd49286 [1,1,0,0,0,0|1,0,0]=3 864 B8R0.7 CSCOCCC(=O)N 80656c5e91a3a0e1eab18691c1ff654d [1,1,0,0,0,0|1,0,0]=3 865 B8R0.7 CSCOCCC(=O)O 729e28748e361be58000ab33275c6b91 [1,1,0,0,0,0|0,0,0]=2 866 B8R0.7 CSCOCCS(=O)C 36c06b13169a7a72e8a51ac6beeed9ff [1,1,0,0,0,0|2,0,0]=4 867 B8R0.7 CSCOCC[N+](=O)[O-] a8e53e59529e1e59f22f7e8be399ce4a [1,1,0,0,0,0|1,0,1]=4 868 B8R0.7 CSCOCNC(=O)C 30bfc52f57e4ed91a642bf8853a3d4bb [1,1,0,0,0,0|2,0,0]=4 869 B8R0.7 CSCOCNC(=O)N e604504e4304b798bbdf3488c593e93f [1,1,0,0,0,0|2,0,0]=4 870 B8R0.7 N#CCCNCC(=O)O 7bfcf1dd2660ba45e086fc214d0fdf1b [1,1,0,0,0,0|2,0,0]=4 871 B8R0.7 N#CCCOCC(=O)O 913a62d3473039da7a70e24bab5e1d23 [1,1,0,0,0,0|2,0,0]=4 872 B8R0.7 N#CCNCCC(=O)O 26556793ee589201382d4a045c687d03 [1,1,0,0,0,0|2,0,0]=4 873 B8R0.7 N#CCOCCC(=O)O 5682b245006f80100a85fc7fd38aef94 [1,1,0,0,0,0|2,0,0]=4 874 B8R0.7 N#CSCOCC(=O)O f04eba213eb0e16424d9312cff8fec49 [1,1,0,0,0,0|1,0,1]=4 875 B8R0.7 NC(=O)CCCNCF 69e545c202cd7c9a6342c69c6e6a5f59 [1,1,0,0,0,0|2,0,0]=4 876 B8R0.7 NC(=O)CCCNCO f70a60c235672d89293f900a8d9cefa7 [1,1,0,0,0,0|2,0,0]=4 877 B8R0.7 NC(=O)CCCOCF 15f9a4387dce16382a2e493f0dda5b13 [1,1,0,0,0,0|1,1,0]=4 878 B8R0.7 NOCCNCC(=O)O 567becea339978b1d5a450bf35e41e83 [1,1,0,0,0,0|1,1,0]=4 879 B8R0.7 O=C(O)CCCNCF 670cea18bd6ba2b81ceecb2577e1a7ab [1,1,0,0,0,0|1,0,0]=3 880 B8R0.7 O=C(O)CCCNCO 6267c5eeb1933064d917e4e814ad9722 [1,1,0,0,0,0|1,0,0]=3 881 B8R0.7 O=C(O)CCNCCBr 29cc353153febf3a8c067ebc7d4659a9 [1,1,0,0,0,0|2,0,0]=4 882 B8R0.7 O=C(O)CCNCCF cb03b3b8d9be6ed00316ec8fa58ea22d [1,1,0,0,0,0|2,0,0]=4 883 B8R0.7 O=C(O)CCNCCI 1fb0bb507aa993f2a3522c41edc93100 [1,1,0,0,0,0|2,0,0]=4 884 B8R0.7 O=C(O)CCNCCO 7fda1e67c117139da08349807b03ae85 [1,1,0,0,0,0|2,0,0]=4 885 B8R0.7 O=C(O)CCNCCS e7b12ac116347e188c56484ce05a8410 [1,1,0,0,0,0|2,0,0]=4 886 B8R0.7 O=C(O)CCOCCF fcf96ee60132be28c36745264cbf0317 [1,1,0,0,0,0|2,0,0]=4 887 B8R0.7 O=C(O)CCOCCS 61b8e7b02af12e03f8a3747e8eb16780 [1,1,0,0,0,0|2,0,0]=4 888 B8R0.7 O=C(O)CNCCCCl 6975978044558bce000c0ca780485b76 [1,1,0,0,0,0|2,0,0]=4 889 B8R0.7 O=C(O)CNCCCF 69db0caef1002e94499cf44277421fb3 [1,1,0,0,0,0|2,0,0]=4 890 B8R0.7 O=C(O)CNCCCO 15bb30af3bbf0b9503efbda60ef38d51 [1,1,0,0,0,0|2,0,0]=4 891 B8R0.7 O=C(O)CNCCCS 69374183d65b27382aaeea8dfc3bb03c [1,1,0,0,0,0|2,0,0]=4 892 B8R0.7 O=C(O)COCCCF da2984b4de14bdafc90cabbb14713902 [1,1,0,0,0,0|2,0,0]=4 893 B8R0.7 O=C(O)COCCCS b637a7d4aac2c64b554918898eb44811 [1,1,0,0,0,0|2,0,0]=4 894 B8R0.7 O=CCCNCC(=O)O bf4ced9bc1bbfa03663a8c8af093471d [1,1,0,0,0,0|2,0,0]=4 895 B8R0.7 O=CCCOCC(=O)O ef6505414c853b0dfbd12bbe62edb448 [1,1,0,0,0,0|2,0,0]=4 896 B8R0.7 O=CCNCCC(=O)O 2746d5d7d8507565af45509ba7bc6f1c [1,1,0,0,0,0|2,0,0]=4 897 B8R0.7 O=CCOCCC(=O)O de14f86217b2e4a0f4d6c6c831b08e2c [1,1,0,0,0,0|2,0,0]=4 898 B8R0.21 CSCNCS(=O)(=O)O 62363713e894550100cea6b057608371 [1,1,0,0,0,0|2,0,0]=4 899 B8R0.28 C=C(C)CNCC(=O)O d2fb071764818c27006da68838bfc61e [1,1,0,0,0,0|2,0,0]=4 900 B8R0.28 C=C(C)COCC(=O)O 832789ca495f30d4ff4e6ddd8693aa4b [1,1,0,0,0,0|2,0,0]=4 901 B8R0.28 CC(=O)CNCC(=O)O 3b62ba43bac1c68066fe81a9d9795c10 [1,1,0,0,0,0|2,0,0]=4 902 B8R0.28 CC(=O)COCC(=O)O f81228ab107345361ebd98034538304d [1,1,0,0,0,0|2,0,0]=4 903 B8R0.28 CC(C)CNCC(=O)O e07c47544f784e3ece77975eaa39fa62 [1,1,0,0,0,0|2,0,0]=4 904 B8R0.28 CC(C)COCC(=O)O 569b76ca429bc6806415c3ae92c5e81d [1,1,0,0,0,0|2,0,0]=4 905 B8R0.28 CC(C)NCCC(=O)O f0554134cac289d8b7cbdbda8f5830d8 [1,1,0,0,0,0|2,0,0]=4 906 B8R0.28 CC(C)OCCC(=O)O a2f1c0df938b61e89340f22784f5d552 [1,1,0,0,0,0|2,0,0]=4 907 B8R0.28 CC(F)COCC(=O)O 5825b41f210e11c756bbcfb99cc1b006 [1,1,0,0,0,0|2,0,0]=4 908 B8R0.28 CC(O)CNCC(=O)O 0fd36ebbcdac4288c2c1e57036c66736 [1,1,0,0,0,0|2,0,0]=4 909 B8R0.28 CC(S)COCC(=O)O 572404985c8dcbb1715d2ff9748114ee [1,1,0,0,0,0|2,0,0]=4 910 B8R0.28 CN(C)CNCC(=O)O e6fa8314318b79cfd8ae4ca00ea3b758 [1,1,0,0,0,0|2,0,0]=4 911 B8R0.28 CN(C)COCC(=O)O fc3ba42b9747b2743ad7eda51803bfcf [1,1,0,0,0,0|2,0,0]=4 912 B8R0.28 C[C@@H](F)COCC(=O)O d9eb7ecba762e434dc71a2e535d45ab3 [1,1,0,0,0,0|2,0,0]=4 913 B8R0.28 C[C@@H](O)CNCC(=O)O 6173ec4fb928b6f3ec52f242f1027a0f [1,1,0,0,0,0|2,0,0]=4 914 B8R0.28 C[C@H](F)COCC(=O)O 5eaade2b5a7f385567c5eb3b69b32ab7 [1,1,0,0,0,0|2,0,0]=4 915 B8R0.28 C[C@H](O)CNCC(=O)O 369122c3216fc4d9a4a5ea858770fa62 [1,1,0,0,0,0|2,0,0]=4 916 B8R0.2 CCN(C)C(C)C(=O)O 6f2a7033474106426aec9bd9ed3b37aa [1,1,0,0,0,0|2,0,0]=4 917 B8R0.2 CCN(C)[C@@H](C)C(=O)O ccda40b7947e3ec868172b2d11a39e32 [1,1,0,0,0,0|2,0,0]=4 918 B8R0.2 CCN(C)[C@H](C)C(=O)O a423cd91a719c568f85e9128b6162ae1 [1,1,0,0,0,0|2,0,0]=4 919 B8R0.12 CCNC(C)(C)C(=O)O 6a4bebf8bb98ff706835230f86b4cd13 [1,1,0,0,0,0|2,0,0]=4 920 B8R0.15 C#CC(OCC)C(=O)O ad5f5db2dc84c44b6973fc430054569b [1,1,0,0,0,0|2,0,0]=4 921 B8R0.15 C=CC(NCC)C(=O)O b4ac7d60381bf72b1b23118f771cafec [1,1,0,0,0,0|2,0,0]=4 922 B8R0.15 C=C[C@H](NCC)C(=O)O 5c2988d6d8a73101b114f1f85def6c90 [1,1,0,0,0,0|2,0,0]=4 923 B8R0.15 CCNC(CC)C(=O)O 811bed40f759e9415b190b45b938f031 [1,1,0,0,0,0|2,0,0]=4 924 B8R0.15 CCNC(CCl)C(=O)O a1a6122a812437e412d0d064cc9dd1e8 [1,1,0,0,0,0|2,0,0]=4 925 B8R0.15 CCNC(CF)C(=O)O 017cf9dba405ee85cd9a648c4507e326 [1,1,0,0,0,0|2,0,0]=4 926 B8R0.15 CCNC(CO)C(=O)O ebf98372f13717a9df2df682387bdc5a [1,1,0,0,0,0|2,0,0]=4 927 B8R0.15 CCNC(CS)C(=O)O 8d04389a625618eb9889b3cd17b2e8e6 [1,1,0,0,0,0|2,0,0]=4 928 B8R0.15 CCN[C@@H](CC)C(=O)O ad39164e8fc918d5e58308b586171474 [1,1,0,0,0,0|2,0,0]=4 929 B8R0.15 CCN[C@@H](CCl)C(=O)O 81a0c413a80ec8dc4a086548b2e2f8a3 [1,1,0,0,0,0|2,0,0]=4 930 B8R0.15 CCN[C@@H](CO)C(=O)O e2d91799e466e2d5ad0fbeab938b0c5a [1,1,0,0,0,0|2,0,0]=4 931 B8R0.15 CCN[C@@H](CS)C(=O)O ecb0401bca4bb7db9d87809814f9d4f3 [1,1,0,0,0,0|2,0,0]=4 932 B8R0.15 CCN[C@H](CC)C(=O)O f7f7d1d8bf30d5fe2da91fe96021fe3c [1,1,0,0,0,0|2,0,0]=4 933 B8R0.15 CCN[C@H](CCl)C(=O)O 26dcc066f21950a5ba1142c74ad60cbc [1,1,0,0,0,0|2,0,0]=4 934 B8R0.15 CCN[C@H](CO)C(=O)O ceca2f5f870f50fddc0292e18011d619 [1,1,0,0,0,0|2,0,0]=4 935 B8R0.15 CCN[C@H](CS)C(=O)O 7c010ea0d3f5055c0e7214a8d340a87c [1,1,0,0,0,0|2,0,0]=4 936 B8R0.15 CCOC(CC)C(=O)O 382aa920ebdd6f2bbe768902640ad9e2 [1,1,0,0,0,0|2,0,0]=4 937 B8R0.15 CCO[C@@H](CC)C(=O)O 94f5195873e16b29cb1b8369b5daad14 [1,1,0,0,0,0|2,0,0]=4 938 B8R0.15 CCO[C@H](CC)C(=O)O b8c9ca25086a8c61d2a1f7aecbcec13d [1,1,0,0,0,0|2,0,0]=4 939 B8R0.15 CCO[C@H](CF)C(=O)O afbab515ead87d58e6c9f68e24ff80d8 [1,1,0,0,0,0|2,0,0]=4 940 B8R0.23 CC(C)NC(C)C(=O)O 14fb43a096987787a4c4cfde0de411d4 [1,1,0,0,0,0|2,0,0]=4 941 B8R0.23 CC(C)NC(O)C(=O)O 9854a2bbdccc28b8651cc97fd5606c53 [1,1,0,0,0,0|2,0,0]=4 942 B8R0.23 CC(C)N[C@@H](C)C(=O)O 97090174d192ee499ea4beaa2fe31161 [1,1,0,0,0,0|2,0,0]=4 943 B8R0.23 CC(C)N[C@H](C)C(=O)O 1a6c2905adf438d6c173d7efe8c0cadc [1,1,0,0,0,0|2,0,0]=4 944 B8R0.23 CC(C)OC(C)C(=O)O 0a58b34c739ceb5a5963c9b3548f472a [1,1,0,0,0,0|2,0,0]=4 945 B8R0.23 CC(C)O[C@@H](C)C(=O)O 3e6aa85ab276fb2f3b41c452e067b375 [1,1,0,0,0,0|2,0,0]=4 946 B8R0.23 CC(C)O[C@H](C)C(=O)O 3c1a1d8dc45ffece35d6cbe571959a73 [1,1,0,0,0,0|2,0,0]=4 947 B10R0.6 CCCCNC(C)CC(=O)O c633822bdd37960050b77a4c542ea52f [0,1,0,0,0,1|2,0,0]=4 948 B10R0.6 CCCCN[C@@H](C)CC(=O)O fb7944b4d683d296fe4ee273d84f1842 [0,1,0,0,0,1|2,0,0]=4 949 B10R0.6 CCCCN[C@H](C)CC(=O)O effa4168fb691284724307507367e076 [0,1,0,0,0,1|2,0,0]=4 950 B10R0.6 CCCCOC(C)CC(=O)O 7d385d82783db9ce90ee671d43dd6564 [0,1,0,0,0,1|2,0,0]=4 951 B10R0.6 CCCCO[C@@H](C)CC(=O)O e0b1114df9792477e60a032af290ecc0 [0,1,0,0,0,1|2,0,0]=4 952 B10R0.6 CCCCO[C@H](C)CC(=O)O 72d7a585b30718443ba3a12d0dc6335b [0,1,0,0,0,1|2,0,0]=4 953 B10R0.6 CCCNCC(O)CC(=O)O 16b23299f37a8d9496c6c0b6251c38a9 [0,1,0,0,0,1|2,0,0]=4 954 B10R0.6 CCCNC[C@@H](O)CC(=O)O 291cb1436a6d09c088f19d633b5b0ffe [0,1,0,0,0,1|2,0,0]=4 955 B10R0.6 CCCNC[C@H](O)CC(=O)O d3a494af08bc1bf4019a0efd791c0770 [0,1,0,0,0,1|2,0,0]=4 956 B10R0.6 CCSCCN(C)CC(=O)O bf9cb6b97ff05d946ff937b1880a0d94 [0,1,0,0,0,1|2,0,0]=4 957 B10R0.6 COCCNC(C)CC(=O)O 866bf16b62e1dc773e32e16c0e9cd051 [0,1,0,0,0,1|1,1,0]=4 958 B10R0.6 COCCN[C@@H](C)CC(=O)O ec4a659a240a6314aa96b92d2dff1eec [0,1,0,0,0,1|1,1,0]=4 959 B10R0.6 COCCN[C@H](C)CC(=O)O 838f867351d83330c44dc0c28aec25bc [0,1,0,0,0,1|1,1,0]=4 960 B10R0.6 COCCOC(C)CC(=O)O d0e3d911dad40bab8f3555ffc7325db6 [0,1,0,0,0,1|1,1,0]=4 961 B10R0.6 COCCO[C@@H](C)CC(=O)O 47f213839360a14b30232500a6e3a55c [0,1,0,0,0,1|1,1,0]=4 962 B10R0.6 COCCO[C@H](C)CC(=O)O 595ef25f89eca27131e928b5b3eaded7 [0,1,0,0,0,1|1,1,0]=4 963 B10R0.6 COCNCC(O)CC(=O)O 8d44744b4402d927adaa9c95cd9bc254 [0,1,0,0,0,1|1,1,0]=4 964 B10R0.6 COCNC[C@@H](O)CC(=O)O b76f776dd7118b8425bf415bc2ed1004 [0,1,0,0,0,1|1,1,0]=4 965 B10R0.6 COCNC[C@H](O)CC(=O)O 2908c5b804b30593d9e0b74ee60b265a [0,1,0,0,0,1|1,1,0]=4 966 B10R0.6 CSCCCN(C)CC(=O)O fa30553e74200a7f26d562b5c7e9478c [0,1,0,0,0,1|2,0,0]=4 967 B10R0.6 CSCCNC(C)CC(=O)O 9da2962f33fb37a44ca64ede33ad8f52 [0,1,0,0,0,1|1,0,0]=3 968 B10R0.6 CSCCNC(C)OC(=O)C 66f1161f4233855af8cbcc9cacf542f2 [0,1,0,0,0,1|2,0,0]=4 969 B10R0.6 CSCCN[C@@H](C)CC(=O)O 39385d46d0a84bc98fffdcad4c3bc192 [0,1,0,0,0,1|1,0,0]=3 970 B10R0.6 CSCCN[C@H](C)CC(=O)O 1c67020f7e973da201e07f7e06f13cbe [0,1,0,0,0,1|1,0,0]=3 971 B10R0.6 CSCCOC(C)CC(=O)N 04bf6638e4426c41b241958dc8f9838a [0,1,0,0,0,1|2,0,0]=4 972 B10R0.6 CSCCOC(C)CC(=O)O 6911747b09b0e914783455dfa183174e [0,1,0,0,0,1|1,0,0]=3 973 B10R0.6 CSCCOC(C)OC(=O)C e0273c5077d4f522a38d659eff6fb81d [0,1,0,0,0,1|2,0,0]=4 974 B10R0.6 CSCCO[C@@H](C)CC(=O)O 49c5c9a29588caf6c1e9c935784d524d [0,1,0,0,0,1|1,0,0]=3 975 B10R0.6 CSCCO[C@H](C)CC(=O)O 9b88641f60cd511fa1cc0648b62c50b9 [0,1,0,0,0,1|1,0,0]=3 976 B10R0.6 CSCNCC(O)CC(=O)O 02430295015252d5ce860cb307f4f8f9 [0,1,0,0,0,1|1,0,0]=3 977 B10R0.6 CSCNC[C@@H](O)CC(=O)O 8a6322b9af45b16f1d1046e12b2ef258 [0,1,0,0,0,1|1,0,0]=3 978 B10R0.6 CSCNC[C@H](O)CC(=O)O 07989b96aa7c9e9593b7783798d8142b [0,1,0,0,0,1|1,0,0]=3 979 B10R0.6 CSCOCC(C)NC(=O)C c4da42624d2d19f56064336622d3638f [0,1,0,0,0,1|2,0,0]=4 980 B10R0.6 CSCOC[C@@H](C)NC(=O)C 57f158fbb543775acb2fba0756f8fd3c [0,1,0,0,0,1|2,0,0]=4 981 B10R0.18 CCCCC(C)NC(=O)CO 8fb0c98abcb6f3d6cfa770bb2e2f5738 [0,1,0,0,0,1|2,0,0]=4 982 B10R0.18 CCCC[C@@H](C)NC(=O)CO c6508d24c14a6e10519c52d9dd7dd887 [0,1,0,0,0,1|2,0,0]=4 983 B10R0.18 COC(=O)CC(C)NCSC cdda66107a5b35a3aac10bdaabc5f52b [0,1,0,0,0,1|2,0,0]=4 984 B10R0.18 COC(=O)CC(C)OCSC 5018d576511599630996c433e73c3be0 [0,1,0,0,0,1|2,0,0]=4 985 B10R0.18 COC(=O)CN(C)CCSC f8671c9dc0702b2c5c1c90fb11ebc50a [0,1,0,0,0,1|2,0,0]=4 986 B10R0.18 COC(=O)C[C@@H](C)NCSC f46daba204fdf9a330f76bcefe0034d9 [0,1,0,0,0,1|2,0,0]=4 987 B10R0.18 COC(=O)C[C@@H](C)OCSC a17a37ec6dba22de5d256a99dff083c5 [0,1,0,0,0,1|2,0,0]=4 988 B10R0.18 COC(=O)C[C@H](C)NCSC 34d1644a78b65af664dfc96de4bb341e [0,1,0,0,0,1|2,0,0]=4 989 B10R0.18 COC(=O)C[C@H](C)OCSC 907af620fdcb76552de31c0368411809 [0,1,0,0,0,1|2,0,0]=4 990 B10R0.18 CSCCN(C)CC(=O)CO 695f9d0c9cf8842dcb3445eb75c39ac4 [0,1,0,0,0,1|2,0,0]=4 991 B10R0.32 CSCN(C)C(C)CC(=O)O 68933bbed4a91e351096dffbbe3bc632 [0,1,0,0,0,1|2,0,0]=4 992 B10R0.81 CSCCN(C)C(C)C(=O)O 448198022664144d79fcc2bf2bfec915 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CSCN(C)C(C)(C)C(=O)O 3a0badde298a53f5a5c1430817c307cd [0,2,0,0,0,0|2,0,0]=4 1016 B10R0.101 CC[C@@H](C(=O)O)N(C)CSC 8b0f36b0c0d66eae09a26b9dae0e7887 [0,2,0,0,0,0|2,0,0]=4 1017 B10R0.101 CSCN(C)C(CO)C(=O)O e847a180e20bc3fd5f529563f5e57d10 [0,2,0,0,0,0|2,0,0]=4 1018 B10R0.101 CSCN(C)[C@@H](CO)C(=O)O 9f28953d39f2b3f5a5752905f1fdb9ff [0,2,0,0,0,0|2,0,0]=4 1019 B10R0.101 CSCN(C)[C@H](CO)C(=O)O 5f9badfb60e75bddd8d231f8542b8fb7 [0,2,0,0,0,0|2,0,0]=4 1020 B10R0.82 CCC(C)CNC(C)C(=O)O 4eb92c8159a8e92e27f6a629da094686 [0,2,0,0,0,0|2,0,0]=4 1021 B10R0.82 CCC(C)CNC(O)C(=O)O 8d088909e12f440ef3ba7f8984680b08 [0,2,0,0,0,0|2,0,0]=4 1022 B10R0.82 CCC(C)CN[C@@H](C)C(=O)O 65f8ca2265d995518df7c90bed3c39e8 [0,2,0,0,0,0|2,0,0]=4 1023 B10R0.82 CCC(C)CN[C@H](C)C(=O)O f634393dcc7d43fc2a4e85725209b91f [0,2,0,0,0,0|2,0,0]=4 1024 B10R0.82 CCC(C)COC(C)C(=O)O 92249b0717518a8eb4f7cca474352a95 [0,2,0,0,0,0|2,0,0]=4 1025 B10R0.82 CCC(C)CO[C@@H](C)C(=O)O 4a92d3ed2a0783d216a842ac4d2bf860 [0,2,0,0,0,0|2,0,0]=4 1026 B10R0.82 CCC(C)CO[C@H](C)C(=O)O 1522b26b55fe0e6482b3617a23a859f0 [0,2,0,0,0,0|2,0,0]=4 1027 B10R0.82 CCC(C)NCC(C)C(=O)O bdea2ec5eec0145b433afba6681986da [0,2,0,0,0,0|2,0,0]=4 1028 B10R0.82 CCC(C)NCC(F)C(=O)O 0161f5ccc1e16e8bc5d498729794df09 [0,2,0,0,0,0|2,0,0]=4 1029 B10R0.82 CCC(C)NCC(O)C(=O)O 293e6d8f66a18fef6a815196424bc9de [0,2,0,0,0,0|2,0,0]=4 1030 B10R0.82 CCC(C)NC[C@@H](C)C(=O)O 034de03d9b0c033e1f527fcc827c9920 [0,2,0,0,0,0|2,0,0]=4 1031 B10R0.82 CCC(C)NC[C@@H](O)C(=O)O d275a36d8f661427c2f773c6d7e8b01e [0,2,0,0,0,0|2,0,0]=4 1032 B10R0.82 CCC(C)NC[C@H](C)C(=O)O e33ae66e1d2b94e1d8edd8184dcbce51 [0,2,0,0,0,0|2,0,0]=4 1033 B10R0.82 CCC(C)NC[C@H](O)C(=O)O 51f83390d9b74f2cc35f6149417ef947 [0,2,0,0,0,0|2,0,0]=4 1034 B10R0.82 CCC(C)OCC(C)C(=O)O fef51914b5f50b6b3f826860bdf3beec [0,2,0,0,0,0|2,0,0]=4 1035 B10R0.82 CCC(C)OC[C@@H](C)C(=O)O 127aee286a7c8753c9f4a1a8606c7fb6 [0,2,0,0,0,0|2,0,0]=4 1036 B10R0.82 CCC(C)OC[C@H](C)C(=O)O 264348b162bd01bec4c55f35f8b9417d [0,2,0,0,0,0|2,0,0]=4 1037 B10R0.82 CCC(O)CNC(C)C(=O)O 842db4266084ee90405c6773b78ea16f [0,2,0,0,0,0|2,0,0]=4 1038 B10R0.82 CCC(O)CNC(F)C(=O)O 9d51851e66362d1cac2cbd742c53da37 [0,2,0,0,0,0|2,0,0]=4 1039 B10R0.82 CCC(O)CNC(O)C(=O)O 8f1fa7eb99b19b7ec2d0f34265fbf217 [0,2,0,0,0,0|2,0,0]=4 1040 B10R0.82 CCC(O)CN[C@@H](C)C(=O)O 2c0131f8131b95c5d73c3ae6c6762071 [0,2,0,0,0,0|2,0,0]=4 1041 B10R0.82 CCC(O)CN[C@@H](F)C(=O)O ecb8997904a38b1ca31a2bac10e1f340 [0,2,0,0,0,0|2,0,0]=4 1042 B10R0.82 CCC(O)CN[C@H](C)C(=O)O bd0fda6d5373b1a292d99aa701df05d5 [0,2,0,0,0,0|2,0,0]=4 1043 B10R0.82 CC[C@@H](C)CNC(C)C(=O)O 575eb3bae8fcb5528050afed2c29b47f [0,2,0,0,0,0|2,0,0]=4 1044 B10R0.82 CC[C@@H](C)CNC(O)C(=O)O 1fa01bc8a6527e921b693a127579aa93 [0,2,0,0,0,0|2,0,0]=4 1045 B10R0.82 CC[C@@H](C)CN[C@@H](C)C(=O)O 08ef982151edac5e821282d4f7291dcd [0,2,0,0,0,0|2,0,0]=4 1046 B10R0.82 CC[C@@H](C)CN[C@H](C)C(=O)O af0cf6c8321d1433101015c8e04794a3 [0,2,0,0,0,0|2,0,0]=4 1047 B10R0.82 CC[C@@H](C)COC(C)C(=O)O a3162181255be473484b3f444f94ae27 [0,2,0,0,0,0|2,0,0]=4 1048 B10R0.82 CC[C@@H](C)CO[C@@H](C)C(=O)O 795ab94096364a345e1acedfbf9b6292 [0,2,0,0,0,0|2,0,0]=4 1049 B10R0.82 CC[C@@H](C)CO[C@H](C)C(=O)O a25e0758d6efd81d3fefb80b85da1845 [0,2,0,0,0,0|2,0,0]=4 1050 B10R0.82 CC[C@@H](C)NCC(C)C(=O)O 774ecbb59144ae1e06642994989a93ac [0,2,0,0,0,0|2,0,0]=4 1051 B10R0.82 CC[C@@H](C)OCC(C)C(=O)O c4799c6e888f8088ce9a4129b3deced2 [0,2,0,0,0,0|2,0,0]=4 1052 B10R0.82 CC[C@@H](O)CNC(C)C(=O)O 777d6e2f6980f739e97aa87ef5e2acb7 [0,2,0,0,0,0|2,0,0]=4 1053 B10R0.82 CC[C@@H](O)CNC(F)C(=O)O 2f7475f71ab6ad49283c0b18d69bc7bb [0,2,0,0,0,0|2,0,0]=4 1054 B10R0.82 CC[C@@H](O)CN[C@@H](C)C(=O)O 3922255426b7a2756c6e9329c3c09809 [0,2,0,0,0,0|2,0,0]=4 1055 B10R0.82 CC[C@@H](O)CN[C@@H](F)C(=O)O ab9cd36d1b0ccecee9e52b8fb1b13cd1 [0,2,0,0,0,0|2,0,0]=4 1056 B10R0.82 CC[C@@H](O)CN[C@H](C)C(=O)O d5e9a704b546ec22a6c5ec93a85538eb [0,2,0,0,0,0|2,0,0]=4 1057 B10R0.82 CC[C@H](C)CNC(C)C(=O)O b127f8e375319603be9d404268fffe7b [0,2,0,0,0,0|2,0,0]=4 1058 B10R0.82 CC[C@H](C)CNC(O)C(=O)O e881655dade6b5c0776cc38b908364f1 [0,2,0,0,0,0|2,0,0]=4 1059 B10R0.82 CC[C@H](C)CN[C@@H](C)C(=O)O 0ffbe98d72b81e0b7355b65deb2cd4e6 [0,2,0,0,0,0|2,0,0]=4 1060 B10R0.82 CC[C@H](C)CN[C@H](C)C(=O)O 49c6cf7b45c72f8fd1f02aebf1b83aa0 [0,2,0,0,0,0|2,0,0]=4 1061 B10R0.82 CC[C@H](C)COC(C)C(=O)O 758deaa65155705fe3eb8126f381caeb [0,2,0,0,0,0|2,0,0]=4 1062 B10R0.82 CC[C@H](C)CO[C@@H](C)C(=O)O 1c975370f639d3ded1b5347d376d1f3b [0,2,0,0,0,0|2,0,0]=4 1063 B10R0.82 CC[C@H](C)CO[C@H](C)C(=O)O 1c5165ea87b821648abe0dedecd36ec4 [0,2,0,0,0,0|2,0,0]=4 1064 B10R0.82 CC[C@H](C)NCC(C)C(=O)O 168affa2f0797d6cd88a838f2524904b [0,2,0,0,0,0|2,0,0]=4 1065 B10R0.82 CC[C@H](C)OCC(C)C(=O)O 65a44931dc77db5ba367976f49c26c74 [0,2,0,0,0,0|2,0,0]=4 1066 B10R0.82 COC(C)CNC(C)C(=O)O a00d6da07b392557d27e9a19f8aa2612 [0,2,0,0,0,0|1,1,0]=4 1067 B10R0.82 COC(C)CNC(O)C(=O)O 44ac2bc53adc9e34fb3f0a496b860c1f [0,2,0,0,0,0|1,1,0]=4 1068 B10R0.82 COC(C)CN[C@@H](C)C(=O)O 9956a5f1fc555dfc98d9403bbe6ddbe8 [0,2,0,0,0,0|1,1,0]=4 1069 B10R0.82 COC(C)CN[C@H](C)C(=O)O ddb788e5e3d89cbaf266cee7c8477af4 [0,2,0,0,0,0|1,1,0]=4 1070 B10R0.82 COC(C)COC(C)C(=O)O 8d8d3edaed8e0a8b8cfacf0392a7ad48 [0,2,0,0,0,0|1,1,0]=4 1071 B10R0.82 COC(C)CO[C@@H](C)C(=O)O 99694c8233b1c8cbe695e6eebea6a85c [0,2,0,0,0,0|1,1,0]=4 1072 B10R0.82 COC(C)CO[C@H](C)C(=O)O fe439245c80d9e111815e97073c748bc [0,2,0,0,0,0|1,1,0]=4 1073 B10R0.82 CO[C@@H](C)CNC(C)C(=O)O e7b93f49001dad94781e633179f2b13e [0,2,0,0,0,0|1,1,0]=4 1074 B10R0.82 CO[C@@H](C)CNC(O)C(=O)O 1c189a4dc21bdca1b8b628e2c5d8bb73 [0,2,0,0,0,0|1,1,0]=4 1075 B10R0.82 CO[C@@H](C)CN[C@@H](C)C(=O)O 788748faeaf87fe920256de688cc6dd1 [0,2,0,0,0,0|1,1,0]=4 1076 B10R0.82 CO[C@@H](C)CN[C@H](C)C(=O)O 0185549d8ae24b881162fb0f5bbdd8b5 [0,2,0,0,0,0|1,1,0]=4 1077 B10R0.82 CO[C@@H](C)COC(C)C(=O)O 50d94a348338741d1cb44f7f32cc7b6f [0,2,0,0,0,0|1,1,0]=4 1078 B10R0.82 CO[C@@H](C)CO[C@@H](C)C(=O)O ffbbcda4eafa271c19a21be712fbf7db [0,2,0,0,0,0|1,1,0]=4 1079 B10R0.82 CO[C@@H](C)CO[C@H](C)C(=O)O 2094d1464eb78857d08c8c9109327751 [0,2,0,0,0,0|1,1,0]=4 1080 B10R0.82 CO[C@H](C)CNC(C)C(=O)O 351a7b19bda2fa24e59c7bd414332e86 [0,2,0,0,0,0|1,1,0]=4 1081 B10R0.82 CO[C@H](C)CNC(O)C(=O)O a1d809501cb4cfa0d28a1c585deb7d51 [0,2,0,0,0,0|1,1,0]=4 1082 B10R0.82 CO[C@H](C)CN[C@@H](C)C(=O)O 3701a10ecc3a5e3ce7bbc71ca260a2a0 [0,2,0,0,0,0|1,1,0]=4 1083 B10R0.82 CO[C@H](C)CN[C@H](C)C(=O)O 69f8d2eeecd380f85ac5477b7fdd077b [0,2,0,0,0,0|1,1,0]=4 1084 B10R0.82 CO[C@H](C)COC(C)C(=O)O 9fa794d618635bc0b745a3b7757f45ae [0,2,0,0,0,0|1,1,0]=4 1085 B10R0.82 CO[C@H](C)CO[C@@H](C)C(=O)O 241dc2a8613f109f08111f20a81bc84f [0,2,0,0,0,0|1,1,0]=4 1086 B10R0.82 CO[C@H](C)CO[C@H](C)C(=O)O d6c72d8d180605446b8ba589939e6fc6 [0,2,0,0,0,0|1,1,0]=4 1087 B10R0.19 CCOC(=O)C(C)OCSC cd91fd18a612d8c5c10fbf2ba48318b3 [0,2,0,0,0,0|2,0,0]=4 1088 B10R0.19 CCOC(=O)[C@@H](C)NCSC dbc28556b9a8bc59336f0af509aa4836 [0,2,0,0,0,0|2,0,0]=4 1089 B10R0.19 CCOC(=O)[C@@H](C)OCSC b356af9367a0d09fe45fe2ecf2a2739c [0,2,0,0,0,0|2,0,0]=4 1090 B10R0.19 CCOC(=O)[C@H](C)OCSC 83fc4e59b76985b825fcf4c9a31c6b4b [0,2,0,0,0,0|2,0,0]=4 1091 B10R0.19 COCC(=O)N(C)CCSC 8e50c924d1a9b2f048730c583e3aca95 [0,2,0,0,0,0|2,0,0]=4 1092 B10R0.19 CSCCC(O)C(=O)NC#N 72983e218625688cd1ae920291d32535 [0,2,0,0,0,0|2,0,0]=4 1093 B10R0.19 CSCCN(C)C(=O)CCO 4f0ee50ceadfd24b697f4808acc587f2 [0,2,0,0,0,0|2,0,0]=4 1094 B10R0.19 CSCCN(C)C(=O)CON 4497692cfabb40c7f2ac9f7ec5dbc05c [0,2,0,0,0,0|2,0,0]=4 1095 B10R0.83 C=C(COCSC)C(=O)OC c53ece4131e94127b69b984202f5afdb [0,2,0,0,0,0|1,0,1]=4 1096 B10R0.83 CCC(=O)C(C)NCCSC 6c5ef062c68e2f208748e59453256ae9 [0,2,0,0,0,0|2,0,0]=4 1097 B10R0.83 CCC(=O)C(C)OCCSC f14e380f058d5f1848e720b7c941cdc4 [0,2,0,0,0,0|2,0,0]=4 1098 B10R0.83 CCCCNC(C)C(=O)OC f0cedc72d611e5d88715cb6708e886af [0,2,0,0,0,0|2,0,0]=4 1099 B10R0.83 CCCCN[C@@H](C)C(=O)OC 7afc25d414d6cde30252e45be2eeb676 [0,2,0,0,0,0|2,0,0]=4 1100 B10R0.83 CCCCN[C@H](C)C(=O)OC 3972d17c83b9b022852f0d979b569e04 [0,2,0,0,0,0|2,0,0]=4 1101 B10R0.83 CCCCOC(C)C(=O)OC 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[0,2,0,0,0,0|1,0,0]=3 1124 B10R0.83 COC(=O)[C@H](C)NCCSC f55d171a074ec37771317d2fcd9edc80 [0,2,0,0,0,0|1,0,0]=3 1125 B10R0.83 COC(=O)[C@H](C)OCCSC 9845868d7cd032053781a7742087d2f9 [0,2,0,0,0,0|1,0,0]=3 1126 B10R0.83 COCCNC(C)C(=O)OC 971cf464d5e6b8323364633a9f685a0a [0,2,0,0,0,0|1,1,0]=4 1127 B10R0.83 COCCN[C@@H](C)C(=O)OC 67c0e2f4770f286fed834d538fcb8a57 [0,2,0,0,0,0|1,1,0]=4 1128 B10R0.83 COCCN[C@H](C)C(=O)OC c34895b1db5a4cceec0379f09eb4847d [0,2,0,0,0,0|1,1,0]=4 1129 B10R0.83 COCCOC(C)C(=O)OC 379d51733730910d72c5c8847318c8ad [0,2,0,0,0,0|1,1,0]=4 1130 B10R0.83 COCCO[C@@H](C)C(=O)OC da6c9345cfc43665bfcc63b5d9a3ba02 [0,2,0,0,0,0|1,1,0]=4 1131 B10R0.83 COCCO[C@H](C)C(=O)OC 192c4e41c94d2e820bad42a20000c01c [0,2,0,0,0,0|1,1,0]=4 1132 B10R0.83 COCNCC(C)C(=O)OC 3857f9fa450575c6ceda863771bc2501 [0,2,0,0,0,0|1,1,0]=4 1133 B10R0.83 COCOCC(C)C(=O)OC fc93484545fa349b5fa9e49db9dab325 [0,2,0,0,0,0|1,1,0]=4 1134 B10R0.83 COCOCC(F)C(=O)OC 2e8e882fda34b821f22d55b25d2e8858 [0,2,0,0,0,0|1,1,0]=4 1135 B10R0.83 COCOC[C@@H](C)C(=O)OC 28ab83cd99d557f48c8b1c4d24c81495 [0,2,0,0,0,0|1,1,0]=4 1136 B10R0.83 COCOC[C@H](C)C(=O)OC 9127cf117857859e2bffc29b9f4c86b5 [0,2,0,0,0,0|1,1,0]=4 1137 B10R0.85 C=CC(OCSC)C(=O)OC e3430d6da206de3481c62589ce1d9123 [0,2,0,0,0,0|2,0,0]=4 1138 B10R0.85 CCC(NCSC)C(=O)NO 7918b03e8d1f792e39598214d4104365 [0,2,0,0,0,0|2,0,0]=4 1139 B10R0.85 CCC(OCSC)C(=O)OC 2d9b93e93162563f98303c78a32753f4 [0,2,0,0,0,0|2,0,0]=4 1140 B10R0.85 CC[C@@H](NCSC)C(=O)OC cd04724eeb2cd60eb8b551efe98fd33e [0,2,0,0,0,0|2,0,0]=4 1141 B10R0.85 CC[C@@H](OCSC)C(=O)OC 456d8d34330d76ee7f5d0dd0f27881be [0,2,0,0,0,0|2,0,0]=4 1142 B10R0.85 CC[C@H](NCSC)C(=O)OC b59162f3d8f1d347734b2da88177a84c [0,2,0,0,0,0|2,0,0]=4 1143 B10R0.85 CC[C@H](OCSC)C(=O)OC 11db6b0951f32bb3cbec4c8449105aeb [0,2,0,0,0,0|2,0,0]=4 1144 B10R0.85 COC(=O)C(C#N)NCSC 1e8d4ff94d99e6d3e867205fe2399780 [0,2,0,0,0,0|1,0,1]=4 1145 B10R0.85 COC(=O)C(C#N)OCSC 8424e00a3b0453052fb200f172cb3f87 [0,2,0,0,0,0|1,0,1]=4 1146 B10R0.85 COC(=O)C(CO)NCSC 1d033a99f1cae2a8db0794f277e7ce5e [0,2,0,0,0,0|2,0,0]=4 1147 B10R0.85 COC(=O)C(OC)OCSC adf01d7f2b78f7dab650786cd716f1aa [0,2,0,0,0,0|2,0,0]=4 1148 B10R0.85 COC(=O)[C@@H](CO)NCSC 3375e2f3b6b329fe11a638d6555e5765 [0,2,0,0,0,0|2,0,0]=4 1149 B10R0.85 COC(=O)[C@H](CO)NCSC 68d8a2dbbe03018a4342a37e46b8a180 [0,2,0,0,0,0|2,0,0]=4 1150 B10R0.85 CSCNC(CO)C(=O)NO b8ccbdb9fe6a0880ad4b1f22b3c30a14 [0,2,0,0,0,0|2,0,0]=4 1151 B10R0.124 COC(=O)C(C)(C)NCSC d18ee9475aeca6a786bbf0c833e99bae [0,2,0,0,0,0|2,0,0]=4 1152 B10R0.17 CCOCC(C(=O)O)N(C)C 51e494dde183ff785440b48739abadf4 [0,2,0,0,0,0|2,0,0]=4 1153 B10R0.17 CCOC[C@@H](C(=O)O)N(C)C 7fbaf6403582375900900cd1284e7590 [0,2,0,0,0,0|2,0,0]=4 1154 B10R0.17 CSCNC(C(=O)N)C(=O)N 16d09d595ef16e5ad691b25c2f74a7de [0,2,0,0,0,0|2,0,0]=4 1155 B10R0.17 CSCNC(C(=O)O)C(=O)O 63d40876f94fcc5ccdc41a2d5ef97f28 [0,2,0,0,0,0|2,0,0]=4 1156 B10R0.17 CSCNC(C(=O)O)C(C)C ba38809b04f0c0ea45334ab4e0c26157 [0,2,0,0,0,0|2,0,0]=4 1157 B10R0.17 CSCNC(C(=O)O)C(C)F 5ef41f2301e25d2a95f4806ce626c220 [0,2,0,0,0,0|2,0,0]=4 1158 B10R0.17 CSCNC(C(=O)O)C(C)O 929f61bfa3d7428d43c79a1be8a3630e [0,2,0,0,0,0|2,0,0]=4 1159 B10R0.17 CSCNC(C(=O)O)[C@H](C)O ad536908b6e545dc7b816a0b96418cdb [0,2,0,0,0,0|2,0,0]=4 1160 B10R0.17 CSCN[C@@H](C(=O)O)C(C)C 0993629419b355cb7192adea3e7ad127 [0,2,0,0,0,0|2,0,0]=4 1161 B10R0.17 CSCN[C@@H](C(=O)O)[C@@H](C)O 066a1d87b347233a6e61f2dc49087ec5 [0,2,0,0,0,0|2,0,0]=4 1162 B10R0.17 CSCN[C@@H](C(=O)O)[C@H](C)O c4c2622d74b32c83cb2c00158f98be34 [0,2,0,0,0,0|2,0,0]=4 1163 B10R0.17 CSCN[C@H](C(=O)O)C(C)C 0405f950142d69c7b9203f14889fe8d6 [0,2,0,0,0,0|2,0,0]=4 1164 B10R0.17 CSCN[C@H](C(=O)O)[C@@H](C)O 18e5a1a7ad663be1aa5f080fae2f77e7 [0,2,0,0,0,0|2,0,0]=4 1165 B10R0.17 CSCN[C@H](C(=O)O)[C@H](C)O b928f21a48ef1ff4bc90597a809abe27 [0,2,0,0,0,0|2,0,0]=4 1166 B10R0.17 CSCOC(C(=O)O)C(=O)O 63b402c562019b62d7fbe3d57f0eec26 [0,2,0,0,0,0|2,0,0]=4 1167 B10R0.17 CSCOC(C(=O)O)C(C)C dcdacc8bcf0d9367d4be07b702789a55 [0,2,0,0,0,0|2,0,0]=4 1168 B10R0.17 CSCO[C@@H](C(=O)O)C(C)C 5e0524532e8996f5b9c6a7658fc92ff7 [0,2,0,0,0,0|2,0,0]=4 1169 B10R0.17 CSCO[C@H](C(=O)O)C(C)C f98b0ab2da95516cf802ab8cad1de5d1 [0,2,0,0,0,0|2,0,0]=4 1170 B10R0.86 C#CC(OCCCC)C(=O)O 836085c35bc212c8b9fc4c10308f4e60 [0,2,0,0,0,0|2,0,0]=4 1171 B10R0.86 C#CC(OCCOC)C(=O)O ab11b662e17dc15d25704dc7d1ecc6b1 [0,2,0,0,0,0|1,1,0]=4 1172 B10R0.86 C#CC(OCCSC)C(=O)O 0a9ccba9ab94285c2333bae75e356a67 [0,2,0,0,0,0|1,0,0]=3 1173 B10R0.86 C/C=C(\OCCSC)/C(=O)O cf7cb4b5126e55c08c950552d332a992 [0,2,0,0,0,0|1,0,1]=4 1174 B10R0.86 C=CC(NCCCC)C(=O)O da5926850cba2bee635639e54e439153 [0,2,0,0,0,0|2,0,0]=4 1175 B10R0.86 C=CC(NCCOC)C(=O)O b602ccac4aba7532fa7968bd72e483ed [0,2,0,0,0,0|1,1,0]=4 1176 B10R0.86 C=CC(NCCSC)C(=O)O 6e8610819c706307089a11f8320922e2 [0,2,0,0,0,0|1,0,0]=3 1177 B10R0.86 C=C[C@H](NCCCC)C(=O)O 4684c45a6d2cd39abe7f6a2f3997e9b6 [0,2,0,0,0,0|2,0,0]=4 1178 B10R0.86 C=C[C@H](NCCOC)C(=O)O f2b5e37784686984250044ec056419c1 [0,2,0,0,0,0|1,1,0]=4 1179 B10R0.86 C=C[C@H](NCCSC)C(=O)O 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C[C@H](CNCCCF)C(=O)O 17a102b54c5459c5476cb8f8a74d692c [0,2,0,0,0,0|2,0,0]=4 1579 B10R0.75 C[C@H](CNCCCO)C(=O)O af7a2c0a7f68894696358259f3b6617c [0,2,0,0,0,0|2,0,0]=4 1580 B10R0.75 C[C@H](CNCCCS)C(=O)O dfc2557c0615b0f77f17da932856b1c0 [0,2,0,0,0,0|2,0,0]=4 1581 B10R0.75 C[C@H](CNCSC#N)C(=O)O 0a854e3271007bde6e3cb20564a557ae [0,2,0,0,0,0|1,0,1]=4 1582 B10R0.75 C[C@H](COCCCF)C(=O)O 33550bbb64f3c931bdd974414d3aaee6 [0,2,0,0,0,0|2,0,0]=4 1583 B10R0.75 C[C@H](COCCCS)C(=O)O bae2089bb8473bc491cd066708a4f551 [0,2,0,0,0,0|2,0,0]=4 1584 B10R0.75 C[C@H](COCSC#N)C(=O)O e8a164f995ea3517e15703c98c47a4d5 [0,2,0,0,0,0|1,0,1]=4 1585 B10R0.75 C[C@H](NCCCCCl)C(=O)O 122350c1c341412d0d43bd05ab68f9e0 [0,2,0,0,0,0|2,0,0]=4 1586 B10R0.75 C[C@H](NCCCCF)C(=O)O 675b37b8e4240ba1491fee21927eb746 [0,2,0,0,0,0|2,0,0]=4 1587 B10R0.75 C[C@H](NCCCCO)C(=O)O c445a3e289904fa28e5ba8b7bd4aacc8 [0,2,0,0,0,0|2,0,0]=4 1588 B10R0.75 C[C@H](NCCCCS)C(=O)O bb4ebed3985048c148ce32657f9fd33f [0,2,0,0,0,0|2,0,0]=4 1589 B10R0.75 C[C@H](OCCCCF)C(=O)O d2b1e0a5c7f8bd0102a1a298b58e5b2c [0,2,0,0,0,0|2,0,0]=4 1590 B10R0.75 N#CCNCCC(F)C(=O)O 9393a0347c870d0ac0ef10c3a50fabb8 [0,2,0,0,0,0|2,0,0]=4 1591 B10R0.75 N#CCNCCC(O)C(=O)O 43f1fa689604829a8a7e0df90ca64aa2 [0,2,0,0,0,0|2,0,0]=4 1592 B10R0.75 N#CCNCC[C@H](O)C(=O)O 472b824343ea871b59e3f116dd12ee9d [0,2,0,0,0,0|2,0,0]=4 1593 B10R0.75 N#CSCNCC(O)C(=O)O 1f080dca1c4e521e9fbc5b68e5d99089 [0,2,0,0,0,0|1,0,1]=4 1594 B10R0.75 N#CSCNC[C@@H](O)C(=O)O 97d040ee5defc62a641ec06cdd720480 [0,2,0,0,0,0|1,0,1]=4 1595 B10R0.75 N#CSCNC[C@H](O)C(=O)O d6e2b4cebbfc1feb2c7adb8f8008a672 [0,2,0,0,0,0|1,0,1]=4 1596 B10R0.75 O=C(O)C(F)CCNCCF 4ccf6598a98a805d36ad248e4e66b97b [0,2,0,0,0,0|2,0,0]=4 1597 B10R0.75 O=C(O)C(F)CCNCCO 6284eef18fff078bdb29bdcabf6b8200 [0,2,0,0,0,0|2,0,0]=4 1598 B10R0.75 O=C(O)C(F)CCNCCS 5558b8f50ca34248e13f5e8583739b75 [0,2,0,0,0,0|2,0,0]=4 1599 B10R0.75 O=C(O)C(F)CNCCCF d05f494229698c5e2652e06b84e91376 [0,2,0,0,0,0|2,0,0]=4 1600 B10R0.75 O=C(O)C(F)CNCCCO 0f7c210c6b81e67050df7be2311e4e99 [0,2,0,0,0,0|2,0,0]=4 1601 B10R0.75 O=C(O)C(O)CCNCCF 4eb0444245ea8711907e9cdaf00db0c3 [0,2,0,0,0,0|2,0,0]=4 1602 B10R0.75 O=C(O)C(O)CCNCCO 0952715bb656ef532bbecdab0d049b07 [0,2,0,0,0,0|2,0,0]=4 1603 B10R0.75 O=C(O)C(O)CCNCCS 93c36a2dc59fa90922b20f7d6fbf0ea8 [0,2,0,0,0,0|2,0,0]=4 1604 B10R0.75 O=C(O)C(O)CNCCCCl 86d7e8d3961ebb1ffff2964d1772bd29 [0,2,0,0,0,0|2,0,0]=4 1605 B10R0.75 O=C(O)C(O)CNCCCF 1e58e7140990d6ee8017d30500a489fc [0,2,0,0,0,0|2,0,0]=4 1606 B10R0.75 O=C(O)C(O)CNCCCO 92b6e20acc84dc533dc1e855781bebab [0,2,0,0,0,0|2,0,0]=4 1607 B10R0.75 O=C(O)C(O)CNCCCS 97cbab7ccd7500f5a7839d1ba50310ea [0,2,0,0,0,0|2,0,0]=4 1608 B10R0.75 O=C(O)C(O)NCCCCF a0563fa24d766451d7c8fc60ccc8f954 [0,2,0,0,0,0|2,0,0]=4 1609 B10R0.75 O=C(O)C(O)NCCCCO 7110ba7b7e3eb0eb4f8d0bf7331edb9e [0,2,0,0,0,0|2,0,0]=4 1610 B10R0.75 O=C(O)[C@@H](O)CCNCCF e50bd41a53efd9c0ab24c17df2012f7f [0,2,0,0,0,0|2,0,0]=4 1611 B10R0.75 O=C(O)[C@@H](O)CCNCCO 10b541f576ed1c87d335faf8a6b596b0 [0,2,0,0,0,0|2,0,0]=4 1612 B10R0.75 O=C(O)[C@@H](O)CCNCCS 3c3c7040da611de8eafc6903b31a0bf3 [0,2,0,0,0,0|2,0,0]=4 1613 B10R0.75 O=C(O)[C@@H](O)CNCCCCl f128c0c5fa5a2be7a3ae81211c775d1f [0,2,0,0,0,0|2,0,0]=4 1614 B10R0.75 O=C(O)[C@@H](O)CNCCCF 2c7e1b555185bedc525cdbd0c21f229e [0,2,0,0,0,0|2,0,0]=4 1615 B10R0.75 O=C(O)[C@@H](O)CNCCCO 0909269fe45f5137d6876ff98e19d727 [0,2,0,0,0,0|2,0,0]=4 1616 B10R0.75 O=C(O)[C@@H](O)CNCCCS 1f4cf1497dfea99a4a0221cefee37a86 [0,2,0,0,0,0|2,0,0]=4 1617 B10R0.75 O=C(O)[C@H](O)CNCCCF bf00b75790ea63119fc32841cac21ae2 [0,2,0,0,0,0|2,0,0]=4 1618 B10R0.75 O=C(O)[C@H](O)CNCCCO 13b6a75e1d8201592c2b3cd65e45cd45 [0,2,0,0,0,0|2,0,0]=4 1619 B10R0.75 O=C(O)[C@H](O)CNCCCS 9a349ef4aaa19c39cd57ddd5f09fc89f [0,2,0,0,0,0|2,0,0]=4 1620 B10R0.75 O=CCNCCC(F)C(=O)O ee7fbccd1dea8623de26b1624959e028 [0,2,0,0,0,0|2,0,0]=4 1621 B10R0.75 O=CCNCCC(O)C(=O)O 6d67b2ec2810e4b9ae66ac5ae4999b3c [0,2,0,0,0,0|2,0,0]=4 1622 B10R0.75 O=CCNCC[C@H](O)C(=O)O bf4b81d852a9d133443871fedd2323cc [0,2,0,0,0,0|2,0,0]=4 1623 B10R0.98 C=C(C)CCNC(C)C(=O)O b0e0e4fd1004d6886a2c7bb1bac44ff4 [0,2,0,0,0,0|2,0,0]=4 1624 B10R0.98 C=C(C)CCNC(O)C(=O)O 3a381811292a13207580c8c58da3c06c [0,2,0,0,0,0|2,0,0]=4 1625 B10R0.98 C=C(C)CCN[C@@H](C)C(=O)O cf4d2e83ba1da80531ea16678389966e [0,2,0,0,0,0|2,0,0]=4 1626 B10R0.98 C=C(C)CCN[C@H](C)C(=O)O c39d41be1a4b65b510a7cd65818f6800 [0,2,0,0,0,0|2,0,0]=4 1627 B10R0.98 C=C(C)CNCC(C)C(=O)O 6d7030fcc19440f6f3be5ef4d03704b2 [0,2,0,0,0,0|2,0,0]=4 1628 B10R0.98 C=C(C)CNCC(F)C(=O)O 539b77e968f4d5cba623a31a349483a1 [0,2,0,0,0,0|2,0,0]=4 1629 B10R0.98 C=C(C)CNCC(O)C(=O)O 0c7f2cbe370bf8fdbddb195b6140866f [0,2,0,0,0,0|2,0,0]=4 1630 B10R0.98 C=C(C)CNC[C@@H](C)C(=O)O e218a48bfdebd811193dbefbb7dc4953 [0,2,0,0,0,0|2,0,0]=4 1631 B10R0.98 C=C(C)CNC[C@@H](O)C(=O)O 943a88840b3dce10afd255b47022e5f7 [0,2,0,0,0,0|2,0,0]=4 1632 B10R0.98 C=C(C)CNC[C@H](C)C(=O)O 0120729daa22b2e6616ba9fafb81b145 [0,2,0,0,0,0|2,0,0]=4 1633 B10R0.98 C=C(C)CNC[C@H](O)C(=O)O 297d2359ccb87cf853bd202bbfbfe49c [0,2,0,0,0,0|2,0,0]=4 1634 B10R0.98 C=C(C)COCC(C)C(=O)O 93baf4cba2d031846073fe0ce8d4d86e [0,2,0,0,0,0|2,0,0]=4 1635 B10R0.98 C=C(C)COC[C@@H](C)C(=O)O 51e76c87bd8016021d24b2282fff3b6c [0,2,0,0,0,0|2,0,0]=4 1636 B10R0.98 C=C(C)COC[C@H](C)C(=O)O eec220459a8fb63a795115bd99bf9531 [0,2,0,0,0,0|2,0,0]=4 1637 B10R0.98 CC(=O)CCNC(C)C(=O)O 8e4e9c3c70905b84712bdb23a0427cae [0,2,0,0,0,0|2,0,0]=4 1638 B10R0.98 CC(=O)CCNC(O)C(=O)O ba99921a597f6d9aeff2bb5cc0b7c37b [0,2,0,0,0,0|2,0,0]=4 1639 B10R0.98 CC(=O)CCN[C@@H](C)C(=O)O d60350eed36d575275c9bf8e2a044697 [0,2,0,0,0,0|2,0,0]=4 1640 B10R0.98 CC(=O)CCN[C@H](C)C(=O)O 3bf033668f6750d363fc3f9c01917cda [0,2,0,0,0,0|2,0,0]=4 1641 B10R0.98 CC(=O)CNCC(C)C(=O)O 954f59d2a15bcc577e78fb0280f85f2d [0,2,0,0,0,0|2,0,0]=4 1642 B10R0.98 CC(=O)CNCC(O)C(=O)O 436043327e17179b869da8149709b3ca [0,2,0,0,0,0|2,0,0]=4 1643 B10R0.98 CC(=O)CNC[C@H](O)C(=O)O 9245e0f36479d27493764ee57f2273cf [0,2,0,0,0,0|2,0,0]=4 1644 B10R0.98 CC(=O)COCC(C)C(=O)O 2c26bd0abfa54a0d285268c0f23477b3 [0,2,0,0,0,0|2,0,0]=4 1645 B10R0.98 CC(C)CCNC(C)C(=O)O 7c356ad363206dbfb94332f95583e6c7 [0,2,0,0,0,0|2,0,0]=4 1646 B10R0.98 CC(C)CCNC(F)C(=O)O f6005c29c218d3678403207954439f46 [0,2,0,0,0,0|2,0,0]=4 1647 B10R0.98 CC(C)CCNC(O)C(=O)O ff9959618e255f3f01dc630482dc2c11 [0,2,0,0,0,0|2,0,0]=4 1648 B10R0.98 CC(C)CCN[C@@H](C)C(=O)O 48ba99fb8c9035c214263be063bd2701 [0,2,0,0,0,0|2,0,0]=4 1649 B10R0.98 CC(C)CCN[C@@H](F)C(=O)O 9d323772148a29581c5add33b310acbe [0,2,0,0,0,0|2,0,0]=4 1650 B10R0.98 CC(C)CCN[C@H](C)C(=O)O 44604275ff37ce77d5b1b9d5fa5ff127 [0,2,0,0,0,0|2,0,0]=4 1651 B10R0.98 CC(C)CCOC(C)C(=O)O be1540d3490c421fbd3facefcdcb90fd [0,2,0,0,0,0|2,0,0]=4 1652 B10R0.98 CC(C)CCO[C@@H](C)C(=O)O ba67932c38534671015a4b563b780481 [0,2,0,0,0,0|2,0,0]=4 1653 B10R0.98 CC(C)CCO[C@H](C)C(=O)O d9f942a525d318084f970825882bd429 [0,2,0,0,0,0|2,0,0]=4 1654 B10R0.98 CC(C)CNCC(C)C(=O)O 0b0cb0a7503d34784ba06d7d95f6634c [0,2,0,0,0,0|2,0,0]=4 1655 B10R0.98 CC(C)CNCC(F)C(=O)O 92d5e0d6cc951e6812b9f57639c63b18 [0,2,0,0,0,0|2,0,0]=4 1656 B10R0.98 CC(C)CNCC(O)C(=O)O 5b8d0e09a6ebcfe17a385e0e3323b2bf [0,2,0,0,0,0|2,0,0]=4 1657 B10R0.98 CC(C)CNC[C@@H](C)C(=O)O 6a925fecbce36afb11f9e9dbec22cc1b [0,2,0,0,0,0|2,0,0]=4 1658 B10R0.98 CC(C)CNC[C@@H](O)C(=O)O 9c20323571595ca9c54ab9cdd94bfd43 [0,2,0,0,0,0|2,0,0]=4 1659 B10R0.98 CC(C)CNC[C@H](C)C(=O)O cab4ff6dd2f5e01b6768fb9f7000ee34 [0,2,0,0,0,0|2,0,0]=4 1660 B10R0.98 CC(C)CNC[C@H](O)C(=O)O ab12d78643289439e18248e8323c6d84 [0,2,0,0,0,0|2,0,0]=4 1661 B10R0.98 CC(C)COCC(C)C(=O)O ba81c91813524d0a838dd0f8d05e5930 [0,2,0,0,0,0|2,0,0]=4 1662 B10R0.98 CC(C)COC[C@@H](C)C(=O)O 1bb47428e3f080db3944f5e2f3e90f8e [0,2,0,0,0,0|2,0,0]=4 1663 B10R0.98 CC(C)COC[C@H](C)C(=O)O 2af5f914f748091ae0a1a311627fbff5 [0,2,0,0,0,0|2,0,0]=4 1664 B10R0.98 CC(C)NCCC(F)C(=O)O ea3d1382e2b9e5afad75160f921fad81 [0,2,0,0,0,0|2,0,0]=4 1665 B10R0.98 CC(C)NCCC(O)C(=O)O 0cba2410a56cef65b53fd774b6460b7f [0,2,0,0,0,0|2,0,0]=4 1666 B10R0.98 CC(C)NCC[C@H](O)C(=O)O 83ba59224d375c4b4e4f80a59ab8ae66 [0,2,0,0,0,0|2,0,0]=4 1667 B10R0.98 CC(CNCN(C)C)C(=O)O 213750ceeae1d369aad689af6c1bf9ae [0,2,0,0,0,0|2,0,0]=4 1668 B10R0.98 CC(CNC[C@@H](C)O)C(=O)O ffe68cb1cf0529caaa32b5ba68082474 [0,2,0,0,0,0|2,0,0]=4 1669 B10R0.98 CC(CNC[C@H](C)O)C(=O)O a962ee6d5b3f33d87f0d30f2c111752e [0,2,0,0,0,0|2,0,0]=4 1670 B10R0.98 CC(COCN(C)C)C(=O)O 5cd13e6071876187ae464796073204b1 [0,2,0,0,0,0|2,0,0]=4 1671 B10R0.98 CC(COC[C@@H](C)F)C(=O)O 6949c7cbec4c67294d263be2ec088e82 [0,2,0,0,0,0|2,0,0]=4 1672 B10R0.98 CC(COC[C@H](C)F)C(=O)O 836e4ef4a1a8ace58256e7da791d59d3 [0,2,0,0,0,0|2,0,0]=4 1673 B10R0.98 CC(F)COCC(C)C(=O)O 923ad77f456d61932ce4501e8973646c [0,2,0,0,0,0|2,0,0]=4 1674 B10R0.98 CC(NCCN(C)C)C(=O)O 7380cfb246c886a987b5ad1a20ced6c3 [0,2,0,0,0,0|2,0,0]=4 1675 B10R0.98 CC(NCCS(=O)C)C(=O)O 306b67e794af77d21b929b474f996277 [0,2,0,0,0,0|1,0,1]=4 1676 B10R0.98 CC(NCC[C@@H](C)O)C(=O)O 638961694cac5e25f25d04059f80c1a9 [0,2,0,0,0,0|2,0,0]=4 1677 B10R0.98 CC(NCC[C@H](C)O)C(=O)O 2d97e4d1f6ba82375be6c755b78c46eb [0,2,0,0,0,0|2,0,0]=4 1678 B10R0.98 CC(O)CCNC(C)C(=O)O 743b5734155aeab8ecffa661a084279c [0,2,0,0,0,0|2,0,0]=4 1679 B10R0.98 CC(O)CCNC(O)C(=O)O be3cf1c12d7146c585c7826c8ff136a7 [0,2,0,0,0,0|2,0,0]=4 1680 B10R0.98 CC(O)CCN[C@@H](C)C(=O)O a5c032a819ad3e0025084766595db654 [0,2,0,0,0,0|2,0,0]=4 1681 B10R0.98 CC(O)CCN[C@H](C)C(=O)O 61a886134e1419c4544db8972f045789 [0,2,0,0,0,0|2,0,0]=4 1682 B10R0.98 CC(O)CNCC(C)C(=O)O e7c0bd85618ac399022dcc03d155a9ea [0,2,0,0,0,0|2,0,0]=4 1683 B10R0.98 CC(O)CNCC(F)C(=O)O ad990f9b168674ea86858ed366045894 [0,2,0,0,0,0|2,0,0]=4 1684 B10R0.98 CC(O)CNCC(O)C(=O)O 6ebf935f011517db5e449ff45bfbf5cb [0,2,0,0,0,0|2,0,0]=4 1685 B10R0.98 CC(O)CNC[C@@H](C)C(=O)O 3ba58d29337007268cf5f2174d0140a4 [0,2,0,0,0,0|2,0,0]=4 1686 B10R0.98 CC(O)CNC[C@@H](O)C(=O)O 8ea4ffbf11b3d19125aeccde6aa89209 [0,2,0,0,0,0|2,0,0]=4 1687 B10R0.98 CC(O)CNC[C@H](C)C(=O)O 4aeb5c3a58d1eaa2866c19c740d1971e [0,2,0,0,0,0|2,0,0]=4 1688 B10R0.98 CC(O)CNC[C@H](O)C(=O)O 5d36e921426db3e3411c7b046bd1ef69 [0,2,0,0,0,0|2,0,0]=4 1689 B10R0.98 CC(S)COCC(C)C(=O)O 2325ba542c3fe88d083ae7b520c50117 [0,2,0,0,0,0|2,0,0]=4 1690 B10R0.98 CN(C)CCNC(O)C(=O)O f5f9540bf9be2cee677924fa8124b574 [0,2,0,0,0,0|2,0,0]=4 1691 B10R0.98 CN(C)CNCC(F)C(=O)O 39a47bbcba8c123f0d3291a283256b41 [0,2,0,0,0,0|2,0,0]=4 1692 B10R0.98 CN(C)CNCC(O)C(=O)O dd11ff92196fe30ec9b4b1382bf71ca1 [0,2,0,0,0,0|2,0,0]=4 1693 B10R0.98 CN(C)CNC[C@@H](O)C(=O)O 1cbf0ee945a4fc208bf2fe3682af9d8b [0,2,0,0,0,0|2,0,0]=4 1694 B10R0.98 CN(C)CNC[C@H](O)C(=O)O 6107f0679a30aff50f10c653386b906e [0,2,0,0,0,0|2,0,0]=4 1695 B10R0.98 CS(=O)CCNC(O)C(=O)O e78b5560c89fdb117bbc78425aa76daa [0,2,0,0,0,0|1,0,1]=4 1696 B10R0.98 C[C@@H](CNCN(C)C)C(=O)O 2409d798106a1c285bbe295ff40c7fa5 [0,2,0,0,0,0|2,0,0]=4 1697 B10R0.98 C[C@@H](COCN(C)C)C(=O)O 1632199dce0d38f59dd18545fdef8c45 [0,2,0,0,0,0|2,0,0]=4 1698 B10R0.98 C[C@@H](NCCN(C)C)C(=O)O 1162d2b5dbf4f0e35e142db35d1d7d7b [0,2,0,0,0,0|2,0,0]=4 1699 B10R0.98 C[C@@H](NCCS(=O)C)C(=O)O 0cb66cc04d6569f1123e9d990cc79c65 [0,2,0,0,0,0|1,0,1]=4 1700 B10R0.98 C[C@@H](O)CCN[C@H](C)C(=O)O 95413991a1737a606e6c43cd31332ed9 [0,2,0,0,0,0|2,0,0]=4 1701 B10R0.98 C[C@@H](O)CNCC(F)C(=O)O 1a6e2a371093c286422b1992f2656ee1 [0,2,0,0,0,0|2,0,0]=4 1702 B10R0.98 C[C@@H](O)CNCC(O)C(=O)O 43b8fcd0cff8f01d7b2f32d27dedb579 [0,2,0,0,0,0|2,0,0]=4 1703 B10R0.98 C[C@@H](O)CNC[C@@H](O)C(=O)O 2e35011a864928fb460c5b6783278ffb [0,2,0,0,0,0|2,0,0]=4 1704 B10R0.98 C[C@@H](O)CNC[C@H](C)C(=O)O f36cdcee9e17ea72bac8461876581d04 [0,2,0,0,0,0|2,0,0]=4 1705 B10R0.98 C[C@@H](O)CNC[C@H](O)C(=O)O a05a4fc6fe2491d50a1db2305c464a4c [0,2,0,0,0,0|2,0,0]=4 1706 B10R0.98 C[C@H](CNCN(C)C)C(=O)O de5c4ac3b2a1fbc57a2fc4976b12338b [0,2,0,0,0,0|2,0,0]=4 1707 B10R0.98 C[C@H](CNC[C@@H](C)O)C(=O)O f03369a4f16a9d4882d0a8dfccc92c94 [0,2,0,0,0,0|2,0,0]=4 1708 B10R0.98 C[C@H](COCN(C)C)C(=O)O 75fa0e2b5815d7925804d208da7fda55 [0,2,0,0,0,0|2,0,0]=4 1709 B10R0.98 C[C@H](NCCN(C)C)C(=O)O 2c9fc38e8068f838b107f75a7a8d50b6 [0,2,0,0,0,0|2,0,0]=4 1710 B10R0.98 C[C@H](NCCS(=O)C)C(=O)O 7f517c806033517746ec2ff50c3d49f9 [0,2,0,0,0,0|1,0,1]=4 1711 B10R0.98 C[C@H](NCC[C@@H](C)O)C(=O)O f3664faad10d57e6f177dee758ef6d7f [0,2,0,0,0,0|2,0,0]=4 1712 B10R0.98 C[C@H](O)CCN[C@@H](C)C(=O)O e5a67e8cd4f3e8163781fa7fa60a147e [0,2,0,0,0,0|2,0,0]=4 1713 B10R0.98 C[C@H](O)CCN[C@H](C)C(=O)O 4bc984973efb61162fed0ac0f80bc160 [0,2,0,0,0,0|2,0,0]=4 1714 B10R0.98 C[C@H](O)CNCC(F)C(=O)O f0ad6e6e83d6c5aab978131b077af281 [0,2,0,0,0,0|2,0,0]=4 1715 B10R0.98 C[C@H](O)CNCC(O)C(=O)O 7a047cd5ec4baf7f6de900713314629e [0,2,0,0,0,0|2,0,0]=4 1716 B10R0.98 C[C@H](O)CNC[C@@H](C)C(=O)O 8ec8b1345a93a6f55b3956e735ef036b [0,2,0,0,0,0|2,0,0]=4 1717 B10R0.98 C[C@H](O)CNC[C@@H](O)C(=O)O e2a447f9ac284af5c6f9a681fd672cd3 [0,2,0,0,0,0|2,0,0]=4 1718 B10R0.98 C[C@H](O)CNC[C@H](C)C(=O)O 1601ed825a0f4102fa593c3a00c35d45 [0,2,0,0,0,0|2,0,0]=4 1719 B10R0.98 C[C@H](O)CNC[C@H](O)C(=O)O 923ea34d52ca0b2760f40232a2becbe7 [0,2,0,0,0,0|2,0,0]=4 1720 B8R1.2 O=CN1CCSCC1 ef4056096863dc4bdb0fd1df8e6f14a0 [1,0,0,1,0,0|2,0,0]=4 1721 B8R1.47 CSC1CN(C1)C=O 3e599a49c3beebe60d5d28a097e005b4 [1,0,0,1,0,0|2,0,0]=4 1722 B8R1.7 CC(=O)N1CCSC1 df98add89dd15161c9f678ec3ecd18ec [1,0,0,1,0,0|2,0,0]=4 1723 B8R1.34 O=C(O)CN1CCC1 ae8e836e7c2a4bf3a61b53e9068f6f2f [1,0,0,1,0,0|2,0,0]=4 1724 B8R1.35 O=C(O)CNC1CC1 b2ef6ef58e3db3eafb40e50595acdfb4 [1,0,0,1,0,0|2,0,0]=4 1725 B8R1.35 O=C(O)COC1CC1 7246c239d90b158329e958bbc0895f52 [1,0,0,1,0,0|2,0,0]=4 1726 B10R1.16 CSCOC1COC(=O)C1 cbd009c4c5a840fe00e101587c94141a [0,0,0,1,0,1|2,0,0]=4 1727 B10R1.16 CSCO[C@@H]1COC(=O)C1 4aa6fae240bcf7abc3d45a90c77b7a3e [0,0,0,1,0,1|2,0,0]=4 1728 B10R1.16 CSCO[C@H]1COC(=O)C1 c09873df08b2f469271ead3aaddfad2e [0,0,0,1,0,1|2,0,0]=4 1729 B10R1.18 CC(=O)NC1CCSCC1 532c6db35a0b9f3a89303777aedbda02 [0,0,0,1,0,1|2,0,0]=4 1730 B10R1.18 O=C(O)CN1CCSCC1 71c83e558b9a1fa155bf6e87dce077b1 [0,0,0,1,0,1|2,0,0]=4 1731 B10R1.168 CSC1CN(C1)CC(=O)O 52aa5dda9bc367f3e44f292a8582d857 [0,0,0,1,0,1|2,0,0]=4 1732 B10R1.23 CC(=O)C(C)N1CCSC1 8e6770c57bada9830c261aebaaf83470 [0,1,0,1,0,0|2,0,0]=4 1733 B10R1.23 CC(C(=O)N)N1CCSC1 e8bc9d8e6a595b99f52589b855d8dacd [0,1,0,1,0,0|2,0,0]=4 1734 B10R1.23 CC(C(=O)O)N1CCSC1 661948dd53a17e7f3b9b6a9a700cbead [0,1,0,1,0,0|1,0,0]=3 1735 B10R1.23 C[C@@H](C(=O)N)N1CCSC1 a06827c520610074938103e3a23e82c8 [0,1,0,1,0,0|2,0,0]=4 1736 B10R1.23 C[C@@H](C(=O)O)N1CCSC1 ab77f523a875be02b08716feb20e262d [0,1,0,1,0,0|1,0,0]=3 1737 B10R1.23 C[C@H](C(=O)N)N1CCSC1 1ba55db53f2991c598ce8d476d5d2816 [0,1,0,1,0,0|2,0,0]=4 1738 B10R1.23 C[C@H](C(=O)O)N1CCSC1 96bc205232e6e7d152576fd0dd55fda4 [0,1,0,1,0,0|1,0,0]=3 1739 B10R1.23 NC(=O)C(F)N1CCSC1 4fe39a8fcddccba66a630ad15273619f [0,1,0,1,0,0|2,0,0]=4 1740 B10R1.23 O=C(O)C(F)N1CCSC1 de19b94d1a840d80f8bad73124d7ebe4 [0,1,0,1,0,0|1,0,0]=3 1741 B10R1.23 O=C(O)[C@H](F)N1CCSC1 528cc262b2ebcd2bf66c11eee80404a5 [0,1,0,1,0,0|1,0,0]=3 1742 B10R1.86 CSCN1CCC1C(=O)O 06b3a26ab590f56c6c04e8f4851d2737 [0,1,0,1,0,0|2,0,0]=4 1743 B10R1.86 CSCN1CC[C@@H]1C(=O)O 78d7ed147126e3a49f5a824faa209a2c [0,1,0,1,0,0|2,0,0]=4 1744 B10R1.86 CSCN1CC[C@H]1C(=O)O 03066c57d20cc6511320a42980afb9f1 [0,1,0,1,0,0|2,0,0]=4 1745 B10R1.190 CC(NC1CC1C)C(=O)O 8b4f0e0a8f7ae70dbbcc99f6aef543b3 [0,1,0,1,0,0|2,0,0]=4 1746 B10R1.190 CC1CC1NC(F)C(=O)O ff4cbff908c37159d6be79f1218cebf4 [0,1,0,1,0,0|2,0,0]=4 1747 B10R1.190 CC1CC1N[C@@H](C)C(=O)O 409bf9bc37337209da51a1949aaa558e [0,1,0,1,0,0|2,0,0]=4 1748 B10R1.190 CC1CC1N[C@@H](F)C(=O)O 8617f823894b72fbbc3b8d825cf75466 [0,1,0,1,0,0|2,0,0]=4 1749 B10R1.190 CC1CC1N[C@H](C)C(=O)O 3aaef09be3defde71c4f3d9db1bfa598 [0,1,0,1,0,0|2,0,0]=4 1750 B10R1.205 CC(CNC1CC1)C(=O)O f8c7a371082940c05add248ba86dd6a2 [0,1,0,1,0,0|2,0,0]=4 1751 B10R1.205 CC(COC1CC1)C(=O)O cb320b2cec7f77fb5002a5fca58dbe68 [0,1,0,1,0,0|2,0,0]=4 1752 B10R1.205 CC(NCC1CC1)C(=O)O 917021753707e1f213d8112c556507b0 [0,1,0,1,0,0|2,0,0]=4 1753 B10R1.205 CC(OCC1CC1)C(=O)O 06225dc2065772465a293fef13ee9846 [0,1,0,1,0,0|2,0,0]=4 1754 B10R1.205 C[C@@H](CNC1CC1)C(=O)O 80abdf8c030326b076e26c2d14fa58ca [0,1,0,1,0,0|2,0,0]=4 1755 B10R1.205 C[C@@H](COC1CC1)C(=O)O 7df0da5d3a504aa40bd4d740de31ab70 [0,1,0,1,0,0|2,0,0]=4 1756 B10R1.205 C[C@@H](NCC1CC1)C(=O)O b962dac5fc1ae9d36e403751184af886 [0,1,0,1,0,0|2,0,0]=4 1757 B10R1.205 C[C@@H](OCC1CC1)C(=O)O a5a91923008d7bc942402a6ad118cc95 [0,1,0,1,0,0|2,0,0]=4 1758 B10R1.205 C[C@H](CNC1CC1)C(=O)O 80fe88245faf9b153fd52c289744407e [0,1,0,1,0,0|2,0,0]=4 1759 B10R1.205 C[C@H](COC1CC1)C(=O)O e4dbec1ca2ea899d83870d081cfa5ce8 [0,1,0,1,0,0|2,0,0]=4 1760 B10R1.205 C[C@H](NCC1CC1)C(=O)O e5973f9f7a81cc6d0cf388975d87e7b8 [0,1,0,1,0,0|2,0,0]=4 1761 B10R1.205 C[C@H](OCC1CC1)C(=O)O e27e0399b1813e3a7e11cad88115458c [0,1,0,1,0,0|2,0,0]=4 1762 B10R1.205 O=C(O)C(F)CNC1CC1 52c1c877e74d96193edeb82b27575cf1 [0,1,0,1,0,0|2,0,0]=4 1763 B10R1.205 O=C(O)C(F)NCC1CC1 62a36983f0038882639bc9c302f2f1db [0,1,0,1,0,0|2,0,0]=4 1764 B10R1.205 O=C(O)C(O)CNC1CC1 c038e2452a7b42d2b8e1c9b184c9373c [0,1,0,1,0,0|2,0,0]=4 1765 B10R1.205 O=C(O)C(O)NCC1CC1 a08085845d2225d0b8c47c14341de172 [0,1,0,1,0,0|2,0,0]=4 1766 B10R1.205 O=C(O)[C@@H](O)CNC1CC1 824e64ded34ab20359e6367451ad6894 [0,1,0,1,0,0|2,0,0]=4 1767 B10R1.205 O=C(O)[C@H](F)NCC1CC1 61d05a3c93d36401a8b14f5be3fd89dc [0,1,0,1,0,0|2,0,0]=4 1768 B10R1.205 O=C(O)[C@H](O)CNC1CC1 4c820e1cd7e0cc21b215ae5fe6435e79 [0,1,0,1,0,0|2,0,0]=4 1769 B10R1.15 O=C(CO)N1CCSCC1 9ff8ebad9843e177a4cae3acc661bc59 [0,1,0,1,0,0|2,0,0]=4 1770 B10R1.29 CSCNC1CONC1=O f5ef1fefca6c8415300c57ce229bc16f [0,1,0,1,0,0|2,0,0]=4 1771 B10R1.29 CSCN[C@@H]1CCOC1=O e33612666f7375193a5b091e62a82c44 [0,1,0,1,0,0|2,0,0]=4 1772 B10R1.29 CSCN[C@@H]1CONC1=O 950e8ae0164638a6af4c8d4e00b32a73 [0,1,0,1,0,0|2,0,0]=4 1773 B10R1.29 CSCN[C@H]1CCOC1=O 6f470a401f898acd687d28b8feb595e6 [0,1,0,1,0,0|2,0,0]=4 1774 B10R1.29 CSCN[C@H]1CONC1=O 85edf33f707ad2ae4129f8d5d0e658a5 [0,1,0,1,0,0|2,0,0]=4 1775 B10R1.29 CSCOC1CCOC1=O 2ea5a32db620f6dd026c8a7a1d68b7be [0,1,0,1,0,0|2,0,0]=4 1776 B10R1.29 CSCO[C@@H]1CCOC1=O 19ab7ee2a41d901357b74ccf35480889 [0,1,0,1,0,0|2,0,0]=4 1777 B10R1.29 CSCO[C@H]1CCOC1=O fb28601613dcc0a896af6ad7714b707e [0,1,0,1,0,0|2,0,0]=4 1778 B10R1.99 COC(=O)C1CN1CSC da2c25001379027f328118ff692997d1 [0,1,0,1,0,0|2,0,0]=4 1779 B10R1.99 COC(=O)[C@@H]1CN1CSC 555cb22c95f660e09d6f3252656874a6 [0,1,0,1,0,0|2,0,0]=4 1780 B10R1.169 CSC1CN(C1)C(=O)CO 789d305a92ffc31c4393ca3bb5d29f6c [0,1,0,1,0,0|2,0,0]=4 1781 B10R1.31 CCN1CCC(C1)C(=O)O c6ab06b42eb214fd7bf4d162e9cf09ca [0,1,0,1,0,0|2,0,0]=4 1782 B10R1.31 CCN1CC[C@@H](C1)C(=O)O f470b10a1439f229c4fd1d97ea38dce4 [0,1,0,1,0,0|2,0,0]=4 1783 B10R1.31 CCN1CC[C@H](C1)C(=O)O 6fcabbaec4e96b21d63b1d5e1ab6c74e [0,1,0,1,0,0|2,0,0]=4 1784 B10R1.31 O=C(O)C1CCN(C1)CF ca49f253d96e894c5c6ee2f9d13c4de5 [0,1,0,1,0,0|2,0,0]=4 1785 B10R1.31 O=C(O)C1CCN(C1)CO 9300646053b94cc353f09fdc9345497f [0,1,0,1,0,0|2,0,0]=4 1786 B10R1.31 O=C(O)[C@@H]1CCN(C1)CF 2f3d6ca490a773ab169d9af98e7ed460 [0,1,0,1,0,0|2,0,0]=4 1787 B10R1.31 O=C(O)[C@@H]1CCN(C1)CO bf06be6b9efe2069a6495bd2c9a12715 [0,1,0,1,0,0|2,0,0]=4 1788 B10R1.31 O=C(O)[C@H]1CCN(C1)CF 95efba9fbb33e72c433e3d9c27f2b450 [0,1,0,1,0,0|2,0,0]=4 1789 B10R1.31 O=C(O)[C@H]1CCN(C1)CO d23a4c9f680bddafc9f654313a160825 [0,1,0,1,0,0|2,0,0]=4 1790 B10R1.437 CSCNC1(CC1)C(=O)O 38acd28cd05c5c6836864a24ab9bff22 [0,1,0,1,0,0|2,0,0]=4 1791 B10R1.204 CC(=O)C(C)OC1CSC1 fc112fd899b1934e2d19ed0fb5429974 [0,1,0,1,0,0|2,0,0]=4 1792 B10R1.204 CC(CN1CCC1)C(=O)O 928630bc2de249d235fc019e7aa68e9a [0,1,0,1,0,0|2,0,0]=4 1793 B10R1.204 CC(NC1CCC1)C(=O)O bf9f16af652cea127c9132012a3ac36d [0,1,0,1,0,0|2,0,0]=4 1794 B10R1.204 CC(OC1CCC1)C(=O)O 662c9e0c0b78bcd25ad328a6f14f7744 [0,1,0,1,0,0|2,0,0]=4 1795 B10R1.204 CC(OC1CSC1)C(=O)N b3fcd824d7ab71fb649276c641fe6299 [0,1,0,1,0,0|2,0,0]=4 1796 B10R1.204 C[C@@H](NC1CCC1)C(=O)O e2d5281e9814419f6832172ff1b7b379 [0,1,0,1,0,0|2,0,0]=4 1797 B10R1.204 C[C@@H](OC1CCC1)C(=O)O 9a5417fc7ed36d349494202bb6b7346d [0,1,0,1,0,0|2,0,0]=4 1798 B10R1.204 C[C@H](NC1CCC1)C(=O)O 37c11d2314ec3c268e95dad9833516c2 [0,1,0,1,0,0|2,0,0]=4 1799 B10R1.204 C[C@H](OC1CCC1)C(=O)O 60515a0225f5bec3a5d3fee3c693ede1 [0,1,0,1,0,0|2,0,0]=4 1800 B10R1.204 O=C(O)C(F)NC1CCC1 e9f1448abdf5bbebfdc6bae9d71d05d8 [0,1,0,1,0,0|2,0,0]=4 1801 B10R1.204 O=C(O)C(O)NC1CCC1 b106cebf3b5b02881d61ad75f5341464 [0,1,0,1,0,0|2,0,0]=4 1802 B10R1.204 O=C(O)C(O)NC1COC1 ebe3b65958c632d83ce13dd75fdf67f0 [0,1,0,1,0,0|1,1,0]=4 1803 B10R1.204 O=C(O)[C@H](F)NC1CCC1 20a80109a26532f5607889d3af94faa0 [0,1,0,1,0,0|2,0,0]=4 1804 B10R1.37 CCCNCC1COC1=O 99ee514ca2ac33542134281e9e088097 [0,1,0,1,0,0|2,0,0]=4 1805 B10R1.37 CCCOCC1COC1=O 0e5edb7b715011b8da6e7e8dfcb86505 [0,1,0,1,0,0|2,0,0]=4 1806 B10R1.37 COCOCC1COC1=O 8447cdecc5be02190bc4bcf4681c71fb [0,1,0,1,0,0|1,1,0]=4 1807 B10R1.37 CSCCN[C@H]1CNC1=O 6c89910539f62f042784e9cea65b55c6 [0,1,0,1,0,0|2,0,0]=4 1808 B10R1.37 CSCCOC1CCC1=O 17db54454de6a7eed9f072ef27ad27cf [0,1,0,1,0,0|2,0,0]=4 1809 B10R1.37 CSCOCC1CCC1=O ebff85a75f589df72a0c56f96d388bb6 [0,1,0,1,0,0|2,0,0]=4 1810 B10R1.93 CCCN1CC(C1)C(=O)O 2e0f44757ecc5178985bfbb9789f5f23 [0,1,0,1,0,0|2,0,0]=4 1811 B10R1.93 CCNC1CC(C1)C(=O)O 9fce0667c974e56ba87e3761995994f2 [0,1,0,1,0,0|2,0,0]=4 1812 B10R1.93 CCN[C@H]1C[C@@H](C1)C(=O)O 41f7d6201c87af4fc4bc71f9a277dbc7 [0,1,0,1,0,0|2,0,0]=4 1813 B10R1.93 CCN[C@H]1C[C@H](C1)C(=O)O 30636da879ca1fccf49af0f9cd4affd8 [0,1,0,1,0,0|2,0,0]=4 1814 B10R1.93 CCOC1CC(C1)C(=O)O ed820ec4712b1cdfcd63b64a557759ee [0,1,0,1,0,0|1,1,0]=4 1815 B10R1.93 CCO[C@H]1C[C@@H](C1)C(=O)O bfd8fe9c1a845d0e6dff6bf2b96b0e0f [0,1,0,1,0,0|1,1,0]=4 1816 B10R1.93 CCO[C@H]1C[C@H](C1)C(=O)O 427e5391180241573405a3855d1b911b [0,1,0,1,0,0|1,1,0]=4 1817 B10R1.93 COCN1CC(C1)C(=O)O 4d4cd5b6fde69e108e9410aaf661fb24 [0,1,0,1,0,0|1,1,0]=4 1818 B10R1.93 CSCN1CC(C1)C(=O)N 27b6d9123cde15b688af82df953e5de7 [0,1,0,1,0,0|2,0,0]=4 1819 B10R1.93 CSCN1CC(C1)C(=O)O d37a8ed6e46d2f875df265747a2d0619 [0,1,0,1,0,0|1,0,0]=3 1820 B10R1.93 O=C(O)C1CC(C1)NCF 4b9cc7a039e2ea244847fd73e3626b91 [0,1,0,1,0,0|2,0,0]=4 1821 B10R1.93 O=C(O)C1CC(C1)NCO ac917456ecadd370e29b9aa49a512a70 [0,1,0,1,0,0|2,0,0]=4 1822 B10R1.93 O=C(O)C1CC(C1)OCF a9b15bd64ac481c71e873aa0cf27c13c [0,1,0,1,0,0|1,1,0]=4 1823 B10R1.93 O=C(O)[C@H]1C[C@@H](C1)NCF a7bc2c7a70f37b920dfb75fae880bd02 [0,1,0,1,0,0|2,0,0]=4 1824 B10R1.93 O=C(O)[C@H]1C[C@@H](C1)NCO 370cf2260de55f34d591f5ff82c1c22f [0,1,0,1,0,0|2,0,0]=4 1825 B10R1.93 O=C(O)[C@H]1C[C@@H](C1)OCF bc3538785c7d4cb125c795f5bd61fbfc [0,1,0,1,0,0|1,1,0]=4 1826 B10R1.93 O=C(O)[C@H]1C[C@H](C1)NCF c216785a74b05b9fe8b63d43829e7256 [0,1,0,1,0,0|2,0,0]=4 1827 B10R1.93 O=C(O)[C@H]1C[C@H](C1)NCO 4b9e10ba1a0b4b00a36c8841f4ca7fdc [0,1,0,1,0,0|2,0,0]=4 1828 B10R1.93 O=C(O)[C@H]1C[C@H](C1)OCF e54d55d32b9c4e5a2ba21a53d143f03d [0,1,0,1,0,0|1,1,0]=4 1829 B10R0.78 CCCCC(C)NCC(=O)O ca8ad46e018df2faa99dbf908bd443e1 [0,0,0,0,0,2|2,0,0]=4 1830 B10R0.78 CCCCC(C)OCC(=O)O a9747b2dc6b524106d5700f387a2a510 [0,0,0,0,0,2|2,0,0]=4 1831 B10R0.78 CCCC[C@@H](C)NCC(=O)O cdf353e5bc7239425db33062b64cab42 [0,0,0,0,0,2|2,0,0]=4 1832 B10R0.78 CCCC[C@@H](C)OCC(=O)O fcdde6a6446f16e594fd1de5903e1b1b [0,0,0,0,0,2|2,0,0]=4 1833 B10R0.78 CCCC[C@H](C)OCC(=O)O 7b88542caf2c6272fa28507597d32d4c [0,0,0,0,0,2|2,0,0]=4 1834 B10R0.78 COCCC(C)OCC(=O)O 76ca78191cee40c1b9b8fb4f37b53d72 [0,0,0,0,0,2|1,1,0]=4 1835 B10R0.78 CSCCC(C)OCC(=O)N 7cc5b7e9493c3c5f8c2bc7affe68a9fc [0,0,0,0,0,2|2,0,0]=4 1836 B10R0.78 CSCCC(C)OCC(=O)O 7e21c7b86c9c1278fd86356500849ab4 [0,0,0,0,0,2|1,0,0]=3 1837 B10R0.78 CSCCN(C)CCC(=O)O 889a55ace19552a938331e6cdad3d926 [0,0,0,0,0,2|2,0,0]=4 1838 B10R0.78 CSCNC(C)CCC(=O)O bafdfaa63b84df8ddac61b1460c7ec48 [0,0,0,0,0,2|2,0,0]=4 1839 B10R0.78 CSCN[C@@H](C)CCC(=O)O c17c3a655fcf622becc77d31957d3e6d [0,0,0,0,0,2|2,0,0]=4 1840 B10R0.78 CSCOC(C)CCC(=O)O b274ba4e4e52658c4be3d129907ff4fb [0,0,0,0,0,2|2,0,0]=4