0 B11R0.120 C/C=C(/C)\C(=O)NCC(O)CO 9e4a016e23aa6dea77307b00bbb6dcf1 [0,0,1,0,0,0|3,0,0]=4 1 B11R0.120 C/C=C(/C)\C(=O)NC[C@@H](O)CO 35be6c2580540127e78175e1bd8f8056 [0,0,1,0,0,0|3,0,0]=4 2 B11R0.120 C/C=C(/C)\C(=O)NC[C@H](O)CO a0f3760c9c71bed33b46df8af7b2c737 [0,0,1,0,0,0|3,0,0]=4 3 B11R0.120 C/C=C(\Br)/C(=O)NCC(O)CO 4cb6758b4789173cd6e2deccb4314301 [0,0,1,0,0,0|3,0,0]=4 4 B11R0.120 C/C=C(\Br)/C(=O)NC[C@@H](O)CO fb198808f4c91af9d24ddb67eb4984ad [0,0,1,0,0,0|3,0,0]=4 5 B11R0.120 C/C=C(\Br)/C(=O)NC[C@H](O)CO e19d308bb194ce94596864a71577e8a8 [0,0,1,0,0,0|3,0,0]=4 6 B11R0.120 C/C=C(\C)/C(=O)NCC(O)CO 73a0bbc92ada1941f506cd930d53e0e6 [0,0,1,0,0,0|3,0,0]=4 7 B11R0.120 C/C=C(\C)/C(=O)NC[C@@H](O)CO b282ec59f3b5986761d1e57fca2e0576 [0,0,1,0,0,0|3,0,0]=4 8 B11R0.120 C/C=C(\C)/C(=O)NC[C@H](O)CO 6315bf0f133a5768f1dcd15ac199629e [0,0,1,0,0,0|3,0,0]=4 9 B11R0.120 C/C=C(\Cl)/C(=O)NCC(O)CO 7a10d9ba266bae582e223c2ec00356c8 [0,0,1,0,0,0|3,0,0]=4 10 B11R0.120 C/C=C(\Cl)/C(=O)NC[C@@H](O)CO e3a6eedd584f379f5c8a54dba777e358 [0,0,1,0,0,0|3,0,0]=4 11 B11R0.120 C/C=C(\Cl)/C(=O)NC[C@H](O)CO 23a59b89a5e63a56974b8a923d556249 [0,0,1,0,0,0|3,0,0]=4 12 B11R0.120 C/C=C(\O)/C(=O)NCC(C)CO 4000822d2049bbdc7a5d2b5fb2db62cd [0,0,1,0,0,0|3,0,0]=4 13 B11R0.120 C/C=C(\O)/C(=O)NCC(F)CO 6545c0b4ea9c78361ad2e3d9f8a420a9 [0,0,1,0,0,0|3,0,0]=4 14 B11R0.120 C/C=C(\O)/C(=O)NCC(O)CC 7d85a45aa3dd0eb592ec8720b12e001f [0,0,1,0,0,0|3,0,0]=4 15 B11R0.120 C/C=C(\O)/C(=O)NCC(O)CO 2c9d5e12b231d8fd29b08780a8a1df18 [0,0,1,0,0,0|2,0,0]=3 16 B11R0.120 C/C=C(\O)/C(=O)NC[C@@H](F)CO d153ceaaf31b9e3815b39c9d1765f08c [0,0,1,0,0,0|3,0,0]=4 17 B11R0.120 C/C=C(\O)/C(=O)NC[C@@H](O)CO bfdf791a97259640f2d84dfff4b5163f [0,0,1,0,0,0|2,0,0]=3 18 B11R0.120 C/C=C(\O)/C(=O)NC[C@H](C)CO 33cb0dd2f9c362e0d2b6b00d92c5ca93 [0,0,1,0,0,0|3,0,0]=4 19 B11R0.120 C/C=C(\O)/C(=O)NC[C@H](F)CO 08659183198e9be033f7a2c41129b06d [0,0,1,0,0,0|3,0,0]=4 20 B11R0.120 C/C=C(\O)/C(=O)NC[C@H](O)CC eb28c6158fcf0866ee6d45e542074e11 [0,0,1,0,0,0|3,0,0]=4 21 B11R0.120 C/C=C(\O)/C(=O)NC[C@H](O)CO 292afd323014ea8d0db4be1ae8b86c57 [0,0,1,0,0,0|2,0,0]=3 22 B11R0.120 C=C(CO)C(=O)NCC(O)CO 0b499a869dab933147235013aab974b6 [0,0,1,0,0,0|2,0,1]=4 23 B11R0.120 C=C(CO)C(=O)NC[C@@H](O)CO 7bbcaaafdc09a847ab29d49eeed8e45b [0,0,1,0,0,0|2,0,1]=4 24 B11R0.120 C=C(CO)C(=O)NC[C@H](O)CO 27b9b8d1f6950dbe65e1c2fc4df36ec6 [0,0,1,0,0,0|2,0,1]=4 25 B11R0.120 C=CC(=O)C(=O)NCC(O)CO 5296f53688a0ca0d41d1b1a1b132fccb [0,0,1,0,0,0|2,0,1]=4 26 B11R0.120 C=CC(=O)C(=O)NC[C@@H](O)CO 4778cd4f8973d64454a611a5749d89a8 [0,0,1,0,0,0|2,0,1]=4 27 B11R0.120 C=CC(=O)C(=O)NC[C@H](O)CO 29a97761515aed3a5e1e6a54d642c05c [0,0,1,0,0,0|2,0,1]=4 28 B11R0.120 CC=C(C)C(=O)NCC(O)CO a101eaa58ef6b51aea59405e3b71664f [0,0,1,0,0,0|3,0,0]=4 29 B11R0.120 CC=C(C)C(=O)NC[C@@H](O)CO 9369111028de39d160aa942c5bcbe9d8 [0,0,1,0,0,0|3,0,0]=4 30 B11R0.120 CC=C(C)C(=O)NC[C@H](O)CO ba08fed35db7fcd2dfcb81fda7f0e07e [0,0,1,0,0,0|3,0,0]=4 31 B11R0.120 O=C(NCC(O)CO)C(O)CO 5700dd85036e55ee6f2b9af4531cfb46 [0,0,1,0,0,0|1,0,2]=4 32 B11R0.120 O=C(NCC(O)CO)[C@@H](O)CO baeba5d9b1516e2bd0bd33326d180283 [0,0,1,0,0,0|1,0,2]=4 33 B11R0.120 O=C(NC[C@@H](O)CO)C(O)CO 892850f3e6dc8416370275cb29470021 [0,0,1,0,0,0|1,0,2]=4 34 B11R0.120 O=C(NC[C@@H](O)CO)[C@@H](O)CO a459748f54b532ad31bae288a4f04e80 [0,0,1,0,0,0|1,0,2]=4 35 B11R0.120 O=C(NC[C@H](O)CO)C(O)CO 8c12448e2037487f57b95d4605b56cff [0,0,1,0,0,0|1,0,2]=4 36 B11R0.120 O=C(NC[C@H](O)CO)[C@@H](O)CO e40c1ff71a871ed9138c1c6a4c083f2c [0,0,1,0,0,0|1,0,2]=4 37 B10R0.82 C=C(Br)C(=O)NCC(O)CO 20f5a32a5a4bd986b314cb0b67e4481e [1,0,1,0,0,0|2,0,0]=4 38 B10R0.82 C=C(Br)C(=O)NC[C@@H](O)CO ae9dd3fb670d31bf35c143d1bf64affb [1,0,1,0,0,0|2,0,0]=4 39 B10R0.82 C=C(Br)C(=O)NC[C@H](O)CO f85142fb9b93795a7010655677968396 [1,0,1,0,0,0|2,0,0]=4 40 B10R0.82 C=C(C)C(=O)NCC(O)CO a7c7b9e55b043ff97b06327d8fc098e9 [1,0,1,0,0,0|2,0,0]=4 41 B10R0.82 C=C(C)C(=O)NC[C@@H](O)CO bbae1b1416893f5c8d4046afbd9379e3 [1,0,1,0,0,0|2,0,0]=4 42 B10R0.82 C=C(C)C(=O)NC[C@H](O)CO 431516cc9dfb81f07cb10373c9476c27 [1,0,1,0,0,0|2,0,0]=4 43 B10R0.82 C=C(Cl)C(=O)NCC(O)CO d541e30cdc488a842f4b280eace49996 [1,0,1,0,0,0|2,0,0]=4 44 B10R0.82 C=C(Cl)C(=O)NC[C@@H](O)CO 3fa7b9615194a849a5d7a1235cc6cb50 [1,0,1,0,0,0|2,0,0]=4 45 B10R0.82 C=C(Cl)C(=O)NC[C@H](O)CO 45469cadf39a83fddbdc3d74895a96d8 [1,0,1,0,0,0|2,0,0]=4 46 B10R0.82 C=C(F)C(=O)NCC(O)CO 36cf8b7cb1d0f003873974d4585293f5 [1,0,1,0,0,0|2,0,0]=4 47 B10R0.82 C=C(F)C(=O)NC[C@@H](O)CO 4d97251abbffd74f72366c07a8634f6b [1,0,1,0,0,0|2,0,0]=4 48 B10R0.82 C=C(F)C(=O)NC[C@H](O)CO ccb24d61e9d4890e133a8154a945a7b0 [1,0,1,0,0,0|2,0,0]=4 49 B10R0.82 O=C(NCC(O)CO)C(O)O 73c004ead79cd0b9e7fd375fbf3b0fa1 [1,0,1,0,0,0|1,0,1]=4 50 B10R0.82 O=C(NC[C@@H](O)CO)C(O)O acdab94ddda2c76504d6cfcf344bcc20 [1,0,1,0,0,0|1,0,1]=4 51 B10R0.82 O=C(NC[C@H](O)CO)C(O)O ed268a06e787f2192bb0c49ba6460e49 [1,0,1,0,0,0|1,0,1]=4 52 B10R0.82 O=C(O)C(O)NCC(O)CO 2a70fc7300a18983d46dea239eb73d83 [1,0,1,0,0,0|1,0,1]=4 53 B10R0.82 O=C(O)C(O)NC[C@@H](O)CO 6850d97d16a203a937e80c7aed1b70fe [1,0,1,0,0,0|1,0,1]=4 54 B10R0.82 O=C(O)C(O)NC[C@H](O)CO a29a9a69d81f830f3ec8e3a1162c0b9c [1,0,1,0,0,0|1,0,1]=4 55 B10R0.57 C/C=C(\O)/C(=O)NCC(C)O 780ef2ef11fa60112d64b61a7ae65e7f [1,0,1,0,0,0|2,0,0]=4 56 B10R0.57 C/C=C(\O)/C(=O)NC[C@@H](C)O 882ea9677f8ac0a0ac5990fd20bf2690 [1,0,1,0,0,0|2,0,0]=4 57 B10R0.57 C/C=C(\O)/C(=O)NC[C@H](C)O fbbd941df45da796d1dadaf08c9fc48d [1,0,1,0,0,0|2,0,0]=4 58 B10R0.83 C/C=C(\O)/C(=O)NCCCO 2592f2cdd535af1a991c498b649c3bd7 [1,0,1,0,0,0|2,0,0]=4 59 B10R0.108 C/C=C/C(=O)NCC(O)CO 83164f0ac1631f217b87ac425a52d250 [1,0,1,0,0,0|2,0,0]=4 60 B10R0.108 C/C=C/C(=O)NC[C@@H](O)CO 112164585200f67eb0ab415942969e9a [1,0,1,0,0,0|2,0,0]=4 61 B10R0.108 C/C=C/C(=O)NC[C@H](O)CO 10e835f4a5220dddc5382fcb444927d8 [1,0,1,0,0,0|2,0,0]=4 62 B10R0.108 O=C(/C=C/Br)NCC(O)CO 3877788a36c266ce686b9fc9be4363cf [1,0,1,0,0,0|2,0,0]=4 63 B10R0.108 O=C(/C=C/Br)NC[C@@H](O)CO 932f728fd42104889f0650b4296d3f42 [1,0,1,0,0,0|2,0,0]=4 64 B10R0.108 O=C(/C=C/Br)NC[C@H](O)CO 9ae22d7a89f45b6725e90925817fc76f [1,0,1,0,0,0|2,0,0]=4 65 B10R0.108 O=C(/C=C/Cl)NCC(O)CO b006429f632f7196004b7555439c87c2 [1,0,1,0,0,0|2,0,0]=4 66 B10R0.108 O=C(/C=C/Cl)NC[C@@H](O)CO 6ed062de838368b81c2648e07d64df76 [1,0,1,0,0,0|2,0,0]=4 67 B10R0.108 O=C(/C=C/Cl)NC[C@H](O)CO 652ac31848d4e4695c70f9f8ea77705b [1,0,1,0,0,0|2,0,0]=4 68 B10R0.108 O=C(/C=C/I)NCC(O)CO 7596e4f0323162d779d37c957dc671c7 [1,0,1,0,0,0|2,0,0]=4 69 B10R0.108 O=C(/C=C/I)NC[C@@H](O)CO 4c337ba1d7bdfd663387697d9a2ac8b2 [1,0,1,0,0,0|2,0,0]=4 70 B10R0.108 O=C(/C=C/I)NC[C@H](O)CO a21cfaf9f004246e6d4fc56298c5202a [1,0,1,0,0,0|2,0,0]=4 71 B10R0.108 O=C(/C=C\Br)NCC(O)CO 6a35601b3fddb5c70507c7b4ae07814e [1,0,1,0,0,0|2,0,0]=4 72 B10R0.108 O=C(/C=C\Br)NC[C@@H](O)CO 0fdbca14ad679b5fdc7f38ab3b1fa62a [1,0,1,0,0,0|2,0,0]=4 73 B10R0.108 O=C(/C=C\Br)NC[C@H](O)CO 4db94cc83b024b7ab6354b1b1329905b [1,0,1,0,0,0|2,0,0]=4 74 B10R0.108 O=C(/C=C\Cl)NCC(O)CO 22a4482d75e6d3d29e5bc61e50605969 [1,0,1,0,0,0|2,0,0]=4 75 B10R0.108 O=C(/C=C\Cl)NC[C@@H](O)CO 7d39fe02ce29defe3b9e2fdced07b849 [1,0,1,0,0,0|2,0,0]=4 76 B10R0.108 O=C(/C=C\Cl)NC[C@H](O)CO 8842feaf5f28176c806a375c4c4b6a5b [1,0,1,0,0,0|2,0,0]=4 77 B10R0.108 O=C(/C=C\I)NCC(O)CO a14674bc1440c7491ca2207a36a7cb03 [1,0,1,0,0,0|2,0,0]=4 78 B10R0.108 O=C(/C=C\I)NC[C@@H](O)CO b2578d0e59af0afe6f293f7e995bf9ab [1,0,1,0,0,0|2,0,0]=4 79 B10R0.108 O=C(/C=C\I)NC[C@H](O)CO cfb99f48ed0e018d929b7b7f8dc895f5 [1,0,1,0,0,0|2,0,0]=4 80 B10R0.108 O=C(C=CBr)NCC(O)CO a8bc1e2a5d8d4951f2dd0150aab314bc [1,0,1,0,0,0|2,0,0]=4 81 B10R0.108 O=C(C=CBr)NC[C@@H](O)CO 67d5d258691baa45f5a76dc86586d400 [1,0,1,0,0,0|2,0,0]=4 82 B10R0.108 O=C(C=CBr)NC[C@H](O)CO 3c4583554b8c3b5e20cefda1429d0297 [1,0,1,0,0,0|2,0,0]=4 83 B10R0.108 O=C(C=CI)NCC(O)CO 3c8957656145378ed0cafa998741d3eb [1,0,1,0,0,0|2,0,0]=4 84 B10R0.108 O=C(C=CI)NC[C@@H](O)CO 8eb92a4123b17bd29b5a0399c69aa99d [1,0,1,0,0,0|2,0,0]=4 85 B10R0.108 O=C(C=CI)NC[C@H](O)CO 65cad6dd08904c3510186faf39be0228 [1,0,1,0,0,0|2,0,0]=4 86 B12R0.79 C/C=C(\O)/C(=O)NCC(O)COC 9b0a41373dc17f95c1f769e3e02350d1 [0,1,1,0,0,0|2,0,0]=4 87 B12R0.79 C/C=C(\O)/C(=O)NC[C@H](O)COC 9c46ec60050f852288359052cd73c917 [0,1,1,0,0,0|2,0,0]=4 88 B12R0.344 C/C=C(\O)/C(=O)NCC(CO)CO 30d49c57b9c596055058982286760fc4 [0,1,1,0,0,0|2,0,0]=4 89 B12R0.344 C/C=C(\O)/C(=O)NC[C@H](CO)OC 5306e641054b023dc2d8637a272c5683 [0,1,1,0,0,0|2,0,0]=4 90 B14R1.4394 O=C1OC(C(=C1Br)Br)OC(CO)CO c74762e3fd86d1afec81e746b6334986 [0,1,0,0,0,1|2,0,0]=4 91 B14R1.4394 O=C1OC(C(=C1Cl)Cl)OC(CO)CO 597ee4bdae039ba4ae5dfd032ab02b78 [0,1,0,0,0,1|2,0,0]=4 92 B12R1.353 OCC(O)COc1nocc1Br 3988b49d4a9aad7592d04d61c0414623 [0,0,1,1,0,0|2,0,0]=4 93 B12R1.353 OC[C@@H](O)COc1nocc1Br a7acac96e0283fb033eb561df5fcffa3 [0,0,1,1,0,0|2,0,0]=4 94 B12R1.353 OC[C@H](O)COc1nocc1Br 2164c5476f33d5c7fc8eb42cf92e4096 [0,0,1,1,0,0|2,0,0]=4 95 B12R0.156 C/C=C(\O)/C(=O)NCCC(O)CO ca259f3e7ae4e7fc2d7b1ce724c2a16f [0,0,1,0,0,1|2,0,0]=4 96 B14R1.829 O=C1OC(C(=C1Br)Br)OCC(O)CO 64f0118032694b94a6256b34b0aafedd [0,0,0,0,0,2|2,0,0]=4 97 B14R1.829 O=C1OC(C(=C1Br)Br)OC[C@@H](O)CO e70cd0761f074fb73feb3a3059616537 [0,0,0,0,0,2|2,0,0]=4 98 B14R1.829 O=C1OC(C(=C1Br)Br)OC[C@H](O)CO c667d4eeb9d1c63fb7f936e22cd45b0e [0,0,0,0,0,2|2,0,0]=4 99 B14R1.829 O=C1OC(C(=C1Cl)Cl)OCC(O)CO 36199599f772df8860bb0d4e6f5b35bb [0,0,0,0,0,2|2,0,0]=4 100 B14R1.829 O=C1OC(C(=C1Cl)Cl)OC[C@@H](O)CO 90c3f66db50d200d14bf6a0b01cd7b62 [0,0,0,0,0,2|2,0,0]=4 101 B14R1.829 O=C1OC(C(=C1Cl)Cl)OC[C@H](O)CO 54debd544b242c1b97e30b8661092562 [0,0,0,0,0,2|2,0,0]=4