0 B11R0.40 C#CC(=O)NCCCCCCC 0eae3cad00dce1265569f39d62b75552 [0,0,0,0,0,0|2,0,2]=4 1 B11R0.40 C#CCCCCNCC(=O)OC e2f6dc715589a8ece346caf0b5248175 [0,0,0,0,0,0|1,0,3]=4 2 B11R0.40 C#CCCCCOCC(=O)OC c2244c24c70f3fcdb9ab83229390685f [0,0,0,0,0,0|1,0,3]=4 3 B11R0.40 C#CCCNC/C=C/C(=O)OC 16684b3dcfe66c2cbcb5f3d1012c4197 [0,0,0,0,0,0|1,0,2]=3 4 B11R0.40 C#CCCNC/C=C\C(=O)OC 30f96a8d18294497f169ee8a83ceee91 [0,0,0,0,0,0|1,0,2]=3 5 B11R0.40 C#CCCNCC=CC(=O)OC 0ddf4f714f8de76d73145b1703357267 [0,0,0,0,0,0|1,0,2]=3 6 B11R0.40 C#CCCOC/C=C/C(=O)OC 7667be6eb5a67588075f3998d84722a3 [0,0,0,0,0,0|1,0,2]=3 7 B11R0.40 C#CCCOC/C=C\C(=O)OC 38bc9f0f7e379b899a82a836e8d1fd95 [0,0,0,0,0,0|1,0,2]=3 8 B11R0.40 C#CCCOCC=CC(=O)OC 7d5a248ade2dba6718a697516ec1416d [0,0,0,0,0,0|1,0,2]=3 9 B11R0.40 C/C=C/CCCOCC(=O)OC e6738c64f6b1d05e552b3b1b0b054e3b [0,0,0,0,0,0|1,0,3]=4 10 B11R0.40 C/C=C/COC/C=C/C(=O)OC 587d529cd6a766219aac008a58e5dfd7 [0,0,0,0,0,0|1,0,2]=3 11 B11R0.40 C/C=C/COC/C=C\C(=O)OC c9e868668bba4687d78f68f1ba73927e [0,0,0,0,0,0|1,0,2]=3 12 B11R0.40 C/C=C/COCC=CC(=O)OC 5a40bb05d9a4d1517413c0a1a748bd9a [0,0,0,0,0,0|1,0,2]=3 13 B11R0.40 C/C=C\CCCNCC(=O)OC 19ba686f1de3be12e553e62d243d41e8 [0,0,0,0,0,0|1,0,3]=4 14 B11R0.40 C/C=C\CCCOCC(=O)OC d055c54752e506493b99651e5f8db6b0 [0,0,0,0,0,0|1,0,3]=4 15 B11R0.40 C/C=C\COC/C=C/C(=O)OC abb564b33636289055b7d231261873a9 [0,0,0,0,0,0|1,0,2]=3 16 B11R0.40 C/C=C\COC/C=C\C(=O)OC e30103ef20ac734d0a5f8f880745b841 [0,0,0,0,0,0|1,0,2]=3 17 B11R0.40 C/C=C\COCC=CC(=O)OC 4cce204fa0b5f0d36a0728c4999b9128 [0,0,0,0,0,0|1,0,2]=3 18 B11R0.40 C=C(CC)CNCCCCCC 5673d4e4fc129c4bc12fcdeb75eab606 [0,0,0,0,0,0|3,0,1]=4 19 B11R0.40 C=C(CC)COCCCCCC 212d40314ce0351be00200277ccfea95 [0,0,0,0,0,0|3,0,1]=4 20 B11R0.40 C=C(CNCCCCCC)OC b50f3fa0913553bb25a4d41e332bf3c9 [0,0,0,0,0,0|2,0,1]=3 21 B11R0.40 C=C(CNCCCCCCl)OC 1cb1858c3553d806a686df59ba0bf5b9 [0,0,0,0,0,0|3,0,1]=4 22 B11R0.40 C=C(CNCCCCCO)OC 7c919390f7508e7dd8910a06f3652f2d [0,0,0,0,0,0|3,0,1]=4 23 B11R0.40 C=C(CNCCCCOC)OC af4d5148c0b7d44722b281be3123cf0c [0,0,0,0,0,0|3,0,1]=4 24 B11R0.40 C=C(CNCCCCSC)OC b8365b25f7a97ec119451b42dc111051 [0,0,0,0,0,0|3,0,1]=4 25 B11R0.40 C=C(CNCCCOCC)OC 8c90a666a9e8448438105143d51caa28 [0,0,0,0,0,0|3,0,1]=4 26 B11R0.40 C=C(CNCCOCCC)OC f236b86882d7627db9752e34521fefaf [0,0,0,0,0,0|3,0,1]=4 27 B11R0.40 C=C(COCCCCCC)OC 0b95e642e1e4df81a1841fb1104211cb [0,0,0,0,0,0|2,0,1]=3 28 B11R0.40 C=C(COCCCCOC)OC 229fe40cd31f1015d5a2c69993efdd02 [0,0,0,0,0,0|3,0,1]=4 29 B11R0.40 C=C(COCCCCSC)OC 6d188d3c5a4e9dd4927e04f86c2c486e [0,0,0,0,0,0|3,0,1]=4 30 B11R0.40 C=C(COCCCOCC)OC 6e4ad9478e650943c7322831ea8c3687 [0,0,0,0,0,0|3,0,1]=4 31 B11R0.40 C=C(COCCCSCC)OC 4b7a9928bb796166643448fad9fd8026 [0,0,0,0,0,0|3,0,1]=4 32 B11R0.40 C=C(COCCOCCC)OC e9e22309f5066dadc128b2745a271c60 [0,0,0,0,0,0|3,0,1]=4 33 B11R0.40 C=C(COCCSCCC)OC af434454cf98382d87af6d9aa02d4d21 [0,0,0,0,0,0|3,0,1]=4 34 B11R0.40 C=CC(=O)NCCCCCCC f1adb5880043356bf107a0e1433c2cec [0,0,0,0,0,0|2,0,2]=4 35 B11R0.40 C=CCCCCNCC(=O)OC 9793dbbee288dbcc904bdfdc467eead2 [0,0,0,0,0,0|1,0,3]=4 36 B11R0.40 C=CCCCCOCC(=O)OC c2a5e504b8fe567a17ce6510530e06a6 [0,0,0,0,0,0|1,0,3]=4 37 B11R0.40 C=CCCNC/C=C/C(=O)OC 0b8a08438b64db0faebcc6de6b3fc109 [0,0,0,0,0,0|1,0,2]=3 38 B11R0.40 C=CCCNC/C=C\C(=O)OC 16c06ebffce4736f579b8723455d2ff5 [0,0,0,0,0,0|1,0,2]=3 39 B11R0.40 C=CCCNCC=CC(=O)OC 97a252b8ce82d64dca6cdaf6e86561eb [0,0,0,0,0,0|1,0,2]=3 40 B11R0.40 C=CCCOC/C=C/C(=O)OC 2b83dc5f26b833e7b788bec7a725a585 [0,0,0,0,0,0|1,0,2]=3 41 B11R0.40 C=CCCOC/C=C\C(=O)OC 0f14d58da76637ab9bc684b5e86ff7ab [0,0,0,0,0,0|1,0,2]=3 42 B11R0.40 C=CCCOCC=CC(=O)OC 68889f6465dff0a1a25ab3734d8c37a5 [0,0,0,0,0,0|1,0,2]=3 43 B11R0.40 CC#CCCCOCC(=O)OC 3c6dd8cdc37da413137ccfcee5220282 [0,0,0,0,0,0|1,0,3]=4 44 B11R0.40 CC#CCNC/C=C/C(=O)OC 0e3fd995826c7e5fa2cd48caabc00933 [0,0,0,0,0,0|1,0,2]=3 45 B11R0.40 CC#CCNC/C=C\C(=O)OC 6046a00f0febece50d52a45a1a4bc8c8 [0,0,0,0,0,0|1,0,2]=3 46 B11R0.40 CC#CCNCC=CC(=O)OC 78ded4658ee61b8ed4b02dccb82efec0 [0,0,0,0,0,0|1,0,2]=3 47 B11R0.40 CC#CCOC/C=C/C(=O)OC 3e2669798038dfaf23d4ea0ad99f2e37 [0,0,0,0,0,0|1,0,2]=3 48 B11R0.40 CC#CCOC/C=C\C(=O)OC 6774e518ad95e19113dbc3baf098f17d [0,0,0,0,0,0|1,0,2]=3 49 B11R0.40 CC#CCOCC=CC(=O)OC e37fdd2a3ed16782607f3aed213faa9e [0,0,0,0,0,0|1,0,2]=3 50 B11R0.40 CC/C=C/CCOCC(=O)OC 6293af53f86b7b6af2dad649392b8297 [0,0,0,0,0,0|1,0,3]=4 51 B11R0.40 CC/C=C\CCNCC(=O)OC 2fbfc155d56dcba5809aaf9a2943d0d5 [0,0,0,0,0,0|1,0,3]=4 52 B11R0.40 CC/C=C\CCOCC(=O)OC 89064c1ffbbb951a087c64e7150f0981 [0,0,0,0,0,0|1,0,3]=4 53 B11R0.40 CC=CCCCOCC(=O)OC 58a58c868bcf876f660a2c30982521e3 [0,0,0,0,0,0|1,0,3]=4 54 B11R0.40 CC=CCNC/C=C/C(=O)OC d7a70f23e634521f2b9d3c05b352dc8d [0,0,0,0,0,0|1,0,2]=3 55 B11R0.40 CC=CCNC/C=C\C(=O)OC 90ba92bb52561ceeb3d6aeb8c4c4cebb [0,0,0,0,0,0|1,0,2]=3 56 B11R0.40 CC=CCNCC=CC(=O)OC 7ecd909e94974ad41e904fe066e4cebe [0,0,0,0,0,0|1,0,2]=3 57 B11R0.40 CC=CCOC/C=C/C(=O)OC 3c614e0adc8e48ea38552fed697e524b [0,0,0,0,0,0|1,0,2]=3 58 B11R0.40 CC=CCOC/C=C\C(=O)OC b15df967e0f413bb2370105a76eb1394 [0,0,0,0,0,0|1,0,2]=3 59 B11R0.40 CC=CCOCC=CC(=O)OC 50aad5d2ca49355e176f1b7cb4d95b6c [0,0,0,0,0,0|1,0,2]=3 60 B11R0.40 CCC#CCCOCC(=O)OC b9789bd2f2c0b23abfc7d38985352c87 [0,0,0,0,0,0|1,0,3]=4 61 B11R0.40 CCC(=O)CNCCCCCCl 169847daaa232a59c508e79ce465d1e5 [0,0,0,0,0,0|3,0,1]=4 62 B11R0.40 CCC(=O)CNCCCCCO 91c7de1de227e0265fc520775d22d8c8 [0,0,0,0,0,0|3,0,1]=4 63 B11R0.40 CCC(=O)CNCCCCOC d5b6790bb3d7512c23a539ebe949f5a7 [0,0,0,0,0,0|3,0,1]=4 64 B11R0.40 CCC(=O)CNCCCCSC adfe90b7cfa2d2b67fa90f773d60c43d [0,0,0,0,0,0|3,0,1]=4 65 B11R0.40 CCC(=O)COCCCCCF 4d534a6cf979caa0f2da56f2652dc1d0 [0,0,0,0,0,0|3,0,1]=4 66 B11R0.40 CCC(=O)COCCCCOC 4661f8c22c4d0285a2d318daa5b937e6 [0,0,0,0,0,0|3,0,1]=4 67 B11R0.40 CCC(=O)COCCCCSC 973dc3a8bf4d40d91f3f7ce58aa6fa50 [0,0,0,0,0,0|3,0,1]=4 68 B11R0.40 CCC(=O)NCCCCCCCl c12f1575728cff95c45926a5cd979a80 [0,0,0,0,0,0|3,0,1]=4 69 B11R0.40 CCC(=O)NCCCCCCO e5b240676bd8c501c6689b9f6771a132 [0,0,0,0,0,0|3,0,1]=4 70 B11R0.40 CCC(=O)NCCCCCOC 179b4dfc9da292e65446bd9e0bb45f8b [0,0,0,0,0,0|3,0,1]=4 71 B11R0.40 CCC/C=C/CNCC(=O)OC 977cd2ffa57377ad6072967decfb1d10 [0,0,0,0,0,0|1,0,3]=4 72 B11R0.40 CCC/C=C/COCC(=O)OC 04cc98d7105b52f9ce9f81076af6ea3a [0,0,0,0,0,0|1,0,3]=4 73 B11R0.40 CCC/C=C\CNCC(=O)OC 1360ea2057aef13ba79a0858f65ed978 [0,0,0,0,0,0|1,0,3]=4 74 B11R0.40 CCC/C=C\COCC(=O)OC d0d03f62c6e937ca3985487fc878763a [0,0,0,0,0,0|1,0,3]=4 75 B11R0.40 CCCC#CCOCC(=O)OC ad556fbd28f83bdd0e84c83418bfec68 [0,0,0,0,0,0|1,0,3]=4 76 B11R0.40 CCCCCCCNC(=O)C=O abee9ded1e7a7a6b29f3f186b2d24366 [0,0,0,0,0,0|3,0,1]=4 77 B11R0.40 CCCCCCCNC(=O)CC 686f1ce47fd62528159d592ae6144fd0 [0,0,0,0,0,0|2,0,1]=3 78 B11R0.40 CCCCCCCNC(=O)CF 406840209e6eaaa926c9723f43f43bb3 [0,0,0,0,0,0|3,0,1]=4 79 B11R0.40 CCCCCCCNC(=O)CO 649c57dfd5f4fa0f4565341b8aa151e7 [0,0,0,0,0,0|3,0,1]=4 80 B11R0.40 CCCCCCCNC(=O)CS 53771c9c8b167b3f7995337d22f4a6f9 [0,0,0,0,0,0|3,0,1]=4 81 B11R0.40 CCCCCCNCC(=O)CC c8e5732d0f65da9c5c5b2a092b9f01ac [0,0,0,0,0,0|2,0,1]=3 82 B11R0.40 CCCCCCNCC(=O)CO 22481f5647b4924598aea5bd39f61ac5 [0,0,0,0,0,0|3,0,1]=4 83 B11R0.40 CCCCCCNCC(=O)NC 40b08a506355532a04de3945e21a62e5 [0,0,0,0,0,0|2,0,1]=3 84 B11R0.40 CCCCCCNCC(=O)NO 70ed1d49a75a058f80d6cb8d6355c00e [0,0,0,0,0,0|3,0,1]=4 85 B11R0.40 CCCCCCNCC(=O)OC b4b64d05ad9791105a1ead038a87d73e [0,0,0,0,0,0|1,0,1]=2 86 B11R0.40 CCCCCCNCC(C)OC 0cff621ac604a8bce9e3d9429b7785c4 [0,0,0,0,0,0|2,0,2]=4 87 B11R0.40 CCCCCCNC[C@@H](C)OC 7c4b121f35ac8a52cba607f05a6e7573 [0,0,0,0,0,0|2,0,2]=4 88 B11R0.40 CCCCCCNC[C@H](C)OC bf1ce180e50f8f2b920876a6b3eeeddc [0,0,0,0,0,0|2,0,2]=4 89 B11R0.40 CCCCCCOCC(=O)CC adcf10a6b79c1dbe703e4ef32ea4d479 [0,0,0,0,0,0|2,0,1]=3 90 B11R0.40 CCCCCCOCC(=O)NC 36fff55613dedf0508c95b9965e07157 [0,0,0,0,0,0|2,0,1]=3 91 B11R0.40 CCCCCCOCC(=O)OC 09bff5c54ea2c2317e4ffa1248f416e4 [0,0,0,0,0,0|1,0,1]=2 92 B11R0.40 CCCCCCOCC(C)OC a0fa230585bca5f2e00c13371d45b4f7 [0,0,0,0,0,0|2,0,2]=4 93 B11R0.40 CCCCCCOC[C@@H](C)OC eea6b16218526f0f26da2e08c85b1bb6 [0,0,0,0,0,0|2,0,2]=4 94 B11R0.40 CCCCCCOC[C@H](C)OC 30171bb57d76d51c5ab163cee13542db [0,0,0,0,0,0|2,0,2]=4 95 B11R0.40 CCCCCNCCC(=O)NC bf2880d61bf311927f37d9459b95311c [0,0,0,0,0,0|2,0,2]=4 96 B11R0.40 CCCCCNCCC(=O)OC 528d03f621767c5da7a29df90a9b38b7 [0,0,0,0,0,0|1,0,2]=3 97 B11R0.40 CCCCCNCOC(=O)CC 738d6b861ce276b5e51842c47cb9a606 [0,0,0,0,0,0|3,0,1]=4 98 B11R0.40 CCCCCNCOC(=O)OC 1a984734eabc63cd259d87fe0f6d0e3a [0,0,0,0,0,0|2,0,1]=3 99 B11R0.40 CCCCCOCCC(=O)NC d53a8d398531b211866f279fd03bc27d [0,0,0,0,0,0|2,0,2]=4 100 B11R0.40 CCCCCOCCC(=O)OC ccac832df9f8c79f4c2f2e191d935c4d [0,0,0,0,0,0|1,0,2]=3 101 B11R0.40 CCCCCOCOC(=O)CC 1566d44e71376e77797064cfeb4bdbd4 [0,0,0,0,0,0|3,0,1]=4 102 B11R0.40 CCCCCOCOC(=O)OC 8437c1266fb81e44453bd4eda59a8fa6 [0,0,0,0,0,0|2,0,1]=3 103 B11R0.40 CCCCNC/C=C/C(=O)OC b3a514a731f1acedd7ecc6400b164781 [0,0,0,0,0,0|1,0,0]=1 104 B11R0.40 CCCCNC/C=C\C(=O)OC 471ceb065340c9365beed3e9d2ebfa53 [0,0,0,0,0,0|1,0,0]=1 105 B11R0.40 CCCCNCC#CC(=O)OC b07dee74ff9f27fc053920faab56536a [0,0,0,0,0,0|1,0,2]=3 106 B11R0.40 CCCCNCC=CC(=O)OC 0d0826bdd8498869565a4f15cf2066f6 [0,0,0,0,0,0|1,0,0]=1 107 B11R0.40 CCCCNCCCC(=O)NC 5ab58c06c9aebec88dfab837bc396f59 [0,0,0,0,0,0|2,0,2]=4 108 B11R0.40 CCCCNCCCC(=O)OC af4a3bbabc42a3dd3e1785630a7ed514 [0,0,0,0,0,0|1,0,2]=3 109 B11R0.40 CCCCNCCNC(=O)CC eafd4f313dd1c9da61b2b14982bece7b [0,0,0,0,0,0|3,0,1]=4 110 B11R0.40 CCCCOC/C=C/C(=O)OC 2578e2b41359b1205a52e699296f8f5d [0,0,0,0,0,0|1,0,0]=1 111 B11R0.40 CCCCOC/C=C\C(=O)OC a4231358b1b34ec0f8a3eeab7233249a [0,0,0,0,0,0|1,0,0]=1 112 B11R0.40 CCCCOCC#CC(=O)OC 8934e7b25dfb48eb96b5a4ca53d2fd91 [0,0,0,0,0,0|1,0,2]=3 113 B11R0.40 CCCCOCC=CC(=O)OC ae9d980bde0206669ae07f1e0557de43 [0,0,0,0,0,0|1,0,0]=1 114 B11R0.40 CCCCOCCCC(=O)NC c2d274710c85b38a446478cdb547f403 [0,0,0,0,0,0|2,0,2]=4 115 B11R0.40 CCCCOCCCC(=O)OC 2c00c25d55f4aed289459825ca6caf67 [0,0,0,0,0,0|1,0,2]=3 116 B11R0.40 CCCCOCCNC(=O)CC e75a887cb4393e27da632a529a3d90a7 [0,0,0,0,0,0|3,0,1]=4 117 B11R0.40 CCCCOCCOC(=O)CC 6522276dd406ffc521118952ffb4c4ea [0,0,0,0,0,0|3,0,1]=4 118 B11R0.40 CCCCOCCOC(=O)OC b231bf275b01e991c727c5357c04f648 [0,0,0,0,0,0|2,0,1]=3 119 B11R0.40 CCCCOCNCC(=O)NC 616599147b30c3950bdb1b2fd39b4562 [0,0,0,0,0,0|3,0,1]=4 120 B11R0.40 CCCCOCNCC(=O)OC 730d997397b70287e85ae8c4a8daeadc [0,0,0,0,0,0|2,0,1]=3 121 B11R0.40 CCCCOCOCC(=O)CC 89e908693e91dd0d0e69177990ed0083 [0,0,0,0,0,0|3,0,1]=4 122 B11R0.40 CCCCOCOCC(=O)NC 4b55806592c9b9b1a2f1a1bbf4f1bb36 [0,0,0,0,0,0|3,0,1]=4 123 B11R0.40 CCCCOCOCC(=O)OC 946e25ac7c12d92c76f185574d681691 [0,0,0,0,0,0|2,0,1]=3 124 B11R0.40 CCCNCCCCC(=O)CC a0ca041e30af7810958502bfc4beeb26 [0,0,0,0,0,0|2,0,2]=4 125 B11R0.40 CCCNCCCCC(=O)OC 060557c49fc8b2682bce09dcecd26897 [0,0,0,0,0,0|1,0,2]=3 126 B11R0.40 CCCNCCOCC(=O)OC 7d542560aee618cccb8ce15c1eff67f0 [0,0,0,0,0,0|2,0,1]=3 127 B11R0.40 CCCOCCCCC(=O)CC 177be31e74ea458cdea2086674fce0ec [0,0,0,0,0,0|2,0,2]=4 128 B11R0.40 CCCOCCCCC(=O)OC c38c96dc4e6815105987ed08074c5cd5 [0,0,0,0,0,0|1,0,2]=3 129 B11R0.40 CCCOCCCNC(=O)CC fec3893936a6956cbc39d82258f1e626 [0,0,0,0,0,0|3,0,1]=4 130 B11R0.40 CCCOCCNCC(=O)CC af6d8ece5f96f6d5993dca91750c6331 [0,0,0,0,0,0|3,0,1]=4 131 B11R0.40 CCCOCCNCC(=O)NC 31d2582b75dee5c561ae8d9d18b5f73a [0,0,0,0,0,0|3,0,1]=4 132 B11R0.40 CCCOCCNCC(=O)OC dc4681ef40747337e3903e762819be10 [0,0,0,0,0,0|2,0,1]=3 133 B11R0.40 CCCOCCOCC(=O)CC 723ec6dd1a32570a19662d1e12346296 [0,0,0,0,0,0|3,0,1]=4 134 B11R0.40 CCCOCCOCC(=O)NC faa395813f7f435b9e71ac3a336b018c [0,0,0,0,0,0|3,0,1]=4 135 B11R0.40 CCCOCCOCC(=O)OC 64aebb87f3244a9d7b7f06c29592a387 [0,0,0,0,0,0|2,0,1]=3 136 B11R0.40 CCCSCCOCC(=O)CC d2067d23d0e94c02b501473ae1f752be [0,0,0,0,0,0|3,0,1]=4 137 B11R0.40 CCCSCCOCC(=O)NC d89728054d6897369246b7981ce18df3 [0,0,0,0,0,0|3,0,1]=4 138 B11R0.40 CCCSCCOCC(=O)OC bfd9150e07503b75f145ebf21333d513 [0,0,0,0,0,0|2,0,1]=3 139 B11R0.40 CCNCCCCCC(=O)OC 78bd529289af6b285c7f270dc69f9cc3 [0,0,0,0,0,0|1,0,2]=3 140 B11R0.40 CCOCCCCCC(=O)OC 9b80041f3611c56f4bedd2a18eade3b1 [0,0,0,0,0,0|1,0,2]=3 141 B11R0.40 CCOCCCNCC(=O)CC 4f4839c9cf33d5a6041ac0e17d66aa31 [0,0,0,0,0,0|3,0,1]=4 142 B11R0.40 CCOCCCNCC(=O)NC 18ed4231805b9315b892feddb4a0f142 [0,0,0,0,0,0|3,0,1]=4 143 B11R0.40 CCOCCCNCC(=O)OC c7485a37569a461c52aa81ad8055e3b4 [0,0,0,0,0,0|2,0,1]=3 144 B11R0.40 CCOCCCOCC(=O)CC 9c1461ad3db61a1f493b386fb087b9cc [0,0,0,0,0,0|3,0,1]=4 145 B11R0.40 CCOCCCOCC(=O)NC 614e23071f34b17a173bf4898b942683 [0,0,0,0,0,0|3,0,1]=4 146 B11R0.40 CCOCCCOCC(=O)OC 57dddf421e069c47297be6f52caa57fc [0,0,0,0,0,0|2,0,1]=3 147 B11R0.40 CCOCCNCCC(=O)OC 9739503ab4bf541699a74f281c2e2b9c [0,0,0,0,0,0|2,0,2]=4 148 B11R0.40 CCOCCNCOC(=O)OC 2f46520d864a633cb0e2110e3e899494 [0,0,0,0,0,0|3,0,1]=4 149 B11R0.40 CCOCCOCCC(=O)OC b15bdf82e04bdb738b2e374226a2be54 [0,0,0,0,0,0|2,0,2]=4 150 B11R0.40 CCOCCOCOC(=O)OC 1b001321ce33a4b0045747fb5636ab5b [0,0,0,0,0,0|3,0,1]=4 151 B11R0.40 CCOCNCCCC(=O)OC 46be0dc6a2fa53d0e3dcfb4db7331cb1 [0,0,0,0,0,0|2,0,2]=4 152 B11R0.40 CCOCOC/C=C/C(=O)OC e4cc36343f90e4a61dcf5e1719d24380 [0,0,0,0,0,0|2,0,0]=2 153 B11R0.40 CCOCOCC#CC(=O)OC 135e4d7ebe5f8e61574ee7928eac2024 [0,0,0,0,0,0|2,0,2]=4 154 B11R0.40 CCOCOCCOC(=O)OC f54b3c8afccb92210f71af931469dca3 [0,0,0,0,0,0|3,0,1]=4 155 B11R0.40 CCSCCCCNC(=O)CC ea0f6528589aacf58e162b969c059b14 [0,0,0,0,0,0|3,0,1]=4 156 B11R0.40 CCSCCCNCC(=O)NC 8d72ebbd34eef83f425180c3ebbaabc8 [0,0,0,0,0,0|3,0,1]=4 157 B11R0.40 CCSCCCNCC(=O)OC d693d460276bdecc5b8f625d27e28722 [0,0,0,0,0,0|2,0,1]=3 158 B11R0.40 CCSCCCOCC(=O)CC e95eea67d707e354332756055989bd1d [0,0,0,0,0,0|3,0,1]=4 159 B11R0.40 CCSCCCOCC(=O)NC 2a5a295fa3b1af8becdc9290c9b7f233 [0,0,0,0,0,0|3,0,1]=4 160 B11R0.40 CCSCCCOCC(=O)OC 3e5dce16e86bb76e36032bc19e30b6c4 [0,0,0,0,0,0|2,0,1]=3 161 B11R0.40 CCSCCNCCC(=O)OC 06a359cc9c842e83d31563a3d685e384 [0,0,0,0,0,0|2,0,2]=4 162 B11R0.40 CCSCCNCOC(=O)OC 99091e33f20ac8cdddca7f1f8400fb0e [0,0,0,0,0,0|3,0,1]=4 163 B11R0.40 CCSCCOCCC(=O)OC 3a5d46de8a20f41384df05397c6e099d [0,0,0,0,0,0|2,0,2]=4 164 B11R0.40 CCSCCOCOC(=O)OC 0c96435cf2792cfaf92b3bf76d4c8058 [0,0,0,0,0,0|3,0,1]=4 165 B11R0.40 CNC(=O)CNCCCCCCl 1b24bb6cfabdfe0025087d1d392598b1 [0,0,0,0,0,0|3,0,1]=4 166 B11R0.40 CNC(=O)CNCCCCCF 7b5105d20aa8de64473ea79cf8b50525 [0,0,0,0,0,0|3,0,1]=4 167 B11R0.40 CNC(=O)CNCCCCCO 728cf07c565537ba2c1fca79a62d199b [0,0,0,0,0,0|3,0,1]=4 168 B11R0.40 CNC(=O)CNCCCCOC f7baaa1dac3847017477b23b2f48566a [0,0,0,0,0,0|3,0,1]=4 169 B11R0.40 CNC(=O)CNCCCCSC 02be1b09bbf0b9bcfd517d1564f71a68 [0,0,0,0,0,0|3,0,1]=4 170 B11R0.40 CNC(=O)COCCCCCF 30a06aacc12e6be93a441e8da3712845 [0,0,0,0,0,0|3,0,1]=4 171 B11R0.40 CNC(=O)COCCCCOC a539f4641c3a9dab39104b55ede71de3 [0,0,0,0,0,0|3,0,1]=4 172 B11R0.40 CNC(=O)COCCCCSC 0d9899b882fa3d6dcae7317e3bdd0e37 [0,0,0,0,0,0|3,0,1]=4 173 B11R0.40 COC(=O)/C=C/CNCCC#N c93abe84e6499e9da2438934b83647d8 [0,0,0,0,0,0|2,0,1]=3 174 B11R0.40 COC(=O)/C=C/CNCCCCl 31d29c9cf32854db69adb74e9398c6e0 [0,0,0,0,0,0|2,0,0]=2 175 B11R0.40 COC(=O)/C=C/CNCCCO 3086293ec3ba001d5228a6041b89b656 [0,0,0,0,0,0|2,0,0]=2 176 B11R0.40 COC(=O)/C=C/CNCCON 932c2d56119e4debd33a93ab03c9ebfc [0,0,0,0,0,0|3,0,0]=3 177 B11R0.40 COC(=O)/C=C/CNCCSC 94dc336038796b036e662bb139bf3b97 [0,0,0,0,0,0|2,0,0]=2 178 B11R0.40 COC(=O)/C=C/COC/C=C/Cl 4f357d191909121643a623c6d374c62c [0,0,0,0,0,0|2,0,2]=4 179 B11R0.40 COC(=O)/C=C/COC/C=C\Cl 87496c423a8cc68011c4ce91a8e6e24e [0,0,0,0,0,0|2,0,2]=4 180 B11R0.40 COC(=O)/C=C/COCC#CI 7faf0bdefa69007224d8ad8eeb8832f0 [0,0,0,0,0,0|2,0,2]=4 181 B11R0.40 COC(=O)/C=C/COCC=CCl 9229f0d40091ed8c829184b24b30d23a [0,0,0,0,0,0|2,0,2]=4 182 B11R0.40 COC(=O)/C=C/COCCC#N 9352499cdf19db68ffc8746220dd0e9f [0,0,0,0,0,0|2,0,1]=3 183 B11R0.40 COC(=O)/C=C/COCCC=O 02f0af8798a12c3212e06f6ba4aad93b [0,0,0,0,0,0|2,0,1]=3 184 B11R0.40 COC(=O)/C=C/COCCCF a622ef36946041ca8ed3593aeb8a6fcc [0,0,0,0,0,0|2,0,0]=2 185 B11R0.40 COC(=O)/C=C/COCCCS 197ddce6d82e7e120500b3f7cfb49d51 [0,0,0,0,0,0|2,0,0]=2 186 B11R0.40 COC(=O)/C=C/COCCSC b726e97dd21fedc8d6704fd688e2e723 [0,0,0,0,0,0|2,0,0]=2 187 B11R0.40 COC(=O)/C=C/COCSC#N 44e435dbdacc1b6f76a034d42e8711eb [0,0,0,0,0,0|3,0,1]=4 188 B11R0.40 COC(=O)/C=C\CNCCC#N f3e771a8cf4de70fd8f16dfd213ea124 [0,0,0,0,0,0|2,0,1]=3 189 B11R0.40 COC(=O)/C=C\CNCCCCl 8e5d9577fb6cdb58469207cb0aa354fe [0,0,0,0,0,0|2,0,0]=2 190 B11R0.40 COC(=O)/C=C\CNCCCO e3b7987e1c3f50a09620f9837cb4dae6 [0,0,0,0,0,0|2,0,0]=2 191 B11R0.40 COC(=O)/C=C\CNCCON 837abe90fc59c391e7eb2a50259f2562 [0,0,0,0,0,0|3,0,0]=3 192 B11R0.40 COC(=O)/C=C\CNCCSC 0da40c460d9c78f0daa19f19fb1d079a [0,0,0,0,0,0|2,0,0]=2 193 B11R0.40 COC(=O)/C=C\COC/C=C/Cl b1aafb2c398fc95828846a180af151dd [0,0,0,0,0,0|2,0,2]=4 194 B11R0.40 COC(=O)/C=C\COCC#CI 5b3c04183cd92346d65205287e624ad3 [0,0,0,0,0,0|2,0,2]=4 195 B11R0.40 COC(=O)/C=C\COCC=CCl ec467ab37a19e16e38e51532397bc1d1 [0,0,0,0,0,0|2,0,2]=4 196 B11R0.40 COC(=O)/C=C\COCCC#N 68e53ce8e6edf95a09abb16d09d32bdf [0,0,0,0,0,0|2,0,1]=3 197 B11R0.40 COC(=O)/C=C\COCCC=O dcd90198649ccb432562bf4802aed449 [0,0,0,0,0,0|2,0,1]=3 198 B11R0.40 COC(=O)/C=C\COCCCF d50881f283c439885800539722c8f680 [0,0,0,0,0,0|2,0,0]=2 199 B11R0.40 COC(=O)/C=C\COCCCS 773b01df776a39eef1df34d41bd8f3e0 [0,0,0,0,0,0|2,0,0]=2 200 B11R0.40 COC(=O)/C=C\COCCSC 2f433c3689b5d29ca1e4e77960bfcef0 [0,0,0,0,0,0|2,0,0]=2 201 B11R0.40 COC(=O)C#CCNCCCCl ea1bca30a0b15e668fe56a6308d60bc8 [0,0,0,0,0,0|2,0,2]=4 202 B11R0.40 COC(=O)C#CCNCCCO 994bfaf2ea41e864a527f9732b88ecaf [0,0,0,0,0,0|2,0,2]=4 203 B11R0.40 COC(=O)C#CCNCCSC e1242afe77694b94abf80657f69c4762 [0,0,0,0,0,0|2,0,2]=4 204 B11R0.40 COC(=O)C#CCOCCCF d15b70f2c6877e2875c0740272113e58 [0,0,0,0,0,0|2,0,2]=4 205 B11R0.40 COC(=O)C#CCOCCCS 5dc0128a2ae3dcea5389061485a619c8 [0,0,0,0,0,0|2,0,2]=4 206 B11R0.40 COC(=O)C#CCOCCSC a0b15aba1659a5e9625488c7492e0d56 [0,0,0,0,0,0|2,0,2]=4 207 B11R0.40 COC(=O)C=CCNCCC#N 37031aa275ba383c18e34fe5c6589971 [0,0,0,0,0,0|2,0,1]=3 208 B11R0.40 COC(=O)C=CCNCCCCl 6ce630bc119dac44a8a54c05960b10cf [0,0,0,0,0,0|2,0,0]=2 209 B11R0.40 COC(=O)C=CCNCCCO 8790e6d4575f3ac148bb52bd18349a88 [0,0,0,0,0,0|2,0,0]=2 210 B11R0.40 COC(=O)C=CCNCCON 19f644bab50d663c116b69a652a524ab [0,0,0,0,0,0|3,0,0]=3 211 B11R0.40 COC(=O)C=CCNCCSC 25007d804cda642b798a703773bb8aaf [0,0,0,0,0,0|2,0,0]=2 212 B11R0.40 COC(=O)C=CCOC/C=C/Cl 29394bbe3395b5b5591c4c78739fd21e [0,0,0,0,0,0|2,0,2]=4 213 B11R0.40 COC(=O)C=CCOCC#CI bb42b2384df46291dc0865458cd3c6ca [0,0,0,0,0,0|2,0,2]=4 214 B11R0.40 COC(=O)C=CCOCC=CCl 9089b862deb1bffdb6e1e8882d438790 [0,0,0,0,0,0|2,0,2]=4 215 B11R0.40 COC(=O)C=CCOCCC#N e4fb9704b7de7d147ee9a5d1b43232b5 [0,0,0,0,0,0|2,0,1]=3 216 B11R0.40 COC(=O)C=CCOCCC=O c5304e184d722b549a9381c043766ec5 [0,0,0,0,0,0|2,0,1]=3 217 B11R0.40 COC(=O)C=CCOCCCF 286d146ffa5f200f251f77c80fc97c03 [0,0,0,0,0,0|2,0,0]=2 218 B11R0.40 COC(=O)C=CCOCCCS 756cc3caaee3807c3f46472f02b3489c [0,0,0,0,0,0|2,0,0]=2 219 B11R0.40 COC(=O)C=CCOCCSC 6a98899d57cefe83952824ad42a9f633 [0,0,0,0,0,0|2,0,0]=2 220 B11R0.40 COC(=O)CCCCCNCF 2fdeafd19615aabdfecac65c7ee85598 [0,0,0,0,0,0|2,0,2]=4 221 B11R0.40 COC(=O)CCCCCNCO af7eaee93a3fef3c4544e48a16c6e56f [0,0,0,0,0,0|2,0,2]=4 222 B11R0.40 COC(=O)CCCCCOCF 3b8a2ff8fc1bef6bde3b7c835f3e6a30 [0,0,0,0,0,0|2,0,2]=4 223 B11R0.40 COC(=O)CCCCNCCBr 389a9425bed3fc47018de90353426cdc [0,0,0,0,0,0|2,0,2]=4 224 B11R0.40 COC(=O)CCCCNCCF acdfcaf980a2e2514f502844739bd67a [0,0,0,0,0,0|2,0,2]=4 225 B11R0.40 COC(=O)CCCCNCCI 8fc5f158498fb34376eecf1a634e8fc5 [0,0,0,0,0,0|2,0,2]=4 226 B11R0.40 COC(=O)CCCCNCCO e7f0e01865858a91030334a948df571f [0,0,0,0,0,0|2,0,2]=4 227 B11R0.40 COC(=O)CCCCNCCS 530b407c8654dbd48105c768dba745e8 [0,0,0,0,0,0|2,0,2]=4 228 B11R0.40 COC(=O)CCCCNCSC a8830018c591017122980cf3745fb50b [0,0,0,0,0,0|2,0,2]=4 229 B11R0.40 COC(=O)CCCCOCCF 1d20051be253a43f413739bd5e7398e1 [0,0,0,0,0,0|2,0,2]=4 230 B11R0.40 COC(=O)CCCCOCCS 5f146b13f8bc53f0b1d9f8770994d494 [0,0,0,0,0,0|2,0,2]=4 231 B11R0.40 COC(=O)CCCCOCSC 0863b97c6be13255d8906e28183b8659 [0,0,0,0,0,0|2,0,2]=4 232 B11R0.40 COC(=O)CCCNCCCCl 8508da7d6b43fa27c5046753d4a650fb [0,0,0,0,0,0|2,0,2]=4 233 B11R0.40 COC(=O)CCCNCCCF c509034befe6b0b71c5e6bf9f704b220 [0,0,0,0,0,0|2,0,2]=4 234 B11R0.40 COC(=O)CCCNCCCO ae78a0866713110e761cbc6c0669803d [0,0,0,0,0,0|2,0,2]=4 235 B11R0.40 COC(=O)CCCNCCCS b8568108aca169fbbea4b0e8d5dcbc4d [0,0,0,0,0,0|2,0,2]=4 236 B11R0.40 COC(=O)CCCNCCSC 6bea0abab707a37e0a3725effd1a3095 [0,0,0,0,0,0|2,0,2]=4 237 B11R0.40 COC(=O)CCCOCCCF ad4a657375774e174695b5c380767605 [0,0,0,0,0,0|2,0,2]=4 238 B11R0.40 COC(=O)CCCOCCCS 614db15c725c13d73ce896e4a3526258 [0,0,0,0,0,0|2,0,2]=4 239 B11R0.40 COC(=O)CCCOCCSC a532869a6a9d1335d72148f96ad99d09 [0,0,0,0,0,0|2,0,2]=4 240 B11R0.40 COC(=O)CCNCCCCCl bb826384e531e4c800eddcc5d242e17f [0,0,0,0,0,0|2,0,2]=4 241 B11R0.40 COC(=O)CCNCCCCF d4b42e07dbe86fc7a477b2dc03e98869 [0,0,0,0,0,0|2,0,2]=4 242 B11R0.40 COC(=O)CCNCCCCO 01547e1a5ff564f49609eb19c19b3246 [0,0,0,0,0,0|2,0,2]=4 243 B11R0.40 COC(=O)CCNCCCCS e5445b20c264ac106343d36efa453bce [0,0,0,0,0,0|2,0,2]=4 244 B11R0.40 COC(=O)CCNCCCSC f634b170aff4c9918b899afbd28dc77d [0,0,0,0,0,0|2,0,2]=4 245 B11R0.40 COC(=O)CCOCCCCF fdd63d188c06e45bc0534668d783c9fe [0,0,0,0,0,0|2,0,2]=4 246 B11R0.40 COC(=O)CCOCCCCS 3b9308a913cffb35eed8fd20b29ba3e8 [0,0,0,0,0,0|2,0,2]=4 247 B11R0.40 COC(=O)CCOCCCSC b26f1a53d0c30e5fe57fe463fe93b69e [0,0,0,0,0,0|2,0,2]=4 248 B11R0.40 COC(=O)CNCCCCC#N 5be3186471a79c03b3ec14277a3d0965 [0,0,0,0,0,0|2,0,2]=4 249 B11R0.40 COC(=O)CNCCCCC=O 44cb8d3deb7b70f3ec297431d02ef7a4 [0,0,0,0,0,0|2,0,2]=4 250 B11R0.40 COC(=O)CNCCCCCCl 0c1d69aaf18f86e286dc851d6b343161 [0,0,0,0,0,0|2,0,1]=3 251 B11R0.40 COC(=O)CNCCCCCF 820ed3e8b866d3514f6760b96b1f6d43 [0,0,0,0,0,0|2,0,1]=3 252 B11R0.40 COC(=O)CNCCCCCO 5569fb90468880f109cc36d64e9a9a82 [0,0,0,0,0,0|2,0,1]=3 253 B11R0.40 COC(=O)CNCCCCON 5aa7e4651b3cc8fb416d227ed7612db7 [0,0,0,0,0,0|3,0,1]=4 254 B11R0.40 COC(=O)CNCCCCSC b2c17859876c00fe792d17efa257daec [0,0,0,0,0,0|2,0,1]=3 255 B11R0.40 COC(=O)CNCCOCCO d857fecd728df366e2e37ac1cfedb67c [0,0,0,0,0,0|3,0,1]=4 256 B11R0.40 COC(=O)CNCCOCCS 1695ce910485caa6bae6424b039a45e2 [0,0,0,0,0,0|3,0,1]=4 257 B11R0.40 COC(=O)CNCCSCCO 139acc59232a4499157abe36e901ccd6 [0,0,0,0,0,0|3,0,1]=4 258 B11R0.40 COC(=O)COCCCCC#N 1f2fdfb728a648fc7a05998668ac7b57 [0,0,0,0,0,0|2,0,2]=4 259 B11R0.40 COC(=O)COCCCCC=O c980f88c2addfeab188fbf48650b4298 [0,0,0,0,0,0|2,0,2]=4 260 B11R0.40 COC(=O)COCCCCCF cba36326a78ca1f965959e137fb7ac72 [0,0,0,0,0,0|2,0,1]=3 261 B11R0.40 COC(=O)COCCCCSC 447c9e188b6f6e43d32a8bc9d652b2ad [0,0,0,0,0,0|2,0,1]=3 262 B11R0.40 COC(=O)COCCCOCF 16bc0079c17fee6d4c7fe217a42855a3 [0,0,0,0,0,0|3,0,1]=4 263 B11R0.40 COC(=O)COCCNCCBr 4bec773a0c58356a00c8d6aaee402259 [0,0,0,0,0,0|3,0,1]=4 264 B11R0.40 COC(=O)COCCNCCF 18e11886c262cd7473c5f3dfa8890b9d [0,0,0,0,0,0|3,0,1]=4 265 B11R0.40 COC(=O)COCCNCCI dc9337944c8f41d1539a6744b2d7e6ba [0,0,0,0,0,0|3,0,1]=4 266 B11R0.40 COC(=O)COCCNCCO cb74cd831122e9df4bb8add78cdc15bb [0,0,0,0,0,0|3,0,1]=4 267 B11R0.40 COC(=O)COCCNCCS cf05785ecb758e5ac2a5b93c3a67dc09 [0,0,0,0,0,0|3,0,1]=4 268 B11R0.40 COC(=O)COCCOCCF ff3128386a5c1cb228a59813ed3d26ec [0,0,0,0,0,0|3,0,1]=4 269 B11R0.40 COC(=O)COCCOCCS af887c5e10625673873df556ffb66edd [0,0,0,0,0,0|3,0,1]=4 270 B11R0.40 COC(=O)COCCOCSC ca5bcabc5c9d48c8703ea3dd54208e5d [0,0,0,0,0,0|3,0,1]=4 271 B11R0.40 COC(=O)OCCOCCCF de029e7ac1644d7e90d3b7c22ec5348b [0,0,0,0,0,0|3,0,1]=4 272 B11R0.40 COC(=O)OCCOCCCS 89fffcc0bbee4cf534fff47521a1b7a2 [0,0,0,0,0,0|3,0,1]=4 273 B11R0.40 COC(=O)OCCOCCSC 2ceeed8cd5b255e33d51f776445a31a4 [0,0,0,0,0,0|3,0,1]=4 274 B11R0.40 COC(=O)OCNCCCCCl 4e9a14e548c308432e06e6dbfef901f0 [0,0,0,0,0,0|3,0,1]=4 275 B11R0.40 COC(=O)OCNCCCCO 0ccd9717301e3cf82ebb5da45eb3604c [0,0,0,0,0,0|3,0,1]=4 276 B11R0.40 COC(=O)OCNCCCCS 426dd4d42947f05957ddb7ca13ef8bef [0,0,0,0,0,0|3,0,1]=4 277 B11R0.40 COC(=O)OCNCCCSC 902e0b29940a4df3a1ba5a8130ae941a [0,0,0,0,0,0|3,0,1]=4 278 B11R0.40 COC(=O)OCOCCCCF fca55a25cec8b0cea6dae367d2cdc8ec [0,0,0,0,0,0|3,0,1]=4 279 B11R0.40 COC(=O)OCOCCCCS 385d9b18da918b0f0f3955a95adbad26 [0,0,0,0,0,0|3,0,1]=4 280 B11R0.40 COC(=O)OCOCCCSC d075f96e63d65a9fb63b5baec68d4274 [0,0,0,0,0,0|3,0,1]=4 281 B11R0.40 COCCCCNCC(=O)OC 047baeb57289bf0885885f64979f4866 [0,0,0,0,0,0|2,0,1]=3 282 B11R0.40 COCCCCOCC(=O)OC 931b9f10ba823e1596417b22b927de75 [0,0,0,0,0,0|2,0,1]=3 283 B11R0.40 COCCCNCCC(=O)OC e306541eb8340983226a2af15f8dfebb [0,0,0,0,0,0|2,0,2]=4 284 B11R0.40 COCCCNCOC(=O)OC 2b18f33f90e6c5cc10697137b589f815 [0,0,0,0,0,0|3,0,1]=4 285 B11R0.40 COCCCOCCC(=O)OC b4f1d1de8127af98e6f242234cd1ea0e [0,0,0,0,0,0|2,0,2]=4 286 B11R0.40 COCCCOCOC(=O)OC dfb6df9693f75e83ed062be54f66691e [0,0,0,0,0,0|3,0,1]=4 287 B11R0.40 COCCNC/C=C/C(=O)OC 6d1ac0fd530d9a5fe6d0b4126cf622b9 [0,0,0,0,0,0|2,0,0]=2 288 B11R0.40 COCCNC/C=C\C(=O)OC 80e62c5eb08d38a0ed1c91d32c2b40d1 [0,0,0,0,0,0|2,0,0]=2 289 B11R0.40 COCCNCC#CC(=O)OC 882ef41f72925e7f9d124ec45c550aa2 [0,0,0,0,0,0|2,0,2]=4 290 B11R0.40 COCCNCC=CC(=O)OC 703dcb542a725c8788a503f9b02f6e25 [0,0,0,0,0,0|2,0,0]=2 291 B11R0.40 COCCNCCCC(=O)OC 83cc4d7e4535f097edd93f9c804c386b [0,0,0,0,0,0|2,0,2]=4 292 B11R0.40 COCCOC/C=C/C(=O)OC 7700f5ad955e245cab5533a2256db2bb [0,0,0,0,0,0|2,0,0]=2 293 B11R0.40 COCCOC/C=C\C(=O)OC fe61f0871283c13ff7568ff5e501e76e [0,0,0,0,0,0|2,0,0]=2 294 B11R0.40 COCCOCC#CC(=O)OC 1b8052ac76aecb42d629a990daad9f80 [0,0,0,0,0,0|2,0,2]=4 295 B11R0.40 COCCOCC=CC(=O)OC d4c282d2521862001977ced1a31b3a9a [0,0,0,0,0,0|2,0,0]=2 296 B11R0.40 COCCOCCCC(=O)OC 99cf3628ca871405b6cc15b92d3d5b58 [0,0,0,0,0,0|2,0,2]=4 297 B11R0.40 COCCOCCOC(=O)OC 25c20c3eee60a7db8df16c9461ecbcb8 [0,0,0,0,0,0|3,0,1]=4 298 B11R0.40 COCCOCNCC(=O)OC ab0f82b071000d64fddbc5cb54fa100c [0,0,0,0,0,0|3,0,1]=4 299 B11R0.40 COCCOCOCC(=O)OC 44684d1343c616e87fc778e0ebb56e1f [0,0,0,0,0,0|3,0,1]=4 300 B11R0.40 COCNCCCCC(=O)OC ca301f2e53472380737e2e1a16df5a62 [0,0,0,0,0,0|2,0,2]=4 301 B11R0.40 COCOCCCCC(=O)OC 46187c7866992bbcae1859b32e6d100b [0,0,0,0,0,0|2,0,2]=4 302 B11R0.40 COCOCCNCC(=O)OC 8454ab259ca547f0dbb22448bd7df281 [0,0,0,0,0,0|3,0,1]=4 303 B11R0.40 COCOCCOCC(=O)OC 82f079e871292a54857bdc4b3014d475 [0,0,0,0,0,0|3,0,1]=4 304 B10R0.4 C#CCCNC/C=C/C(=O)O ae3134ff6c383168a1a315f6049c4aa1 [1,0,0,0,0,0|1,0,2]=4 305 B10R0.4 C#CCCNCC=CC(=O)O 9e0bd0263b6d3f303a780bdeb77f1eec [1,0,0,0,0,0|1,0,2]=4 306 B10R0.4 C#CCCOC/C=C/C(=O)O e97750fbe3af5cd25ada2c0b161a6a43 [1,0,0,0,0,0|1,0,2]=4 307 B10R0.4 C#CCCOCC=CC(=O)O 6ab6714a8ac9af17a2070b163f189fee [1,0,0,0,0,0|1,0,2]=4 308 B10R0.4 C/C=C/CNC/C=C/C(=O)O d8109611f2b46b7440b12543ef5a2667 [1,0,0,0,0,0|1,0,2]=4 309 B10R0.4 C/C=C/CNCC=CC(=O)O 99f0968071b56653d5d1f852845a71bc [1,0,0,0,0,0|1,0,2]=4 310 B10R0.4 C/C=C/COC/C=C/C(=O)O 9e3e67353299b82b6f2d1fc032d7f433 [1,0,0,0,0,0|1,0,2]=4 311 B10R0.4 C/C=C/COCC=CC(=O)O 4774a202bf666ad1a4096b4c9409afd7 [1,0,0,0,0,0|1,0,2]=4 312 B10R0.4 C/C=C\CNC/C=C/C(=O)O 58340f175c6cfa9f1c62a211fd57dc61 [1,0,0,0,0,0|1,0,2]=4 313 B10R0.4 C/C=C\CNCC=CC(=O)O 37bb86a727976fdefe183e3a2f21d8f6 [1,0,0,0,0,0|1,0,2]=4 314 B10R0.4 C/C=C\COC/C=C/C(=O)O cca6a1204e18f7410064d167f94b7196 [1,0,0,0,0,0|1,0,2]=4 315 B10R0.4 C/C=C\COCC=CC(=O)O 720963ab98658428ca9cdb73a3c7067a [1,0,0,0,0,0|1,0,2]=4 316 B10R0.4 C=C(C)CNCCCCCC 57e2209f6875fc62d2bad933ad5990a8 [1,0,0,0,0,0|2,0,1]=4 317 B10R0.4 C=C(C)COCCCCCC 18580082a3e432d96826bd208c01f2c4 [1,0,0,0,0,0|2,0,1]=4 318 B10R0.4 C=CCCNC/C=C/C(=O)O 0ce8299bcba3d55dfa58287dcb1b5e18 [1,0,0,0,0,0|1,0,2]=4 319 B10R0.4 C=CCCNCC=CC(=O)O 4b4b34f4734d27de6f7b413960c8cf4b [1,0,0,0,0,0|1,0,2]=4 320 B10R0.4 C=CCCOC/C=C/C(=O)O d4e7ebabd9d174ae70dcc3a6643469bb [1,0,0,0,0,0|1,0,2]=4 321 B10R0.4 C=CCCOCC=CC(=O)O 7bd1366b2591f6209e78b61d6f057c32 [1,0,0,0,0,0|1,0,2]=4 322 B10R0.4 CC#CCNC/C=C/C(=O)O 193160385daad07530a72090ecc528aa [1,0,0,0,0,0|1,0,2]=4 323 B10R0.4 CC#CCNCC=CC(=O)O 303eb49b65c84048b13b7352666de23b [1,0,0,0,0,0|1,0,2]=4 324 B10R0.4 CC#CCOC/C=C/C(=O)O b5b6290f6029c90a4fbca75b9212cef8 [1,0,0,0,0,0|1,0,2]=4 325 B10R0.4 CC#CCOCC=CC(=O)O 668237141c77270a84a30fb36a77a4dc [1,0,0,0,0,0|1,0,2]=4 326 B10R0.4 CC(=O)CNCCCCCF 14ed717f1f055fc3ffebcb0f3bb7f6ab [1,0,0,0,0,0|2,0,1]=4 327 B10R0.4 CC(=O)CNCCCCCO 64da7cdb6d2a9c33dc01f9b5a780e4d4 [1,0,0,0,0,0|2,0,1]=4 328 B10R0.4 CC(=O)COCCCCCF 7aec6ce84a2c3f216e8ae40d950f6334 [1,0,0,0,0,0|2,0,1]=4 329 B10R0.4 CC(=O)NCCCCCCCl f93e4eee74ea26870e48ebdfc4f07177 [1,0,0,0,0,0|2,0,1]=4 330 B10R0.4 CC(=O)NCCCCCCO f4c6533638e4e2bcf3850e47e46df271 [1,0,0,0,0,0|2,0,1]=4 331 B10R0.4 CC=CCNC/C=C/C(=O)O bfdefbcb87efc1e234a5d413c61ade0a [1,0,0,0,0,0|1,0,2]=4 332 B10R0.4 CC=CCNCC=CC(=O)O 87f7384c87fed03a9320e38798a7984f [1,0,0,0,0,0|1,0,2]=4 333 B10R0.4 CC=CCOC/C=C/C(=O)O afa0bfcbedf14cfa4f6346226dc63ff0 [1,0,0,0,0,0|1,0,2]=4 334 B10R0.4 CC=CCOCC=CC(=O)O 3ecf7907a1bda688d22605b4407d2793 [1,0,0,0,0,0|1,0,2]=4 335 B10R0.4 CCCCCCCNC(=O)C 7ff946498704aad8136855c3c0214f94 [1,0,0,0,0,0|1,0,1]=3 336 B10R0.4 CCCCCCNCC(=O)C e3842b8fd2cae14899e78886113beba0 [1,0,0,0,0,0|1,0,1]=3 337 B10R0.4 CCCCCCNCC(=O)N 3fae3fcfcc109d047ed465f3e2b847e2 [1,0,0,0,0,0|2,0,1]=4 338 B10R0.4 CCCCCCNCC(=O)O fb02da52628d24bba2741502ccbc57e6 [1,0,0,0,0,0|1,0,1]=3 339 B10R0.4 CCCCCCOCC(=O)C c622979e72a3edd318802db3f6123eee [1,0,0,0,0,0|1,0,1]=3 340 B10R0.4 CCCCCCOCC(=O)N 9c51cacea528460eb1c6e4fbed6a2905 [1,0,0,0,0,0|2,0,1]=4 341 B10R0.4 CCCCCCOCC(=O)O d5f902343f3fbf5baaa362a21e128151 [1,0,0,0,0,0|1,0,1]=3 342 B10R0.4 CCCCCCOCS(=O)O 2b6780218bd3498af4d92344e34b6465 [1,0,0,0,0,0|2,0,1]=4 343 B10R0.4 CCCCCNC/C=C(/C)\I 888f407c9912c682883282c5fa449bc3 [1,0,0,0,0,0|2,0,1]=4 344 B10R0.4 CCCCCNC/C=C(\C)/Cl 177e0edb752142a6e20de7fca3adb5b2 [1,0,0,0,0,0|2,0,1]=4 345 B10R0.4 CCCCCNCC=C(C)C 86a525cd8e4a6b34c066789a57566e47 [1,0,0,0,0,0|2,0,1]=4 346 B10R0.4 CCCCCNCC=C(C)Cl 50118f3abc69b2d8e563f0002063ccb1 [1,0,0,0,0,0|2,0,1]=4 347 B10R0.4 CCCCCNCC=C(C)I b6202e36bf5cc884706cc14a806fb748 [1,0,0,0,0,0|2,0,1]=4 348 B10R0.4 CCCCCNCCC(=O)C 2bb7295af3afb64defefb63687bea421 [1,0,0,0,0,0|1,0,2]=4 349 B10R0.4 CCCCCNCCC(=O)O c651e7e992c1332ced5d27852e6267f0 [1,0,0,0,0,0|1,0,2]=4 350 B10R0.4 CCCCCNCOC(=O)C 35ef47aef23a171936e6801a261865e1 [1,0,0,0,0,0|2,0,1]=4 351 B10R0.4 CCCCCOC/C=C(/C)\Cl aa962184d6cd966db0085f8251712374 [1,0,0,0,0,0|2,0,1]=4 352 B10R0.4 CCCCCOC/C=C(/C)\I 888a413f21dfbd656fc488c73a67a4d6 [1,0,0,0,0,0|2,0,1]=4 353 B10R0.4 CCCCCOC/C=C(\C)/Cl 4c8af2dec5ba3b4dfe6107e44ddef16b [1,0,0,0,0,0|2,0,1]=4 354 B10R0.4 CCCCCOCC=C(C)C d6a15546708c44b4ae5a35a9bc35cd2c [1,0,0,0,0,0|2,0,1]=4 355 B10R0.4 CCCCCOCC=C(C)Cl 520db63c0e141892ce317b451f1cdca4 [1,0,0,0,0,0|2,0,1]=4 356 B10R0.4 CCCCCOCC=C(C)I f3bc6ca17f79771d527e93998bd60d7e [1,0,0,0,0,0|2,0,1]=4 357 B10R0.4 CCCCCOCCC(=O)C 7d336bbb7dc5619074d320d9d5eeebd1 [1,0,0,0,0,0|1,0,2]=4 358 B10R0.4 CCCCCOCCC(=O)O 183ac3fdf6b059104c4c0237bab12aa8 [1,0,0,0,0,0|1,0,2]=4 359 B10R0.4 CCCCCOCNC(=O)C 3014ea30bb40b67aa6a1ce125b435cc1 [1,0,0,0,0,0|2,0,1]=4 360 B10R0.4 CCCCCOCOC(=O)C 62a840560a1a56a085f7882cc96ba1f5 [1,0,0,0,0,0|2,0,1]=4 361 B10R0.4 CCCCNC/C=C/C(=O)O 47b1a103370b1a6a86bcade53e559dd6 [1,0,0,0,0,0|1,0,0]=2 362 B10R0.4 CCCCNC/C=C/C(C)C a2deef38ecabb8eebc071867bac084b2 [1,0,0,0,0,0|2,0,1]=4 363 B10R0.4 CCCCNCC#CC(=O)O 8b42ea6f5918936295863b52eb2b06d1 [1,0,0,0,0,0|1,0,2]=4 364 B10R0.4 CCCCNCC=CC(=O)O f8dc0eb33b8e1238b7e6a28f8075ce7a [1,0,0,0,0,0|1,0,0]=2 365 B10R0.4 CCCCNCCC=C(C)C d9b770f84c8be90ca1d17cd0fdf54f4c [1,0,0,0,0,0|2,0,1]=4 366 B10R0.4 CCCCNCCCC(=O)C a2bda33665ed49237506dfdf7a5fb684 [1,0,0,0,0,0|1,0,2]=4 367 B10R0.4 CCCCNCCCC(=O)O 638f7b21d5bd5641b607514c8fb8caf4 [1,0,0,0,0,0|1,0,2]=4 368 B10R0.4 CCCCNCCNC(=O)C a0257fcf7897366323909d66114b6809 [1,0,0,0,0,0|2,0,1]=4 369 B10R0.4 CCCCNCCOC(=O)C dac752d37b046d20aa6fa7632de515a6 [1,0,0,0,0,0|2,0,1]=4 370 B10R0.4 CCCCNCCSC(=O)C 0ac4a109a3992122f41a3a955bc15a16 [1,0,0,0,0,0|2,0,1]=4 371 B10R0.4 CCCCOC/C=C/C(=O)O f8be4ebbb6c99643b3f6245797365927 [1,0,0,0,0,0|1,0,0]=2 372 B10R0.4 CCCCOC/C=C/C(C)C b1f2e0e0dbab8fa754580343d5eea046 [1,0,0,0,0,0|2,0,1]=4 373 B10R0.4 CCCCOCC#CC(=O)O 38cad6637629b89e3c26c481e48db3f0 [1,0,0,0,0,0|1,0,2]=4 374 B10R0.4 CCCCOCC=CC(=O)O a5c4798b7a417df05ba6cec5bd7ffd88 [1,0,0,0,0,0|1,0,0]=2 375 B10R0.4 CCCCOCCC=C(C)C 12c3c1f2c9c2d69ab18de77f0a3087ea [1,0,0,0,0,0|2,0,1]=4 376 B10R0.4 CCCCOCCCC(=O)C f0df1029dafc15690be3f3c094f0ad8e [1,0,0,0,0,0|1,0,2]=4 377 B10R0.4 CCCCOCCNC(=O)C ddcfe368ad37fbe3701a827b8b343f83 [1,0,0,0,0,0|2,0,1]=4 378 B10R0.4 CCCCOCCOC(=O)C 8f9bbeb4cacbf148ed1331b02f645662 [1,0,0,0,0,0|2,0,1]=4 379 B10R0.4 CCCCOCCSC(=O)C cd6988dd5f5d2697eb1fd4eec9b07d56 [1,0,0,0,0,0|2,0,1]=4 380 B10R0.4 CCCCOCNCC(=O)C af2d8785a5c96c78e17462ebf7d0cbc7 [1,0,0,0,0,0|2,0,1]=4 381 B10R0.4 CCCCOCNCC(=O)O fd1573ef0e57ade41e912b86193789e2 [1,0,0,0,0,0|2,0,1]=4 382 B10R0.4 CCCCOCOCC(=O)C de19627aa5bea52305b73b51889c5d58 [1,0,0,0,0,0|2,0,1]=4 383 B10R0.4 CCCCOCOCC(=O)O 44a077c696800f20f8f77d9f489d7e0a [1,0,0,0,0,0|2,0,1]=4 384 B10R0.4 CCCNCCCCC(=O)C ab2c95adbd41ecce6f11ada83f1aa463 [1,0,0,0,0,0|1,0,2]=4 385 B10R0.4 CCCNCCCCC(=O)O d7ced2df62e692539bca6ff33ab8a797 [1,0,0,0,0,0|1,0,2]=4 386 B10R0.4 CCCNCCCNC(=O)C 889a8f130116f443d6fd6e1232ef1497 [1,0,0,0,0,0|2,0,1]=4 387 B10R0.4 CCCNCCCOC(=O)C e1cec712d82f801a0d54d1944e98e203 [1,0,0,0,0,0|2,0,1]=4 388 B10R0.4 CCCNCCCSC(=O)C 2889b29bc4848ab93d3dd022a17fab90 [1,0,0,0,0,0|2,0,1]=4 389 B10R0.4 CCCNCCOCC(=O)O 6a2b5a7e2d583d3c6ba150b8c3cc16e1 [1,0,0,0,0,0|2,0,1]=4 390 B10R0.4 CCCNCCSCC(=O)O 94cff0686c4de2d0110011adc5739807 [1,0,0,0,0,0|2,0,1]=4 391 B10R0.4 CCCOCCC#CC(=O)O f4d5055400d31c308ce57b5764e65d8e [1,0,0,0,0,0|1,0,2]=4 392 B10R0.4 CCCOCCC=C=C(C)C ff90a2ec7c74bf60b333ceec06584888 [1,0,0,0,0,0|2,0,1]=4 393 B10R0.4 CCCOCCCCC(=O)C fd3e516a01dea40bc28ef8e85abe7b9e [1,0,0,0,0,0|1,0,2]=4 394 B10R0.4 CCCOCCCCC(=O)O b2ac1b83aca818e80a2df2f954405a9e [1,0,0,0,0,0|1,0,2]=4 395 B10R0.4 CCCOCCCNC(=O)C 7a5b85034a356fda536fac05ed90cc22 [1,0,0,0,0,0|2,0,1]=4 396 B10R0.4 CCCOCCCOC(=O)C a4e530952a94d07d0a2346bd1f1072e5 [1,0,0,0,0,0|2,0,1]=4 397 B10R0.4 CCCOCCCSC(=O)C 79a61e06633112b372a67f8d0e405976 [1,0,0,0,0,0|2,0,1]=4 398 B10R0.4 CCCOCCNCC(=O)C ca708ee5deb46f0d1f0948a3a215a9a0 [1,0,0,0,0,0|2,0,1]=4 399 B10R0.4 CCCOCCNCC(=O)O 9f97370ef19b48f601d53c72298be028 [1,0,0,0,0,0|2,0,1]=4 400 B10R0.4 CCCOCCOCC(=O)C 8a0436c09947b0d42e02b341d19a096c [1,0,0,0,0,0|2,0,1]=4 401 B10R0.4 CCCOCCOCC(=O)O c681b062af673d5355b0c992bcf9a03b [1,0,0,0,0,0|2,0,1]=4 402 B10R0.4 CCCSCCOCC(=O)O f1f74803f7accfdcb460a94fed60dea0 [1,0,0,0,0,0|2,0,1]=4 403 B10R0.4 CCNCCCCCC(=O)O 656d004177b3de742f8798a032b0925d [1,0,0,0,0,0|1,0,2]=4 404 B10R0.4 CCNCCCCNC(=O)C 56499de7750c75071aaf8455aae5ba93 [1,0,0,0,0,0|2,0,1]=4 405 B10R0.4 CCOCCCCCC(=O)O 8d0433351c28cc9400e6f6da602a903d [1,0,0,0,0,0|1,0,2]=4 406 B10R0.4 CCOCCCCOC(=O)C 136f9e9edd7237f018da84644cfcf35d [1,0,0,0,0,0|2,0,1]=4 407 B10R0.4 CCOCCCNCC(=O)C 26586e90bfaea7cf445b6081e122678a [1,0,0,0,0,0|2,0,1]=4 408 B10R0.4 CCOCCCNCC(=O)O 682f6d420ba5c774818f236d90f0fb13 [1,0,0,0,0,0|2,0,1]=4 409 B10R0.4 CCOCCCOCC(=O)C 454eab324c0bac50570ee31f562f3c52 [1,0,0,0,0,0|2,0,1]=4 410 B10R0.4 CCOCCCOCC(=O)O 2de1613f4b1376069d28111d2a4e00b4 [1,0,0,0,0,0|2,0,1]=4 411 B10R0.4 CCOCNC/C=C/C(=O)O 2875c981ec79c893eafb4a6f15f0c999 [1,0,0,0,0,0|2,0,0]=3 412 B10R0.4 CCOCNCC=CC(=O)O b7037b5f4256548a82996c2c775a2b30 [1,0,0,0,0,0|2,0,0]=3 413 B10R0.4 CCOCOC/C=C/C(=O)O 3a239d5167d5d5441a7edf345b5ed409 [1,0,0,0,0,0|2,0,0]=3 414 B10R0.4 CCOCOCC=CC(=O)O a538502bdb45503f331579e779e48792 [1,0,0,0,0,0|2,0,0]=3 415 B10R0.4 CCSCCCCNC(=O)C a92a124e17ab18927891ca9e4716ceb8 [1,0,0,0,0,0|2,0,1]=4 416 B10R0.4 CCSCCCNCC(=O)C e1d13e283a2d771ef21f5de250f59362 [1,0,0,0,0,0|2,0,1]=4 417 B10R0.4 CCSCCCNCC(=O)O 4844b03ae0e8362029b66cb17ab7da38 [1,0,0,0,0,0|2,0,1]=4 418 B10R0.4 CCSCCCOCC(=O)C c02cf25c3006eccd2ce0cd99c6e30a5c [1,0,0,0,0,0|2,0,1]=4 419 B10R0.4 CCSCCCOCC(=O)O 40fb12fd65694580de8c81fcc6657b85 [1,0,0,0,0,0|2,0,1]=4 420 B10R0.4 COCCCCCNC(=O)C bf09c8275c5b54d3f2dfe84453f1edeb [1,0,0,0,0,0|2,0,1]=4 421 B10R0.4 COCCCCNCC(=O)C cbfa920fe125fc55313b8605fe9796ca [1,0,0,0,0,0|2,0,1]=4 422 B10R0.4 COCCCCNCC(=O)O e7016d96fdd719c414f251fdf8041599 [1,0,0,0,0,0|2,0,1]=4 423 B10R0.4 COCCCCOCC(=O)C 1fb872d7e0dc73f602bada9dd9543de8 [1,0,0,0,0,0|2,0,1]=4 424 B10R0.4 COCCCCOCC(=O)O c66cf56e8604e7dab5e9dc4c5dc31662 [1,0,0,0,0,0|2,0,1]=4 425 B10R0.4 COCCNC/C=C/C(=O)O b1d04a179acee46908956917264c8cc5 [1,0,0,0,0,0|2,0,0]=3 426 B10R0.4 COCCNCC=CC(=O)O ef0e4ce163e3241834baff0dae811c80 [1,0,0,0,0,0|2,0,0]=3 427 B10R0.4 COCCOC/C=C/C(=O)O 66070973a0357b16620bc879320e93c3 [1,0,0,0,0,0|2,0,0]=3 428 B10R0.4 COCCOCC=CC(=O)O f37127939adc5d6a066eae4cdb179c6b [1,0,0,0,0,0|2,0,0]=3 429 B10R0.4 CSCCCCNCC(=O)O fe5f17285810fe796abbdf4483e3c94f [1,0,0,0,0,0|2,0,1]=4 430 B10R0.4 CSCCCCOCC(=O)O 6959643b4f26b002ad25adcfb835b476 [1,0,0,0,0,0|2,0,1]=4 431 B10R0.4 CSCCNC/C=C/C(=O)O b1228173c26f88bf0095cbc45a5e21db [1,0,0,0,0,0|2,0,0]=3 432 B10R0.4 CSCCNCC=CC(=O)O 7f5fb377fe5377cc803de2553c28d287 [1,0,0,0,0,0|2,0,0]=3 433 B10R0.4 CSCCOC/C=C/C(=O)O c6623daae1bdc6df0eea5b6cc80f5ef4 [1,0,0,0,0,0|2,0,0]=3 434 B10R0.4 CSCCOCC=CC(=O)O 0fd583ba97df6e5e9337d21463221f93 [1,0,0,0,0,0|2,0,0]=3 435 B10R0.4 N#CCCNC/C=C/C(=O)O f887a38db6c08a68bae5c143c5c7e20a [1,0,0,0,0,0|2,0,1]=4 436 B10R0.4 N#CCCNCC=CC(=O)O 817da5765f57345afb062d88ad788ae1 [1,0,0,0,0,0|2,0,1]=4 437 B10R0.4 N#CCCOC/C=C/C(=O)O fe11672977d372dfe059aa42cebdc7f8 [1,0,0,0,0,0|2,0,1]=4 438 B10R0.4 N#CCCOCC=CC(=O)O b1561a4669bf43c05913524f5158078a [1,0,0,0,0,0|2,0,1]=4 439 B10R0.4 NOCCNC/C=C/C(=O)O 1aca31a3ab67b7f0901f1eb8297bdf44 [1,0,0,0,0,0|3,0,0]=4 440 B10R0.4 NOCCNCC=CC(=O)O 394b5316a352f4534f6d8a345a2fdfb7 [1,0,0,0,0,0|3,0,0]=4 441 B10R0.4 O=C(O)/C=C/CNCCCCl 5d7b01cccad7f7aa9fa7f0406bab9e93 [1,0,0,0,0,0|2,0,0]=3 442 B10R0.4 O=C(O)/C=C/CNCCCF d92460741b8dda97762a1d7a72ba3673 [1,0,0,0,0,0|2,0,0]=3 443 B10R0.4 O=C(O)/C=C/CNCCCO d9e674b13507c040b7a7a8b90c96e7d6 [1,0,0,0,0,0|2,0,0]=3 444 B10R0.4 O=C(O)/C=C/CNCCCS 35fcb2a0be1464b0b2be2b2c55fc6187 [1,0,0,0,0,0|2,0,0]=3 445 B10R0.4 O=C(O)/C=C/COCCCF 138adf3e5a621d89d67231c17793e2e6 [1,0,0,0,0,0|2,0,0]=3 446 B10R0.4 O=C(O)/C=C/COCCCS 5bd8e6a45493d9cc00eb46a146676303 [1,0,0,0,0,0|2,0,0]=3 447 B10R0.4 O=C(O)C=CCNCCCCl 1e72e22dd52648dea2d4205cb25f9624 [1,0,0,0,0,0|2,0,0]=3 448 B10R0.4 O=C(O)C=CCNCCCF e26a9782d7430c923fbcae00d797add2 [1,0,0,0,0,0|2,0,0]=3 449 B10R0.4 O=C(O)C=CCNCCCO fcba38efbd09999c051c3dc2d8670641 [1,0,0,0,0,0|2,0,0]=3 450 B10R0.4 O=C(O)C=CCNCCCS 48d055f95461678cbe308cd4c0a345e3 [1,0,0,0,0,0|2,0,0]=3 451 B10R0.4 O=C(O)C=CCOCCCF 8899ee31fe53daf02a3aea8b5f0aced2 [1,0,0,0,0,0|2,0,0]=3 452 B10R0.4 O=C(O)C=CCOCCCS 1ca378389e39abb72f78c4e13ec684a5 [1,0,0,0,0,0|2,0,0]=3 453 B10R0.4 O=C(O)CNCCCCCCl a83b6bb993dd65ffba33eb2586cdf494 [1,0,0,0,0,0|2,0,1]=4 454 B10R0.4 O=C(O)CNCCCCCF 4dbeaa853a61d08f169520460ad25911 [1,0,0,0,0,0|2,0,1]=4 455 B10R0.4 O=C(O)CNCCCCCO 95121d7be2e3a87e4e81ec26c166df24 [1,0,0,0,0,0|2,0,1]=4 456 B10R0.4 O=C(O)COCCCCCF 8e4729e23febda2f8d2fd6c5de67d134 [1,0,0,0,0,0|2,0,1]=4 457 B10R0.4 O=CCCNC/C=C/C(=O)O 7bd4dcb8b5e1e1b17acd9b5e06e6ddef [1,0,0,0,0,0|2,0,1]=4 458 B10R0.4 O=CCCNCC=CC(=O)O 5aa84de6d5dfc561a2e6220d02aae921 [1,0,0,0,0,0|2,0,1]=4 459 B10R0.4 O=CCCOC/C=C/C(=O)O cb402409316a1b67485f36e13fd9a6d4 [1,0,0,0,0,0|2,0,1]=4 460 B10R0.4 O=CCCOCC=CC(=O)O c7f3f78e5a4b4270dcf0d4946eb7cd47 [1,0,0,0,0,0|2,0,1]=4 461 B10R0.71 C/C=C/C=C/COCCCC 5be7c2b1277a2751ff6b685b75a09aa7 [1,0,0,0,0,0|2,0,0]=3 462 B10R0.71 C/C=C/C=C/COCCCF 517e388ccc8a69b3c3b788f42f35e0b5 [1,0,0,0,0,0|3,0,0]=4 463 B10R0.71 C/C=C/C=C/COCCCS 88605be89f61a37c5537d42de9111ec5 [1,0,0,0,0,0|3,0,0]=4 464 B10R0.71 C/C=C/C=C/COCCOC 09d182365213d814b51c617be63aafcf [1,0,0,0,0,0|3,0,0]=4 465 B10R0.71 C/C=C/C=C/COCCSC ec2ec57c424865d8f04a31497e5e1709 [1,0,0,0,0,0|3,0,0]=4 466 B10R0.71 C/C=C/C=C/COCOCC e709fdf8cc680576f78ffda36573d054 [1,0,0,0,0,0|3,0,0]=4 467 B10R0.71 C/C=C/CNCCCCCC 23f0bb0d5026d859ab84031e8dc94320 [1,0,0,0,0,0|2,0,1]=4 468 B10R0.71 C/C=C/COCCCCCC 2cc86534d43c03349a69990f00a712f1 [1,0,0,0,0,0|2,0,1]=4 469 B10R0.71 C/C=C\CNCCCCCC 51c50a34f77d344a6f9e8db0e46ec177 [1,0,0,0,0,0|2,0,1]=4 470 B10R0.71 C/C=C\COCCCCCC c3215f168781748ebc00617e7f23375f [1,0,0,0,0,0|2,0,1]=4 471 B10R0.71 CC/C=C/CCOCCCC c8bbe4a116e9837c5acb0bd130d88747 [1,0,0,0,0,0|2,0,1]=4 472 B10R0.71 CC/C=C/CNCCCCC 396ae7fd2aad2d3062225091f1ed8121 [1,0,0,0,0,0|2,0,1]=4 473 B10R0.71 CC/C=C/COCCCCC 4244476ee625bb91d4c75005fa57b26a [1,0,0,0,0,0|2,0,1]=4 474 B10R0.71 CC/C=C\CCCCOCC 6f672bd2ab358cb454803e83d5c0e284 [1,0,0,0,0,0|2,0,1]=4 475 B10R0.71 CC/C=C\CCCOCCC 7fa768d31f02c71335efb28537f1ed87 [1,0,0,0,0,0|2,0,1]=4 476 B10R0.71 CC/C=C\CCNCCCC c4f059f6ebacdc59905230714b6eff68 [1,0,0,0,0,0|2,0,1]=4 477 B10R0.71 CC/C=C\CCOCCCC 8e83903dc8b2dc055f80be84ab4a3d9c [1,0,0,0,0,0|2,0,1]=4 478 B10R0.71 CC/C=C\COCCCCC 273210e5829d96509e829e222979bc8b [1,0,0,0,0,0|2,0,1]=4 479 B10R0.71 CC=CC=CCOCCCC b2db690d4b1d749e1abe5e187adedbf9 [1,0,0,0,0,0|2,0,0]=3 480 B10R0.71 CC=CC=CCOCCCF e301058a6bb123dacb4663e8390cc1a8 [1,0,0,0,0,0|3,0,0]=4 481 B10R0.71 CC=CC=CCOCCCS 59699e406486475c037d740ca486c3f0 [1,0,0,0,0,0|3,0,0]=4 482 B10R0.71 CC=CC=CCOCCOC 39a09f3f320ae5f898ad13e2186ab48e [1,0,0,0,0,0|3,0,0]=4 483 B10R0.71 CC=CC=CCOCCSC 5eff3cf4aba18dda9a2e518051a746c7 [1,0,0,0,0,0|3,0,0]=4 484 B10R0.71 CC=CC=CCOCOCC c66b1d730b21c0e0db8cfe55755471fc [1,0,0,0,0,0|3,0,0]=4 485 B10R0.71 CC=CCNCCCCCC a2b3321184d80eccc150605d97b3fa96 [1,0,0,0,0,0|2,0,1]=4 486 B10R0.71 CC=CCOCCCCCC a58ad78e13367fd9a0795b0d0efdc386 [1,0,0,0,0,0|2,0,1]=4 487 B10R0.71 CCC/C=C/CCCOCC 96c575cc0a2c58edec4b18e8b3051827 [1,0,0,0,0,0|2,0,1]=4 488 B10R0.71 CCC/C=C/CNCCCC eb6f385e07ebf81c43b715a8e6898101 [1,0,0,0,0,0|2,0,1]=4 489 B10R0.71 CCC/C=C/COCCCC 5cb7fad967976b46414fd1e0981df754 [1,0,0,0,0,0|2,0,1]=4 490 B10R0.71 CCC/C=C\CCCOCC 1c8765980afe95de3eca026e03130832 [1,0,0,0,0,0|2,0,1]=4 491 B10R0.71 CCC/C=C\CCOCCC affe8f34b74549b94b8274cb3a319479 [1,0,0,0,0,0|2,0,1]=4 492 B10R0.71 CCC/C=C\CNCCCC bec0667c6be34c83c909fc9cd36559c3 [1,0,0,0,0,0|2,0,1]=4 493 B10R0.71 CCC/C=C\COCCCC 12552b98ae2ab17ee7aaf14497e6f771 [1,0,0,0,0,0|2,0,1]=4 494 B10R0.71 CCCCCCCNCOC f2d51f45d743c2c6bb60d201a5c48204 [1,0,0,0,0,0|1,0,2]=4 495 B10R0.71 CCCCCCCOCOC 5ce19ed9c6e4108e173e3dc063eaeb4e [1,0,0,0,0,0|1,0,2]=4 496 B10R0.71 CCCCCCNCCOC d8a9b2ae4f4d1a2408c43a2120d332fc [1,0,0,0,0,0|1,0,2]=4 497 B10R0.71 CCCCCCOCCOC 498c1d974b36c5798a5345f99389e8d2 [1,0,0,0,0,0|1,0,2]=4 498 B10R0.74 C#CC(=O)NCCCCCC 9ce0dcb0417530c831957f5468426ec6 [1,0,0,0,0,0|2,0,1]=4 499 B10R0.74 C#CCNC/C=C/C(=O)OC 126a5fc28b295206ef3e2dae181ca65d [1,0,0,0,0,0|1,0,2]=4 500 B10R0.74 C#CCNC/C=C\C(=O)OC 46cdc648962e4664b626aae619b5e3a8 [1,0,0,0,0,0|1,0,2]=4 501 B10R0.74 C#CCNCC=CC(=O)OC d833cecf4ce9a28eaeb11979d69a392d [1,0,0,0,0,0|1,0,2]=4 502 B10R0.74 C#CCOC/C=C/C(=O)OC 461371d38c505bbd31a52664f8c8c360 [1,0,0,0,0,0|1,0,2]=4 503 B10R0.74 C#CCOC/C=C\C(=O)OC 1b651c90a4db789c89cdbe6985442027 [1,0,0,0,0,0|1,0,2]=4 504 B10R0.74 C#CCOCC=CC(=O)OC adbc361c9e7826f8e5bda80f6b119acb [1,0,0,0,0,0|1,0,2]=4 505 B10R0.74 C=C(CNCCCCC)OC 7ceed52b8862c2740fad9864ee680023 [1,0,0,0,0,0|2,0,1]=4 506 B10R0.74 C=C(COCCCCC)OC 1bd3146a306a9b176c071f317d4b189d [1,0,0,0,0,0|2,0,1]=4 507 B10R0.74 C=CC(=O)NCCCCCC 88ce4279cd9f4230d78384982723ab15 [1,0,0,0,0,0|2,0,1]=4 508 B10R0.74 C=CCOC/C=C/C(=O)OC 432dcd1557658b8f12403efbf072adba [1,0,0,0,0,0|1,0,2]=4 509 B10R0.74 CCC(=O)NCCCCCCl 719912c2fc32999aaca586ce6a33a4fc [1,0,0,0,0,0|3,0,0]=4 510 B10R0.74 CCC(=O)NCCCCCO 1c6fabc29010351852246ff1decd06a1 [1,0,0,0,0,0|3,0,0]=4 511 B10R0.74 CCC(=O)NCCCCOC 304fb086e3dbdc4472ef768bd3e17d25 [1,0,0,0,0,0|3,0,0]=4 512 B10R0.74 CCC(=O)NCCCCSC e2aaa2c9252a2834ce862f0cb7545c18 [1,0,0,0,0,0|3,0,0]=4 513 B10R0.74 CCCCCCNC(=O)C=O 77542971675e4c1be34f9cc380438664 [1,0,0,0,0,0|3,0,0]=4 514 B10R0.74 CCCCCCNC(=O)CC f0032df3cc8c2000bc1576b718e1412f [1,0,0,0,0,0|2,0,0]=3 515 B10R0.74 CCCCCCNC(=O)CF 738680f040b17c056aa0d8344a6ec8af [1,0,0,0,0,0|3,0,0]=4 516 B10R0.74 CCCCCCNC(=O)CO e8cf9f23cdf04b79897a080a69f10636 [1,0,0,0,0,0|3,0,0]=4 517 B10R0.74 CCCCCCNC(=O)CS 3e91e20700d92addaced40b0a6fc3a10 [1,0,0,0,0,0|3,0,0]=4 518 B10R0.74 CCCCCNCC(=O)CC 9dd2e224792ae6d66bce0b7cb1ae679b [1,0,0,0,0,0|2,0,1]=4 519 B10R0.74 CCCCCNCC(=O)NC 824806198187a2c8b60b648f0512f923 [1,0,0,0,0,0|2,0,1]=4 520 B10R0.74 CCCCCNCC(=O)OC 648365248fe1587b1bbc2cd6174118d5 [1,0,0,0,0,0|1,0,1]=3 521 B10R0.74 CCCCCOCC(=O)CC dbc68622c1630e1162d4ac42bae10c20 [1,0,0,0,0,0|2,0,1]=4 522 B10R0.74 CCCCCOCC(=O)NC 7963aeae3ec675f3acaacb8898855202 [1,0,0,0,0,0|2,0,1]=4 523 B10R0.74 CCCCCOCC(=O)OC b7118d3515803bc38039c9851ac2a113 [1,0,0,0,0,0|1,0,1]=3 524 B10R0.74 CCCCNCCC(=O)NC 9358a84b45aa382250269cc4a432e002 [1,0,0,0,0,0|2,0,1]=4 525 B10R0.74 CCCCNCCC(=O)OC 09ad74908609854771fdcf0490c9897c [1,0,0,0,0,0|1,0,1]=3 526 B10R0.74 CCCCNCOC(=O)CC e0b802cea9bb962c4bfe33b428a79424 [1,0,0,0,0,0|3,0,0]=4 527 B10R0.74 CCCCNCOC(=O)OC b9862ebe4e8cf9ca635d6e2c0b6a69d3 [1,0,0,0,0,0|2,0,0]=3 528 B10R0.74 CCCCOCCC(=O)NC 45b320f2a23c3fb98d60c20a9148826e [1,0,0,0,0,0|2,0,1]=4 529 B10R0.74 CCCCOCCC(=O)OC e3be7e6d51b5d91e883aedbf1fdb6a9f [1,0,0,0,0,0|1,0,1]=3 530 B10R0.74 CCCCOCOC(=O)CC 79f92447ebf68bdbe7c87af9f238ac09 [1,0,0,0,0,0|3,0,0]=4 531 B10R0.74 CCCCOCOC(=O)OC f2b08abd9d6a5d7efd1cbb987a41251e [1,0,0,0,0,0|2,0,0]=3 532 B10R0.74 CCCNC/C=C/C(=O)OC d187b40bc82130c5216e6dc2996aa46d [1,0,0,0,0,0|1,0,0]=2 533 B10R0.74 CCCNC/C=C\C(=O)OC d531e3c68942266bed58d1eba3e9966a [1,0,0,0,0,0|1,0,0]=2 534 B10R0.74 CCCNCC#CC(=O)OC fa9c5088cb0bba6fdab9fe49508304f7 [1,0,0,0,0,0|1,0,2]=4 535 B10R0.74 CCCNCC=CC(=O)OC 350c6262148a20258506775102337b8b [1,0,0,0,0,0|1,0,0]=2 536 B10R0.74 CCCNCCCC(=O)NC a3b31883785f33a03890cefb42b1d82a [1,0,0,0,0,0|2,0,1]=4 537 B10R0.74 CCCNCCCC(=O)OC b16643f72059eae0ad94565e3f229a1f [1,0,0,0,0,0|1,0,1]=3 538 B10R0.74 CCCNCCNC(=O)CC 654790e0c463f303ea5b5f1e104b3b23 [1,0,0,0,0,0|3,0,0]=4 539 B10R0.74 CCCOC/C=C/C(=O)OC bfce11a355dc4f4a5487c0dbb8f55e6b [1,0,0,0,0,0|1,0,0]=2 540 B10R0.74 CCCOC/C=C\C(=O)OC dcfa8ae3af300ec4f68156f25ffba366 [1,0,0,0,0,0|1,0,0]=2 541 B10R0.74 CCCOCC#CC(=O)OC c1615b7f88b4176630c07fca414f7744 [1,0,0,0,0,0|1,0,2]=4 542 B10R0.74 CCCOCC=CC(=O)OC 6c5e7ef1753396b9c64f09bd9c14ee05 [1,0,0,0,0,0|1,0,0]=2 543 B10R0.74 CCCOCCCC(=O)NC 47cc15a6d3336cd77ff2e352f7e46945 [1,0,0,0,0,0|2,0,1]=4 544 B10R0.74 CCCOCCCC(=O)OC 6777d826a7092669282f32ac583d5482 [1,0,0,0,0,0|1,0,1]=3 545 B10R0.74 CCCOCCNC(=O)CC 37663f297721ace7d18f666f43feb975 [1,0,0,0,0,0|3,0,0]=4 546 B10R0.74 CCCOCCOC(=O)CC 0266b80a03c10e2cb61b113dd4b9130c [1,0,0,0,0,0|3,0,0]=4 547 B10R0.74 CCCOCCOC(=O)OC 19df69bdbd15a1dd1020380f97d55a25 [1,0,0,0,0,0|2,0,0]=3 548 B10R0.74 CCNCCCCC(=O)OC 2fc49225e902a66c0506ebb2378fe230 [1,0,0,0,0,0|1,0,1]=3 549 B10R0.74 CCOCCCCC(=O)OC 26c440802f326860db2c18e76f91ac90 [1,0,0,0,0,0|1,0,1]=3 550 B10R0.74 CCOCCCNC(=O)CC 32ec07714ce8038f039e2cd922179ddc [1,0,0,0,0,0|3,0,0]=4 551 B10R0.74 CCOCCNCC(=O)OC 4e8de05c8bba98d3809ba8d488720d7e [1,0,0,0,0,0|2,0,1]=4 552 B10R0.74 CCOCCOCC(=O)OC a85fffda64a094bd9fa34bf171e10958 [1,0,0,0,0,0|2,0,1]=4 553 B10R0.74 CCOCNCCC(=O)OC d1aa96682cb912ad175d4f3af69a7407 [1,0,0,0,0,0|2,0,1]=4 554 B10R0.74 CCOCOCCC(=O)OC a1011f85baa037966a10f0db7d9f71d6 [1,0,0,0,0,0|2,0,1]=4 555 B10R0.74 CCSCCNCC(=O)OC 1ffb21202fa1cb9c1e862f710d175ea3 [1,0,0,0,0,0|2,0,1]=4 556 B10R0.74 CCSCCOCC(=O)OC 5721b0d191f483b2c5970b87ced2a450 [1,0,0,0,0,0|2,0,1]=4 557 B10R0.74 COC(=O)/C=C/CNCC#N 0474f0820424f74120e12f0fd7642625 [1,0,0,0,0,0|2,0,1]=4 558 B10R0.74 COC(=O)/C=C/CNCCBr 73677ab34b774abf24778f86bf131e1e [1,0,0,0,0,0|2,0,0]=3 559 B10R0.74 COC(=O)/C=C/CNCCF 57a2bbd0230ce1628f775ab39fefb743 [1,0,0,0,0,0|2,0,0]=3 560 B10R0.74 COC(=O)/C=C/CNCCI 5ddcff647664867ecd395ab4dc647af1 [1,0,0,0,0,0|2,0,0]=3 561 B10R0.74 COC(=O)/C=C/CNCCO 99ad6690606683c7fe3601f45e5995f7 [1,0,0,0,0,0|2,0,0]=3 562 B10R0.74 COC(=O)/C=C/CNCCS d5b945c8957b5a8c2c409094f3ed814f [1,0,0,0,0,0|2,0,0]=3 563 B10R0.74 COC(=O)/C=C/COCC#N 5e649b4ca69e35e022f63e51389d3a4f [1,0,0,0,0,0|2,0,1]=4 564 B10R0.74 COC(=O)/C=C/COCC=O ad4b690689e0da46346bffcb26e4ac31 [1,0,0,0,0,0|2,0,1]=4 565 B10R0.74 COC(=O)/C=C/COCCF f91c5100843d61bea777edf3a6c99ecd [1,0,0,0,0,0|2,0,0]=3 566 B10R0.74 COC(=O)/C=C/COCCS 64f3c59868ecfbc89055a5a60a27a1e4 [1,0,0,0,0,0|2,0,0]=3 567 B10R0.74 COC(=O)/C=C/COCSC 6d044bd479e670a6ad22c79ec4215d9d [1,0,0,0,0,0|2,0,0]=3 568 B10R0.74 COC(=O)/C=C\CNCC#N 86dfa7355ea2d4c56e55c5ecb1f445c3 [1,0,0,0,0,0|2,0,1]=4 569 B10R0.74 COC(=O)/C=C\CNCCBr c1e749ea2e852bb9b90c9abfaa70ab2e [1,0,0,0,0,0|2,0,0]=3 570 B10R0.74 COC(=O)/C=C\CNCCF aceefae84eda509e759bb162e7c5aae4 [1,0,0,0,0,0|2,0,0]=3 571 B10R0.74 COC(=O)/C=C\CNCCI 66711c5707b35441398e3dd21d541b4e [1,0,0,0,0,0|2,0,0]=3 572 B10R0.74 COC(=O)/C=C\CNCCO 2c8ef9eb8250cd8b1316c6bd7529bdfa [1,0,0,0,0,0|2,0,0]=3 573 B10R0.74 COC(=O)/C=C\CNCCS 9cc9d95bcda5e83dac99b512ee992bf0 [1,0,0,0,0,0|2,0,0]=3 574 B10R0.74 COC(=O)/C=C\COCC#N ba9cbd4f64bf337ad834379008889681 [1,0,0,0,0,0|2,0,1]=4 575 B10R0.74 COC(=O)/C=C\COCCF a388dcdda16c98c79cd713d02a940118 [1,0,0,0,0,0|2,0,0]=3 576 B10R0.74 COC(=O)/C=C\COCCS b375fd31f61d15b72cbea1f7caaafdb7 [1,0,0,0,0,0|2,0,0]=3 577 B10R0.74 COC(=O)C=CCNCC#N 5c4a69cab9bdd490b86a37e38ce023d4 [1,0,0,0,0,0|2,0,1]=4 578 B10R0.74 COC(=O)C=CCNCCBr 915a4a4e08dd469d7c4ee4a84ca507ab [1,0,0,0,0,0|2,0,0]=3 579 B10R0.74 COC(=O)C=CCNCCF ef03a3d8f9ecf0617be8671e6368792b [1,0,0,0,0,0|2,0,0]=3 580 B10R0.74 COC(=O)C=CCNCCI ee5f0a4fefc0a33f4255d31a0144152a [1,0,0,0,0,0|2,0,0]=3 581 B10R0.74 COC(=O)C=CCNCCO 6c521971a904a33f89836779f06fd78a [1,0,0,0,0,0|2,0,0]=3 582 B10R0.74 COC(=O)C=CCNCCS a6516dc0ec668e78ea6de7e34578df8b [1,0,0,0,0,0|2,0,0]=3 583 B10R0.74 COC(=O)C=CCOCC#N 1a641b25469a4eb65ac884b567d12416 [1,0,0,0,0,0|2,0,1]=4 584 B10R0.74 COC(=O)C=CCOCCF 7ff4d11cd6ea2ab3cf857743fea44c75 [1,0,0,0,0,0|2,0,0]=3 585 B10R0.74 COC(=O)C=CCOCCS a755c294ccec8e0758472fd9e63d811d [1,0,0,0,0,0|2,0,0]=3 586 B10R0.74 COC(=O)CCCCNCF 24fe1f8ef5e7f92df15e23d781c2bda6 [1,0,0,0,0,0|2,0,1]=4 587 B10R0.74 COC(=O)CCCCNCO f030f24f4426fe74e7d8ea04e70e74ca [1,0,0,0,0,0|2,0,1]=4 588 B10R0.74 COC(=O)CCCCOCF 174910bab2d037713b18a265a8f3f46a [1,0,0,0,0,0|2,0,1]=4 589 B10R0.74 COC(=O)CCCNCCBr 9c51d334e0953320e19fea85b6b1fd6c [1,0,0,0,0,0|2,0,1]=4 590 B10R0.74 COC(=O)CCCNCCF ab83e9b19a9d2139da2ebfe0bd5d3b37 [1,0,0,0,0,0|2,0,1]=4 591 B10R0.74 COC(=O)CCCNCCI e868fd7399f288687e6a6c32f65774b5 [1,0,0,0,0,0|2,0,1]=4 592 B10R0.74 COC(=O)CCCNCCO 8668c445b163b442f85ab895d00987c8 [1,0,0,0,0,0|2,0,1]=4 593 B10R0.74 COC(=O)CCCNCCS d701e11e7ad693a35efd750085305a74 [1,0,0,0,0,0|2,0,1]=4 594 B10R0.74 COC(=O)CCCNCSC faedf9d17f7f69f05e860d9f4c2eedac [1,0,0,0,0,0|2,0,1]=4 595 B10R0.74 COC(=O)CCCOCCF 7a0d6361420304c7bd4ae6ecca548250 [1,0,0,0,0,0|2,0,1]=4 596 B10R0.74 COC(=O)CCCOCCS c957c36687ac3de604796819e2d658fc [1,0,0,0,0,0|2,0,1]=4 597 B10R0.74 COC(=O)CCNCCCCl fcdabf0770998f9d46c59cfa4e7bc088 [1,0,0,0,0,0|2,0,1]=4 598 B10R0.74 COC(=O)CCNCCCF 2069cb4a743aa178a680e4a0d2a4552a [1,0,0,0,0,0|2,0,1]=4 599 B10R0.74 COC(=O)CCNCCCO e96655e5337f5162972d522187b13057 [1,0,0,0,0,0|2,0,1]=4 600 B10R0.74 COC(=O)CCNCCCS 91305a6874847a37968800110fe7e78a [1,0,0,0,0,0|2,0,1]=4 601 B10R0.74 COC(=O)CCNCCSC 9e4c27bedbde00d5252809e0aa58c89e [1,0,0,0,0,0|2,0,1]=4 602 B10R0.74 COC(=O)CCOCCCF 0aefebceea2c1de4d61a01719abc4a0b [1,0,0,0,0,0|2,0,1]=4 603 B10R0.74 COC(=O)CCOCCCS 5520c0b92e39a85c24dc627f637a0781 [1,0,0,0,0,0|2,0,1]=4 604 B10R0.74 COC(=O)CCOCCSC fdd64bc9ba11e14400f289a9f49df6a4 [1,0,0,0,0,0|2,0,1]=4 605 B10R0.74 COC(=O)CNCCCCCl 5e9c4c1e412ed1d57e7a65a24f3d16e9 [1,0,0,0,0,0|2,0,1]=4 606 B10R0.74 COC(=O)CNCCCCF 9c6b6f9c58be9fe01b9d5c3b50313ca6 [1,0,0,0,0,0|2,0,1]=4 607 B10R0.74 COC(=O)CNCCCCO ea42ac0b81f4922b97a1f7174639fed1 [1,0,0,0,0,0|2,0,1]=4 608 B10R0.74 COC(=O)CNCCCCS 81de9b1e99aeb0dc4a838becc69c5385 [1,0,0,0,0,0|2,0,1]=4 609 B10R0.74 COC(=O)CNCCCSC 5fac51759d1aaf12d9eb7dac1709d600 [1,0,0,0,0,0|2,0,1]=4 610 B10R0.74 COC(=O)COCCCCF 004fc87d8325e555e0ba69b8de39ce15 [1,0,0,0,0,0|2,0,1]=4 611 B10R0.74 COC(=O)COCCCCS 66361017a5f0eedafd224c8fdcb3465c [1,0,0,0,0,0|2,0,1]=4 612 B10R0.74 COC(=O)COCCCSC cccf2e9fa2ee0349c1d66b0bc4f29a76 [1,0,0,0,0,0|2,0,1]=4 613 B10R0.74 COC(=O)OCCOCCF 3e93e2da9fd5bb891a00a4d9e4ff966c [1,0,0,0,0,0|3,0,0]=4 614 B10R0.74 COC(=O)OCCOCCS 4f916091a7653337bd8b08ea257c2679 [1,0,0,0,0,0|3,0,0]=4 615 B10R0.74 COC(=O)OCCOCSC 26e45fce16a76890b8820ac852cfbbed [1,0,0,0,0,0|3,0,0]=4 616 B10R0.74 COC(=O)OCNCCCCl d79540cf63b385e5a7bb99911ba947b9 [1,0,0,0,0,0|3,0,0]=4 617 B10R0.74 COC(=O)OCNCCCO aa57fdea458b9cde3098f1b2b1cac60d [1,0,0,0,0,0|3,0,0]=4 618 B10R0.74 COC(=O)OCNCCSC 5226cf2e698b7b2701cdb1ea5e1ff800 [1,0,0,0,0,0|3,0,0]=4 619 B10R0.74 COC(=O)OCOCCCF 0bd11ef2421d394ee1fc14f2647065ad [1,0,0,0,0,0|3,0,0]=4 620 B10R0.74 COC(=O)OCOCCCS e0aafe56f3d968247475b6fe1690b9c8 [1,0,0,0,0,0|3,0,0]=4 621 B10R0.74 COC(=O)OCOCCSC d1a8d2ca5dd68b79bcb6ee0a01436975 [1,0,0,0,0,0|3,0,0]=4 622 B10R0.74 COCCCNCC(=O)OC 32312a1b3f85bb4e70f6e4e37ca6fef7 [1,0,0,0,0,0|2,0,1]=4 623 B10R0.74 COCCCOCC(=O)OC d608caa140492e0b0fcb94dda1926cf5 [1,0,0,0,0,0|2,0,1]=4 624 B10R0.74 COCCNCCC(=O)OC 7c1ddb99a5aa10e5cebf2f0a1943a5a1 [1,0,0,0,0,0|2,0,1]=4 625 B10R0.74 COCCNCOC(=O)OC 6381be7280054d6355fce5e1cfbfa9ed [1,0,0,0,0,0|3,0,0]=4 626 B10R0.74 COCCOCCC(=O)OC 9517e4d9c854e0a6d5b0b99ca928d942 [1,0,0,0,0,0|2,0,1]=4 627 B10R0.74 COCCOCOC(=O)OC a5c2d2e6baaf0a1567c032e04db1bf65 [1,0,0,0,0,0|3,0,0]=4 628 B10R0.74 COCNCCCC(=O)OC 085c0ab887f5e3d1ddfd29e981267fd3 [1,0,0,0,0,0|2,0,1]=4 629 B10R0.74 COCOC/C=C/C(=O)OC 175b76ddede30141c65013f476488129 [1,0,0,0,0,0|2,0,0]=3 630 B10R0.74 COCOC/C=C\C(=O)OC dcf94eed82c6bed54f6644ce8af5211b [1,0,0,0,0,0|2,0,0]=3 631 B10R0.74 COCOCC=CC(=O)OC cb63d2781613b42c8ccc03608ce7081e [1,0,0,0,0,0|2,0,0]=3 632 B10R0.74 COCOCCCC(=O)OC b68fbbe3b66cde135d1c1e599e84c93f [1,0,0,0,0,0|2,0,1]=4 633 B10R0.74 COCOCCOC(=O)OC 40eecdd82c26596431406769198420fd [1,0,0,0,0,0|3,0,0]=4 634 B12R0.1 C#CCCNC/C=C/C(=O)OCC 7f989aa32543bf17544b12f1ac5efb96 [0,1,0,0,0,0|1,0,2]=4 635 B12R0.1 C#CCCNCC=CC(=O)OCC d783e3cb31722e7c7332f21b5bcaaa0f [0,1,0,0,0,0|1,0,2]=4 636 B12R0.1 C#CCCOC/C=C/C(=O)OCC 4754c7da0407548e446a3acc296e5ffd [0,1,0,0,0,0|1,0,2]=4 637 B12R0.1 C#CCCOCC=CC(=O)OCC 0f2fe9eabe7efc724e50dbddeb3cab08 [0,1,0,0,0,0|1,0,2]=4 638 B12R0.1 C#CCNCCC=CC(=O)OCC 6611f01c48e8616ced6985c0b66f9e47 [0,1,0,0,0,0|1,0,2]=4 639 B12R0.1 C#CCOCC/C=C/C(=O)OCC 20abb4a1e8f491dadda5accb265e8d20 [0,1,0,0,0,0|1,0,2]=4 640 B12R0.1 C#CCOCCC=CC(=O)OCC 0dad2f269f9395b296f3e386e1b90bb7 [0,1,0,0,0,0|1,0,2]=4 641 B12R0.1 C/C=C/C(=O)NCCCCCCC 143aedf4a24336379d4af9ae7f8e7244 [0,1,0,0,0,0|2,0,1]=4 642 B12R0.1 C/C=C/COC/C=C/C(=O)OCC fc61957abd7f551ba9d75864e5496e38 [0,1,0,0,0,0|1,0,2]=4 643 B12R0.1 C/C=C/COCC=CC(=O)OCC 8f33042164cb2661df410098e2b67d15 [0,1,0,0,0,0|1,0,2]=4 644 B12R0.1 C/C=C\COC/C=C/C(=O)OCC 169f6ac3f942f5e1d268698659419bf4 [0,1,0,0,0,0|1,0,2]=4 645 B12R0.1 C/C=C\COCC=CC(=O)OCC c025ee5e4f2b4b165307b210784243c9 [0,1,0,0,0,0|1,0,2]=4 646 B12R0.1 C=CCCNC/C=C/C(=O)OCC dc0a7c1c0e88637afe0400c9abb59e66 [0,1,0,0,0,0|1,0,2]=4 647 B12R0.1 C=CCCNCC=CC(=O)OCC 26db7667d3340963ec0465e7b0c6c88e [0,1,0,0,0,0|1,0,2]=4 648 B12R0.1 C=CCCOC/C=C/C(=O)OCC 3f8b441270e8967746e81b7af559f911 [0,1,0,0,0,0|1,0,2]=4 649 B12R0.1 C=CCCOCC=CC(=O)OCC 1bd84639b0eade69457dc080af18fc39 [0,1,0,0,0,0|1,0,2]=4 650 B12R0.1 C=CCOCC/C=C/C(=O)OCC 77c47ec3b50d5f36f404d19634b17dcc [0,1,0,0,0,0|1,0,2]=4 651 B12R0.1 C=COC(=O)CNCCCCCC e9ae05b3b71f216c904e41e0357eb5ac [0,1,0,0,0,0|1,0,2]=4 652 B12R0.1 C=COC(=O)COCCCCCC 73f13ae300b8e438635aeb67c6c4b1c0 [0,1,0,0,0,0|1,0,2]=4 653 B12R0.1 CC#CC(=O)NCCCCCCC 9dc706b7e8ba935d6397c1b687367039 [0,1,0,0,0,0|2,0,1]=4 654 B12R0.1 CC#CCNC/C=C/C(=O)OCC b4153e33b1d6346c6336b36d5b43a038 [0,1,0,0,0,0|1,0,2]=4 655 B12R0.1 CC#CCNCC=CC(=O)OCC a5a57711a921eaacd7b2fcb4052dc840 [0,1,0,0,0,0|1,0,2]=4 656 B12R0.1 CC#CCOC/C=C/C(=O)OCC 044963383c583ae7b4136b96425e60c6 [0,1,0,0,0,0|1,0,2]=4 657 B12R0.1 CC#CCOCC=CC(=O)OCC 8eef4480ea3cf460537cee3945cc3d4a [0,1,0,0,0,0|1,0,2]=4 658 B12R0.1 CC=CCNC/C=C/C(=O)OCC c5ba722b65516d9e3dc117179d91bb11 [0,1,0,0,0,0|1,0,2]=4 659 B12R0.1 CC=CCNCC=CC(=O)OCC 5fcf3c7498dfecde979d619e42d6b4e4 [0,1,0,0,0,0|1,0,2]=4 660 B12R0.1 CC=CCOC/C=C/C(=O)OCC 188625c2247658469655243fecacdab1 [0,1,0,0,0,0|1,0,2]=4 661 B12R0.1 CC=CCOCC=CC(=O)OCC 48f92f4371819963c5b4e177d97bcfa6 [0,1,0,0,0,0|1,0,2]=4 662 B12R0.1 CCCCCC/C=C/C(=O)NC#N 86256d262e1049657feb5d7559adb3b1 [0,1,0,0,0,0|1,0,1]=3 663 B12R0.1 CCCCCCCNC(=O)CCC cc2f9bb62ae47c3d56fe2447919a6820 [0,1,0,0,0,0|2,0,1]=4 664 B12R0.1 CCCCCCCNC(=O)CCF fa0b05635b6bfb27486c6422091cb933 [0,1,0,0,0,0|2,0,1]=4 665 B12R0.1 CCCCCCCNC(=O)CCO 343037cb27d2431bfada229e8eb220ca [0,1,0,0,0,0|2,0,1]=4 666 B12R0.1 CCCCCCCNC(=O)CCS e56e6d944e0a2c16d5f7d697345a11f7 [0,1,0,0,0,0|2,0,1]=4 667 B12R0.1 CCCCCCCNC(=O)COC 193e0da5b2923750db7cb40f6b96f198 [0,1,0,0,0,0|1,0,1]=3 668 B12R0.1 CCCCCCCNC(=O)CON 805f1318c8e41cd79c4b07ee2a157072 [0,1,0,0,0,0|2,0,1]=4 669 B12R0.1 CCCCCCCNC(=O)CSC 7a958c47d32a819174cd82af4a8b4478 [0,1,0,0,0,0|1,1,1]=4 670 B12R0.1 CCCCCCNCC(=O)CCC f47dda3d1f83759950f26c4f3e9b6cda [0,1,0,0,0,0|2,0,1]=4 671 B12R0.1 CCCCCCNCC(=O)COC fdaf82dcdc1091c41ce15fe821b1dfd3 [0,1,0,0,0,0|1,0,1]=3 672 B12R0.1 CCCCCCNCC(=O)NCC 9289ae5a2cd52bef677cbf2896aad3e1 [0,1,0,0,0,0|2,0,1]=4 673 B12R0.1 CCCCCCNCC(=O)NCO 98a14368a8997b39c86f3cfc4e54affb [0,1,0,0,0,0|2,0,1]=4 674 B12R0.1 CCCCCCNCC(=O)OCC 6be77b6d291e5bcb1b5ee543218d2829 [0,1,0,0,0,0|1,0,1]=3 675 B12R0.1 CCCCCCOCC(=O)CCC a26767bbedda544e6a69ee985b0c3dee [0,1,0,0,0,0|2,0,1]=4 676 B12R0.1 CCCCCCOCC(=O)COC e8fe61cc4918a2434916dd7e928678a8 [0,1,0,0,0,0|1,0,1]=3 677 B12R0.1 CCCCCCOCC(=O)NCC b3fb8ad45dd10df9af353f6793a9e4c8 [0,1,0,0,0,0|2,0,1]=4 678 B12R0.1 CCCCCCOCC(=O)OCC bbe6630c73c21fc02210547f28d8da58 [0,1,0,0,0,0|1,0,1]=3 679 B12R0.1 CCCCCNCCC(=O)OCC ccfebc809b095b1cf38f2ca180de6861 [0,1,0,0,0,0|1,0,2]=4 680 B12R0.1 CCCCCNCOC(=O)OCC 68c2ca21685c705ec33c7083f32cd13e [0,1,0,0,0,0|2,0,1]=4 681 B12R0.1 CCCCCOCCC(=O)OCC 0e8d283a882f47cc8cf67da5cc42052f [0,1,0,0,0,0|1,0,2]=4 682 B12R0.1 CCCCCOCOC(=O)OCC 69d9cd494ae71bfbe851f78311fd2ef7 [0,1,0,0,0,0|2,0,1]=4 683 B12R0.1 CCCCNC/C=C/C(=O)OCC 1ed5449023ba030743a3ae056eca355b [0,1,0,0,0,0|1,0,0]=2 684 B12R0.1 CCCCNCC=CC(=O)OCC dc25e93e632bd5eebd16694cb89d7b9d [0,1,0,0,0,0|1,0,0]=2 685 B12R0.1 CCCCNCCCC(=O)OCC 8b28206bbb47bf0a96f03d9b954c92cc [0,1,0,0,0,0|1,0,2]=4 686 B12R0.1 CCCCOC/C=C/C(=O)OCC e181cd6e2cd1be5c79bb3d0735422fe2 [0,1,0,0,0,0|1,0,0]=2 687 B12R0.1 CCCCOCC#CC(=O)OCC db21299404520e568d0a62d2caca2057 [0,1,0,0,0,0|1,0,2]=4 688 B12R0.1 CCCCOCC=CC(=O)OCC a47918836e21ce5e28774d557ccd72ac [0,1,0,0,0,0|1,0,0]=2 689 B12R0.1 CCCCOCCCC(=O)OCC 911ef1f6024850e2650d76a8173e5556 [0,1,0,0,0,0|1,0,2]=4 690 B12R0.1 CCCCOCCNC(=O)COC 78670faf01e91a127ed9c62498b397c9 [0,1,0,0,0,0|2,0,1]=4 691 B12R0.1 CCCCOCNCC(=O)OCC faabb817975ddf6641c6b9f6c190b083 [0,1,0,0,0,0|2,0,1]=4 692 B12R0.1 CCCCOCOCC(=O)OCC 935958810e74725b96744c4ceee01b4a [0,1,0,0,0,0|2,0,1]=4 693 B12R0.1 CCCNCCC=CC(=O)OCC 9cfa1e2cb2a6dd48c725806d070b04e3 [0,1,0,0,0,0|1,0,0]=2 694 B12R0.1 CCCNCCCCC(=O)OCC af859276231b6944d66e75bb032a0322 [0,1,0,0,0,0|1,0,2]=4 695 B12R0.1 CCCOCC/C=C/C(=O)OCC 2303bf326aa3f733f62fc47186ae09c4 [0,1,0,0,0,0|1,0,0]=2 696 B12R0.1 CCCOCCC=CC(=O)OCC ee774255ff7f32f7caf1532cbc9ee9ea [0,1,0,0,0,0|1,0,0]=2 697 B12R0.1 CCCOCCCCC(=O)OCC 51d78253f7b52ee9e7147bf25348aaba [0,1,0,0,0,0|1,0,2]=4 698 B12R0.1 CCCOCCCNC(=O)COC cb2a1424fb6e69d125e95d1bd75229df [0,1,0,0,0,0|2,0,1]=4 699 B12R0.1 CCCOCCNCC(=O)COC 9b464853d5b9bc1c552f074c1ae22247 [0,1,0,0,0,0|2,0,1]=4 700 B12R0.1 CCCOCCNCC(=O)OCC 239aff86a3253f4e92984b6924e8935e [0,1,0,0,0,0|2,0,1]=4 701 B12R0.1 CCCOCCOCC(=O)COC 8aa1a8445662292885a5e7701f1c8aaa [0,1,0,0,0,0|2,0,1]=4 702 B12R0.1 CCCOCCOCC(=O)OCC e956761b010e3123844814131e112ba1 [0,1,0,0,0,0|2,0,1]=4 703 B12R0.1 CCCSCCOCC(=O)COC 7c182db9c19d397159abdbf53a9a3da7 [0,1,0,0,0,0|2,0,1]=4 704 B12R0.1 CCCSCCOCC(=O)OCC 7dc809704e5077e6bd03885f18e6a5e7 [0,1,0,0,0,0|2,0,1]=4 705 B12R0.1 CCNCCCCCC(=O)OCC 3082b4e9c515f8b8be859ad9fb770d19 [0,1,0,0,0,0|1,0,2]=4 706 B12R0.1 CCOC(=O)/C=C/CCCNC#N cc77ecfda0f4e5bf16aa9b5554c9e704 [0,1,0,0,0,0|2,0,1]=4 707 B12R0.1 CCOC(=O)/C=C/CCOCC#N 57d480315d8122b0237661320d485031 [0,1,0,0,0,0|2,0,1]=4 708 B12R0.1 CCOC(=O)/C=C/CCOCC=O 284963111f0d8c94e349bd1c631b7cc4 [0,1,0,0,0,0|2,0,1]=4 709 B12R0.1 CCOC(=O)/C=C/CCOCCF 67c7bad9ddf22dab717be6f2d73b62be [0,1,0,0,0,0|2,0,0]=3 710 B12R0.1 CCOC(=O)/C=C/CCOCCS 88f226a1ea146c1866ad420346e5e4b3 [0,1,0,0,0,0|2,0,0]=3 711 B12R0.1 CCOC(=O)/C=C/CCOCOC ed88416f9090d2092a2f1406764a0f42 [0,1,0,0,0,0|2,0,0]=3 712 B12R0.1 CCOC(=O)/C=C/CCOCSC 27d7403bf1ee2cbec5bb908787708eb5 [0,1,0,0,0,0|2,0,0]=3 713 B12R0.1 CCOC(=O)/C=C/CNCCC#N 46ad2b2f2c55d23bab5e1f9020c6be74 [0,1,0,0,0,0|2,0,1]=4 714 B12R0.1 CCOC(=O)/C=C/CNCCCCl 5d4655317fe367223f625679de83951c [0,1,0,0,0,0|2,0,0]=3 715 B12R0.1 CCOC(=O)/C=C/CNCCCO 577bac6a2bf469a8dd31af2e590b0af5 [0,1,0,0,0,0|2,0,0]=3 716 B12R0.1 CCOC(=O)/C=C/CNCCOC a6404e3eb342c3bcb46ac68d82256614 [0,1,0,0,0,0|2,0,0]=3 717 B12R0.1 CCOC(=O)/C=C/CNCCON facb74e624d7202f1eccc09a6cb04cfd [0,1,0,0,0,0|3,0,0]=4 718 B12R0.1 CCOC(=O)/C=C/CNCCSC aeee375a6b62fc8ea42fcd7c86c2112e [0,1,0,0,0,0|2,0,0]=3 719 B12R0.1 CCOC(=O)/C=C/COCCC#N f73f8ba5b52fb07e484d720c536d6991 [0,1,0,0,0,0|2,0,1]=4 720 B12R0.1 CCOC(=O)/C=C/COCCC=O 3e78128887ad9db49864dc018fe89ccd [0,1,0,0,0,0|2,0,1]=4 721 B12R0.1 CCOC(=O)/C=C/COCCCF 48bddaa97e64b39f1d7e409edcaba290 [0,1,0,0,0,0|2,0,0]=3 722 B12R0.1 CCOC(=O)/C=C/COCCCS 69843832e8fc8c896e41661729d39437 [0,1,0,0,0,0|2,0,0]=3 723 B12R0.1 CCOC(=O)/C=C/COCCOC c0a50d4ee3af10c212f6ac3f2bdec792 [0,1,0,0,0,0|2,0,0]=3 724 B12R0.1 CCOC(=O)/C=C/COCCSC 26431de3cf1174070f02cc11b7cdd74c [0,1,0,0,0,0|2,0,0]=3 725 B12R0.1 CCOC(=O)C=CCCNCC#N 5b34e1bda2104b38c75021a83db678bc [0,1,0,0,0,0|2,0,1]=4 726 B12R0.1 CCOC(=O)C=CCCNCCBr 38d528c9583438986f47d4fd1bacf82b [0,1,0,0,0,0|2,0,0]=3 727 B12R0.1 CCOC(=O)C=CCCNCCF f0600d68db570213c12a120f11ce38be [0,1,0,0,0,0|2,0,0]=3 728 B12R0.1 CCOC(=O)C=CCCNCCI a3171ce6b5e209211519f43cbb534a91 [0,1,0,0,0,0|2,0,0]=3 729 B12R0.1 CCOC(=O)C=CCCNCCO 864da4061bf8394554c73ce02622ee95 [0,1,0,0,0,0|2,0,0]=3 730 B12R0.1 CCOC(=O)C=CCCNCCS 54c950bec13adeb0bb37509797cb3b0e [0,1,0,0,0,0|2,0,0]=3 731 B12R0.1 CCOC(=O)C=CCCOCC#N c1f3ecab7b250d6b5df8ebc84ef5675a [0,1,0,0,0,0|2,0,1]=4 732 B12R0.1 CCOC(=O)C=CCCOCCF 376ec7f1b07e0fbb702dca3a1241fce5 [0,1,0,0,0,0|2,0,0]=3 733 B12R0.1 CCOC(=O)C=CCCOCCS ff240577026ca2b2768402af44fabfca [0,1,0,0,0,0|2,0,0]=3 734 B12R0.1 CCOC(=O)C=CCCOCOC ef4411f91dd696951159b7d708a34d73 [0,1,0,0,0,0|2,0,0]=3 735 B12R0.1 CCOC(=O)C=CCNCCC#N 18e72cbb6e90aa1d472e1c35bc5ee3ce [0,1,0,0,0,0|2,0,1]=4 736 B12R0.1 CCOC(=O)C=CCNCCCCl 9338fb8b17afe87720c2589e859a055c [0,1,0,0,0,0|2,0,0]=3 737 B12R0.1 CCOC(=O)C=CCNCCCO f65f647c0a7357e74903b74e6a3177a2 [0,1,0,0,0,0|2,0,0]=3 738 B12R0.1 CCOC(=O)C=CCNCCOC 17e09285d12975e5b4d72f54fcf837c8 [0,1,0,0,0,0|2,0,0]=3 739 B12R0.1 CCOC(=O)C=CCNCCON a4c193ecc65776ab1176b961ba64b37a [0,1,0,0,0,0|3,0,0]=4 740 B12R0.1 CCOC(=O)C=CCNCCSC 8378e5d27c572a68f5b3fdd6e17aa6e1 [0,1,0,0,0,0|2,0,0]=3 741 B12R0.1 CCOC(=O)C=CCOCCC#N 0a2f66df836c07d950c53ecddfaf441a [0,1,0,0,0,0|2,0,1]=4 742 B12R0.1 CCOC(=O)C=CCOCCC=O 1bd3634c61a193f41577a5020d928d21 [0,1,0,0,0,0|2,0,1]=4 743 B12R0.1 CCOC(=O)C=CCOCCCF f10cefab99c63cd8b8d603ff7db37111 [0,1,0,0,0,0|2,0,0]=3 744 B12R0.1 CCOC(=O)C=CCOCCCS 52e4844831e44ba8d90dd13b16ad44e3 [0,1,0,0,0,0|2,0,0]=3 745 B12R0.1 CCOC(=O)C=CCOCCOC d476a740417a55d9b88ab62007a60fa5 [0,1,0,0,0,0|2,0,0]=3 746 B12R0.1 CCOC(=O)C=CCOCCSC dfa46ddb0059d43e585d381c934ffe14 [0,1,0,0,0,0|2,0,0]=3 747 B12R0.1 CCOC(=O)CNCCCCCCl 58e161da4ecc780d2991740be8c089d5 [0,1,0,0,0,0|2,0,1]=4 748 B12R0.1 CCOC(=O)CNCCCCCF d29011e4a1e166877af4f961a4f2490a [0,1,0,0,0,0|2,0,1]=4 749 B12R0.1 CCOC(=O)CNCCCCCO 9aa3e90fe522eccc11acb2dcce0f12a4 [0,1,0,0,0,0|2,0,1]=4 750 B12R0.1 CCOC(=O)CNCCCCOC 20b52f33ea51a932ab9c35f8dddd54bc [0,1,0,0,0,0|2,0,1]=4 751 B12R0.1 CCOC(=O)CNCCCCSC 3aa87d0193ec4066a857561ba6181c9f [0,1,0,0,0,0|2,0,1]=4 752 B12R0.1 CCOC(=O)CNCCCSCC c696b86d2cc68efa4569836d55494198 [0,1,0,0,0,0|2,0,1]=4 753 B12R0.1 CCOC(=O)COCCCCCF 50c7fa072831b49b3af2edaf08d4c8a4 [0,1,0,0,0,0|2,0,1]=4 754 B12R0.1 CCOC(=O)COCCCCOC 4ccc51ace4bb9ca789adb9a045234d9f [0,1,0,0,0,0|2,0,1]=4 755 B12R0.1 CCOC(=O)COCCCCSC 2e64cc00939356121bac05eacf564071 [0,1,0,0,0,0|2,0,1]=4 756 B12R0.1 CCOC(=O)COCCCSCC b54712bbae2dd3901cfa3d61585de9c0 [0,1,0,0,0,0|2,0,1]=4 757 B12R0.1 CCOCCCCCC(=O)OCC 776de740a04afd55ce4174c29edf7765 [0,1,0,0,0,0|1,0,2]=4 758 B12R0.1 CCOCCCNCC(=O)COC 860662edf4a972d3b31d01156b7bc332 [0,1,0,0,0,0|2,0,1]=4 759 B12R0.1 CCOCCCNCC(=O)OCC c1cce805d15c27205b56cf9d1768e34b [0,1,0,0,0,0|2,0,1]=4 760 B12R0.1 CCOCCCOCC(=O)COC 47bc5ccd3420fa54e86f9cd5fd1e695c [0,1,0,0,0,0|2,0,1]=4 761 B12R0.1 CCOCCCOCC(=O)OCC 5076ceeeee32075b701b383adc26b88e [0,1,0,0,0,0|2,0,1]=4 762 B12R0.1 CCOCOC/C=C/C(=O)OCC 417db3814677d1ba80088c83395c0f4c [0,1,0,0,0,0|2,0,0]=3 763 B12R0.1 CCSCCCCNC(=O)COC 8121783f22c698c44d9e8b2b20561f0b [0,1,0,0,0,0|2,0,1]=4 764 B12R0.1 CCSCCCOCC(=O)COC 4f37cacebc21a84fe13b7ef6a88f0a6c [0,1,0,0,0,0|2,0,1]=4 765 B12R0.1 COCC(=O)CNCCCCCCl fccdb41c7c069a66732258d99883415c [0,1,0,0,0,0|2,0,1]=4 766 B12R0.1 COCC(=O)CNCCCCCO 9120529d0967c2dc131e6bc009c4e41f [0,1,0,0,0,0|2,0,1]=4 767 B12R0.1 COCC(=O)CNCCCCSC d6d379e370d7b519d568d3eff3f0e2b1 [0,1,0,0,0,0|2,0,1]=4 768 B12R0.1 COCC(=O)COCCCCSC 42c4aaea28a73b373af3e289007550ea [0,1,0,0,0,0|2,0,1]=4 769 B12R0.1 COCC(=O)NCCCCCCCl f56305a7cce204e84369b7b636615ad0 [0,1,0,0,0,0|2,0,1]=4 770 B12R0.1 COCC(=O)NCCCCCCO 47eb2d30db7a99156764f24b8c47b808 [0,1,0,0,0,0|2,0,1]=4 771 B12R0.1 COCCCCCNC(=O)COC 3f3af212cf0957902c0363b5e2edb388 [0,1,0,0,0,0|2,0,1]=4 772 B12R0.1 COCCCCNCC(=O)COC db4a8c3b5e567158737d640c0c4bc172 [0,1,0,0,0,0|2,0,1]=4 773 B12R0.1 COCCCCOCC(=O)COC 863c08947f65c4bdba2b82e33412ad6c [0,1,0,0,0,0|2,0,1]=4 774 B12R0.49 C#CCCCCNC(=O)C(=O)OC f593fa50665f4910c6ee4d62371b5b55 [0,1,0,0,0,0|1,0,2]=4 775 B12R0.49 C#CCCCOC=C(F)C(=O)OC 1737935c80ed2679c828fa9e1be19e17 [0,1,0,0,0,0|1,0,2]=4 776 B12R0.49 C/C=C(/C)\C(=O)NCCCCCC cd32294c3f255e13f2ea57ccf12a1c0f [0,1,0,0,0,0|3,0,0]=4 777 B12R0.49 C/C=C(\Br)/C(=O)NCCCCCC cb892edc21f70be92c0879f15d6e7664 [0,1,0,0,0,0|3,0,0]=4 778 B12R0.49 C/C=C(\C)/C(=O)NCCCCCC 28d798f12917629e9bc00cd67721f1d5 [0,1,0,0,0,0|3,0,0]=4 779 B12R0.49 C/C=C(\Cl)/C(=O)NCCCCCC 33f013ed59aaee7a78d1bf516ec515f9 [0,1,0,0,0,0|3,0,0]=4 780 B12R0.49 C/C=C(\O)/C(=O)NCCCCCC 94af456fd706a8858ebc297c6cfe6973 [0,1,0,0,0,0|2,0,1]=4 781 B12R0.49 C=C(CC)C(=O)NCCCCCC 9d8959196f3c3634e8011b8ca564656f [0,1,0,0,0,0|3,0,0]=4 782 B12R0.49 C=C(CNCCCCC)C(=O)OC d8cfd6f27bf99dfb2439c91972cfa2f0 [0,1,0,0,0,0|1,0,1]=3 783 B12R0.49 C=C(CNCCCCCl)C(=O)OC 76a41c7f77926e0b91018806dd84cf59 [0,1,0,0,0,0|2,0,1]=4 784 B12R0.49 C=C(CNCCCCO)C(=O)OC 946155b20b5085dd250e944d1b365795 [0,1,0,0,0,0|2,0,1]=4 785 B12R0.49 C=C(CNCCCCS)C(=O)OC ff4edb78029eadbe6d9c19082770d982 [0,1,0,0,0,0|2,0,1]=4 786 B12R0.49 C=C(CNCCCOC)C(=O)OC 01ec21abd78b73233cb7f3811434c5a0 [0,1,0,0,0,0|2,0,1]=4 787 B12R0.49 C=C(CNCCCSC)C(=O)OC af2fefb56caeb17dd0a5547cca4d62d7 [0,1,0,0,0,0|2,0,1]=4 788 B12R0.49 C=C(CNCCOCC)C(=O)OC c265ee0d62d8889e1fe3fbbeafb5c482 [0,1,0,0,0,0|2,0,1]=4 789 B12R0.49 C=C(CNCCSCC)C(=O)OC 12e1d6eb6239ada0786c83433c99548f [0,1,0,0,0,0|2,0,1]=4 790 B12R0.49 C=C(COCCCCC)C(=O)OC abf4f87f748eb21088b2647d06f6e055 [0,1,0,0,0,0|1,0,1]=3 791 B12R0.49 C=C(COCCCCF)C(=O)OC 5b8a643e62e333868134955e72fd97e3 [0,1,0,0,0,0|2,0,1]=4 792 B12R0.49 C=C(COCCCCS)C(=O)OC e024131e913feadd52e50905a7774643 [0,1,0,0,0,0|2,0,1]=4 793 B12R0.49 C=C(COCCCOC)C(=O)OC ed6136ba7ac0680319b901c78459582c [0,1,0,0,0,0|2,0,1]=4 794 B12R0.49 C=C(COCCCSC)C(=O)OC 5c04bfefd3a05060c9dd713fcb516f95 [0,1,0,0,0,0|2,0,1]=4 795 B12R0.49 C=C(COCCOCC)C(=O)OC 0f006ae3c200b770bd698dbf4621ab0c [0,1,0,0,0,0|2,0,1]=4 796 B12R0.49 C=C(COCCSCC)C(=O)OC 54b22ea7c9f7324d1dbfc153f62c25fd [0,1,0,0,0,0|2,0,1]=4 797 B12R0.49 C=CC(=O)C(=O)NCCCCCC 62023df119eb9b20907fb4463f9a799e [0,1,0,0,0,0|2,0,1]=4 798 B12R0.49 C=CCCCCNC(=O)C(=O)OC 3781580ac69f96b1a13cacbc8fc52ddf [0,1,0,0,0,0|1,0,2]=4 799 B12R0.49 C=CCCCOC=C(F)C(=O)OC baa5a016a3110b0c17650dbb7f8dd0dd [0,1,0,0,0,0|1,0,2]=4 800 B12R0.49 CC/C=C/COC=C(F)C(=O)OC 86f02f52b27f4ae55a0735d1a56aa5ef [0,1,0,0,0,0|1,0,2]=4 801 B12R0.49 CC=C(C)C(=O)NCCCCCC 7308b8bb44f85460bf27c9ac13fcc027 [0,1,0,0,0,0|3,0,0]=4 802 B12R0.49 CCC#CCOC=C(F)C(=O)OC 90992b74bf8ba709c6f91d7224e9541b [0,1,0,0,0,0|1,0,2]=4 803 B12R0.49 CCC(=O)C(=O)NCCCCCCl cb1825668dda86a084b889033e739c89 [0,1,0,0,0,0|3,0,0]=4 804 B12R0.49 CCC(=O)C(=O)NCCCCCO d2ad8df0885a2c11d6e8bd800c2fb99d [0,1,0,0,0,0|3,0,0]=4 805 B12R0.49 CCC(=O)C(=O)NCCCCOC 5e10aa51a325abddb7b40370d880d5e2 [0,1,0,0,0,0|3,0,0]=4 806 B12R0.49 CCC(=O)C(=O)NCCCCSC 19667dbd1c2a4f65682e366ac50eedfd [0,1,0,0,0,0|3,0,0]=4 807 B12R0.49 CCCCCCCN(C)C(=O)CC c0dc9cd4191dd947c0579f8d55e9df30 [0,1,0,0,0,0|2,0,1]=4 808 B12R0.49 CCCCCCNC(=O)C(=O)CC 7264216756797e0820cbad46eb24a1ae [0,1,0,0,0,0|2,0,0]=3 809 B12R0.49 CCCCCCNC(=O)C(=O)CS 1fdde9ea43a533cb00a651f3ae6c2041 [0,1,0,0,0,0|3,0,0]=4 810 B12R0.49 CCCCCCNC(=O)C(=O)NC 019e6e4c3e343df93665f7cb503c6e96 [0,1,0,0,0,0|2,0,0]=3 811 B12R0.49 CCCCCCNC(=O)C(=O)OC 58458ff126e2f04017c72d7375f209c5 [0,1,0,0,0,0|1,0,0]=2 812 B12R0.49 CCCCCCNC(=O)C(C)OC b77bfc4f3a4a50a0e3f74b97e3cf3c2d [0,1,0,0,0,0|2,0,1]=4 813 B12R0.49 CCCCCCNC(=O)[C@@H](C)OC c7684af5b7ff45f4507ad84577e32b95 [0,1,0,0,0,0|2,0,1]=4 814 B12R0.49 CCCCCCNC(=O)[C@H](C)OC cbdd9a82ec4e5509ada63f3705450143 [0,1,0,0,0,0|2,0,1]=4 815 B12R0.49 CCCCCCNC(C)C(=O)CC d59b975fa49b506c91fbb6e793da6866 [0,1,0,0,0,0|2,0,1]=4 816 B12R0.49 CCCCCCNC(C)C(=O)NC a0b2dc4ff88911b1a1d951183fd7549d [0,1,0,0,0,0|2,0,1]=4 817 B12R0.49 CCCCCCNC(C)C(=O)OC 935f824207428f5a0a8dc2bd1425ce38 [0,1,0,0,0,0|1,0,1]=3 818 B12R0.49 CCCCCCN[C@@H](C)C(=O)OC fc2689db2acb716c0a9d71e3bdff1771 [0,1,0,0,0,0|1,0,1]=3 819 B12R0.49 CCCCCCN[C@H](C)C(=O)OC 5964ebc99d324f56792d26e4fd279215 [0,1,0,0,0,0|1,0,1]=3 820 B12R0.49 CCCCCCOC(C)C(=O)CC 77eb954fa0eab347b81b442736d1a06d [0,1,0,0,0,0|2,0,1]=4 821 B12R0.49 CCCCCCOC(C)C(=O)NC 85e5b84cb5780f078a05551590d60f36 [0,1,0,0,0,0|2,0,1]=4 822 B12R0.49 CCCCCCOC(C)C(=O)OC 72bda27c3e7ade62a915488d63ad3370 [0,1,0,0,0,0|1,0,1]=3 823 B12R0.49 CCCCCCO[C@@H](C)C(=O)OC 1ecb63b81748e89ad70eaafc5b3ef822 [0,1,0,0,0,0|1,0,1]=3 824 B12R0.49 CCCCCCO[C@H](C)C(=O)OC 93da100d735fa67e5c5b808a6dc67eef [0,1,0,0,0,0|1,0,1]=3 825 B12R0.49 CCCCCNCC(=O)C(=O)OC 43ccf197bfca57ec06c7113862315c47 [0,1,0,0,0,0|1,0,1]=3 826 B12R0.49 CCCCCNCC(C)C(=O)OC d2e27d65559acfbe01b531c2393508bf [0,1,0,0,0,0|1,0,2]=4 827 B12R0.49 CCCCCNCC(O)C(=O)OC 77ce417a53b96b018df25e8f0f9601d7 [0,1,0,0,0,0|1,0,2]=4 828 B12R0.49 CCCCCNC[C@@H](C)C(=O)OC 3eff1aaa71a48a5b2ed02b1858f674b0 [0,1,0,0,0,0|1,0,2]=4 829 B12R0.49 CCCCCNC[C@H](C)C(=O)OC c0e4ff6ed2940b3e90547595a5f7442e [0,1,0,0,0,0|1,0,2]=4 830 B12R0.49 CCCCCOC=C(F)C(=O)OC 7314078fc63c864148b79098e157e3dd [0,1,0,0,0,0|1,0,0]=2 831 B12R0.49 CCCCCOCC(=O)C(=O)OC 46b36beda31fc1591fb81caf391d7d08 [0,1,0,0,0,0|1,0,1]=3 832 B12R0.49 CCCCCOCC(C)C(=O)OC 22f278e96a28e8e47c519d192f960c7c [0,1,0,0,0,0|1,0,2]=4 833 B12R0.49 CCCCCOCC(F)C(=O)OC a7534166087c980ffe4ae88ab10904f9 [0,1,0,0,0,0|1,0,2]=4 834 B12R0.49 CCCCCOC[C@@H](C)C(=O)OC 75a87e9f5549461824d47f0775cfdfbf [0,1,0,0,0,0|1,0,2]=4 835 B12R0.49 CCCCCOC[C@H](C)C(=O)OC 2763b1855818bf44166b57fa0e3d6680 [0,1,0,0,0,0|1,0,2]=4 836 B12R0.49 CCCCNCCC(C)C(=O)OC ca7d9173072dac734bfc9b19d5b570a4 [0,1,0,0,0,0|1,0,2]=4 837 B12R0.49 CCCCOCCC(C)C(=O)OC 179edb09d1bf706674a70c2a5ddb7fcc [0,1,0,0,0,0|1,0,2]=4 838 B12R0.49 CCCCOCOC(C)C(=O)OC 359155ea515e4e695e14eaee7c33e2a2 [0,1,0,0,0,0|2,0,1]=4 839 B12R0.49 CCCCOCO[C@@H](C)C(=O)OC 19f6e9a21cb387582147213f46ba3b6d [0,1,0,0,0,0|2,0,1]=4 840 B12R0.49 CCCCOCO[C@H](C)C(=O)OC c7dd70965ba5d171a68762351dfab5d1 [0,1,0,0,0,0|2,0,1]=4 841 B12R0.49 CCCNCCCC(=O)C(=O)OC 42510c10b8f1be88c7320a56eebe5182 [0,1,0,0,0,0|1,0,1]=3 842 B12R0.49 CCCNCCCC(C)C(=O)OC 1556d48db015df333bf23ecabbd2baeb [0,1,0,0,0,0|1,0,2]=4 843 B12R0.49 CCCOCCCC(=O)C(=O)OC cadc75b0dd12cdf19ab65047f12a447c [0,1,0,0,0,0|1,0,1]=3 844 B12R0.49 CCCOCCCC(C)C(=O)OC 3e8160301e35e413960fb394d5c39c6d [0,1,0,0,0,0|1,0,2]=4 845 B12R0.49 CCCOCCNC(=O)C(=O)CC 604861ed88e8caaaf850f487699d0736 [0,1,0,0,0,0|3,0,0]=4 846 B12R0.49 CCCOCCNC(=O)C(=O)NC 79211b931bb0959401e0cb908462638c [0,1,0,0,0,0|3,0,0]=4 847 B12R0.49 CCCOCCNC(=O)C(=O)OC a4c8212fda7b59d5ec0ae4fedbb2f0de [0,1,0,0,0,0|2,0,0]=3 848 B12R0.49 CCCOCCNC(C)C(=O)OC c24f9807550e2a9e6c4e295e7112cd85 [0,1,0,0,0,0|2,0,1]=4 849 B12R0.49 CCCOCCN[C@@H](C)C(=O)OC 77756bac7cfcaeb762520e26b4e46229 [0,1,0,0,0,0|2,0,1]=4 850 B12R0.49 CCCOCCN[C@H](C)C(=O)OC 7d262b973cb4ddf74cdc42c2a5410994 [0,1,0,0,0,0|2,0,1]=4 851 B12R0.49 CCCOCCOC(C)C(=O)OC e55159a19f6ef50500444c4211667e5c [0,1,0,0,0,0|2,0,1]=4 852 B12R0.49 CCCOCCO[C@@H](C)C(=O)OC 201540066d28eb4bb68721c5ad5b02cb [0,1,0,0,0,0|2,0,1]=4 853 B12R0.49 CCCOCCO[C@H](C)C(=O)OC fe383e2a8bd485352d9360bde7a1f42d [0,1,0,0,0,0|2,0,1]=4 854 B12R0.49 CCOCCCNC(=O)C(=O)CC b2e30ccf3fe004254f5b06bde088aa23 [0,1,0,0,0,0|3,0,0]=4 855 B12R0.49 CCOCCCNC(=O)C(=O)NC 1b92e0f63b483479981823e464cfb6a2 [0,1,0,0,0,0|3,0,0]=4 856 B12R0.49 CCOCCCNC(=O)C(=O)OC 871ef4f7609ed607338e20eeea79ad36 [0,1,0,0,0,0|2,0,0]=3 857 B12R0.49 CCOCCCNC(C)C(=O)OC d32b930c3e7f1411af8139d04034df6d [0,1,0,0,0,0|2,0,1]=4 858 B12R0.49 CCOCCCN[C@@H](C)C(=O)OC 62c3ce0680237df16dd6007bd8f61ce0 [0,1,0,0,0,0|2,0,1]=4 859 B12R0.49 CCOCCCN[C@H](C)C(=O)OC c37699d0b0429217c70016eb3e0b33e6 [0,1,0,0,0,0|2,0,1]=4 860 B12R0.49 CCOCCCOC(C)C(=O)OC e0bfc4266e6a4f9e152f436e3cf95c9a [0,1,0,0,0,0|2,0,1]=4 861 B12R0.49 CCOCCCO[C@@H](C)C(=O)OC 670cd5bc3638e98c88d5d4c3d7f64a95 [0,1,0,0,0,0|2,0,1]=4 862 B12R0.49 CCOCCCO[C@H](C)C(=O)OC ad62c1b67067264c1cc318bc28685454 [0,1,0,0,0,0|2,0,1]=4 863 B12R0.49 CCOCCNCC(=O)C(=O)OC 8355a9c5248d34c2c33442796b7cb1e1 [0,1,0,0,0,0|2,0,1]=4 864 B12R0.49 CCOCCOC=C(F)C(=O)OC 771f483ac5243654714efa0351b5e3df [0,1,0,0,0,0|2,0,0]=3 865 B12R0.49 CCOCCOCC(=O)C(=O)OC 3cd6c3b4c9d83a405a53e0e0d5e87828 [0,1,0,0,0,0|2,0,1]=4 866 B12R0.49 CCSCCCOC(C)C(=O)OC e5c61ae0490f4ed0f71e80ad170ee787 [0,1,0,0,0,0|2,0,1]=4 867 B12R0.49 CCSCCCO[C@@H](C)C(=O)OC bb708efdd66f7715a1d70ce495961916 [0,1,0,0,0,0|2,0,1]=4 868 B12R0.49 CCSCCCO[C@H](C)C(=O)OC 4cd25e739dfa6efcd48392a0a77e7545 [0,1,0,0,0,0|2,0,1]=4 869 B12R0.49 CCSCCNCC(=O)C(=O)OC d94cb2a2a475a89e1b84ee0c32ecec04 [0,1,0,0,0,0|2,0,1]=4 870 B12R0.49 CCSCCOC=C(F)C(=O)OC 07ff1dfc637f39a53dc68ef795e735fd [0,1,0,0,0,0|2,0,0]=3 871 B12R0.49 CCSCCOCC(=O)C(=O)OC 078756d4b4f56647bfa5aa9375c32534 [0,1,0,0,0,0|2,0,1]=4 872 B12R0.49 CNC(=O)C(=O)NCCCCCCl 40105a963811f31789c1e7216a2b3fb9 [0,1,0,0,0,0|3,0,0]=4 873 B12R0.49 CNC(=O)C(=O)NCCCCCO aa4286272ed868ff4ca089c5232e7a86 [0,1,0,0,0,0|3,0,0]=4 874 B12R0.49 CNC(=O)C(=O)NCCCCOC 1bc91129359fe6cf4eeeb5f0f60c3309 [0,1,0,0,0,0|3,0,0]=4 875 B12R0.49 CNC(=O)C(=O)NCCCCSC c0f6fdad4345dd755620e2d8e12b0379 [0,1,0,0,0,0|3,0,0]=4 876 B12R0.49 COC(=O)C(=COCCCC#N)F d1a1283f66568d683dd130adbdd015b9 [0,1,0,0,0,0|2,0,1]=4 877 B12R0.49 COC(=O)C(=COCCCC=O)F d393e60a372e3de016d249cff8cecd62 [0,1,0,0,0,0|2,0,1]=4 878 B12R0.49 COC(=O)C(=COCCCCF)F 29a97e55d4427edd8ccbc97c527b63f0 [0,1,0,0,0,0|2,0,0]=3 879 B12R0.49 COC(=O)C(=COCCCSC)F fe125c12e1436b0d324bcb9919a06a26 [0,1,0,0,0,0|2,0,0]=3 880 B12R0.49 COC(=O)C(=O)CCCNCCBr 6ec8fef98dde704dd6595ccc8d72d6b1 [0,1,0,0,0,0|2,0,1]=4 881 B12R0.49 COC(=O)C(=O)CCCNCCF 35a52ad43d4adb0c68bbecbf9f27b2b8 [0,1,0,0,0,0|2,0,1]=4 882 B12R0.49 COC(=O)C(=O)CCCNCCI 17d91cc55d5a2d2f2065cfbf8869d91c [0,1,0,0,0,0|2,0,1]=4 883 B12R0.49 COC(=O)C(=O)CCCNCCO d3e30024de0e3606a8e65f100d85299b [0,1,0,0,0,0|2,0,1]=4 884 B12R0.49 COC(=O)C(=O)CCCNCCS 4957e08f883ed082228fa30f3bc3a464 [0,1,0,0,0,0|2,0,1]=4 885 B12R0.49 COC(=O)C(=O)CCCOCCF 645372c8cbc0347e2a0f0437b6e699f1 [0,1,0,0,0,0|2,0,1]=4 886 B12R0.49 COC(=O)C(=O)CCCOCCS 74e872d1414f91526b76c4091ecdb740 [0,1,0,0,0,0|2,0,1]=4 887 B12R0.49 COC(=O)C(=O)CNCCCCCl eeafc6f61d6a7de096bdadefc24ff449 [0,1,0,0,0,0|2,0,1]=4 888 B12R0.49 COC(=O)C(=O)CNCCCCO f4e463652ab0f4b74ffb88c824eddcfa [0,1,0,0,0,0|2,0,1]=4 889 B12R0.49 COC(=O)C(=O)CNCCCCS d22252da4506abba412ac459425c1823 [0,1,0,0,0,0|2,0,1]=4 890 B12R0.49 COC(=O)C(=O)CNCCCSC 5dd85671ba137ea4f2db719e58537deb [0,1,0,0,0,0|2,0,1]=4 891 B12R0.49 COC(=O)C(=O)COCCCCF e3029df234336a219188dc0418eb9c0b [0,1,0,0,0,0|2,0,1]=4 892 B12R0.49 COC(=O)C(=O)COCCCCS a9822a05b8815a5d04bbd98add83f41e [0,1,0,0,0,0|2,0,1]=4 893 B12R0.49 COC(=O)C(=O)COCCCSC 8091ac7c6664371e6a0360f026430a44 [0,1,0,0,0,0|2,0,1]=4 894 B12R0.49 COC(=O)C(=O)NCCCCC#N 4f52df395cb7a9a727b138fc68b47c18 [0,1,0,0,0,0|2,0,1]=4 895 B12R0.49 COC(=O)C(=O)NCCCCCCl 55fff2544b5a6c22aa17e681cff67a58 [0,1,0,0,0,0|2,0,0]=3 896 B12R0.49 COC(=O)C(=O)NCCCCCO 0b54fd2d9497003bec4a9a9477fc3b59 [0,1,0,0,0,0|2,0,0]=3 897 B12R0.49 COC(=O)C(=O)NCCCCSC e8f25c41accebd00b282502db50cb938 [0,1,0,0,0,0|2,0,0]=3 898 B12R0.49 COC(=O)C(=O)NCCOCCO 5e90edc68356b0f8c91b71d6a0bf166d [0,1,0,0,0,0|3,0,0]=4 899 B12R0.49 COC(=O)C(=O)NCCOCCS 3d90d1ab6d9d5d984c3873dbaf64d79b [0,1,0,0,0,0|3,0,0]=4 900 B12R0.49 COC(=O)C(=O)NCCSCCO 24f9116c18dea3d618f30a358f62a6bc [0,1,0,0,0,0|3,0,0]=4 901 B12R0.49 COC(=O)C(C)NCCCCCCl a3e3067a23572cccf48c7aab992d5e95 [0,1,0,0,0,0|2,0,1]=4 902 B12R0.49 COC(=O)C(C)NCCCCCO bc12ba453ea89a479af4a8f2c51d281e [0,1,0,0,0,0|2,0,1]=4 903 B12R0.49 COC(=O)C(C)NCCCCSC 43fc3ce2c1fbf241672dd84892ba5833 [0,1,0,0,0,0|2,0,1]=4 904 B12R0.49 COC(=O)C(C)OCCCCCF 0e0806bc8d6470d2d8f2adfa537c7447 [0,1,0,0,0,0|2,0,1]=4 905 B12R0.49 COC(=O)C(C)OCCCCSC f22074b06667991043a7b02b93a0f711 [0,1,0,0,0,0|2,0,1]=4 906 B12R0.49 COC(=O)[C@@H](C)NCCCCCCl c608aac052cf4b32aea3367a2d2cbd1b [0,1,0,0,0,0|2,0,1]=4 907 B12R0.49 COC(=O)[C@@H](C)NCCCCCO c1d2ada57546958c45d7ac70b14f998f [0,1,0,0,0,0|2,0,1]=4 908 B12R0.49 COC(=O)[C@@H](C)NCCCCSC 1bed21bb0c0051db34a3a7cacc820ada [0,1,0,0,0,0|2,0,1]=4 909 B12R0.49 COC(=O)[C@@H](C)OCCCCCF 81b456185ded6429ebdc44ec5b6e6e9f [0,1,0,0,0,0|2,0,1]=4 910 B12R0.49 COC(=O)[C@@H](C)OCCCCSC be98fa34f9a10b21aeb7ae8aa3962218 [0,1,0,0,0,0|2,0,1]=4 911 B12R0.49 COC(=O)[C@H](C)NCCCCCCl 6d3747bc8b4daa1f6f99ee841f43628f [0,1,0,0,0,0|2,0,1]=4 912 B12R0.49 COC(=O)[C@H](C)NCCCCCO 9f09515794bb24bb20bf6392b34a5d66 [0,1,0,0,0,0|2,0,1]=4 913 B12R0.49 COC(=O)[C@H](C)NCCCCSC 4551b83670c858a529169294a5e3bda8 [0,1,0,0,0,0|2,0,1]=4 914 B12R0.49 COC(=O)[C@H](C)OCCCCCF 163e8c7e8ba5a23e3dcb488e03899a01 [0,1,0,0,0,0|2,0,1]=4 915 B12R0.49 COC(=O)[C@H](C)OCCCCSC 13e6780bb720f55d7bea5ff19b9730f0 [0,1,0,0,0,0|2,0,1]=4 916 B12R0.49 COCCCCNC(=O)C(=O)OC e4cc6d988789cbe9be6debe9a920448c [0,1,0,0,0,0|2,0,0]=3 917 B12R0.49 COCCCCNC(C)C(=O)OC c6c131c8f296770cc6e424a60c6a0d57 [0,1,0,0,0,0|2,0,1]=4 918 B12R0.49 COCCCCN[C@@H](C)C(=O)OC 7c084874b758ae57ca7996db353a6f48 [0,1,0,0,0,0|2,0,1]=4 919 B12R0.49 COCCCCN[C@H](C)C(=O)OC bb9650b744272ee08b70dff821ccb95b [0,1,0,0,0,0|2,0,1]=4 920 B12R0.49 COCCCCOC(C)C(=O)OC 6d543fbb0dfc0a5df805059472269090 [0,1,0,0,0,0|2,0,1]=4 921 B12R0.49 COCCCCO[C@@H](C)C(=O)OC 2b486d2390f10b7957412a45e189d48b [0,1,0,0,0,0|2,0,1]=4 922 B12R0.49 COCCCCO[C@H](C)C(=O)OC cd5814393d96784a85fb02171a0af1e5 [0,1,0,0,0,0|2,0,1]=4 923 B12R0.49 COCCCNCC(=O)C(=O)OC 32cd10a95bc891a387de330bd3bc54ef [0,1,0,0,0,0|2,0,1]=4 924 B12R0.49 COCCCOC=C(F)C(=O)OC ed951e48f997a92be6a8fe908fc2e860 [0,1,0,0,0,0|2,0,0]=3 925 B12R0.49 COCCCOCC(=O)C(=O)OC 4ab06b97b6b676c3f28fd909c1e7717a [0,1,0,0,0,0|2,0,1]=4 926 B12R0.49 COCOCCCC(=O)C(=O)OC cf6197158f2cdf395204fcf45c2b597a [0,1,0,0,0,0|2,0,1]=4 927 B12R0.102 C#CCCN(C)C/C=C/C(=O)OC 291a76d42786e50cbdb38caa8ddc8e3d [0,1,0,0,0,0|1,0,2]=4 928 B12R0.102 C#CCCN(C)C/C=C\C(=O)OC 125940fab7d40c075d9f3f34a3a59e19 [0,1,0,0,0,0|1,0,2]=4 929 B12R0.102 C#CCCN(C)CC=CC(=O)OC b3bf50c979d8bde1b35c4db512bf0bb0 [0,1,0,0,0,0|1,0,2]=4 930 B12R0.102 C=C(CNCC(O)CCCC)OC 0c583368a2722ca7e329da67c5c4b592 [0,1,0,0,0,0|2,0,1]=4 931 B12R0.102 C=C(COCC(C)CCCC)OC 4b7a868034b83bae934f3905f80af6d5 [0,1,0,0,0,0|2,0,1]=4 932 B12R0.102 C=CCCN(C)C/C=C/C(=O)OC 8bfac1b2355e8da6ae6cb99cefd638c6 [0,1,0,0,0,0|1,0,2]=4 933 B12R0.102 C=CCCN(C)C/C=C\C(=O)OC 91d69c78cb40de0b0cc449f0119f76bb [0,1,0,0,0,0|1,0,2]=4 934 B12R0.102 C=CCCN(C)CC=CC(=O)OC e063deb784d604c5f7a30bc71862fd1f [0,1,0,0,0,0|1,0,2]=4 935 B12R0.102 CCCCC(C)COCC(=O)CC 31d8617ef75272c2e5a0d4bed09d9a99 [0,1,0,0,0,0|2,0,1]=4 936 B12R0.102 CCCCC(C)COCC(=O)NC e562acab82555c6acc01a1f0a04ab504 [0,1,0,0,0,0|2,0,1]=4 937 B12R0.102 CCCCC(C)COCC(=O)OC 2121eed6a9e61020a350aef014ab90f2 [0,1,0,0,0,0|1,0,1]=3 938 B12R0.102 CCCCC(C)NCCC(=O)OC 3f2036ce60e56086f09357d876e175b2 [0,1,0,0,0,0|1,0,2]=4 939 B12R0.102 CCCCC(C)OCCC(=O)OC b5274cb7add5d513a6c7002a6a8022da [0,1,0,0,0,0|1,0,2]=4 940 B12R0.102 CCCCC(O)CNCC(=O)CC e8f7ed3fb4421be9fc1a3845a750d5fc [0,1,0,0,0,0|2,0,1]=4 941 B12R0.102 CCCCC(O)CNCC(=O)NC cc3cd76fb24d5d60b7df2590486898ff [0,1,0,0,0,0|2,0,1]=4 942 B12R0.102 CCCCC(O)CNCC(=O)OC a0f27da51064fa0d6c11d1c91bcfa7a7 [0,1,0,0,0,0|1,0,1]=3 943 B12R0.102 CCCCN(C)C/C=C/C(=O)OC 13887853ed572b83d0ce3660c9c0e193 [0,1,0,0,0,0|1,0,0]=2 944 B12R0.102 CCCCN(C)C/C=C\C(=O)OC 009767a8b2c72ffcae4f6a6ea2c20074 [0,1,0,0,0,0|1,0,0]=2 945 B12R0.102 CCCCN(C)CC#CC(=O)OC 24fe95dcec2ee4de6bc1aacaf9ca530c [0,1,0,0,0,0|1,0,2]=4 946 B12R0.102 CCCCN(C)CC=CC(=O)OC 737167af22750abed6e1a31bd8677f63 [0,1,0,0,0,0|1,0,0]=2 947 B12R0.102 CCCCN(C)CCCC(=O)OC d0aafc1d60b0e19908b5e62ff46c60bc [0,1,0,0,0,0|1,0,2]=4 948 B12R0.102 CCCC[C@@H](C)NCCC(=O)OC af697e2f120bda6a5c8cafaab6159ccf [0,1,0,0,0,0|1,0,2]=4 949 B12R0.102 CCCC[C@@H](C)OCCC(=O)OC c4f7ca74bbffe635dcb793df27580662 [0,1,0,0,0,0|1,0,2]=4 950 B12R0.102 CCCC[C@H](C)OCCC(=O)OC 3932d84afb402973d80edf75c1687abc [0,1,0,0,0,0|1,0,2]=4 951 B12R0.102 CCCNC(C)CCCC(=O)OC f716e6748fb0bad3622d19d9cce70848 [0,1,0,0,0,0|1,0,2]=4 952 B12R0.102 CCCOC(C)CCCC(=O)OC f03321ff3a5e4a38f954a08fc10afcac [0,1,0,0,0,0|1,0,2]=4 953 B12R0.102 CCOCC(C)COCC(=O)OC cee66df68f3ebb82c2d87e5bcf4a28ca [0,1,0,0,0,0|2,0,1]=4 954 B12R0.102 CCOCC(O)CNCC(=O)OC 7911cb89ac366b66d0cf6346571deeaa [0,1,0,0,0,0|2,0,1]=4 955 B12R0.102 COC(=O)/C=C/CN(C)CCC#N f555727cd096b6d4567318fdbac6c2a6 [0,1,0,0,0,0|2,0,1]=4 956 B12R0.102 COC(=O)/C=C/CN(C)CCCO df5e65190084ae0d966011dd5d086acd [0,1,0,0,0,0|2,0,0]=3 957 B12R0.102 COC(=O)/C=C/CN(C)CCON 862f13eb1a834c098f201db36fd5bc69 [0,1,0,0,0,0|3,0,0]=4 958 B12R0.102 COC(=O)/C=C/CN(C)CCSC 5301fdb6d7d8e0cdc937e62223eba65f [0,1,0,0,0,0|2,0,0]=3 959 B12R0.102 COC(=O)/C=C\CN(C)CCC#N 8d34c1b71cf8103b5e42b8e6025e496c [0,1,0,0,0,0|2,0,1]=4 960 B12R0.102 COC(=O)/C=C\CN(C)CCCO 65bdc5ce1cf983b1b9f00fccf7013867 [0,1,0,0,0,0|2,0,0]=3 961 B12R0.102 COC(=O)/C=C\CN(C)CCON 6f9ea5a07a5f0dc741fe779c17aa2ec5 [0,1,0,0,0,0|3,0,0]=4 962 B12R0.102 COC(=O)/C=C\CN(C)CCSC f68fc08252c6b911d812e59e669a909f [0,1,0,0,0,0|2,0,0]=3 963 B12R0.102 COC(=O)C=CCN(C)CCC#N 228dd4bee0edce39a60e5f0a0e7dcbbb [0,1,0,0,0,0|2,0,1]=4 964 B12R0.102 COC(=O)C=CCN(C)CCCO ea7c134303d9b3db76773987731eb577 [0,1,0,0,0,0|2,0,0]=3 965 B12R0.102 COC(=O)C=CCN(C)CCON d93dcf4a59ac4af5260af83d417b9e11 [0,1,0,0,0,0|3,0,0]=4 966 B12R0.102 COC(=O)C=CCN(C)CCSC 07cab759e9f217e5ce913c732c4e3f42 [0,1,0,0,0,0|2,0,0]=3 967 B12R0.102 COC(=O)CNC[C@H](C)CCCO 8d3dd2fbc39b03441e47b5d81fa9e788 [0,1,0,0,0,0|2,0,1]=4 968 B12R0.102 COCCN(C)C/C=C/C(=O)OC 83b58cc7d4c2d32a0cd5d4af32d32490 [0,1,0,0,0,0|2,0,0]=3 969 B12R0.102 COCCN(C)C/C=C\C(=O)OC a72ef4359ce93f9ce3a170b733210467 [0,1,0,0,0,0|2,0,0]=3 970 B12R0.102 COCCN(C)CC=CC(=O)OC d941585da9d37bf9ae5f7f0c10dcec58 [0,1,0,0,0,0|2,0,0]=3 971 B12R0.113 C=C(CN(C)CCCCCC)OC 8334aa4962b8a30f357199599700f940 [0,1,0,0,0,0|2,0,1]=4 972 B12R0.113 C=C(CNCCCC)CC(=O)OC 7e4bd3122b0bb99ee91c771c5a73eabb [0,1,0,0,0,0|1,0,1]=3 973 B12R0.113 C=C(CNCCCCl)CC(=O)OC 4973f636c7f36029aec17ec3198d6e98 [0,1,0,0,0,0|2,0,1]=4 974 B12R0.113 C=C(CNCCCO)CC(=O)OC 043da50b06aa68b0fd8dca2469512ab6 [0,1,0,0,0,0|2,0,1]=4 975 B12R0.113 C=C(CNCCOC)CC(=O)OC 675dee0dd2e57d4998a1e0033f66accb [0,1,0,0,0,0|2,0,1]=4 976 B12R0.113 C=C(CNCCSC)CC(=O)OC 1ea18d755ff52ae8062bd5167e0b1f42 [0,1,0,0,0,0|2,0,1]=4 977 B12R0.113 C=C(COCCCC)CC(=O)OC c9a2df079508573051409f795b15bef4 [0,1,0,0,0,0|1,0,1]=3 978 B12R0.113 C=C(COCCCF)CC(=O)OC 7f07dd8c82cad73dbc5d9a22462d2e41 [0,1,0,0,0,0|2,0,1]=4 979 B12R0.113 C=C(COCCCS)CC(=O)OC d2a7138e467f80f251d755684137ff88 [0,1,0,0,0,0|2,0,1]=4 980 B12R0.113 C=C(COCCOC)CC(=O)OC af759bd2d71947a95a90c9bbe918a8f6 [0,1,0,0,0,0|2,0,1]=4 981 B12R0.113 C=C(COCCSC)CC(=O)OC 851c9939508c42f4f80fec21f0d7c870 [0,1,0,0,0,0|2,0,1]=4 982 B12R0.113 CCC(=O)/C=C(\C)/OCCCCF 588cca9c6828fbf5df864df0c1a9071a [0,1,0,0,0,0|3,0,0]=4 983 B12R0.113 CCC(=O)/C=C(\C)/OCCCOC 719f436a4ecc360ab82b3bcff5481b01 [0,1,0,0,0,0|3,0,0]=4 984 B12R0.113 CCC(=O)/C=C(\C)/OCCCSC 5c73f427e49248e511ba42ef54672284 [0,1,0,0,0,0|3,0,0]=4 985 B12R0.113 CCCCCCC(C)NC(=O)CC 7a9035c65767e5ae37e7e9206ed97104 [0,1,0,0,0,0|2,0,1]=4 986 B12R0.113 CCCCCCN(C)CC(=O)CC cc04db726591a5d4c86037f6a801408b [0,1,0,0,0,0|2,0,1]=4 987 B12R0.113 CCCCCCN(C)CC(=O)NC 4ea5211085e12623d16af7c6d0da55cb [0,1,0,0,0,0|2,0,1]=4 988 B12R0.113 CCCCCCN(C)CC(=O)OC 0757db9ff0f0880e4b48984b9b2660c6 [0,1,0,0,0,0|1,0,1]=3 989 B12R0.113 CCCCCC[C@@H](C)NC(=O)CC d9d8e9dc8d62f30d87e5300c1c7c8b84 [0,1,0,0,0,0|2,0,1]=4 990 B12R0.113 CCCCCC[C@H](C)NC(=O)CC 3f076e7a8a8156473b72acf89d536884 [0,1,0,0,0,0|2,0,1]=4 991 B12R0.113 CCCCCNC(=O)/C=C(/C)\CC ad5c1d98ed271871cfe377ce6e3d07f2 [0,1,0,0,0,0|3,0,0]=4 992 B12R0.113 CCCCCNC(=O)/C=C(\C)/CC 3d2805c9dd3f87627f84150cdc57b8a7 [0,1,0,0,0,0|3,0,0]=4 993 B12R0.113 CCCCCNC(=O)CC(=O)NC ffb14acf02f34a2bf3c7f81e1961ebc3 [0,1,0,0,0,0|2,0,1]=4 994 B12R0.113 CCCCCNC(=O)CC(=O)OC 01fd35c90ba691485a0d33a929fdadf3 [0,1,0,0,0,0|1,0,1]=3 995 B12R0.113 CCCCCNC(C)CC(=O)OC c44a01c3c38c577e6267926876a64226 [0,1,0,0,0,0|1,0,2]=4 996 B12R0.113 CCCCCNC(C)OC(=O)OC b3345ee4b60dc3611421e1fd73bdfe07 [0,1,0,0,0,0|2,0,1]=4 997 B12R0.113 CCCCCN[C@@H](C)CC(=O)OC 989d9cecc30f81657f98845db77f934d [0,1,0,0,0,0|1,0,2]=4 998 B12R0.113 CCCCCN[C@H](C)CC(=O)OC 5a8118ecb9534ac49586ce02451945bb [0,1,0,0,0,0|1,0,2]=4 999 B12R0.113 CCCCCO/C(=C/C(=O)CC)/C 6ce2730c68b82666aab4bf2e5ec1e6b8 [0,1,0,0,0,0|2,0,0]=3 1000 B12R0.113 CCCCCOC(C)CC(=O)OC 87b3f72c061b9231938c26f2e341fa2f [0,1,0,0,0,0|1,0,2]=4 1001 B12R0.113 CCCCCO[C@@H](C)CC(=O)OC a1e3a7bd068b8c31a7c8f7d58c300938 [0,1,0,0,0,0|1,0,2]=4 1002 B12R0.113 CCCCCO[C@H](C)CC(=O)OC 529fd49700acc10b6710b3e38995b97b [0,1,0,0,0,0|1,0,2]=4 1003 B12R0.113 CCCCNCC(=O)CC(=O)OC 667dde8b502ccc40b89c2f4369bc0c5d [0,1,0,0,0,0|1,0,1]=3 1004 B12R0.113 CCCCNCC(C)CC(=O)OC 0019ae5fed0a029cbc95b96d9c3521a8 [0,1,0,0,0,0|1,0,2]=4 1005 B12R0.113 CCCCNCC(O)CC(=O)OC b421b5ae0f7ecead9915e1c49aa518cb [0,1,0,0,0,0|1,0,2]=4 1006 B12R0.113 CCCCNC[C@@H](O)CC(=O)OC acc2780e322be9b552da629aca1e3f15 [0,1,0,0,0,0|1,0,2]=4 1007 B12R0.113 CCCCNC[C@H](O)CC(=O)OC d93ad54e186bc81a88cd4bd49829d4b3 [0,1,0,0,0,0|1,0,2]=4 1008 B12R0.113 CCCCOCC(=O)CC(=O)OC d98ba9e9abc7783e3d2dd294648a2a83 [0,1,0,0,0,0|1,0,1]=3 1009 B12R0.113 CCCCOCC(C)CC(=O)OC 68ba0b25ca5922c03c741772ee11f389 [0,1,0,0,0,0|1,0,2]=4 1010 B12R0.113 CCCCOCN(C)CC(=O)OC 2baf938ee41697d48a9927a9efe31723 [0,1,0,0,0,0|2,0,1]=4 1011 B12R0.113 CCCNCC[C@@H](C)CC(=O)OC abbd1b08f56324c9f5757feb93b8a9e3 [0,1,0,0,0,0|1,0,2]=4 1012 B12R0.113 CCCOCCC(=O)CC(=O)OC 8318f515144e4c32eaeaf225e10c3542 [0,1,0,0,0,0|1,0,1]=3 1013 B12R0.113 CCCOCCN(C)CC(=O)OC aff2a09ea55bf5cc2cc832ab853d673b [0,1,0,0,0,0|2,0,1]=4 1014 B12R0.113 CCCOCC[C@@H](C)CC(=O)OC 40c6c2bb3e3fee4f7a962576865d250a [0,1,0,0,0,0|1,0,2]=4 1015 B12R0.113 CCOCCCN(C)CC(=O)OC 627840cd892d3fa6fb04a15f1c329b1d [0,1,0,0,0,0|2,0,1]=4 1016 B12R0.113 CCOCCNC(=O)CC(=O)OC 38dc96d355ba292378f970a3d298c017 [0,1,0,0,0,0|2,0,1]=4 1017 B12R0.113 CCOCCO/C(=C/C(=O)CC)/C 02e9ed181970b3585b478ecf40c9f1ce [0,1,0,0,0,0|3,0,0]=4 1018 B12R0.113 CCSCCCN(C)CC(=O)OC 75c84c541e78d77bb0a43334f782c33e [0,1,0,0,0,0|2,0,1]=4 1019 B12R0.113 CCSCCNC(=O)CC(=O)OC 0c361955b6dc001ad2a03de6d8e9afde [0,1,0,0,0,0|2,0,1]=4 1020 B12R0.113 CCSCCO/C(=C/C(=O)CC)/C 8e78619a5764345fd9541388095be758 [0,1,0,0,0,0|3,0,0]=4 1021 B12R0.113 COC(=O)CC(=O)CCOCCF 59667bcbf3c8943b352b55d8135abbde [0,1,0,0,0,0|2,0,1]=4 1022 B12R0.113 COC(=O)CC(=O)CCOCCS 378c2b05dafd70f0b45eacb666a48a54 [0,1,0,0,0,0|2,0,1]=4 1023 B12R0.113 COC(=O)CC(=O)CCOCSC 1a5310e6857abaef9b806a8bc06d7f39 [0,1,0,0,0,0|2,0,1]=4 1024 B12R0.113 COC(=O)CC(=O)CNCCCCl 33abd1acf3c10731680a919cea3c5df3 [0,1,0,0,0,0|2,0,1]=4 1025 B12R0.113 COC(=O)CC(=O)CNCCCO a403bd5fb9973873032bd0b5c859b9eb [0,1,0,0,0,0|2,0,1]=4 1026 B12R0.113 COC(=O)CC(=O)CNCCSC 66246a27a8147ed32e4b17e8660e18a9 [0,1,0,0,0,0|2,0,1]=4 1027 B12R0.113 COC(=O)CC(=O)COCCCF e5f57ef04073b4c7b27e1eaee27b3d18 [0,1,0,0,0,0|2,0,1]=4 1028 B12R0.113 COC(=O)CC(=O)COCCCS bff953702e37be38a865271b3efb001a [0,1,0,0,0,0|2,0,1]=4 1029 B12R0.113 COC(=O)CC(=O)COCCSC d95cda45340f196efd69924c4f0f6d7a [0,1,0,0,0,0|2,0,1]=4 1030 B12R0.113 COC(=O)CC(=O)NCCCCCl 6da7fefd85794af4d13e6b7df5e2cfc2 [0,1,0,0,0,0|2,0,1]=4 1031 B12R0.113 COC(=O)CC(=O)NCCCCO b5f80bd19687cf625678b6dedd1e2357 [0,1,0,0,0,0|2,0,1]=4 1032 B12R0.113 COC(=O)CC(=O)NCCCCS 60008f2c285cf0625411c964c1ca1faa [0,1,0,0,0,0|2,0,1]=4 1033 B12R0.113 COC(=O)CC(=O)NCCCSC 4325b181cc7b52259b6106aef398d814 [0,1,0,0,0,0|2,0,1]=4 1034 B12R0.113 COC(=O)CN(C)CCCCCF 2757ccd22982114c0d20eeb10ef8ba48 [0,1,0,0,0,0|2,0,1]=4 1035 B12R0.113 COC(=O)CN(C)CCCCCO 0854671875dacc3ce6f1699b74d08997 [0,1,0,0,0,0|2,0,1]=4 1036 B12R0.113 COCCCCN(C)CC(=O)OC 93542617d516771c78e9fd3993f4fbba [0,1,0,0,0,0|2,0,1]=4 1037 B12R0.113 COCCCNC(=O)CC(=O)OC 2c901ba9418ec7770469db683810432d [0,1,0,0,0,0|2,0,1]=4 1038 B12R0.113 COCCNCC(=O)CC(=O)OC 94092cfbf2f6432fe1332486ea24cd2e [0,1,0,0,0,0|2,0,1]=4 1039 B12R0.113 COCCOCC(=O)CC(=O)OC 425a46105e0f4e02532a7201b67ee8cc [0,1,0,0,0,0|2,0,1]=4 1040 B12R0.113 COCOCCC(=O)CC(=O)OC 2abd2a3d0e8882a8067e60ef3e548635 [0,1,0,0,0,0|2,0,1]=4 1041 B12R0.142 C=C(CNC(C)CCCCC)OC 7854e9234c369cacb9d2e297b0d550e5 [0,1,0,0,0,0|2,0,1]=4 1042 B12R0.142 C=C(CN[C@@H](C)CCCCC)OC 89e65fabfbb7431e89e36c9f4e461d57 [0,1,0,0,0,0|2,0,1]=4 1043 B12R0.142 C=C(COC(C)CCCCC)OC c1d0dddcc0a49804d3946602d936773d [0,1,0,0,0,0|2,0,1]=4 1044 B12R0.142 C=C(CO[C@@H](C)CCCCC)OC 5bde2f4db2d6e77d070a06c314aa1421 [0,1,0,0,0,0|2,0,1]=4 1045 B12R0.142 C=C(CO[C@H](C)CCCCC)OC ae16250bb31869429b1850384cdab5aa [0,1,0,0,0,0|2,0,1]=4 1046 B12R0.142 CCCCCC(=O)NCC(=O)OC 7b1aeefd0c2c73fc93cc5c282a4a5d83 [0,1,0,0,0,0|1,0,2]=4 1047 B12R0.142 CCCCCC(C)NCC(=O)CC 17dc4b9ec37e69b31e7113874c1aed03 [0,1,0,0,0,0|2,0,1]=4 1048 B12R0.142 CCCCCC(C)NCC(=O)NC 029532ad216c8a4a96f03d9be8e064c7 [0,1,0,0,0,0|2,0,1]=4 1049 B12R0.142 CCCCCC(C)NCC(=O)OC 873d358e235ec9267d3436dbd1c6fb03 [0,1,0,0,0,0|1,0,1]=3 1050 B12R0.142 CCCCCC(C)OCC(=O)CC 1c30785791afb4721027d7aa4535e579 [0,1,0,0,0,0|2,0,1]=4 1051 B12R0.142 CCCCCC(C)OCC(=O)NC f5cf550147b15669693a70eb28cdd9bf [0,1,0,0,0,0|2,0,1]=4 1052 B12R0.142 CCCCCC(C)OCC(=O)OC 2070ab83583f760dab7d994e5c49f6fd [0,1,0,0,0,0|1,0,1]=3 1053 B12R0.142 CCCCCN(C)CCC(=O)OC 8d64ca1b64716127a962e9492f69dceb [0,1,0,0,0,0|1,0,2]=4 1054 B12R0.142 CCCCCN(C)COC(=O)OC eb18a5a9d32273f2c9da21a544eb260d [0,1,0,0,0,0|2,0,1]=4 1055 B12R0.142 CCCCC[C@@H](C)OCC(=O)CC a84236230bdc968089833c76504ec058 [0,1,0,0,0,0|2,0,1]=4 1056 B12R0.142 CCCCC[C@@H](C)OCC(=O)NC 69b25edf5cf71d54a436b7399238a621 [0,1,0,0,0,0|2,0,1]=4 1057 B12R0.142 CCCCC[C@@H](C)OCC(=O)OC 24b15b077650088246280c5624d20552 [0,1,0,0,0,0|1,0,1]=3 1058 B12R0.142 CCCCC[C@H](C)NCC(=O)CC ab7ae5bb1b1f8267fb65e5e8ba7db71b [0,1,0,0,0,0|2,0,1]=4 1059 B12R0.142 CCCCC[C@H](C)NCC(=O)NC 058699fd62dddd0225d41daea99af550 [0,1,0,0,0,0|2,0,1]=4 1060 B12R0.142 CCCCC[C@H](C)NCC(=O)OC 2ada72d5a486b99e1f270bbbe2c1d3f6 [0,1,0,0,0,0|1,0,1]=3 1061 B12R0.142 CCCCC[C@H](C)OCC(=O)CC 535ebec0591b84fab7d612a812393cc2 [0,1,0,0,0,0|2,0,1]=4 1062 B12R0.142 CCCCC[C@H](C)OCC(=O)NC d32bf2a7cf8278cc3b2d7cdad85a255b [0,1,0,0,0,0|2,0,1]=4 1063 B12R0.142 CCCCC[C@H](C)OCC(=O)OC 211c1813388a6fa074bbc91fb09ea2c4 [0,1,0,0,0,0|1,0,1]=3 1064 B12R0.142 CCCCNC(=O)/C=C/C(=O)OC 804ed3738fd6cbfc660aae7bb013abf6 [0,1,0,0,0,0|1,0,1]=3 1065 B12R0.142 CCCCNC(=O)/C=C\C(=O)NC 335bd2c817389f0555d20e21d5d304cc [0,1,0,0,0,0|2,0,1]=4 1066 B12R0.142 CCCCNC(=O)/C=C\C(=O)OC 56caa90733561261f87879c39603c499 [0,1,0,0,0,0|1,0,1]=3 1067 B12R0.142 CCCCNC(=O)C=CC(=O)OC c42988cdd0727cfe921b9f86c147a670 [0,1,0,0,0,0|1,0,1]=3 1068 B12R0.142 CCCCNC(C)CCC(=O)OC faf1a0c084e958de4fca0fc55ff8ad45 [0,1,0,0,0,0|1,0,2]=4 1069 B12R0.142 CCCCOC(C)CCC(=O)OC 1dbd7781bb0e17b6f93f15da3f9daea3 [0,1,0,0,0,0|1,0,2]=4 1070 B12R0.142 CCCNCC(C)CCC(=O)OC 37687a5532bac593ab74a3076e6a3854 [0,1,0,0,0,0|1,0,2]=4 1071 B12R0.142 CCCOCC(C)CCC(=O)OC bc078c298d3e393c6f095d571002d3a6 [0,1,0,0,0,0|1,0,2]=4 1072 B12R0.142 CCCOCC(C)OCC(=O)OC 2a451b3b10750ab256840da3eb445a7a [0,1,0,0,0,0|2,0,1]=4 1073 B12R0.142 COC(=O)/C=C/C(=O)NCCCCl e636a6ad305de7cb50e9f71b94afdbfb [0,1,0,0,0,0|2,0,1]=4 1074 B12R0.142 COC(=O)/C=C/C(=O)NCCCO 0eca21bda8df3811444cefba9eb4dd81 [0,1,0,0,0,0|2,0,1]=4 1075 B12R0.142 COC(=O)/C=C/C(=O)NCCSC fb262b4608c1e7bf4669bcbce3136480 [0,1,0,0,0,0|2,0,1]=4 1076 B12R0.142 COC(=O)/C=C\C(=O)NCCCCl b1cec4b525a7861877b13ce48b39c174 [0,1,0,0,0,0|2,0,1]=4 1077 B12R0.142 COC(=O)/C=C\C(=O)NCCCO b3a9edd2258750fdb85dbd4ec5e17079 [0,1,0,0,0,0|2,0,1]=4 1078 B12R0.142 COC(=O)/C=C\C(=O)NCCSC 2eba6990d96065cec6e3a2bd055ed24a [0,1,0,0,0,0|2,0,1]=4 1079 B12R0.142 COC(=O)C=CC(=O)NCCCCl 36dd2f4518df9fd9ee23878e75b06fe0 [0,1,0,0,0,0|2,0,1]=4 1080 B12R0.142 COC(=O)C=CC(=O)NCCCO 48d5147fbd71248331fdc37870e9696d [0,1,0,0,0,0|2,0,1]=4 1081 B12R0.142 COC(=O)C=CC(=O)NCCSC 3c03dfb5b157e3ec5d19e200fb0ca4ec [0,1,0,0,0,0|2,0,1]=4 1082 B12R0.142 COCCNC(=O)/C=C/C(=O)OC 8c0d9c981d7c492536253a2ea02f2be2 [0,1,0,0,0,0|2,0,1]=4 1083 B12R0.142 COCCNC(=O)/C=C\C(=O)OC 7bc9b297c5640c9d0201723d91d455d7 [0,1,0,0,0,0|2,0,1]=4 1084 B12R0.142 COCCNC(=O)C=CC(=O)OC 854164f29a0894d4c00ad702219fc0a1 [0,1,0,0,0,0|2,0,1]=4 1085 B12R0.183 C=C(CC)COC/C=C/C(=O)OC f19765421b0ca34cd60fe2f436e49a82 [0,1,0,0,0,0|1,0,1]=3 1086 B12R0.183 C=C(COC/C=C/C(=O)OC)OC 3a2490f7d6090e6899e605038a863f06 [0,1,0,0,0,0|2,0,1]=4 1087 B12R0.183 C=C(COCCCC(C)CC)OC cf875971f545c8a75b6b4a87023efc1c [0,1,0,0,0,0|2,0,1]=4 1088 B12R0.183 C=C(COCCC[C@@H](C)CC)OC e66242b994ee99820c74c25a54f7ebf3 [0,1,0,0,0,0|2,0,1]=4 1089 B12R0.183 C=CC(C)COC/C=C/C(=O)OC 8cd08781f8f2ec2888cc1808c296e8f3 [0,1,0,0,0,0|1,0,2]=4 1090 B12R0.183 C=CC(C)COC/C=C\C(=O)OC c5f89389d657321b2785005dc5af2d36 [0,1,0,0,0,0|1,0,2]=4 1091 B12R0.183 C=CC(C)COCC=CC(=O)OC 5ee9b7380d0588585034e3727b14d6d3 [0,1,0,0,0,0|1,0,2]=4 1092 B12R0.183 C=CC(O)CNC/C=C/C(=O)OC 39168cd921e0bde2ebb8b13ad1623266 [0,1,0,0,0,0|1,0,2]=4 1093 B12R0.183 C=CC(O)CNC/C=C\C(=O)OC 0cfcc6eb2d089dca48fc32353d464d73 [0,1,0,0,0,0|1,0,2]=4 1094 B12R0.183 C=CC(O)CNCC=CC(=O)OC 2aef9592038f9d75c5b41923ab86e682 [0,1,0,0,0,0|1,0,2]=4 1095 B12R0.183 CCC(=O)COC/C=C/C(=O)OC 2b8e2c6e5f0f336b4c53b3ab7bc4cb01 [0,1,0,0,0,0|1,0,1]=3 1096 B12R0.183 CCC(=O)COC/C=C\C(=O)OC 76f9c0bcf47453c0499c13553817c388 [0,1,0,0,0,0|1,0,1]=3 1097 B12R0.183 CCC(=O)COCC=CC(=O)OC 1b9e57c3fbe2680ca0d9cad001240976 [0,1,0,0,0,0|1,0,1]=3 1098 B12R0.183 CCC(=O)COCCCC(C)CC a5317ef2c42e3ae80de26ba9e33316b0 [0,1,0,0,0,0|2,0,1]=4 1099 B12R0.183 CCC(=O)COCCC[C@@H](C)CC 3acf229143851d224686ab0eae09d287 [0,1,0,0,0,0|2,0,1]=4 1100 B12R0.183 CCC(C)CCCOCC(=O)NC 707e36d7cae24ec471eeef1d35863941 [0,1,0,0,0,0|2,0,1]=4 1101 B12R0.183 CCC(C)CCCOCC(=O)OC 74f80f01e8aaeef3dda8c05d1a6de077 [0,1,0,0,0,0|1,0,1]=3 1102 B12R0.183 CCC(C)CCNCCC(=O)OC 7d3741f4d5894b35a884461e4eb6aad2 [0,1,0,0,0,0|1,0,2]=4 1103 B12R0.183 CCC(C)CCNCOC(=O)OC f2da8aa1c071322024ff186e22852fcf [0,1,0,0,0,0|2,0,1]=4 1104 B12R0.183 CCC(C)CCOCCC(=O)OC 89119379c4401c8bf3b64487ea6e4388 [0,1,0,0,0,0|1,0,2]=4 1105 B12R0.183 CCC(C)CCOCOC(=O)OC b7a822f89dffbbe3ba944ad35c722ec4 [0,1,0,0,0,0|2,0,1]=4 1106 B12R0.183 CCC(C)CNC/C=C/C(=O)OC 155001798c8c089545e73c0c5f9ff5da [0,1,0,0,0,0|1,0,0]=2 1107 B12R0.183 CCC(C)CNC/C=C\C(=O)OC 3cbf290bbd6d9f6e184ee3d19402a447 [0,1,0,0,0,0|1,0,0]=2 1108 B12R0.183 CCC(C)CNCC=CC(=O)OC eb5801501eccece268397885931f675d [0,1,0,0,0,0|1,0,0]=2 1109 B12R0.183 CCC(C)CNCCCC(=O)OC 97d2188c1529568395553a71d8b2eec0 [0,1,0,0,0,0|1,0,2]=4 1110 B12R0.183 CCC(C)COC/C=C/C(=O)OC 01b4d2f1c360138121a59e4813fbc409 [0,1,0,0,0,0|1,0,0]=2 1111 B12R0.183 CCC(C)COC/C=C\C(=O)OC f7d23b2719d0332499f446599c4c2644 [0,1,0,0,0,0|1,0,0]=2 1112 B12R0.183 CCC(C)COCC#CC(=O)OC 63bd0bc9ff4eed088916c13387df9c9c [0,1,0,0,0,0|1,0,2]=4 1113 B12R0.183 CCC(C)COCC=CC(=O)OC 94b3caf85e5b94239b0af107652dca66 [0,1,0,0,0,0|1,0,0]=2 1114 B12R0.183 CCC(C)COCCCC(=O)OC 59bbbf293aa327712c7ba139e6097b56 [0,1,0,0,0,0|1,0,2]=4 1115 B12R0.183 CCC(C)COCCOC(=O)OC 3a269e97fffde59715e5757b1940a73e [0,1,0,0,0,0|2,0,1]=4 1116 B12R0.183 CCC(C)NCCCCC(=O)OC bda6cb5196b26960c0f9b18f7077219d [0,1,0,0,0,0|1,0,2]=4 1117 B12R0.183 CCC(C)NCCOCC(=O)OC 39c836fce025c03c0eb4524849256d50 [0,1,0,0,0,0|2,0,1]=4 1118 B12R0.183 CCC(C)OCCCCC(=O)OC 3bdc1f969cc8560d9cda80804fbad9a2 [0,1,0,0,0,0|1,0,2]=4 1119 B12R0.183 CCC(C)OCCOCC(=O)OC 042242f1ac4ae5c4ed7c1d3ce857d4ce [0,1,0,0,0,0|2,0,1]=4 1120 B12R0.183 CCC(O)CNC/C=C/C(=O)OC 87dffd1be8635cba8b8d2b4e8dc01645 [0,1,0,0,0,0|1,0,0]=2 1121 B12R0.183 CCC(O)CNC/C=C\C(=O)OC 9d5b464fc4cdb08b71e677a450374d2b [0,1,0,0,0,0|1,0,0]=2 1122 B12R0.183 CCC(O)CNCC#CC(=O)OC e43ebf87ddce2a86b6fc7ee6a6b36bf9 [0,1,0,0,0,0|1,0,2]=4 1123 B12R0.183 CCC(O)CNCC=CC(=O)OC 54ff7a78bcaab12160870920a606f50d [0,1,0,0,0,0|1,0,0]=2 1124 B12R0.183 CCC(O)CNCCCC(=O)OC 856690bc11cbee16e1d53b82b4d76013 [0,1,0,0,0,0|1,0,2]=4 1125 B12R0.183 CCC(S)CCOCCC(=O)OC 8dd5c0274c75896a1a8552c4dcbd818a [0,1,0,0,0,0|1,0,2]=4 1126 B12R0.183 CCC(S)CCOCOC(=O)OC ab0ebdb1257a80d80103d4ba9458faf9 [0,1,0,0,0,0|2,0,1]=4 1127 B12R0.183 CCN(C)C/C=C/C=C/C(=O)OC bfbacf3b6edf723e2ea97781f5619d1d [0,1,0,0,0,0|1,0,2]=4 1128 B12R0.183 CCN(C)CC=CC=CC(=O)OC 196e5bb1dc4d41c389a5827ebe433969 [0,1,0,0,0,0|1,0,2]=4 1129 B12R0.183 CCN(C)CCCCCC(=O)OC 5ce749962703614bb269cfbaf51fa479 [0,1,0,0,0,0|1,0,2]=4 1130 B12R0.183 CCN(C)CCCNCC(=O)OC 8cd2f1c525bc1c929ba0ed95e1245e07 [0,1,0,0,0,0|2,0,1]=4 1131 B12R0.183 CCN(C)CCCOCC(=O)OC 409876da9eec789c2126ca1399263916 [0,1,0,0,0,0|2,0,1]=4 1132 B12R0.183 CCN(C)CCCSCC(=O)OC 8026fd7022ce2d8ddfac9bbcc7509c11 [0,1,0,0,0,0|2,0,1]=4 1133 B12R0.183 CC[C@@H](C)CNCCCC(=O)OC 3df5414b151657195d91aa9b33d81dfb [0,1,0,0,0,0|1,0,2]=4 1134 B12R0.183 CC[C@@H](C)COC/C=C/C(=O)OC e72210d74aac745316f8a61457c58473 [0,1,0,0,0,0|1,0,0]=2 1135 B12R0.183 CC[C@@H](C)COC/C=C\C(=O)OC bd99bdcb60064c4cf49aa88073901744 [0,1,0,0,0,0|1,0,0]=2 1136 B12R0.183 CC[C@@H](C)COCC#CC(=O)OC 1b56a4eb431a64cbef1c9527f703e86a [0,1,0,0,0,0|1,0,2]=4 1137 B12R0.183 CC[C@@H](C)COCC=CC(=O)OC 03e0148166241af7430c8cbee0d0d69b [0,1,0,0,0,0|1,0,0]=2 1138 B12R0.183 CC[C@@H](C)COCCCC(=O)OC 6755ea558ce235dee3e65a12c69ccbb5 [0,1,0,0,0,0|1,0,2]=4 1139 B12R0.183 CC[C@@H](C)COCCOC(=O)OC efecd6fdef7ce59b11cad6a2a95b7a86 [0,1,0,0,0,0|2,0,1]=4 1140 B12R0.183 CC[C@@H](C)NCCCCC(=O)OC 81baffad83e4367968d23a8e10974512 [0,1,0,0,0,0|1,0,2]=4 1141 B12R0.183 CC[C@@H](C)NCCOCC(=O)OC 25a6813b352c93c6a869a2552ccaa9c7 [0,1,0,0,0,0|2,0,1]=4 1142 B12R0.183 CC[C@@H](C)OCCCCC(=O)OC be1a2426e7af2563524b45afc73b9f28 [0,1,0,0,0,0|1,0,2]=4 1143 B12R0.183 CC[C@@H](C)OCCOCC(=O)OC a787715f5c367977d51373f5593a4c23 [0,1,0,0,0,0|2,0,1]=4 1144 B12R0.183 CC[C@@H](O)CNC/C=C/C(=O)OC f12ba876a080685db02137d346a8df20 [0,1,0,0,0,0|1,0,0]=2 1145 B12R0.183 CC[C@@H](O)CNC/C=C\C(=O)OC 6351cd1a0ea99c79dcbdb4ce0de698c1 [0,1,0,0,0,0|1,0,0]=2 1146 B12R0.183 CC[C@@H](O)CNCC#CC(=O)OC 68846b8679ece45fea8448cbdaf927a2 [0,1,0,0,0,0|1,0,2]=4 1147 B12R0.183 CC[C@@H](O)CNCC=CC(=O)OC e3769ce2b6238c134e7d4f3a5d7883d2 [0,1,0,0,0,0|1,0,0]=2 1148 B12R0.183 CC[C@@H](O)CNCCCC(=O)OC 861e761cffb1191893dd71d3ba7145a2 [0,1,0,0,0,0|1,0,2]=4 1149 B12R0.183 CC[C@H](C)CCCOCC(=O)NC d2a6805bed9a0b1888779055e082b837 [0,1,0,0,0,0|2,0,1]=4 1150 B12R0.183 CC[C@H](C)CCCOCC(=O)OC d8623e8603a8de32cbf8434df610fe9b [0,1,0,0,0,0|1,0,1]=3 1151 B12R0.183 CC[C@H](C)CCOCCC(=O)OC 8db142142b1e3b810a3a2d23f29533eb [0,1,0,0,0,0|1,0,2]=4 1152 B12R0.183 CC[C@H](C)CCOCOC(=O)OC 04e82ac35316bb708a355584dacde65c [0,1,0,0,0,0|2,0,1]=4 1153 B12R0.183 CC[C@H](C)CNC/C=C/C(=O)OC 586b9bb7d11eb3dd4bf9130156d6f803 [0,1,0,0,0,0|1,0,0]=2 1154 B12R0.183 CC[C@H](C)CNC/C=C\C(=O)OC 64ae2209a12d2f2731ebf1ae6e76fc08 [0,1,0,0,0,0|1,0,0]=2 1155 B12R0.183 CC[C@H](C)CNCC=CC(=O)OC 395f18fb4996f404503667eeebb255b9 [0,1,0,0,0,0|1,0,0]=2 1156 B12R0.183 CC[C@H](C)CNCCCC(=O)OC 89ac3b166f064e23319517825c5a10f7 [0,1,0,0,0,0|1,0,2]=4 1157 B12R0.183 CC[C@H](C)COC/C=C/C(=O)OC f19e35ca2ccb114546840e766fb347ba [0,1,0,0,0,0|1,0,0]=2 1158 B12R0.183 CC[C@H](C)COC/C=C\C(=O)OC 9de1f1ac130b7387c000e8a8ca38ed9d [0,1,0,0,0,0|1,0,0]=2 1159 B12R0.183 CC[C@H](C)COCC#CC(=O)OC 97890f045e943b89e2ab695ae260646f [0,1,0,0,0,0|1,0,2]=4 1160 B12R0.183 CC[C@H](C)COCC=CC(=O)OC a2263896eeca3f38f80ad7bd8f3969c7 [0,1,0,0,0,0|1,0,0]=2 1161 B12R0.183 CC[C@H](C)COCCCC(=O)OC 2f75351e96aa7a7088a97454af34efed [0,1,0,0,0,0|1,0,2]=4 1162 B12R0.183 CC[C@H](C)COCCOC(=O)OC e7893dd9368047fc540f56210a64d3a6 [0,1,0,0,0,0|2,0,1]=4 1163 B12R0.183 CC[C@H](C)NCCCCC(=O)OC 9dd6c10752ae256dc65ffac343929924 [0,1,0,0,0,0|1,0,2]=4 1164 B12R0.183 CC[C@H](C)NCCOCC(=O)OC c2da3fec224396aad0943dbe2e387760 [0,1,0,0,0,0|2,0,1]=4 1165 B12R0.183 CC[C@H](C)OCCCCC(=O)OC 60d17d04ff7327dec8b7a058eb9a74c3 [0,1,0,0,0,0|1,0,2]=4 1166 B12R0.183 CC[C@H](C)OCCOCC(=O)OC b874578b3dc06289733157528f5eaa2e [0,1,0,0,0,0|2,0,1]=4 1167 B12R0.183 CNC(=O)CNC/C=C/C(=O)OC 615a280978118b3fd6db3185e31ebfae [0,1,0,0,0,0|2,0,1]=4 1168 B12R0.183 CNC(=O)CNC/C=C\C(=O)OC bcdbf28ca7ac01b5bba17d094bfbeb47 [0,1,0,0,0,0|2,0,1]=4 1169 B12R0.183 CNC(=O)CNCC=CC(=O)OC b9bbb3ef1a2277ccd444285a23ce62f5 [0,1,0,0,0,0|2,0,1]=4 1170 B12R0.183 CNC(=O)COC/C=C/C(=O)OC 8c63a6c69d63e56eb3f04f30b2fc5901 [0,1,0,0,0,0|2,0,1]=4 1171 B12R0.183 CNC(=O)COC/C=C\C(=O)OC 282cd96f2e3830f7a2bc939b7df3bfdf [0,1,0,0,0,0|2,0,1]=4 1172 B12R0.183 CNC(=O)COCC=CC(=O)OC bebc51b2c5b3249bd8ee3b5bddd1234d [0,1,0,0,0,0|2,0,1]=4 1173 B12R0.183 COC(=O)/C=C/CNCC(=O)OC bb3ef9e3872c4e254ffde2ab561117c4 [0,1,0,0,0,0|2,0,1]=4 1174 B12R0.183 COC(=O)/C=C/CNCC(Br)CBr c206b2b0ecf20ae7cd40f07fe099a0cf [0,1,0,0,0,0|2,0,0]=3 1175 B12R0.183 COC(=O)/C=C/CNCC(C)C#N 396a09fc69b334c3e16f7559d2f778c1 [0,1,0,0,0,0|2,0,1]=4 1176 B12R0.183 COC(=O)/C=C/CNCC(C)CO f87d3f4f5fe5b7a84fda232c89957a2a [0,1,0,0,0,0|2,0,0]=3 1177 B12R0.183 COC(=O)/C=C/CNCC(F)CO b316ea0ca80cfe89c25ae5af5f69b016 [0,1,0,0,0,0|2,0,0]=3 1178 B12R0.183 COC(=O)/C=C/CNCC(O)CO a82892978f91cd504576860ebe036459 [0,1,0,0,0,0|2,0,0]=3 1179 B12R0.183 COC(=O)/C=C/CNC[C@@H](C)OC 971fd7d489586c586f288af4df0fbb5e [0,1,0,0,0,0|2,0,0]=3 1180 B12R0.183 COC(=O)/C=C/CNC[C@@H](F)CO f3f0505a4a5e2ff14392817f9067b12b [0,1,0,0,0,0|2,0,0]=3 1181 B12R0.183 COC(=O)/C=C/CNC[C@@H](O)CO f6a8eac49e61e5f0def5425868d2978f [0,1,0,0,0,0|2,0,0]=3 1182 B12R0.183 COC(=O)/C=C/CNC[C@H](C)CO b45c77817153607cd5cc8b51c372d9c2 [0,1,0,0,0,0|2,0,0]=3 1183 B12R0.183 COC(=O)/C=C/CNC[C@H](C)OC 2cd8c9d1a1020b3370443320283d51c1 [0,1,0,0,0,0|2,0,0]=3 1184 B12R0.183 COC(=O)/C=C/CNC[C@H](F)CO 2f6f600bd02fed382084e66a55915fcb [0,1,0,0,0,0|2,0,0]=3 1185 B12R0.183 COC(=O)/C=C/CNC[C@H](O)CO 4fe5f15d1424eca0760b57d418b4694d [0,1,0,0,0,0|2,0,0]=3 1186 B12R0.183 COC(=O)/C=C/COCC(=O)OC 36283198af3d6a39fa9122d76a2b3950 [0,1,0,0,0,0|2,0,1]=4 1187 B12R0.183 COC(=O)/C=C/COCC(Br)CBr b3cfc554ef358d7758190e81c5a9775a [0,1,0,0,0,0|2,0,0]=3 1188 B12R0.183 COC(=O)/C=C/COCC(C)C#N a42fe698901cc197b9326b32896fcc30 [0,1,0,0,0,0|2,0,1]=4 1189 B12R0.183 COC(=O)/C=C/COCC(C)OC 86c7ca5dc867c44fbb5dd5059e40b36c [0,1,0,0,0,0|2,0,0]=3 1190 B12R0.183 COC(=O)/C=C/COCC(Cl)CCl ec64226470fceb7be9dda976dc0cb16a [0,1,0,0,0,0|2,0,0]=3 1191 B12R0.183 COC(=O)/C=C/COCC(O)CO 7d1c05198a16aa4828ead603c162900d [0,1,0,0,0,0|2,0,0]=3 1192 B12R0.183 COC(=O)/C=C/COCC(S)CS 777041df81142a71b3d6d0ce10f1db9f [0,1,0,0,0,0|2,0,0]=3 1193 B12R0.183 COC(=O)/C=C/COC[C@@H](C)OC 6b1e4a86f865ce5409df1a6dd3ce56b9 [0,1,0,0,0,0|2,0,0]=3 1194 B12R0.183 COC(=O)/C=C/COC[C@@H](O)CO 57b11b97ff5590dc2d199a194b1b009d [0,1,0,0,0,0|2,0,0]=3 1195 B12R0.183 COC(=O)/C=C/COC[C@H](C)OC 9e0452e827ffba0762ea54b63724792e [0,1,0,0,0,0|2,0,0]=3 1196 B12R0.183 COC(=O)/C=C/COC[C@H](O)CO b881a14ac0177046af12b0b1179d5145 [0,1,0,0,0,0|2,0,0]=3 1197 B12R0.183 COC(=O)/C=C\CNCC(=O)OC 2bbf98897c3967bed0b975605792b3d2 [0,1,0,0,0,0|2,0,1]=4 1198 B12R0.183 COC(=O)/C=C\CNCC(Br)CBr 44d3c181a94dd5c1fe937a4f26daffbd [0,1,0,0,0,0|2,0,0]=3 1199 B12R0.183 COC(=O)/C=C\CNCC(C)C#N 1a1813fa2c6c7ff2e381b90534511209 [0,1,0,0,0,0|2,0,1]=4 1200 B12R0.183 COC(=O)/C=C\CNCC(C)CO 87962dc080bbdeecd228b878667bd621 [0,1,0,0,0,0|2,0,0]=3 1201 B12R0.183 COC(=O)/C=C\CNCC(F)CO 18e78904e4962763401aa96725c864c5 [0,1,0,0,0,0|2,0,0]=3 1202 B12R0.183 COC(=O)/C=C\CNCC(O)CO 1f95eb45adb6b13fac635e69cf99a3b7 [0,1,0,0,0,0|2,0,0]=3 1203 B12R0.183 COC(=O)/C=C\CNC[C@@H](C)OC 4862db8d3e68ce24d132150d655bb1c2 [0,1,0,0,0,0|2,0,0]=3 1204 B12R0.183 COC(=O)/C=C\CNC[C@@H](F)CO bfeae000a2765b0af3e8945acec7717b [0,1,0,0,0,0|2,0,0]=3 1205 B12R0.183 COC(=O)/C=C\CNC[C@@H](O)CO 102db0e341ac5c658f581788f036e1f1 [0,1,0,0,0,0|2,0,0]=3 1206 B12R0.183 COC(=O)/C=C\CNC[C@H](C)CO 84478cdf0c701b8a119ad210759c60eb [0,1,0,0,0,0|2,0,0]=3 1207 B12R0.183 COC(=O)/C=C\CNC[C@H](C)OC 86c99a4286903607fa9f2f964a845e60 [0,1,0,0,0,0|2,0,0]=3 1208 B12R0.183 COC(=O)/C=C\CNC[C@H](F)CO 3468c0937543a345dcceefb942ce3c6f [0,1,0,0,0,0|2,0,0]=3 1209 B12R0.183 COC(=O)/C=C\CNC[C@H](O)CO 0f2b343861dd079ebead60b78dc59dd8 [0,1,0,0,0,0|2,0,0]=3 1210 B12R0.183 COC(=O)/C=C\COCC(=O)OC 80d7faa9e224c722c364da964d06c1e6 [0,1,0,0,0,0|2,0,1]=4 1211 B12R0.183 COC(=O)/C=C\COCC(Br)CBr b5c2dd7f23c71d50561db0d0aee67cb4 [0,1,0,0,0,0|2,0,0]=3 1212 B12R0.183 COC(=O)/C=C\COCC(C)C#N 22a9fdfcd989d18798494bd8e25dfddc [0,1,0,0,0,0|2,0,1]=4 1213 B12R0.183 COC(=O)/C=C\COCC(C)OC e9aa4ca8e14d554d721598bd96a19bc7 [0,1,0,0,0,0|2,0,0]=3 1214 B12R0.183 COC(=O)/C=C\COCC(Cl)CCl bb3f2198c9fdd9f55d26b9724270e7be [0,1,0,0,0,0|2,0,0]=3 1215 B12R0.183 COC(=O)/C=C\COCC(S)CS 6376d1650f5fd1e7c4f21eac0eea1609 [0,1,0,0,0,0|2,0,0]=3 1216 B12R0.183 COC(=O)/C=C\COC[C@@H](C)OC 798a9ffa0074f49047d6f95d77b7f440 [0,1,0,0,0,0|2,0,0]=3 1217 B12R0.183 COC(=O)/C=C\COC[C@H](C)OC 188480ee1310fd77226a0bb916efcb13 [0,1,0,0,0,0|2,0,0]=3 1218 B12R0.183 COC(=O)C=CCNCC(=O)OC 82148b967b2fa91ae9d5a5547ccc0934 [0,1,0,0,0,0|2,0,1]=4 1219 B12R0.183 COC(=O)C=CCNCC(Br)CBr 6f7504d4dc11db612c792981afa0c21c [0,1,0,0,0,0|2,0,0]=3 1220 B12R0.183 COC(=O)C=CCNCC(C)C#N 0b07d977dc1baffdd855298f974e99da [0,1,0,0,0,0|2,0,1]=4 1221 B12R0.183 COC(=O)C=CCNCC(C)CO d9b2edb64709919d23574f501480a34d [0,1,0,0,0,0|2,0,0]=3 1222 B12R0.183 COC(=O)C=CCNCC(F)CO a2fd535500681bf0f748dd66bbcce3bf [0,1,0,0,0,0|2,0,0]=3 1223 B12R0.183 COC(=O)C=CCNCC(O)CO b1421a2576698b665fd72f45e133510f [0,1,0,0,0,0|2,0,0]=3 1224 B12R0.183 COC(=O)C=CCNC[C@@H](C)OC dfa269684c150f49f19118e9870f087b [0,1,0,0,0,0|2,0,0]=3 1225 B12R0.183 COC(=O)C=CCNC[C@@H](F)CO 1f6cbadd9ec246a8248f9b1cc20fa7a1 [0,1,0,0,0,0|2,0,0]=3 1226 B12R0.183 COC(=O)C=CCNC[C@@H](O)CO c8e5becfc7f626257a8776b697cfb5df [0,1,0,0,0,0|2,0,0]=3 1227 B12R0.183 COC(=O)C=CCNC[C@H](C)CO 81fc3d83fc9ca8ff4f72e62c47eae8ee [0,1,0,0,0,0|2,0,0]=3 1228 B12R0.183 COC(=O)C=CCNC[C@H](C)OC ce82521feeec1e0f19da4c1409206c23 [0,1,0,0,0,0|2,0,0]=3 1229 B12R0.183 COC(=O)C=CCNC[C@H](F)CO d1b1487fb2c3f65c986ddf21ec8adbc2 [0,1,0,0,0,0|2,0,0]=3 1230 B12R0.183 COC(=O)C=CCNC[C@H](O)CO f92df6aed5b449e89846868e26734162 [0,1,0,0,0,0|2,0,0]=3 1231 B12R0.183 COC(=O)C=CCOCC(=O)OC c2941bb6fb63576d2458843b85019b32 [0,1,0,0,0,0|2,0,1]=4 1232 B12R0.183 COC(=O)C=CCOCC(Br)CBr 119246e8b18b09861381131b47a650b7 [0,1,0,0,0,0|2,0,0]=3 1233 B12R0.183 COC(=O)C=CCOCC(C)C#N 8096f0a2ad2630414e0fe91b88a38d8d [0,1,0,0,0,0|2,0,1]=4 1234 B12R0.183 COC(=O)C=CCOCC(C)OC a1c68e620bec36c403789c12d0152abd [0,1,0,0,0,0|2,0,0]=3 1235 B12R0.183 COC(=O)C=CCOCC(Cl)CCl 4e65b3de8dd0b9a861f2b6509465ca2b [0,1,0,0,0,0|2,0,0]=3 1236 B12R0.183 COC(=O)C=CCOCC(S)CS 9206fbe67f07f47585449d750f981d75 [0,1,0,0,0,0|2,0,0]=3 1237 B12R0.183 COC(=O)C=CCOC[C@@H](C)OC 96d2043d1a43e9a7da415dfb5f2f44c2 [0,1,0,0,0,0|2,0,0]=3 1238 B12R0.183 COC(=O)C=CCOC[C@H](C)OC 930327cf81a7ffc1c9fc03eded4b1f9e [0,1,0,0,0,0|2,0,0]=3 1239 B12R0.183 COC(=O)CNCCCC(C)CO 0ec523d63e64d844b4a4718be3093778 [0,1,0,0,0,0|2,0,1]=4 1240 B12R0.184 C=C(Br)CCOC/C=C/C(=O)OC 9b44d20d2c3998d0e4f46de498786288 [0,1,0,0,0,0|1,0,2]=4 1241 B12R0.184 C=C(Br)CCOC/C=C\C(=O)OC 881dbf70e353855d160c3ee23665697d [0,1,0,0,0,0|1,0,2]=4 1242 B12R0.184 C=C(Br)CCOCC=CC(=O)OC 9edabb5b5b1ef130a50d5ec520533ee6 [0,1,0,0,0,0|1,0,2]=4 1243 B12R0.184 C=C(C)CCNC/C=C/C(=O)OC ba0b3723b2a60d98e707483022069465 [0,1,0,0,0,0|1,0,1]=3 1244 B12R0.184 C=C(C)CCNC/C=C\C(=O)OC 296f66a1732d4f656bb210ecb5f4b7f2 [0,1,0,0,0,0|1,0,1]=3 1245 B12R0.184 C=C(C)CCNCC=CC(=O)OC 764e6c8beaf234fcf06e051d459d2fe9 [0,1,0,0,0,0|1,0,1]=3 1246 B12R0.184 C=C(C)CCOC/C=C/C(=O)OC 5960ea6cb8a0c6e9f4a4f5fea8ff8d21 [0,1,0,0,0,0|1,0,1]=3 1247 B12R0.184 C=C(C)CCOC/C=C\C(=O)OC 18beb7d9ef40a4823149278f8da7144b [0,1,0,0,0,0|1,0,1]=3 1248 B12R0.184 C=C(C)CCOCC=CC(=O)OC 9a05001417f486c77546b90bc4a2bedf [0,1,0,0,0,0|1,0,1]=3 1249 B12R0.184 C=C(COCCCCC(C)C)OC 19ad070460345472b7491c780a061eea [0,1,0,0,0,0|2,0,1]=4 1250 B12R0.184 CCC(=O)COCCCCC(C)C 6a67363bb26ad6ef7f07a3eb1b0f1840 [0,1,0,0,0,0|2,0,1]=4 1251 B12R0.184 CCC(=O)NCCCCCC(C)C 26741a41b58a1dc6614c9bbe0e7045e9 [0,1,0,0,0,0|2,0,1]=4 1252 B12R0.184 CNC(=O)CNCCCCC(C)C 27b860c7981d719cd66b67940a4c1498 [0,1,0,0,0,0|2,0,1]=4 1253 B12R0.184 CNC(=O)CNCCCCC(C)O be107ee09616c35f4ed455f30771c45b [0,1,0,0,0,0|2,0,1]=4 1254 B12R0.184 CNC(=O)CNCCCC[C@@H](C)O 29da0ca8f4942e09f48e8967731f9279 [0,1,0,0,0,0|2,0,1]=4 1255 B12R0.184 CNC(=O)COCCCCC(C)C 92f607a5c9d75285fd29571212e62b54 [0,1,0,0,0,0|2,0,1]=4 1256 B12R0.184 COC(=O)/C=C/C=C/COC(C)C 363321006795ebcf737cc90883057ab9 [0,1,0,0,0,0|1,0,2]=4 1257 B12R0.184 COC(=O)/C=C/CNCC=C(C)C 9193a96deee419c2bde5700a58d0eff0 [0,1,0,0,0,0|1,0,2]=4 1258 B12R0.184 COC(=O)/C=C/CNCCC(=O)N 92c617ad8ddfb4a70114ab9d69615aaa [0,1,0,0,0,0|2,0,1]=4 1259 B12R0.184 COC(=O)/C=C/CNCCC(=O)O 8601e25daae1299657c6c60e8bbdad98 [0,1,0,0,0,0|2,0,1]=4 1260 B12R0.184 COC(=O)/C=C/CNCCC(=S)N e6af26179a189e3b277bdf14e8edb11d [0,1,0,0,0,0|2,0,1]=4 1261 B12R0.184 COC(=O)/C=C/CNCCC(C)C 2600277d9cbeb0940b3601773ec9074c [0,1,0,0,0,0|1,0,0]=2 1262 B12R0.184 COC(=O)/C=C/CNCCC(C)O 403aa624a81c4dc9ad1d6b8ae62c01fa [0,1,0,0,0,0|1,0,0]=2 1263 B12R0.184 COC(=O)/C=C/CNCCC(F)F 0057524bd9a8fbf1f09e203d52a244ec [0,1,0,0,0,0|2,0,0]=3 1264 B12R0.184 COC(=O)/C=C/CNCCN(C)C a088dce8c0e2045ca69ad7c6cd912d11 [0,1,0,0,0,0|2,0,0]=3 1265 B12R0.184 COC(=O)/C=C/CNCCS(=O)C d1b93f4019509099bb30fae4116f722a [0,1,0,0,0,0|2,0,0]=3 1266 B12R0.184 COC(=O)/C=C/CNCCS(=O)O 24ee8f667ea21af4449df9a08fd8b80f [0,1,0,0,0,0|3,0,0]=4 1267 B12R0.184 COC(=O)/C=C/CNCC[C@@H](C)O f686e8b5404d4bcaacbf9ce43395fb13 [0,1,0,0,0,0|1,0,0]=2 1268 B12R0.184 COC(=O)/C=C/CNCC[C@H](C)O c477e09b21ad9f6aab3212c65abc8516 [0,1,0,0,0,0|1,0,0]=2 1269 B12R0.184 COC(=O)/C=C/COC/C=C(/C)\Cl 4173674eeb2560f360f908ca9b910b95 [0,1,0,0,0,0|1,0,2]=4 1270 B12R0.184 COC(=O)/C=C/COC/C=C(/C)\I c133c4d1ea59c0740188ed741e11a27f [0,1,0,0,0,0|1,0,2]=4 1271 B12R0.184 COC(=O)/C=C/COC/C=C(\C)/Cl 465313036c8b50ad5497e04f78670a0a [0,1,0,0,0,0|1,0,2]=4 1272 B12R0.184 COC(=O)/C=C/COCC=C(C)C 3c5bfdc9f7a26324cf469bfa6ce11600 [0,1,0,0,0,0|1,0,2]=4 1273 B12R0.184 COC(=O)/C=C/COCC=C(C)Cl 6c8c2164ad7d58b50aef87c89d229851 [0,1,0,0,0,0|1,0,2]=4 1274 B12R0.184 COC(=O)/C=C/COCC=C(C)I 19443b2941b1a46f8183a1ddc762feb1 [0,1,0,0,0,0|1,0,2]=4 1275 B12R0.184 COC(=O)/C=C/COCCC(=O)C cd5d186eac00aa84fdc999b02ac5fea8 [0,1,0,0,0,0|1,0,1]=3 1276 B12R0.184 COC(=O)/C=C/COCCC(=O)N d59b605bbd4413caaec5e1d6ecaf2e6d [0,1,0,0,0,0|2,0,1]=4 1277 B12R0.184 COC(=O)/C=C/COCCC(=O)O 12445eb9fcfa720045e6b3b1e6021a4b [0,1,0,0,0,0|2,0,1]=4 1278 B12R0.184 COC(=O)/C=C/COCCC(C)C 186dbc99682e080649ff89428b624fb1 [0,1,0,0,0,0|1,0,0]=2 1279 B12R0.184 COC(=O)/C=C/COCCC(F)F 28f2011afb66680430710a26c10d4d98 [0,1,0,0,0,0|2,0,0]=3 1280 B12R0.184 COC(=O)/C=C/COCCN(C)C 01c9058a7b94118cbbb749f1bf975cf5 [0,1,0,0,0,0|2,0,0]=3 1281 B12R0.184 COC(=O)/C=C/COCCS(=O)C 5d813a3986a01a9fa46f44ff358d5099 [0,1,0,0,0,0|2,0,0]=3 1282 B12R0.184 COC(=O)/C=C/COCC[N+](=O)[O-] 0c1ee736eaa2daac4feb4c373ed3d20f [0,1,0,0,0,0|3,0,0]=4 1283 B12R0.184 COC(=O)/C=C/COCNC(=O)C a89acc83006df32e82f3a13be5d3b041 [0,1,0,0,0,0|2,0,1]=4 1284 B12R0.184 COC(=O)/C=C/COCOC(=O)C 71cfb3e6ae4d525aac1b0fdc54cc1b7b [0,1,0,0,0,0|2,0,1]=4 1285 B12R0.184 COC(=O)/C=C/COCOC(C)C af099fa2bee53e587863867dcb664b97 [0,1,0,0,0,0|2,0,0]=3 1286 B12R0.184 COC(=O)/C=C\CNCC=C(C)C 9d4a0299493a0de86e463b9ac4e1151e [0,1,0,0,0,0|1,0,2]=4 1287 B12R0.184 COC(=O)/C=C\CNCCC(=O)N 6c89fdfe2065816697518759dc0d6aef [0,1,0,0,0,0|2,0,1]=4 1288 B12R0.184 COC(=O)/C=C\CNCCC(=O)O dc7cbe9f9b23cd5611934c760c32ff64 [0,1,0,0,0,0|2,0,1]=4 1289 B12R0.184 COC(=O)/C=C\CNCCC(=S)N 346a51627a481d687ce6853f9c252ca2 [0,1,0,0,0,0|2,0,1]=4 1290 B12R0.184 COC(=O)/C=C\CNCCC(C)C 82b4ced000bdf7c253f7901732426ac6 [0,1,0,0,0,0|1,0,0]=2 1291 B12R0.184 COC(=O)/C=C\CNCCC(C)O 617698cd5c2177029e70d0bd3d03b352 [0,1,0,0,0,0|1,0,0]=2 1292 B12R0.184 COC(=O)/C=C\CNCCC(F)F aa866eb6c00159452c05d5a2c0819f54 [0,1,0,0,0,0|2,0,0]=3 1293 B12R0.184 COC(=O)/C=C\CNCCN(C)C 06dd1a7390d34384e50a7910af58be18 [0,1,0,0,0,0|2,0,0]=3 1294 B12R0.184 COC(=O)/C=C\CNCCS(=O)C 878831ab86cd68f2dd12ef188ecf378d [0,1,0,0,0,0|2,0,0]=3 1295 B12R0.184 COC(=O)/C=C\CNCCS(=O)O cda111a676f26b4311dba5cb92715d9d [0,1,0,0,0,0|3,0,0]=4 1296 B12R0.184 COC(=O)/C=C\CNCC[C@@H](C)O 6df73e6c54d78deb0ea3bb2b52645476 [0,1,0,0,0,0|1,0,0]=2 1297 B12R0.184 COC(=O)/C=C\CNCC[C@H](C)O b26cb488e9eb3f5984fd5a132e8a987b [0,1,0,0,0,0|1,0,0]=2 1298 B12R0.184 COC(=O)/C=C\COC/C=C(/C)\Cl 1afd0047ddf1cc75365c9b7b483e0a28 [0,1,0,0,0,0|1,0,2]=4 1299 B12R0.184 COC(=O)/C=C\COC/C=C(/C)\I 6662dbd21c5649c3378b8250849aba61 [0,1,0,0,0,0|1,0,2]=4 1300 B12R0.184 COC(=O)/C=C\COCC=C(C)C fc9b77df4dbf2ae51d04a22c64276b8c [0,1,0,0,0,0|1,0,2]=4 1301 B12R0.184 COC(=O)/C=C\COCC=C(C)I b326074c160b7ca03f75efaca84ecf5c [0,1,0,0,0,0|1,0,2]=4 1302 B12R0.184 COC(=O)/C=C\COCCC(=O)C 0c9e6ac644a8b18a7e7be11cd53fcb63 [0,1,0,0,0,0|1,0,1]=3 1303 B12R0.184 COC(=O)/C=C\COCCC(=O)N 85de01438340a54cd2f1a7cec1d3654a [0,1,0,0,0,0|2,0,1]=4 1304 B12R0.184 COC(=O)/C=C\COCCC(=O)O 895cd458a817a21bc606299ba3f06de9 [0,1,0,0,0,0|2,0,1]=4 1305 B12R0.184 COC(=O)/C=C\COCCC(C)C 5176ae63c764c7f19e711d306d86dfd5 [0,1,0,0,0,0|1,0,0]=2 1306 B12R0.184 COC(=O)/C=C\COCCC(F)F e9af8d0fefdd13b6fd28853497cc940a [0,1,0,0,0,0|2,0,0]=3 1307 B12R0.184 COC(=O)/C=C\COCCN(C)C f7f3f2acf173d7f7c814d8820fbaece7 [0,1,0,0,0,0|2,0,0]=3 1308 B12R0.184 COC(=O)/C=C\COCCS(=O)C ad7b2f45c70142e13611e3360bc87edf [0,1,0,0,0,0|2,0,0]=3 1309 B12R0.184 COC(=O)/C=C\COCC[N+](=O)[O-] ac8c86c3ee847724739928cd09296dfb [0,1,0,0,0,0|3,0,0]=4 1310 B12R0.184 COC(=O)/C=C\COCNC(=O)C b77f90861e8af0da9435ea7ed61fb84d [0,1,0,0,0,0|2,0,1]=4 1311 B12R0.184 COC(=O)C#CCNCCC(C)C 2976ec2c863dd0ed717ea718b7fdc0fc [0,1,0,0,0,0|1,0,2]=4 1312 B12R0.184 COC(=O)C#CCNCCC(C)O 2cfd455f42d12241fdc8684a8188e7d5 [0,1,0,0,0,0|1,0,2]=4 1313 B12R0.184 COC(=O)C#CCNCC[C@@H](C)O 5e8dd5cbca2f4e87c4f3caa46adfda78 [0,1,0,0,0,0|1,0,2]=4 1314 B12R0.184 COC(=O)C#CCNCC[C@H](C)O 7a44b3d8990be458cb169abf3fea2e39 [0,1,0,0,0,0|1,0,2]=4 1315 B12R0.184 COC(=O)C#CCOCCC(C)C 0067e1a0f8dc5913befbbd24792bd0f3 [0,1,0,0,0,0|1,0,2]=4 1316 B12R0.184 COC(=O)C=CC=CCOC(C)C aba2db1f04d83ad974f79a4b04d39a04 [0,1,0,0,0,0|1,0,2]=4 1317 B12R0.184 COC(=O)C=CCNCC=C(C)C ce0129e4c0e0e28b2953eb42f859924b [0,1,0,0,0,0|1,0,2]=4 1318 B12R0.184 COC(=O)C=CCNCCC(=O)N 13e01c71d9fefbba05cb4d7793aa0aa4 [0,1,0,0,0,0|2,0,1]=4 1319 B12R0.184 COC(=O)C=CCNCCC(=O)O 8b78d2f8f1e0a519bd8f609fde045509 [0,1,0,0,0,0|2,0,1]=4 1320 B12R0.184 COC(=O)C=CCNCCC(=S)N 0a526c5ecf34c38077fb69717b3fbdc8 [0,1,0,0,0,0|2,0,1]=4 1321 B12R0.184 COC(=O)C=CCNCCC(C)C 5fde4d2c2d98650d1c3abfe7ab5b8701 [0,1,0,0,0,0|1,0,0]=2 1322 B12R0.184 COC(=O)C=CCNCCC(C)O 3fdbed1aa2790efd838ae662bf247dae [0,1,0,0,0,0|1,0,0]=2 1323 B12R0.184 COC(=O)C=CCNCCC(F)F 04432fd58c485798cd2036562b0a0b04 [0,1,0,0,0,0|2,0,0]=3 1324 B12R0.184 COC(=O)C=CCNCCN(C)C c080e8cc8e2055628b0ea5ed01be7916 [0,1,0,0,0,0|2,0,0]=3 1325 B12R0.184 COC(=O)C=CCNCCS(=O)C 8c510a6b7271c8a7bd2568d5a11ec7c2 [0,1,0,0,0,0|2,0,0]=3 1326 B12R0.184 COC(=O)C=CCNCCS(=O)O 96d8f2460bf078e5c7971a651d7012f7 [0,1,0,0,0,0|3,0,0]=4 1327 B12R0.184 COC(=O)C=CCNCC[C@@H](C)O a06e446f58bdfa5fb1deadf25a30531a [0,1,0,0,0,0|1,0,0]=2 1328 B12R0.184 COC(=O)C=CCNCC[C@H](C)O 9d84a3cf0239992fec287c0bb2aa394f [0,1,0,0,0,0|1,0,0]=2 1329 B12R0.184 COC(=O)C=CCOC/C=C(/C)\Cl 1b286f43388f3d7620f19f8a4689cced [0,1,0,0,0,0|1,0,2]=4 1330 B12R0.184 COC(=O)C=CCOC/C=C(/C)\I 1f375f4329b38f15cfbb1df29bd31411 [0,1,0,0,0,0|1,0,2]=4 1331 B12R0.184 COC(=O)C=CCOCC=C(C)C 60fd0b57b8cdd8621e7fbdcecc735dbe [0,1,0,0,0,0|1,0,2]=4 1332 B12R0.184 COC(=O)C=CCOCC=C(C)I 87306bc33a56e1969f33c111017a2b64 [0,1,0,0,0,0|1,0,2]=4 1333 B12R0.184 COC(=O)C=CCOCCC(=O)C 61f1860a2dfec466d494f2dd6c46f13d [0,1,0,0,0,0|1,0,1]=3 1334 B12R0.184 COC(=O)C=CCOCCC(=O)N 967765d8154c767a3e189d613efdc095 [0,1,0,0,0,0|2,0,1]=4 1335 B12R0.184 COC(=O)C=CCOCCC(=O)O 37780477f7451ac841c2e10e0ef4b7e2 [0,1,0,0,0,0|2,0,1]=4 1336 B12R0.184 COC(=O)C=CCOCCC(C)C 55c1fd6f493883cce7843bc5dfa20f73 [0,1,0,0,0,0|1,0,0]=2 1337 B12R0.184 COC(=O)C=CCOCCC(F)F 852747faa92b60a068d31b3aacb24b97 [0,1,0,0,0,0|2,0,0]=3 1338 B12R0.184 COC(=O)C=CCOCCN(C)C 8fa7508b3758a2f2d779ae358c40613a [0,1,0,0,0,0|2,0,0]=3 1339 B12R0.184 COC(=O)C=CCOCCS(=O)C df14fc5b7d5241a29aed2f8ce176a05f [0,1,0,0,0,0|2,0,0]=3 1340 B12R0.184 COC(=O)C=CCOCC[N+](=O)[O-] d5bcdd41a3e721e4cfedbbd599e9875a [0,1,0,0,0,0|3,0,0]=4 1341 B12R0.184 COC(=O)C=CCOCNC(=O)C 449b5be2ab573094e6a5aa60803cbdd7 [0,1,0,0,0,0|2,0,1]=4 1342 B12R0.184 COC(=O)CCCCCNC(C)C e4c4364139c573a61270fb735960e5b8 [0,1,0,0,0,0|1,0,2]=4 1343 B12R0.184 COC(=O)CCCCCOC(C)C 2e40cb4f72a05a1a15f2fc56e083b30e [0,1,0,0,0,0|1,0,2]=4 1344 B12R0.184 COC(=O)CCCCNCC(C)C 20fdf39c7e8971dc18ce6a71d51edbff [0,1,0,0,0,0|1,0,2]=4 1345 B12R0.184 COC(=O)CCCCNCC(C)O 3a91e87a6308af785bb72a3f6d20e373 [0,1,0,0,0,0|1,0,2]=4 1346 B12R0.184 COC(=O)CCCCNC[C@@H](C)O b262084a030138f68f3c03a5e35baca9 [0,1,0,0,0,0|1,0,2]=4 1347 B12R0.184 COC(=O)CCCCNC[C@H](C)O 4205c96bfc07b0de50538ee503ea269f [0,1,0,0,0,0|1,0,2]=4 1348 B12R0.184 COC(=O)CCCCOCC(C)C 1ca68c733867516b14de7385f7d7f5d7 [0,1,0,0,0,0|1,0,2]=4 1349 B12R0.184 COC(=O)CCCCOCC(C)F 34d1b3b1064b5bd7dea349f19fd9118a [0,1,0,0,0,0|1,0,2]=4 1350 B12R0.184 COC(=O)CCCCOCC(C)S 561023bb5ea6895115be7d8dd5852d50 [0,1,0,0,0,0|1,0,2]=4 1351 B12R0.184 COC(=O)CCCCOC[C@@H](C)F 35b5b1ebcf4e074c0f604a599e3534d2 [0,1,0,0,0,0|1,0,2]=4 1352 B12R0.184 COC(=O)CCCCOC[C@H](C)F 4583b1dafc042818175d2e91c0f8d19d [0,1,0,0,0,0|1,0,2]=4 1353 B12R0.184 COC(=O)CCCNCCC(C)C 3bb02491cec787c4a5e613b2a02f1a14 [0,1,0,0,0,0|1,0,2]=4 1354 B12R0.184 COC(=O)CCCNCCC(C)O 9c1493174fcfea41f6aad482f131c268 [0,1,0,0,0,0|1,0,2]=4 1355 B12R0.184 COC(=O)CCCNCC[C@@H](C)O 1d2338799f321386edeffe7197a83773 [0,1,0,0,0,0|1,0,2]=4 1356 B12R0.184 COC(=O)CCCNCC[C@H](C)O 57283e227293800b7dc98c060e880c95 [0,1,0,0,0,0|1,0,2]=4 1357 B12R0.184 COC(=O)CCCOCCC(C)C f2d72b3da82325319b4b75703841155b [0,1,0,0,0,0|1,0,2]=4 1358 B12R0.184 COC(=O)CCNCCCC(C)C 82a548ececb816c6b329d328ef5bd48f [0,1,0,0,0,0|1,0,2]=4 1359 B12R0.184 COC(=O)CCNCCCC(C)O e437758d2c7709ae14b58722af30fa1c [0,1,0,0,0,0|1,0,2]=4 1360 B12R0.184 COC(=O)CCOCCCC(C)C 29629814b448cbf4e74929d30f12e83f [0,1,0,0,0,0|1,0,2]=4 1361 B12R0.184 COC(=O)CNCCCCC(=O)C 736373d65d48b8a335d23a20efdc0bd3 [0,1,0,0,0,0|1,0,2]=4 1362 B12R0.184 COC(=O)CNCCCCC(C)C 8f2b37aede55d4c47c097bfd4ae5812e [0,1,0,0,0,0|1,0,1]=3 1363 B12R0.184 COC(=O)CNCCCCC(C)O 21351e7f9fd19ba0ebb42e56bea401ce [0,1,0,0,0,0|1,0,1]=3 1364 B12R0.184 COC(=O)CNCCCCC(F)F 00b18b37121994a8bb8a3d0b88922fd2 [0,1,0,0,0,0|2,0,1]=4 1365 B12R0.184 COC(=O)CNCCCCN(C)C 19ca5e8aa7bb7b25bf3fd6d34eaf42df [0,1,0,0,0,0|2,0,1]=4 1366 B12R0.184 COC(=O)CNCCCC[C@@H](C)O 44493351ac0669b1337667d7df301e63 [0,1,0,0,0,0|1,0,1]=3 1367 B12R0.184 COC(=O)CNCCCOC(C)C 57a7bb0e81b29aafaafdbbe56e80eea3 [0,1,0,0,0,0|2,0,1]=4 1368 B12R0.184 COC(=O)CNCCCSC(C)C a822b3b81c835cafe61e5587cb4d1b87 [0,1,0,0,0,0|2,0,1]=4 1369 B12R0.184 COC(=O)CNCCOCC(C)C 9ee15c10fd8ffcf94f1ae12b4dfc40fb [0,1,0,0,0,0|2,0,1]=4 1370 B12R0.184 COC(=O)COCCCCC(=O)C 0f2bfa16545bc2ebc3021c531b08d9ee [0,1,0,0,0,0|1,0,2]=4 1371 B12R0.184 COC(=O)COCCCCC(C)C c343e5cf4736d2369edd770fbb844da3 [0,1,0,0,0,0|1,0,1]=3 1372 B12R0.184 COC(=O)COCCCCN(C)C d63c12ee206a0257b11473553de22103 [0,1,0,0,0,0|2,0,1]=4 1373 B12R0.184 COC(=O)COCCCOC(C)C 3aa8701a506cc1df2904d9b76e634c5b [0,1,0,0,0,0|2,0,1]=4 1374 B12R0.184 COC(=O)COCCCSC(C)C 1619b311cbeb0c79c525358e4d03ffa7 [0,1,0,0,0,0|2,0,1]=4 1375 B12R0.184 COC(=O)COCCNCC(C)C 2f6a961967470c8b61140de14caaf824 [0,1,0,0,0,0|2,0,1]=4 1376 B12R0.184 COC(=O)COCCNCC(C)O 41e243109d197cc4a3bec6c6c8672ff5 [0,1,0,0,0,0|2,0,1]=4 1377 B12R0.184 COC(=O)COCCNC[C@@H](C)O ede81ee8f0e9be413944faca23127e1f [0,1,0,0,0,0|2,0,1]=4 1378 B12R0.184 COC(=O)COCCNC[C@H](C)O f52136184241a61c04b660f3242d27af [0,1,0,0,0,0|2,0,1]=4 1379 B12R0.184 COC(=O)COCCOCC(C)C 93f5b82a727c1373865de6ff613b9ee0 [0,1,0,0,0,0|2,0,1]=4 1380 B12R0.184 COC(=O)COCCOCC(C)F 73e2f7a0b4ddebf376d6720cddf547db [0,1,0,0,0,0|2,0,1]=4 1381 B12R0.184 COC(=O)COCCOCC(C)S c4e90723090085853e8ab88342aee655 [0,1,0,0,0,0|2,0,1]=4 1382 B12R0.184 COC(=O)COCCOC[C@@H](C)F 53a621ef1a5d6ffc704d4ec8cf2df81a [0,1,0,0,0,0|2,0,1]=4 1383 B12R0.184 COC(=O)COCCOC[C@H](C)F 06b62668da21411962997e4ca9b9d5a7 [0,1,0,0,0,0|2,0,1]=4 1384 B12R0.184 COC(=O)COCCSCC(C)C a733af6f2a4c040968ceaa22a2329a9e [0,1,0,0,0,0|2,0,1]=4 1385 B12R0.184 COC(=O)CSCCCOC(C)C 274b6ded351a42a9895f7aefa4c64397 [0,1,0,0,0,0|2,0,1]=4 1386 B12R0.184 COC(=O)OCCOCCC(C)C 981d54d4bb53f8ba85d392cb24933864 [0,1,0,0,0,0|2,0,1]=4 1387 B12R0.184 COC(=O)OCNCCCC(C)C 3c9cf5a50df15df917576706a9299f51 [0,1,0,0,0,0|2,0,1]=4 1388 B12R0.184 COC(=O)OCOCCCC(C)C a4bc87b8d4ec7d52e72d121ea7a6679c [0,1,0,0,0,0|2,0,1]=4 1389 B12R0.248 C#CCCCCCNCC(=O)OC 520d23acc6f0ab6137c3b605896478b7 [0,1,0,0,0,0|1,0,2]=4 1390 B12R0.248 C#CCCCCCOCC(=O)OC 48d6ed526b7a97d74294c4451f2c9346 [0,1,0,0,0,0|1,0,2]=4 1391 B12R0.248 C#CCCCNC/C=C/C(=O)OC d92a7424852dea2badf7f1d2debd1e01 [0,1,0,0,0,0|0,0,2]=3 1392 B12R0.248 C#CCCCNC/C=C\C(=O)OC 5315dd4274924d5aff8c678f9cd5e595 [0,1,0,0,0,0|0,0,2]=3 1393 B12R0.248 C#CCCCNCC=CC(=O)OC aab18b21e5d688d882f416ac2c57ebca [0,1,0,0,0,0|0,0,2]=3 1394 B12R0.248 C#CCCCOC/C=C/C(=O)OC 1901e2dca7a3705975ea379b5fb6bdc9 [0,1,0,0,0,0|0,0,2]=3 1395 B12R0.248 C#CCCCOC/C=C\C(=O)OC 957c52f2dace948fdee91a73e4653d26 [0,1,0,0,0,0|0,0,2]=3 1396 B12R0.248 C#CCCCOCC=CC(=O)OC c658ba81d6b081551b4c862d4fa1c4f7 [0,1,0,0,0,0|0,0,2]=3 1397 B12R0.248 C/C=C/CCOC/C=C/C(=O)OC 83602834c01aa6fcd812102069df06ff [0,1,0,0,0,0|0,0,2]=3 1398 B12R0.248 C/C=C/CCOC/C=C\C(=O)OC 640f96db4695d19eb44be08dad54b65f [0,1,0,0,0,0|0,0,2]=3 1399 B12R0.248 C/C=C/CCOCC=CC(=O)OC 9d86a2b57dee47b3a1b9a97243ddf17b [0,1,0,0,0,0|0,0,2]=3 1400 B12R0.248 C=C(CNCCCCCCC)OC 043016b208b4d94cb43d8730512ebf8d [0,1,0,0,0,0|1,0,2]=4 1401 B12R0.248 C=C(CNCCCCCCCl)OC f983171f2dd9ffd1603757ba74befaf2 [0,1,0,0,0,0|2,0,1]=4 1402 B12R0.248 C=C(CNCCCCCCO)OC 63d666a961311c5c95dd1c201f18e204 [0,1,0,0,0,0|2,0,1]=4 1403 B12R0.248 C=C(CNCCCCCOC)OC 8f547a0f7668fb1d86022f1a9488aa0f [0,1,0,0,0,0|2,0,1]=4 1404 B12R0.248 C=C(CNCCCCSCC)OC c0bae8ee7f16854b864d3f72ae589740 [0,1,0,0,0,0|2,0,1]=4 1405 B12R0.248 C=C(CNCCCOCCC)OC b2dffabe3c9d3489949a526b4f61cddb [0,1,0,0,0,0|2,0,1]=4 1406 B12R0.248 C=C(CNCCOCCCC)OC 2e54f77a9f8a352597a85033a8bd279b [0,1,0,0,0,0|2,0,1]=4 1407 B12R0.248 C=C(COCCCCCCC)OC 0192794a2c9e9295c9ea6e2f5364ef87 [0,1,0,0,0,0|1,0,2]=4 1408 B12R0.248 C=C(COCCCCCCF)OC dfab4e748ad28e7178beacc907594cf9 [0,1,0,0,0,0|2,0,1]=4 1409 B12R0.248 C=C(COCCCCCCS)OC 2e2be5a907c4068ce52873dc29eaf211 [0,1,0,0,0,0|2,0,1]=4 1410 B12R0.248 C=C(COCCOCCCC)OC ccd104d88075853750444d90b44c0806 [0,1,0,0,0,0|2,0,1]=4 1411 B12R0.248 C=C(COCCSCCCC)OC b03057f64f2124db88609a8373645009 [0,1,0,0,0,0|2,0,1]=4 1412 B12R0.248 C=C=CCCOC/C=C/C(=O)OC 25435194f46e2bdeafee16022d3666c2 [0,1,0,0,0,0|0,0,3]=4 1413 B12R0.248 C=C=CCCOC/C=C\C(=O)OC 9d415e7d2185648ddea1507cc865feb6 [0,1,0,0,0,0|0,0,3]=4 1414 B12R0.248 C=C=CCCOCC=CC(=O)OC fc8a6bd21f0e8f20dc0b9cfea9678c8a [0,1,0,0,0,0|0,0,3]=4 1415 B12R0.248 C=CCCCCCNCC(=O)OC a4c628b10e1a7c79bc97e884a11a44a4 [0,1,0,0,0,0|1,0,2]=4 1416 B12R0.248 C=CCCCCCOCC(=O)OC 1ff41dfb3f700cb947df28a39f84a101 [0,1,0,0,0,0|1,0,2]=4 1417 B12R0.248 C=CCCCNC/C=C/C(=O)OC 170162e3847831ca65c56ec17b57c589 [0,1,0,0,0,0|0,0,2]=3 1418 B12R0.248 C=CCCCNC/C=C\C(=O)OC c73ebc796442157f4fe2248d95e329c1 [0,1,0,0,0,0|0,0,2]=3 1419 B12R0.248 C=CCCCNCC=CC(=O)OC e3dd1ddc122d5a7b4fbd73f4f010dc1c [0,1,0,0,0,0|0,0,2]=3 1420 B12R0.248 C=CCCCOC/C=C/C(=O)OC 9dba7c5bc23dd2310ada8a2756a81808 [0,1,0,0,0,0|0,0,2]=3 1421 B12R0.248 C=CCCCOC/C=C\C(=O)OC 018075ca3b261b418407877623fa173e [0,1,0,0,0,0|0,0,2]=3 1422 B12R0.248 C=CCCCOCC=CC(=O)OC 0b1a0632bb95a4711407ee345eeca02f [0,1,0,0,0,0|0,0,2]=3 1423 B12R0.248 C=COCCNC/C=C/C(=O)OC 581bb2713b76a24b600ce8b27e5a663c [0,1,0,0,0,0|1,0,2]=4 1424 B12R0.248 C=COCCNC/C=C\C(=O)OC 19a2b4e0d95986b47de58792ada3b165 [0,1,0,0,0,0|1,0,2]=4 1425 B12R0.248 C=COCCNCC=CC(=O)OC f41acd632da36f6506703fd5210f9d87 [0,1,0,0,0,0|1,0,2]=4 1426 B12R0.248 C=COCCOC/C=C/C(=O)OC 5bc599e4cf057fbf8e4aa1f6a204b184 [0,1,0,0,0,0|1,0,2]=4 1427 B12R0.248 C=COCCOC/C=C\C(=O)OC 67a1666ed4848a7142407d293bfcc60d [0,1,0,0,0,0|1,0,2]=4 1428 B12R0.248 C=COCCOCC=CC(=O)OC 55b3133fe9a287944d6fed1edbe98c69 [0,1,0,0,0,0|1,0,2]=4 1429 B12R0.248 CC#CCCOC/C=C/C(=O)OC f79549ef3c998ca96d7b185c4579e18a [0,1,0,0,0,0|0,0,2]=3 1430 B12R0.248 CC#CCCOC/C=C\C(=O)OC 6b665a501b81a01abc6bb06642a38742 [0,1,0,0,0,0|0,0,2]=3 1431 B12R0.248 CC#CCCOCC=CC(=O)OC 97abfeb8515ee2e72b57f8c943e03673 [0,1,0,0,0,0|0,0,2]=3 1432 B12R0.248 CC/C=C/COC/C=C/C(=O)OC f1be435a8dfc6fccd1d9fdf02bb63001 [0,1,0,0,0,0|0,0,2]=3 1433 B12R0.248 CC/C=C/COC/C=C\C(=O)OC bd1b7a0e0dad707c3de141d4076bc4fd [0,1,0,0,0,0|0,0,2]=3 1434 B12R0.248 CC/C=C/COCC=CC(=O)OC dacbda0aa42e583a2b39bb040a6116bf [0,1,0,0,0,0|0,0,2]=3 1435 B12R0.248 CC/C=C\CCCOCC(=O)OC 33767f297a0786df1f7dfbd63a249d4e [0,1,0,0,0,0|1,0,2]=4 1436 B12R0.248 CC/C=C\COC/C=C/C(=O)OC 4ceed86ac87954c34f98018f5c33e00e [0,1,0,0,0,0|0,0,2]=3 1437 B12R0.248 CC/C=C\COC/C=C\C(=O)OC 937c176f963fdce7beb403106421bdd6 [0,1,0,0,0,0|0,0,2]=3 1438 B12R0.248 CC/C=C\COCC=CC(=O)OC 6fd172568f3a4fa6cc086edeb81151ff [0,1,0,0,0,0|0,0,2]=3 1439 B12R0.248 CCC#CCOC/C=C/C(=O)OC fc4cab3cc2dff1a34a929584105e6c47 [0,1,0,0,0,0|0,0,2]=3 1440 B12R0.248 CCC#CCOC/C=C\C(=O)OC 1ac003a7e01911077fb7ee7ecbb27830 [0,1,0,0,0,0|0,0,2]=3 1441 B12R0.248 CCC#CCOCC=CC(=O)OC 8f46735d3a409eeb9344194985d74459 [0,1,0,0,0,0|0,0,2]=3 1442 B12R0.248 CCC(=O)CNCCCCCCCl 15b711b67723864bb6870df906c803dc [0,1,0,0,0,0|2,0,1]=4 1443 B12R0.248 CCC(=O)CNCCCCCCO 3bd6495eb8a44431ecbf0b7f93a3732c [0,1,0,0,0,0|2,0,1]=4 1444 B12R0.248 CCC(=O)CNCCCCCOC bf6576c1ab05016e3e0b558503cb3c7e [0,1,0,0,0,0|2,0,1]=4 1445 B12R0.248 CCC(=O)COCCCCCCF f84c0266d0bdada97574a117de11577b [0,1,0,0,0,0|2,0,1]=4 1446 B12R0.248 CCC(=O)COCCCCCCS ff88f3593acf82bc428acc7729e20e21 [0,1,0,0,0,0|2,0,1]=4 1447 B12R0.248 CCC(=O)COCCCCCOC 1809792bfd10bb7959865f765295b78f [0,1,0,0,0,0|2,0,1]=4 1448 B12R0.248 CCC(=O)NCCCCCCCO 6eed6530831d420f466164dc32f13bd7 [0,1,0,0,0,0|2,0,1]=4 1449 B12R0.248 CCC/C=C\CCOCC(=O)OC ef4e3b273988452c912c65b248282ee3 [0,1,0,0,0,0|1,0,2]=4 1450 B12R0.248 CCCC#CCCOCC(=O)OC 329db3d62d3f0d05c23c5d66aa256a5e [0,1,0,0,0,0|1,0,2]=4 1451 B12R0.248 CCCC/C=C/CNCC(=O)OC 2238e6859741601f307ad72f9eab2cee [0,1,0,0,0,0|1,0,2]=4 1452 B12R0.248 CCCC/C=C/COCC(=O)OC 59c42c9b842c8ce1475fd05126a2ee05 [0,1,0,0,0,0|1,0,2]=4 1453 B12R0.248 CCCC/C=C\CNCC(=O)OC b79e06c82cbd65ea19065a8f4f16fb90 [0,1,0,0,0,0|1,0,2]=4 1454 B12R0.248 CCCC/C=C\COCC(=O)OC d06c100fefc83b382e9829320a80ff8d [0,1,0,0,0,0|1,0,2]=4 1455 B12R0.248 CCCCC#CCOCC(=O)OC 8ed4f3a0313f013e51bb0f0cd6599b39 [0,1,0,0,0,0|1,0,2]=4 1456 B12R0.248 CCCCCCCCNC(=O)CC 8d5ca65c7bc055f65ae9b9c0d4864e57 [0,1,0,0,0,0|1,0,2]=4 1457 B12R0.248 CCCCCCCNCC(=O)CC 89ed05db9bec07e2e6db05ecef7a0fca [0,1,0,0,0,0|1,0,2]=4 1458 B12R0.248 CCCCCCCNCC(=O)NC 6d9648dacdcc37bc39a5a62812b40b4f [0,1,0,0,0,0|1,0,2]=4 1459 B12R0.248 CCCCCCCNCC(=O)OC 2a593dbd0b5d06f61843f359317cdf86 [0,1,0,0,0,0|0,0,2]=3 1460 B12R0.248 CCCCCCCOCC(=O)CC a8acc97960556a375783be8199237dca [0,1,0,0,0,0|1,0,2]=4 1461 B12R0.248 CCCCCCCOCC(=O)NC f6472919275e3b150f6c0e20fb6ced2d [0,1,0,0,0,0|1,0,2]=4 1462 B12R0.248 CCCCCCCOCC(=O)OC 04031205afbe774e5f21f17cc5098880 [0,1,0,0,0,0|0,0,2]=3 1463 B12R0.248 CCCCCCNCCC(=O)NC f03ff6a74684820323d170d68c8c9cc7 [0,1,0,0,0,0|1,0,2]=4 1464 B12R0.248 CCCCCCNCCC(=O)OC 88018f823e6b9b368e308c072245caf2 [0,1,0,0,0,0|0,0,2]=3 1465 B12R0.248 CCCCCCNCOC(=O)CC de7acfa60fcfbcd75fcb15b0338dbcdd [0,1,0,0,0,0|2,0,1]=4 1466 B12R0.248 CCCCCCNCOC(=O)OC bee4c1191bdb64c03121e2b1fdaf6261 [0,1,0,0,0,0|1,0,1]=3 1467 B12R0.248 CCCCCCOCCC(=O)NC dc8f3be555a715028c848fc47355aefa [0,1,0,0,0,0|1,0,2]=4 1468 B12R0.248 CCCCCCOCCC(=O)OC fcfca6f4a105eb36c6bdf010574fee04 [0,1,0,0,0,0|0,0,2]=3 1469 B12R0.248 CCCCCCOCOC(=O)CC 3b1eb2d7210e074df13a997019128ed2 [0,1,0,0,0,0|2,0,1]=4 1470 B12R0.248 CCCCCCOCOC(=O)OC ece183946507c64ea1bf47b28c6807f3 [0,1,0,0,0,0|1,0,1]=3 1471 B12R0.248 CCCCCNC/C=C/C(=O)OC 70c858835df86f408c211f981d46763f [0,1,0,0,0,0|0,0,0]=1 1472 B12R0.248 CCCCCNC/C=C\C(=O)OC 4d4efc8bc818675609d9a6849ad99f0f [0,1,0,0,0,0|0,0,0]=1 1473 B12R0.248 CCCCCNCC#CC(=O)OC 81df4a10bdf114f27e2cbc2a2e4d33db [0,1,0,0,0,0|0,0,2]=3 1474 B12R0.248 CCCCCNCC=CC(=O)OC 7bd7bd9430fda515f90324f65a892be0 [0,1,0,0,0,0|0,0,0]=1 1475 B12R0.248 CCCCCNCCCC(=O)NC 9e3cd31bd5bd22bd1e57817a487c3f2c [0,1,0,0,0,0|1,0,2]=4 1476 B12R0.248 CCCCCNCCCC(=O)OC df636db288139b82b44ccdc35fadd3aa [0,1,0,0,0,0|0,0,2]=3 1477 B12R0.248 CCCCCNCCNC(=O)CC cdceed1f0b72ea8f2dfb8d1c096a0193 [0,1,0,0,0,0|2,0,1]=4 1478 B12R0.248 CCCCCOC/C=C/C(=O)OC b64f88cac1fa45b860e98adfff12eb1b [0,1,0,0,0,0|0,0,0]=1 1479 B12R0.248 CCCCCOC/C=C\C(=O)OC 9c5e736562ff53312c6cd34c13bf4f02 [0,1,0,0,0,0|0,0,0]=1 1480 B12R0.248 CCCCCOCC#CC(=O)OC 6a87dee1cd4b80f4f8802530b6b63a71 [0,1,0,0,0,0|0,0,2]=3 1481 B12R0.248 CCCCCOCC=CC(=O)OC ae15838d7192ab0d8d26d23881dc06e6 [0,1,0,0,0,0|0,0,0]=1 1482 B12R0.248 CCCCCOCCCC(=O)NC 26adbe93f4240f6151d8eb03ba68d821 [0,1,0,0,0,0|1,0,2]=4 1483 B12R0.248 CCCCCOCCCC(=O)OC 6d595d79d4a782dba780cd78bb66a9c8 [0,1,0,0,0,0|0,0,2]=3 1484 B12R0.248 CCCCCOCCNC(=O)CC dc63ddbc4f1369b6b1650cd52229a426 [0,1,0,0,0,0|2,0,1]=4 1485 B12R0.248 CCCCCOCCOC(=O)CC c5dcbbaf984711ca2355a0d7dcdc1660 [0,1,0,0,0,0|2,0,1]=4 1486 B12R0.248 CCCCCOCCOC(=O)OC 959bff4929d622ff13c888beceb3b015 [0,1,0,0,0,0|1,0,1]=3 1487 B12R0.248 CCCCNCCCCC(=O)CC 75ca588ca1aaa2c811fe1088d3346fe6 [0,1,0,0,0,0|1,0,2]=4 1488 B12R0.248 CCCCNCCCCC(=O)OC 581f41ce8229ec98b014f7c6df60648e [0,1,0,0,0,0|0,0,2]=3 1489 B12R0.248 CCCCNCCOCC(=O)OC 5c4255bebbafa583bf8806a236c674c5 [0,1,0,0,0,0|1,0,1]=3 1490 B12R0.248 CCCCOCCCCC(=O)CC e302404d6275421b52ba8d82a0a0ca19 [0,1,0,0,0,0|1,0,2]=4 1491 B12R0.248 CCCCOCCCCC(=O)OC dd999d0123fc4f5efca686b1cd68edc5 [0,1,0,0,0,0|0,0,2]=3 1492 B12R0.248 CCCCOCCCNC(=O)CC 8c32a8226d92a17d8be681c140dc721d [0,1,0,0,0,0|2,0,1]=4 1493 B12R0.248 CCCCOCCNCC(=O)CC 75d8a218093f78d329e5af052bed1a65 [0,1,0,0,0,0|2,0,1]=4 1494 B12R0.248 CCCCOCCNCC(=O)NC f898608fb7ef4ddfb6fa13e9c77dc7d8 [0,1,0,0,0,0|2,0,1]=4 1495 B12R0.248 CCCCOCCNCC(=O)OC 74a694a213d8fbe68f34631ef61343ca [0,1,0,0,0,0|1,0,1]=3 1496 B12R0.248 CCCCOCCOCC(=O)CC f8726fa251e7ad9e9e69f1f33724cf83 [0,1,0,0,0,0|2,0,1]=4 1497 B12R0.248 CCCCOCCOCC(=O)NC ac82276108a30c92d813f13018c5fe49 [0,1,0,0,0,0|2,0,1]=4 1498 B12R0.248 CCCCOCCOCC(=O)OC 89e5eb57f9e7cc4bc78d0b574208e016 [0,1,0,0,0,0|1,0,1]=3 1499 B12R0.248 CCCCOCNCCC(=O)OC 35b500e39525256661d143221b8cca4b [0,1,0,0,0,0|1,0,2]=4 1500 B12R0.248 CCCCOCOCCC(=O)OC 8b2491aaa475fceebe5f1f149aac5b84 [0,1,0,0,0,0|1,0,2]=4 1501 B12R0.248 CCCCSCCOCC(=O)CC 372f02d9258a1c8a160b99b888c2d707 [0,1,0,0,0,0|2,0,1]=4 1502 B12R0.248 CCCCSCCOCC(=O)NC ca1fa540b738ce75e5bf3aee2e912ff9 [0,1,0,0,0,0|2,0,1]=4 1503 B12R0.248 CCCCSCCOCC(=O)OC 145c4c3a5eb2ca080e078e83a0e608f4 [0,1,0,0,0,0|1,0,1]=3 1504 B12R0.248 CCCNC/C=C/C=C/C(=O)OC 98a001f1a499cef23c9381c1af620336 [0,1,0,0,0,0|0,0,2]=3 1505 B12R0.248 CCCNCC=CC=CC(=O)OC ef98746935714a0d168d26e0ea26c954 [0,1,0,0,0,0|0,0,2]=3 1506 B12R0.248 CCCNCCCCCC(=O)OC 50a153133ff67a283d48c3f51024f3bc [0,1,0,0,0,0|0,0,2]=3 1507 B12R0.248 CCCNCCCOCC(=O)OC b2aa7a5284f8591f17b473536da738ed [0,1,0,0,0,0|1,0,1]=3 1508 B12R0.248 CCCNCCCSCC(=O)OC b3335d0864fc04e62cdc98eb684525c6 [0,1,0,0,0,0|1,0,1]=3 1509 B12R0.248 CCCOC/C=C/C=C/C(=O)OC 44f1ff65ea9770b1e62020efbd7d0790 [0,1,0,0,0,0|0,0,2]=3 1510 B12R0.248 CCCOCC=CC=CC(=O)OC e597be3e321eea4edd041c99f272ad33 [0,1,0,0,0,0|0,0,2]=3 1511 B12R0.248 CCCOCCCCCC(=O)OC 852d725e6d7eda057314915a42d96742 [0,1,0,0,0,0|0,0,2]=3 1512 B12R0.248 CCCOCCCNCC(=O)CC 011b5ed9b3ea255ad0d64e184a310b69 [0,1,0,0,0,0|2,0,1]=4 1513 B12R0.248 CCCOCCCNCC(=O)NC d0bf5d40be163a4fdf55851a16ff1767 [0,1,0,0,0,0|2,0,1]=4 1514 B12R0.248 CCCOCCCNCC(=O)OC 9c1c87eb62581407822b7f3c4196991b [0,1,0,0,0,0|1,0,1]=3 1515 B12R0.248 CCCOCCCOCC(=O)CC 3d5a90d91906d494b786ce6fb0994cf6 [0,1,0,0,0,0|2,0,1]=4 1516 B12R0.248 CCCOCCCOCC(=O)NC 17d60232e22fca00a9030372005c49a4 [0,1,0,0,0,0|2,0,1]=4 1517 B12R0.248 CCCOCCCOCC(=O)OC d8c6a362f9f11e152b9e6f7b79f3b153 [0,1,0,0,0,0|1,0,1]=3 1518 B12R0.248 CCCOCCCSCC(=O)OC 352c21c3b8775780a1f5e81633558eeb [0,1,0,0,0,0|1,0,1]=3 1519 B12R0.248 CCCOCCNCCC(=O)OC 35af4a5bb785702b1c7d1831c9a23905 [0,1,0,0,0,0|1,0,2]=4 1520 B12R0.248 CCCOCCNCOC(=O)OC b4eda17b052f9b1c706967f6d17d047e [0,1,0,0,0,0|2,0,1]=4 1521 B12R0.248 CCCOCCOCCC(=O)OC a89b6adface311e78cbe8e8138bacded [0,1,0,0,0,0|1,0,2]=4 1522 B12R0.248 CCCOCCOCOC(=O)OC 6df05e2b2595ed95be680a7bcc704804 [0,1,0,0,0,0|2,0,1]=4 1523 B12R0.248 CCCSCCCCNC(=O)CC 6ef64e56d6e70e23a877afb15366a972 [0,1,0,0,0,0|2,0,1]=4 1524 B12R0.248 CCCSCCOCCC(=O)OC 85f0fccad2b77557055b9c6707ac1159 [0,1,0,0,0,0|1,0,2]=4 1525 B12R0.248 CCCSCCOCOC(=O)OC 926010db241241d47e7af1bc7db039ee [0,1,0,0,0,0|2,0,1]=4 1526 B12R0.248 CCNCCCCCCC(=O)OC 1cc47f298a3d094fe024703851966ff0 [0,1,0,0,0,0|0,0,2]=3 1527 B12R0.248 CCOCCCCCCC(=O)OC 86e68201f215ac95030704e4770cdead [0,1,0,0,0,0|0,0,2]=3 1528 B12R0.248 CCOCCCNCCC(=O)OC d9235f04256776355ebd81171f13737c [0,1,0,0,0,0|1,0,2]=4 1529 B12R0.248 CCOCCCNCOC(=O)OC b7fa64a3aa9e7807abe2fce023788106 [0,1,0,0,0,0|2,0,1]=4 1530 B12R0.248 CCOCCCOCCC(=O)OC f43e2a7eae5b1694cfc0c56370a39441 [0,1,0,0,0,0|1,0,2]=4 1531 B12R0.248 CCOCCCOCOC(=O)OC c483c8307db2c91fb847b71b1f9a2a7a [0,1,0,0,0,0|2,0,1]=4 1532 B12R0.248 CCOCCNC/C=C/C(=O)OC 4a033fa052533c7b44bb108f0b6bf03b [0,1,0,0,0,0|1,0,0]=2 1533 B12R0.248 CCOCCNC/C=C\C(=O)OC 0106de86818965c477bb3405ca09f74b [0,1,0,0,0,0|1,0,0]=2 1534 B12R0.248 CCOCCNCC#CC(=O)OC d6cef4e474e876e386e6ae623de21d76 [0,1,0,0,0,0|1,0,2]=4 1535 B12R0.248 CCOCCNCC=CC(=O)OC 5bd84a18cd55297d0c9e2753861e271d [0,1,0,0,0,0|1,0,0]=2 1536 B12R0.248 CCOCCNCCCC(=O)OC 7da5cb5b39e907bead146b139ade95a5 [0,1,0,0,0,0|1,0,2]=4 1537 B12R0.248 CCOCCOC/C=C/C(=O)OC dc7ff5320ab434467bfc2f90cae1d85c [0,1,0,0,0,0|1,0,0]=2 1538 B12R0.248 CCOCCOC/C=C\C(=O)OC 7230fd3b4c2409d9ee39ea2d79a72cd9 [0,1,0,0,0,0|1,0,0]=2 1539 B12R0.248 CCOCCOCC#CC(=O)OC 86cd18d161c548a549fd5b512a6999b0 [0,1,0,0,0,0|1,0,2]=4 1540 B12R0.248 CCOCCOCC=CC(=O)OC 42df7a208ec18b335288f17b9e32e5df [0,1,0,0,0,0|1,0,0]=2 1541 B12R0.248 CCOCCOCCCC(=O)OC 43038f2c2e555b478f6609b939240189 [0,1,0,0,0,0|1,0,2]=4 1542 B12R0.248 CCOCCOCCOC(=O)OC e58e0c4eca4cdf2b88ad67dcda0aaabd [0,1,0,0,0,0|2,0,1]=4 1543 B12R0.248 CCOCNCCCCC(=O)OC 966b91d864aaa40ea1dcafe6f13e1f05 [0,1,0,0,0,0|1,0,2]=4 1544 B12R0.248 CCOCOCCCCC(=O)OC bc297d7a2b127a12b0faa0f414b0e8ab [0,1,0,0,0,0|1,0,2]=4 1545 B12R0.248 CCOCOCCOCC(=O)OC e5a94cbce87aadf8e4a26ac7f9db3553 [0,1,0,0,0,0|2,0,1]=4 1546 B12R0.248 CCSCCCCNCC(=O)CC 4bf4db053254de358f5e68cdbc3a3d64 [0,1,0,0,0,0|2,0,1]=4 1547 B12R0.248 CCSCCCCNCC(=O)NC 1a13095f2ac38049bb97fe2a35bbad32 [0,1,0,0,0,0|2,0,1]=4 1548 B12R0.248 CCSCCCCNCC(=O)OC 2368177f1d00eaadb858c99712d5391f [0,1,0,0,0,0|1,0,1]=3 1549 B12R0.248 CCSCCCNCCC(=O)OC b5c11d6e903cc927f9a35805073bcfda [0,1,0,0,0,0|1,0,2]=4 1550 B12R0.248 CCSCCCOCCC(=O)OC 04c5e4a8ae081d870066ed55798da268 [0,1,0,0,0,0|1,0,2]=4 1551 B12R0.248 CCSCCCOCOC(=O)OC 972be63222c22904d0ce039004fbf3ff [0,1,0,0,0,0|2,0,1]=4 1552 B12R0.248 CCSCCNC/C=C/C(=O)OC 9e71e3ebaa843de551bcadc067c42030 [0,1,0,0,0,0|1,0,0]=2 1553 B12R0.248 CCSCCNC/C=C\C(=O)OC 50ff63a797c8b7fc9e08e78171edf073 [0,1,0,0,0,0|1,0,0]=2 1554 B12R0.248 CCSCCNCC#CC(=O)OC c518e633d34a947a68e1ec9d582a65b2 [0,1,0,0,0,0|1,0,2]=4 1555 B12R0.248 CCSCCNCC=CC(=O)OC 5f1d2142d4f972f219f17267f77636a0 [0,1,0,0,0,0|1,0,0]=2 1556 B12R0.248 CCSCCNCCCC(=O)OC da0a8af8abd5757102123198388ea5e0 [0,1,0,0,0,0|1,0,2]=4 1557 B12R0.248 CCSCCOC/C=C/C(=O)OC 0e7114fa88118206fd3a1eb3754252f6 [0,1,0,0,0,0|1,0,0]=2 1558 B12R0.248 CCSCCOC/C=C\C(=O)OC 11f9f27e27f833c3e7e7fb541c99da85 [0,1,0,0,0,0|1,0,0]=2 1559 B12R0.248 CCSCCOCC#CC(=O)OC 257def38dd6f2947c46f4350cdf44bee [0,1,0,0,0,0|1,0,2]=4 1560 B12R0.248 CCSCCOCC=CC(=O)OC 28f99cba716e518ddae8474be337936e [0,1,0,0,0,0|1,0,0]=2 1561 B12R0.248 CCSCCOCCCC(=O)OC a5bb7550b2a8003826b24d020334fa09 [0,1,0,0,0,0|1,0,2]=4 1562 B12R0.248 CCSCCOCCOC(=O)OC 5d76ba52c4b2c8c620fd33f026f77fd5 [0,1,0,0,0,0|2,0,1]=4 1563 B12R0.248 CNC(=O)CNCCCCCCCl 9647823af72d830d44a4c95cc7d6e8d3 [0,1,0,0,0,0|2,0,1]=4 1564 B12R0.248 CNC(=O)CNCCCCCCF f87d042d11245780a79cff7397c1ba35 [0,1,0,0,0,0|2,0,1]=4 1565 B12R0.248 CNC(=O)CNCCCCCCO 6a0b89dbce36ea2cff5e649089e9a9de [0,1,0,0,0,0|2,0,1]=4 1566 B12R0.248 CNC(=O)CNCCCCCOC 74d7497b434f9165b9dcd6e150d095c3 [0,1,0,0,0,0|2,0,1]=4 1567 B12R0.248 CNC(=O)COCCCCCCF 5ebbe7523630d0e2804d91870f448d6a [0,1,0,0,0,0|2,0,1]=4 1568 B12R0.248 CNC(=O)COCCCCCCS e053a1c6682a4d3983ad09d0ec822199 [0,1,0,0,0,0|2,0,1]=4 1569 B12R0.248 CNC(=O)COCCCCCOC a3e60a80667f2fc926f03f1c2a5cd215 [0,1,0,0,0,0|2,0,1]=4 1570 B12R0.248 COC(=O)/C=C/C=C/CNCCBr 65b9f3a93e7cf1f2c2ab5769d384911b [0,1,0,0,0,0|1,0,2]=4 1571 B12R0.248 COC(=O)/C=C/C=C/CNCCF 897aa35e9eea084763dd60b55df9f3a0 [0,1,0,0,0,0|1,0,2]=4 1572 B12R0.248 COC(=O)/C=C/C=C/CNCCI f5ea25dd5b4b7612104ed9ca822332cc [0,1,0,0,0,0|1,0,2]=4 1573 B12R0.248 COC(=O)/C=C/C=C/CNCCO 1290202726650dde61d4d4797585e096 [0,1,0,0,0,0|1,0,2]=4 1574 B12R0.248 COC(=O)/C=C/C=C/CNCCS e778cc98258cec36c3549d0d72c33bab [0,1,0,0,0,0|1,0,2]=4 1575 B12R0.248 COC(=O)/C=C/C=C/COCCF dc534c76704a81c4c1dd6af066e44000 [0,1,0,0,0,0|1,0,2]=4 1576 B12R0.248 COC(=O)/C=C/C=C/COCCS e7f9b83344b98f048b573f69a373ac43 [0,1,0,0,0,0|1,0,2]=4 1577 B12R0.248 COC(=O)/C=C/CNCC#CCO 9135d8c35246de2189a02e0643c994c6 [0,1,0,0,0,0|1,0,2]=4 1578 B12R0.248 COC(=O)/C=C/CNCCCC#N 191ad1a5aa3be4c1f97c932b939ad29e [0,1,0,0,0,0|1,0,1]=3 1579 B12R0.248 COC(=O)/C=C/CNCCCCCl a6a39415c82935aba756484f3aadd056 [0,1,0,0,0,0|1,0,0]=2 1580 B12R0.248 COC(=O)/C=C/CNCCCCO 777f346368144a6194b916c015dbe4b2 [0,1,0,0,0,0|1,0,0]=2 1581 B12R0.248 COC(=O)/C=C/CNCCCCS f19e4cf007ef2455d8351d2eaeefc2a0 [0,1,0,0,0,0|1,0,0]=2 1582 B12R0.248 COC(=O)/C=C/CNCCCSC 6841ceb32d0f2f545b6657a6a453b1f0 [0,1,0,0,0,0|1,0,0]=2 1583 B12R0.248 COC(=O)/C=C/COCCCC#N 3ccd44d34a0d051b19d67aa8d0860953 [0,1,0,0,0,0|1,0,1]=3 1584 B12R0.248 COC(=O)/C=C/COCCCC=O 8d74c87d58c42b938586f57a2f5fb84b [0,1,0,0,0,0|1,0,1]=3 1585 B12R0.248 COC(=O)/C=C/COCCCCF 6e9bf6ce0496dd58725640e8ed23271b [0,1,0,0,0,0|1,0,0]=2 1586 B12R0.248 COC(=O)/C=C/COCCCCS c846ccc48c7b3e71ce56d2b455a96711 [0,1,0,0,0,0|1,0,0]=2 1587 B12R0.248 COC(=O)/C=C/COCCCSC 44cdc9047bcbcd0d617165ed697f86aa [0,1,0,0,0,0|1,0,0]=2 1588 B12R0.248 COC(=O)/C=C/COCCNC=O 34c4be833c0245f5de869fdafe4c9462 [0,1,0,0,0,0|2,0,1]=4 1589 B12R0.248 COC(=O)/C=C/COCCOC=O c5e1f7a42a0161b4b510e76bc92b4a91 [0,1,0,0,0,0|2,0,1]=4 1590 B12R0.248 COC(=O)/C=C\CNCC#CCO edec1c720d77520e64cd3b609999b6d9 [0,1,0,0,0,0|1,0,2]=4 1591 B12R0.248 COC(=O)/C=C\CNCCCC#N 6d07f285d5085bb38fdfa762a5f6e413 [0,1,0,0,0,0|1,0,1]=3 1592 B12R0.248 COC(=O)/C=C\CNCCCCCl fcceb998abc66b43bacde95bfdedab3a [0,1,0,0,0,0|1,0,0]=2 1593 B12R0.248 COC(=O)/C=C\CNCCCCO 9c8d2a52f853f3e894eb9ecf17721b8c [0,1,0,0,0,0|1,0,0]=2 1594 B12R0.248 COC(=O)/C=C\CNCCCCS 0db810e23d02c04d5a4fb257fdf0009f [0,1,0,0,0,0|1,0,0]=2 1595 B12R0.248 COC(=O)/C=C\CNCCCSC 744bbb9a05d8ecbe632ecad869afe2e7 [0,1,0,0,0,0|1,0,0]=2 1596 B12R0.248 COC(=O)/C=C\COCCCC#N 38bc912b737e1cc832daa36a0502cb3c [0,1,0,0,0,0|1,0,1]=3 1597 B12R0.248 COC(=O)/C=C\COCCCC=O 4a3bf091144d0b030777916821d7578b [0,1,0,0,0,0|1,0,1]=3 1598 B12R0.248 COC(=O)/C=C\COCCCCF 736e6c2f75ebd0b6483cc8d23a076160 [0,1,0,0,0,0|1,0,0]=2 1599 B12R0.248 COC(=O)/C=C\COCCCCS 26ccf1a49da8a5661706d4b31a4de179 [0,1,0,0,0,0|1,0,0]=2 1600 B12R0.248 COC(=O)/C=C\COCCCSC 7fc17a2c76b2fe27a620a1e9dd5abf8f [0,1,0,0,0,0|1,0,0]=2 1601 B12R0.248 COC(=O)/C=C\COCCNC=O cc68f0741635813b9cca059f805a8b4d [0,1,0,0,0,0|2,0,1]=4 1602 B12R0.248 COC(=O)/C=C\COCCOC=O 2bcbc7d89b6e8ae943c106251066a9af [0,1,0,0,0,0|2,0,1]=4 1603 B12R0.248 COC(=O)C#CCNCCCCCl ba0b1791e7e8eafcb7d50b48c9589871 [0,1,0,0,0,0|1,0,2]=4 1604 B12R0.248 COC(=O)C#CCNCCCCO 8ebda57cb625d729532501b00b1b8f95 [0,1,0,0,0,0|1,0,2]=4 1605 B12R0.248 COC(=O)C#CCNCCCCS 8f3b9cedb6911757cf3f3f89b997ea4e [0,1,0,0,0,0|1,0,2]=4 1606 B12R0.248 COC(=O)C#CCNCCCSC 1980194bcc05d4039557b4244437ad00 [0,1,0,0,0,0|1,0,2]=4 1607 B12R0.248 COC(=O)C#CCOCCCCF 224db353e69fcb5d6787919f44df73bc [0,1,0,0,0,0|1,0,2]=4 1608 B12R0.248 COC(=O)C#CCOCCCCS e7cff5b19d3634917159fd5a2fcf48b1 [0,1,0,0,0,0|1,0,2]=4 1609 B12R0.248 COC(=O)C#CCOCCCSC 85d9905fef89a1c007140b540a56a02e [0,1,0,0,0,0|1,0,2]=4 1610 B12R0.248 COC(=O)C=CC=CCNCCBr e45d43f6c3b12b112855cee8d5d3fcfe [0,1,0,0,0,0|1,0,2]=4 1611 B12R0.248 COC(=O)C=CC=CCNCCF e015f421c137599524ff651591ffcc4c [0,1,0,0,0,0|1,0,2]=4 1612 B12R0.248 COC(=O)C=CC=CCNCCI 06d18bbb425ade116618c308a112a275 [0,1,0,0,0,0|1,0,2]=4 1613 B12R0.248 COC(=O)C=CC=CCNCCO d1eacde952e8f25403bc63f527ad041b [0,1,0,0,0,0|1,0,2]=4 1614 B12R0.248 COC(=O)C=CC=CCNCCS bb3e353cd0a35ac062fb0948d07f6cfd [0,1,0,0,0,0|1,0,2]=4 1615 B12R0.248 COC(=O)C=CC=CCOCCF a8856418fce67f78e147da9f45de08a4 [0,1,0,0,0,0|1,0,2]=4 1616 B12R0.248 COC(=O)C=CC=CCOCCS 59068e644d275ba4b04ad45eeb86f4a5 [0,1,0,0,0,0|1,0,2]=4 1617 B12R0.248 COC(=O)C=CCNCC#CCO 8bb7111233425d1366e261a094dac278 [0,1,0,0,0,0|1,0,2]=4 1618 B12R0.248 COC(=O)C=CCNCCCC#N 095cabcf5cdf7a55d51eed9d684cc141 [0,1,0,0,0,0|1,0,1]=3 1619 B12R0.248 COC(=O)C=CCNCCCCCl d6c7e9fb21c5749c40f23f4de4475ba5 [0,1,0,0,0,0|1,0,0]=2 1620 B12R0.248 COC(=O)C=CCNCCCCO fa232f8321deb792398d14efcab46545 [0,1,0,0,0,0|1,0,0]=2 1621 B12R0.248 COC(=O)C=CCNCCCCS 1516c608811b277fb104722a70b1ea59 [0,1,0,0,0,0|1,0,0]=2 1622 B12R0.248 COC(=O)C=CCNCCCSC b22793f2294bd31ca834a5697f422675 [0,1,0,0,0,0|1,0,0]=2 1623 B12R0.248 COC(=O)C=CCOCCCC#N d5fe9e22c9706cb64e90bd5a482fdb07 [0,1,0,0,0,0|1,0,1]=3 1624 B12R0.248 COC(=O)C=CCOCCCC=O d167e1b18d36678c09432676be03c484 [0,1,0,0,0,0|1,0,1]=3 1625 B12R0.248 COC(=O)C=CCOCCCCF 095410b12e81bd58335237072fbe2b87 [0,1,0,0,0,0|1,0,0]=2 1626 B12R0.248 COC(=O)C=CCOCCCCS 548e206fd195bb4e61b21d01bbaea308 [0,1,0,0,0,0|1,0,0]=2 1627 B12R0.248 COC(=O)C=CCOCCCSC 8317689c8c244cf2afebe1b3e8e4c276 [0,1,0,0,0,0|1,0,0]=2 1628 B12R0.248 COC(=O)C=CCOCCNC=O 4e8ead221b77eeac7f1e1af50434b945 [0,1,0,0,0,0|2,0,1]=4 1629 B12R0.248 COC(=O)C=CCOCCOC=O aa192fa31187359cc26ea2fa60180923 [0,1,0,0,0,0|2,0,1]=4 1630 B12R0.248 COC(=O)CCCCCCNCF 00d2a79417200a97151f178431883d3a [0,1,0,0,0,0|1,0,2]=4 1631 B12R0.248 COC(=O)CCCCCCNCO 3a6384b8beafa85876670cf2dd11e09f [0,1,0,0,0,0|1,0,2]=4 1632 B12R0.248 COC(=O)CCCCCCOCF 3c60f089e493255ba7349bb800b8ea93 [0,1,0,0,0,0|1,0,2]=4 1633 B12R0.248 COC(=O)CCCCCNCCBr eedf2cc64b954d2d1466dd96b2af1fa3 [0,1,0,0,0,0|1,0,2]=4 1634 B12R0.248 COC(=O)CCCCCNCCF e8065f118934ca3d5f63a601d3c3f41d [0,1,0,0,0,0|1,0,2]=4 1635 B12R0.248 COC(=O)CCCCCNCCI 32f2b0dda4ced89929de48404c3ee160 [0,1,0,0,0,0|1,0,2]=4 1636 B12R0.248 COC(=O)CCCCCNCCO 95607a8bf19c10d1da2194c02b8672e8 [0,1,0,0,0,0|1,0,2]=4 1637 B12R0.248 COC(=O)CCCCCNCCS 482d18f2f1eb4a29e7f89c6c45a82898 [0,1,0,0,0,0|1,0,2]=4 1638 B12R0.248 COC(=O)CCCCCNCSC 4cf48a1f15c73d7301c2eb1583c9b651 [0,1,0,0,0,0|1,0,2]=4 1639 B12R0.248 COC(=O)CCCCCOCCF 3d8c8a4b1ff9fd3224cdeada597e8997 [0,1,0,0,0,0|1,0,2]=4 1640 B12R0.248 COC(=O)CCCCCOCCS c18bfb54b9cdcd89336a3e4417d301aa [0,1,0,0,0,0|1,0,2]=4 1641 B12R0.248 COC(=O)CCCCCOCSC 8e51b9ba05c4e153c5ec26bd024ed72d [0,1,0,0,0,0|1,0,2]=4 1642 B12R0.248 COC(=O)CCCCNCCCCl eecef39fff13a3350d880ab78f34b54b [0,1,0,0,0,0|1,0,2]=4 1643 B12R0.248 COC(=O)CCCCNCCCF f3e54d05b7babf10e585cb34f1fc5f4a [0,1,0,0,0,0|1,0,2]=4 1644 B12R0.248 COC(=O)CCCCNCCCO 09bcdbbaf87da0ad6387baa404b26080 [0,1,0,0,0,0|1,0,2]=4 1645 B12R0.248 COC(=O)CCCCNCCCS 5fe215b01b14427476dfc2ae73f76151 [0,1,0,0,0,0|1,0,2]=4 1646 B12R0.248 COC(=O)CCCCNCCSC f7ca66bdc7addc4da4fb8f12551a0158 [0,1,0,0,0,0|1,0,2]=4 1647 B12R0.248 COC(=O)CCCCOCCCF bbbe3cc0c3dc93f8470810bc74196949 [0,1,0,0,0,0|1,0,2]=4 1648 B12R0.248 COC(=O)CCCCOCCCS 81ad584b317233b8031a8793c90a4cad [0,1,0,0,0,0|1,0,2]=4 1649 B12R0.248 COC(=O)CCCCOCCSC c2c3a617a451eebaa9be27d0f71bb036 [0,1,0,0,0,0|1,0,2]=4 1650 B12R0.248 COC(=O)CCCNCCCCCl b4e49dd92f6c9fb261ad4b7d5676fd3e [0,1,0,0,0,0|1,0,2]=4 1651 B12R0.248 COC(=O)CCCNCCCCF 900baabd275fc2443dc184cda218b3f6 [0,1,0,0,0,0|1,0,2]=4 1652 B12R0.248 COC(=O)CCCNCCCCO c16239952424f85aa7440b249a78aa61 [0,1,0,0,0,0|1,0,2]=4 1653 B12R0.248 COC(=O)CCCNCCCCS b7c9a1eb7f1e86669bc0c0673e17a6ba [0,1,0,0,0,0|1,0,2]=4 1654 B12R0.248 COC(=O)CCCNCCCSC aa00a290890ec941417e3b42911fa106 [0,1,0,0,0,0|1,0,2]=4 1655 B12R0.248 COC(=O)CCCOCCCCF 1482d8cba418161a2e077ca6d7bdef14 [0,1,0,0,0,0|1,0,2]=4 1656 B12R0.248 COC(=O)CCCOCCCCS 6ec1a1d31bb1dfde0174698676a3e7ea [0,1,0,0,0,0|1,0,2]=4 1657 B12R0.248 COC(=O)CCCOCCCSC 84566f51d5ea85990a2d008be9a7cfde [0,1,0,0,0,0|1,0,2]=4 1658 B12R0.248 COC(=O)CCNCCCCCCl 2d2b263209268ee0ab40654752b6919c [0,1,0,0,0,0|1,0,2]=4 1659 B12R0.248 COC(=O)CCNCCCCCF 54218cf3cdf27035401d237b8942e981 [0,1,0,0,0,0|1,0,2]=4 1660 B12R0.248 COC(=O)CCNCCCCCO ea77548d1de240df219d599031efc462 [0,1,0,0,0,0|1,0,2]=4 1661 B12R0.248 COC(=O)CCNCCCCSC 67431ef940305cfb1d0c861a2a4f528f [0,1,0,0,0,0|1,0,2]=4 1662 B12R0.248 COC(=O)CCOCCCCCF 2fab7cb8cb645f8d1406032c1830acc6 [0,1,0,0,0,0|1,0,2]=4 1663 B12R0.248 COC(=O)CCOCCCCSC b741a855b31b680f7773183e0f288ce6 [0,1,0,0,0,0|1,0,2]=4 1664 B12R0.248 COC(=O)CNCCCCCC#N 15db25763214679d735758f9a2deb78f [0,1,0,0,0,0|1,0,2]=4 1665 B12R0.248 COC(=O)CNCCCCCC=O 99d78b1bac8e329f4e356cd35c4d98ef [0,1,0,0,0,0|1,0,2]=4 1666 B12R0.248 COC(=O)CNCCCCCCCl 54b174000cb63b2463201d8f9afdfacd [0,1,0,0,0,0|1,0,1]=3 1667 B12R0.248 COC(=O)CNCCCCCCF 180b41c7f6ce638a27bfd2b4c79b9453 [0,1,0,0,0,0|1,0,1]=3 1668 B12R0.248 COC(=O)CNCCCCCCO 49b692ade1eeca8f05072a884c89d69a [0,1,0,0,0,0|1,0,1]=3 1669 B12R0.248 COC(=O)CNCCCOCCO 66ee2308e0c60d28ec0c0ea919592937 [0,1,0,0,0,0|2,0,1]=4 1670 B12R0.248 COC(=O)CNCCOCCCO db0556fcf0392e4686032c5083df9e1b [0,1,0,0,0,0|2,0,1]=4 1671 B12R0.248 COC(=O)COCCCCCC#N 067d4516f2a7e33ef93c0d683d8d40c3 [0,1,0,0,0,0|1,0,2]=4 1672 B12R0.248 COC(=O)COCCCCCC=O 0b73658532f402148e598a2da216a981 [0,1,0,0,0,0|1,0,2]=4 1673 B12R0.248 COC(=O)COCCCCCCF 066e9acd3a0b96c9aced613b927951aa [0,1,0,0,0,0|1,0,1]=3 1674 B12R0.248 COC(=O)COCCCCCCS da5f0f31cf63aad95cc2934b78a72251 [0,1,0,0,0,0|1,0,1]=3 1675 B12R0.248 COC(=O)COCCCNCCBr 74b026f11ca5bcf8027daf627244ee77 [0,1,0,0,0,0|2,0,1]=4 1676 B12R0.248 COC(=O)COCCCNCCF 79839bf8968b115b8613134db0218aff [0,1,0,0,0,0|2,0,1]=4 1677 B12R0.248 COC(=O)COCCCNCCI 59cf95a3c0a97e467b5f23b42fc2976d [0,1,0,0,0,0|2,0,1]=4 1678 B12R0.248 COC(=O)COCCCNCCO 3746d71692c389cc079905a46ea225af [0,1,0,0,0,0|2,0,1]=4 1679 B12R0.248 COC(=O)COCCCNCCS 585c8a1fb6b149366cb61f2e5baff754 [0,1,0,0,0,0|2,0,1]=4 1680 B12R0.248 COC(=O)COCCCOCCF b372354b9988d28463f3a93fc037dc9f [0,1,0,0,0,0|2,0,1]=4 1681 B12R0.248 COC(=O)COCCCOCCS 5a87d0c1c04aace988b1019caea14406 [0,1,0,0,0,0|2,0,1]=4 1682 B12R0.248 COC(=O)COCCCOCSC b24b607aa467d1d61d1215de220a7f29 [0,1,0,0,0,0|2,0,1]=4 1683 B12R0.248 COC(=O)COCCNCCCCl 27086fd7c095a512bab199b0555b7e10 [0,1,0,0,0,0|2,0,1]=4 1684 B12R0.248 COC(=O)COCCNCCCO 1696aa07caf37a24bd0d6c039bbf25ca [0,1,0,0,0,0|2,0,1]=4 1685 B12R0.248 COC(=O)COCCNCCSC 4880028d6cd4ef487a9b7158e48f58e8 [0,1,0,0,0,0|2,0,1]=4 1686 B12R0.248 COC(=O)COCCOCCCF 2bfa3653bf6ebe2beb0a21c5c7d759d0 [0,1,0,0,0,0|2,0,1]=4 1687 B12R0.248 COC(=O)COCCOCCCS d3cc8d471d9dedcff30dc9699e9d4208 [0,1,0,0,0,0|2,0,1]=4 1688 B12R0.248 COC(=O)COCCOCCSC 8af4a6ba635a81bf3d2c9dd33317ce24 [0,1,0,0,0,0|2,0,1]=4 1689 B12R0.248 COC(=O)CSCCCNCCBr 2208899ad1d6a977286601e05cddbf27 [0,1,0,0,0,0|2,0,1]=4 1690 B12R0.248 COC(=O)CSCCCNCCF 94ad12eae92bd4d0f19e97d43a5e514a [0,1,0,0,0,0|2,0,1]=4 1691 B12R0.248 COC(=O)CSCCCNCCI b8b88effd8c4a2c832a6cd3d28110384 [0,1,0,0,0,0|2,0,1]=4 1692 B12R0.248 COC(=O)CSCCCNCCO f2453ca39f68ab15d6c21ba6677529b4 [0,1,0,0,0,0|2,0,1]=4 1693 B12R0.248 COC(=O)CSCCCNCCS b80b56c928758982a57f97596325dd8a [0,1,0,0,0,0|2,0,1]=4 1694 B12R0.248 COC(=O)CSCCCOCCS 722e76e7e5d4eb036af519ea081c6792 [0,1,0,0,0,0|2,0,1]=4 1695 B12R0.248 COC(=O)OCCOCCCCF 0a8671c929694202c1b5ae117ccd7446 [0,1,0,0,0,0|2,0,1]=4 1696 B12R0.248 COC(=O)OCCOCCCSC 544fa4c9695da77d9a33de0093e517c8 [0,1,0,0,0,0|2,0,1]=4 1697 B12R0.248 COC(=O)OCNCCCCCCl 5778c5e061cb78225ed18c6db346766f [0,1,0,0,0,0|2,0,1]=4 1698 B12R0.248 COC(=O)OCNCCCCCO 0cccbfe1acba1b27a4a58f97c453d194 [0,1,0,0,0,0|2,0,1]=4 1699 B12R0.248 COC(=O)OCNCCCCSC b5dad4a904bed85f7bcfbda4e5eeec11 [0,1,0,0,0,0|2,0,1]=4 1700 B12R0.248 COC(=O)OCOCCCCSC df2e05f4370ce6d67927ec63c8290f60 [0,1,0,0,0,0|2,0,1]=4 1701 B12R0.248 COCCCCCNCC(=O)OC d10691bd31d2d0bf1e503578b1c20d28 [0,1,0,0,0,0|1,0,1]=3 1702 B12R0.248 COCCCCCOCC(=O)OC 04445405aa556fee946a295a872f3156 [0,1,0,0,0,0|1,0,1]=3 1703 B12R0.248 COCCCCNCCC(=O)OC 866fe67d24453c9c77ba339b24c6f817 [0,1,0,0,0,0|1,0,2]=4 1704 B12R0.248 COCCCCNCOC(=O)OC 65db9bce6f6f1fa0da82eec424325d77 [0,1,0,0,0,0|2,0,1]=4 1705 B12R0.248 COCCCCOCCC(=O)OC 6178a26edf97ddd6d174b7671988efc2 [0,1,0,0,0,0|1,0,2]=4 1706 B12R0.248 COCCCCOCOC(=O)OC 299a375a768c97adbdcbc78bf5ff5051 [0,1,0,0,0,0|2,0,1]=4 1707 B12R0.248 COCCCNC/C=C/C(=O)OC 380ea47687bffbbf65ce57db3ffe6873 [0,1,0,0,0,0|1,0,0]=2 1708 B12R0.248 COCCCNC/C=C\C(=O)OC 4377182aad58aaee258a9e1a1d00d4fa [0,1,0,0,0,0|1,0,0]=2 1709 B12R0.248 COCCCNCC#CC(=O)OC 0a4be7c701d1c646e45a530f90acd183 [0,1,0,0,0,0|1,0,2]=4 1710 B12R0.248 COCCCNCC=CC(=O)OC e7c81130fa520c23f225933e4ca77353 [0,1,0,0,0,0|1,0,0]=2 1711 B12R0.248 COCCCNCCCC(=O)OC 8542198eec6606ee078f036e6843754f [0,1,0,0,0,0|1,0,2]=4 1712 B12R0.248 COCCCOC/C=C/C(=O)OC 773c6738a4a15b0c69d4006e8e219d97 [0,1,0,0,0,0|1,0,0]=2 1713 B12R0.248 COCCCOC/C=C\C(=O)OC 8fb2e2b268b0409419d2676c04546ecc [0,1,0,0,0,0|1,0,0]=2 1714 B12R0.248 COCCCOCC#CC(=O)OC f485bc350dc08d3dba4bee5dcf6f89ff [0,1,0,0,0,0|1,0,2]=4 1715 B12R0.248 COCCCOCC=CC(=O)OC 43a44795d04caa16e89c00b1840b8756 [0,1,0,0,0,0|1,0,0]=2 1716 B12R0.248 COCCCOCCCC(=O)OC f2bad4807d9478dd3c2bac6ff9bf8583 [0,1,0,0,0,0|1,0,2]=4 1717 B12R0.248 COCCCOCCOC(=O)OC f486885c19e3ee0b6a0021d20b2b20d5 [0,1,0,0,0,0|2,0,1]=4 1718 B12R0.248 COCCNCCCCC(=O)OC bcc8b4b6498a23c39c6f80eb7f18507a [0,1,0,0,0,0|1,0,2]=4 1719 B12R0.248 COCCNCCOCC(=O)OC cfbd6d06e0ff3b871e587c86847150c1 [0,1,0,0,0,0|2,0,1]=4 1720 B12R0.248 COCCOCCCCC(=O)OC f3189c3c74aa0f1aaee5c15977b5fb2f [0,1,0,0,0,0|1,0,2]=4 1721 B12R0.248 COCCOCCNCC(=O)OC fa9a2dfc713b9c3afca54934449f4f59 [0,1,0,0,0,0|2,0,1]=4 1722 B12R0.248 COCCOCCOCC(=O)OC d0fe862950539297d446e2086c4a0beb [0,1,0,0,0,0|2,0,1]=4 1723 B12R0.248 COCNCCCCCC(=O)OC 8ad3a9d9c1353c228b1066481f3d2302 [0,1,0,0,0,0|1,0,2]=4 1724 B12R0.248 COCOC/C=C/C=C/C(=O)OC 5ef1196c820b5e3c1cd7412cfdfbcec7 [0,1,0,0,0,0|1,0,2]=4 1725 B12R0.248 COCOCC=CC=CC(=O)OC 5e65462e5d22a9960b18d966e4346b56 [0,1,0,0,0,0|1,0,2]=4 1726 B12R0.248 COCOCCCCCC(=O)OC 19a354151b1498e2c1fa9948463fb1f6 [0,1,0,0,0,0|1,0,2]=4 1727 B12R0.248 COCOCCCOCC(=O)OC 85a04fd2d4665f2d5152fa2fec90bfd8 [0,1,0,0,0,0|2,0,1]=4 1728 B12R0.248 COCOCCCSCC(=O)OC 220a743f90dee7c613c8afe0309f7410 [0,1,0,0,0,0|2,0,1]=4 1729 B12R0.251 C=C(C)C(=O)NCCCCCCC e6722bf9a2a91c9b8dafbc0e48f2ce95 [0,1,0,0,0,0|2,0,1]=4 1730 B12R0.251 CCCCCCCNC(=O)C(=O)C 2fc684b914636e7abc7cad1f2627b1b9 [0,1,0,0,0,0|2,0,1]=4 1731 B12R0.251 CCCCCCCNC(=O)C(C)F 57a519b04a5e09b346474d9901a0a13a [0,1,0,0,0,0|2,0,1]=4 1732 B12R0.251 CCCCCCCNC(=O)C(C)O d1e7cf65f0c85036bb4ceff5266af976 [0,1,0,0,0,0|2,0,1]=4 1733 B12R0.251 CCCCCCCNC(=O)C(C)S 21ef221c9222809f89cabe342c7f61ec [0,1,0,0,0,0|2,0,1]=4 1734 B12R0.251 CCCCCCCNC(=O)[C@@H](C)F fe184b2df527f454614f88b19faae6e9 [0,1,0,0,0,0|2,0,1]=4 1735 B12R0.251 CCCCCCCNC(=O)[C@@H](C)O 1726a45d18305ca5241e027bbc53a146 [0,1,0,0,0,0|2,0,1]=4 1736 B12R0.251 CCCCCCCNC(=O)[C@H](C)F 9032b192eba6fe0c7a2ff79ce7a378e0 [0,1,0,0,0,0|2,0,1]=4 1737 B12R0.251 CCCCCCCNC(=O)[C@H](C)O 5f75904c211c95844ff40e06201a21df [0,1,0,0,0,0|2,0,1]=4 1738 B12R0.251 CCCCCCNCC(=O)C(=O)C 4a1ce11368fb9be2829343b5e0273ade [0,1,0,0,0,0|2,0,1]=4 1739 B12R0.251 CCCCCCNCC(=O)C(C)C 9520cdb569f32e1eff04ef5e1cbcad32 [0,1,0,0,0,0|2,0,1]=4 1740 B12R0.251 CCCCCCNCC(=O)N(C)C 798175d0bb98fb23bde4ca34afaaa46f [0,1,0,0,0,0|2,0,1]=4 1741 B12R0.251 CCCCCCOCC(=O)C(=O)C e5d1741b57ed7606a27ceb2b1c0f6bfd [0,1,0,0,0,0|2,0,1]=4 1742 B12R0.251 CCCCCCOCC(=O)C(C)C 97073a309b33a8ba572416aeaf543c56 [0,1,0,0,0,0|2,0,1]=4 1743 B12R0.251 CCCCCCOCC(=O)N(C)C d7c606f5cee1e5d56f70b96909a5e166 [0,1,0,0,0,0|2,0,1]=4 1744 B12R0.251 CCCCNC/C=C/C(=O)N(C)C 52c600124bf647dd119b12985ad1b353 [0,1,0,0,0,0|2,0,0]=3 1745 B12R0.251 CCCCOC/C=C/C(=O)N(C)C 06870b1595ec4eaf62567c3b1b7aa4a0 [0,1,0,0,0,0|2,0,0]=3 1746 B12R0.251 CN(C)C(=O)/C=C/CNCCCCl 764af651b9b9637068c3e4111b3ef433 [0,1,0,0,0,0|3,0,0]=4 1747 B12R0.251 CN(C)C(=O)/C=C/CNCCCO f0678a570e492c1f2bdaa5e15d2db652 [0,1,0,0,0,0|3,0,0]=4 1748 B12R0.251 CN(C)C(=O)/C=C/COCCCF 7b96a1e9cee48e680c404dfa21cfbca0 [0,1,0,0,0,0|3,0,0]=4 1749 B12R0.251 CN(C)C(=O)/C=C/COCCCS 6e8cd707d769963691a3a78220e268d9 [0,1,0,0,0,0|3,0,0]=4 1750 B12R0.251 COCCNC/C=C/C(=O)N(C)C 5e2006d01786633bf6c68a0d39f95d0d [0,1,0,0,0,0|3,0,0]=4 1751 B12R0.251 COCCOC/C=C/C(=O)N(C)C 973efc6ee3f00e7d68cd5295b5fa6e38 [0,1,0,0,0,0|3,0,0]=4 1752 B12R0.251 CSCCNC/C=C/C(=O)N(C)C 0f4d6d67d79e456267d42ff86691430c [0,1,0,0,0,0|3,0,0]=4 1753 B12R0.251 CSCCOC/C=C/C(=O)N(C)C 584b8e7fd61f541aa3bc6f660ada836d [0,1,0,0,0,0|3,0,0]=4 1754 B12R0.276 C/C=C/C(C)OC/C=C/C(=O)OC 86b44a5796a680b6c53f9e02962d7b51 [0,1,0,0,0,0|1,0,2]=4 1755 B12R0.276 C/C=C/C(C)OC/C=C\C(=O)OC 27856ffc59128f1b36c10487af7cfa5f [0,1,0,0,0,0|1,0,2]=4 1756 B12R0.276 C/C=C/C(C)OCC=CC(=O)OC 114f89751c0f790f3777500fb4040eb9 [0,1,0,0,0,0|1,0,2]=4 1757 B12R0.276 C=C(COCCC(C)CCC)OC 9e9a4546b122e9906b7dbf89f38b5021 [0,1,0,0,0,0|2,0,1]=4 1758 B12R0.276 C=C(COCCC(S)CCC)OC 3ec1b4c042e88003d1a7f993afb9c26e [0,1,0,0,0,0|2,0,1]=4 1759 B12R0.276 C=CCC(C)OC/C=C/C(=O)OC 9a7f2c6a86e2f5cfa407b5e9cd89924f [0,1,0,0,0,0|1,0,2]=4 1760 B12R0.276 C=CCC(C)OC/C=C\C(=O)OC 61a1de821bf04fda54176585e9e5b9d9 [0,1,0,0,0,0|1,0,2]=4 1761 B12R0.276 C=CCC(C)OCC=CC(=O)OC 1de0b8d276cea17f8ee6d6f92f348848 [0,1,0,0,0,0|1,0,2]=4 1762 B12R0.276 C=CC[C@@H](C)OC/C=C/C(=O)OC 7908ac5fb31dbc1e31a53d9cd9ab523d [0,1,0,0,0,0|1,0,2]=4 1763 B12R0.276 C=CC[C@@H](C)OC/C=C\C(=O)OC 04f96e4fe0b498ca760c7e5e32624151 [0,1,0,0,0,0|1,0,2]=4 1764 B12R0.276 C=CC[C@@H](C)OCC=CC(=O)OC 762a6111c86e59695ad189e9421a6adc [0,1,0,0,0,0|1,0,2]=4 1765 B12R0.276 C=CC[C@H](C)OC/C=C/C(=O)OC c6cb62bb433bbdc3f5375f9e6ef12c9e [0,1,0,0,0,0|1,0,2]=4 1766 B12R0.276 C=CC[C@H](C)OC/C=C\C(=O)OC abf046ac7b030959b07b4c2e34e3d225 [0,1,0,0,0,0|1,0,2]=4 1767 B12R0.276 C=CC[C@H](C)OCC=CC(=O)OC 634cb3eaffcc6a17d7696def0a4b7be4 [0,1,0,0,0,0|1,0,2]=4 1768 B12R0.276 CC#CC(C)OC/C=C/C(=O)OC 08afc5555463c3966929c428a43b864b [0,1,0,0,0,0|1,0,2]=4 1769 B12R0.276 CC#CC(C)OC/C=C\C(=O)OC 4caa244a3245d3e4865a076e563e2126 [0,1,0,0,0,0|1,0,2]=4 1770 B12R0.276 CC#CC(C)OCC=CC(=O)OC cf8e182e150facada5d04e94063cc9ee [0,1,0,0,0,0|1,0,2]=4 1771 B12R0.276 CC=CC(C)OC/C=C/C(=O)OC 0ab0bf0125a540e2510004d7b339ce27 [0,1,0,0,0,0|1,0,2]=4 1772 B12R0.276 CC=CC(C)OC/C=C\C(=O)OC 5e397098aa072035a634cfefac8ed386 [0,1,0,0,0,0|1,0,2]=4 1773 B12R0.276 CC=CC(C)OCC=CC(=O)OC df0782d4ea242ec7e7941bd9e84b5c2d [0,1,0,0,0,0|1,0,2]=4 1774 B12R0.276 CCCC(=S)OC/C=C/C(=O)OC 46b166edc7aa32fd72c76c6c98d6720e [0,1,0,0,0,0|1,0,1]=3 1775 B12R0.276 CCCC(=S)OC/C=C\C(=O)OC 5666c4a7af5785a34aa4cc0d3ac3aa43 [0,1,0,0,0,0|1,0,1]=3 1776 B12R0.276 CCCC(=S)OCC=CC(=O)OC 9a3089eaf861cc8128a8140a7f4addc5 [0,1,0,0,0,0|1,0,1]=3 1777 B12R0.276 CCCC(C)CCOCC(=O)CC 3a39cd3b5c341b53a0830bd18ef9975f [0,1,0,0,0,0|2,0,1]=4 1778 B12R0.276 CCCC(C)CCOCC(=O)NC 6b93834b97baba22b6125b0aafc4e7c7 [0,1,0,0,0,0|2,0,1]=4 1779 B12R0.276 CCCC(C)CCOCC(=O)OC 3fa6e1c0690926391a688258701cb762 [0,1,0,0,0,0|1,0,1]=3 1780 B12R0.276 CCCC(C)CNCCC(=O)OC 5f24d1d7bcc3289cf765de13760cf6ab [0,1,0,0,0,0|1,0,2]=4 1781 B12R0.276 CCCC(C)COCCC(=O)OC 969c10174f1eb4784f7f1324cc6391a8 [0,1,0,0,0,0|1,0,2]=4 1782 B12R0.276 CCCC(C)COCOC(=O)OC 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COC[C@@H](C)NC/C=C/C(=O)OC 7e29d67ef2565e9ae9d9a1721e0b4fed [0,1,0,0,0,0|2,0,0]=3 1847 B12R0.276 COC[C@@H](C)NC/C=C\C(=O)OC 3a7095cb57c8200d9327a7c16f34c10e [0,1,0,0,0,0|2,0,0]=3 1848 B12R0.276 COC[C@@H](C)NCC=CC(=O)OC c5226732524521a7a9361ccce70ccd38 [0,1,0,0,0,0|2,0,0]=3 1849 B12R0.276 COC[C@@H](C)OC/C=C/C(=O)OC 3c293a377f0f856ec3f476dba2844e4d [0,1,0,0,0,0|2,0,0]=3 1850 B12R0.276 COC[C@@H](C)OC/C=C\C(=O)OC 4b4248a611edee917515c57e5033aba8 [0,1,0,0,0,0|2,0,0]=3 1851 B12R0.276 COC[C@@H](C)OCC=CC(=O)OC 715bca50f8ea3746696f2691137e7406 [0,1,0,0,0,0|2,0,0]=3 1852 B12R0.276 COC[C@H](C)NC/C=C/C(=O)OC a29ea7b18cc2c9ca2b6a89035a493d79 [0,1,0,0,0,0|2,0,0]=3 1853 B12R0.276 COC[C@H](C)NC/C=C\C(=O)OC eae834b449797d28359085c25e7041ca [0,1,0,0,0,0|2,0,0]=3 1854 B12R0.276 COC[C@H](C)NCC=CC(=O)OC 106fd71954b4a9c297b0610e3d86f7f3 [0,1,0,0,0,0|2,0,0]=3 1855 B12R0.276 COC[C@H](C)OC/C=C/C(=O)OC 307509f373f12eba416d10750ccab125 [0,1,0,0,0,0|2,0,0]=3 1856 B12R0.276 COC[C@H](C)OC/C=C\C(=O)OC 594d6286886374dd2cec6befe8204031 [0,1,0,0,0,0|2,0,0]=3 1857 B12R0.276 COC[C@H](C)OCC=CC(=O)OC 40abc94f07ac10d16c38332f87fbeb33 [0,1,0,0,0,0|2,0,0]=3 1858 B12R1.1 CCCCOC1C=CC(=O)CO1 132d4b716978c554094659f0597a4cd9 [0,0,0,1,0,0|3,0,0]=4 1859 B12R1.1 CCCCOC1CCC(=O)OC1 2bcc9a659200bfad2ada20ece3c82254 [0,0,0,1,0,0|1,0,2]=4 1860 B12R1.7 C#CCCNCC1=CC(=O)OC1 c1542901dfe84ad14e162de11a8c9c63 [0,0,0,1,0,0|1,0,2]=4 1861 B12R1.7 C#CCCOCC1=CC(=O)OC1 8da17bb2770f8d6c983fbacd5b36b6f6 [0,0,0,1,0,0|1,0,2]=4 1862 B12R1.7 C/C=C/COCC1=CC(=O)OC1 7a185800e0fe9a96b662452564015145 [0,0,0,1,0,0|1,0,2]=4 1863 B12R1.7 C/C=C\COCC1=CC(=O)OC1 02df55a2763b90bddd738c5263e3fb7b [0,0,0,1,0,0|1,0,2]=4 1864 B12R1.7 C=CCCCOC1=CC(=O)OC1 891353dfa2af4b1ecca606a2d1916b0b [0,0,0,1,0,0|1,0,2]=4 1865 B12R1.7 C=CCCNCC1=CC(=O)OC1 6e5ac5383ae946abef4e26c616d40158 [0,0,0,1,0,0|1,0,2]=4 1866 B12R1.7 C=CCCOCC1=CC(=O)OC1 d200ebf54a4d3cd990b45b10cc54cbb1 [0,0,0,1,0,0|1,0,2]=4 1867 B12R1.7 CC#CCNCC1=CC(=O)OC1 301cf4039e6dd810b5f310c4454bc6aa [0,0,0,1,0,0|1,0,2]=4 1868 B12R1.7 CC/C=C/COC1=CC(=O)OC1 a00051713d92a6a85bed9f90726f957f [0,0,0,1,0,0|1,0,2]=4 1869 B12R1.7 CC=CCNCC1=CC(=O)OC1 7165a795844b2c8b6117f478289d649f [0,0,0,1,0,0|1,0,2]=4 1870 B12R1.7 CC=CCOCC1=CC(=O)OC1 8cb28f9937d3afd1d619f69a77ce597c [0,0,0,1,0,0|1,0,2]=4 1871 B12R1.7 CCCCCCN1CNC(=O)C1 541a01a8e49a04f89e4020d92f061884 [0,0,0,1,0,0|2,0,1]=4 1872 B12R1.7 CCCCCNc1cc(=O)[nH]o1 1713f8034c945e27296a1903020c06cb [0,0,0,1,0,0|3,0,0]=4 1873 B12R1.7 CCCCCNc1cc(on1)C 12ab17964ea0f67ed618ae389c8d5d78 [0,0,0,1,0,0|3,0,0]=4 1874 B12R1.7 CCCCCNc1noc(=O)[nH]1 d56f90eb6adc60d70a050b27e4eff62c [0,0,0,1,0,0|3,0,0]=4 1875 B12R1.7 CCCCCOC1=CC(=O)CC1 2984e20894b01b349c191501961a2c92 [0,0,0,1,0,0|2,0,0]=3 1876 B12R1.7 CCCCCOC1=CC(=O)NC1 815c904dca3e0f0f71fa25e90d145300 [0,0,0,1,0,0|2,0,0]=3 1877 B12R1.7 CCCCCOC1=CC(=O)OC1 5e81427e32a646867418a4763d348784 [0,0,0,1,0,0|1,0,0]=2 1878 B12R1.7 CCCCCOC1=COC(=O)C1 1d6401510ccb97ca44c43b910e2e9b98 [0,0,0,1,0,0|1,0,2]=4 1879 B12R1.7 CCCCCOC1COC(=O)C1 418ea627e4ea48a93b6eee1811a01b00 [0,0,0,1,0,0|1,0,2]=4 1880 B12R1.7 CCCCCO[C@@H]1COC(=O)C1 fdbfda67f659e709976656835e7c930b [0,0,0,1,0,0|1,0,2]=4 1881 B12R1.7 CCCCCO[C@H]1COC(=O)C1 1cf5f8f25c3f0853024d7dd13bfc4c3c [0,0,0,1,0,0|1,0,2]=4 1882 B12R1.7 CCCCNCC1=CC(=O)OC1 b583e4c3c72b28981149e8999d337d85 [0,0,0,1,0,0|1,0,0]=2 1883 B12R1.7 CCCCNCc1cc(=O)[nH]o1 f0764dd705082a5cb3797057a7fbb4b0 [0,0,0,1,0,0|3,0,0]=4 1884 B12R1.7 CCCCNCc1cc(on1)C bba511c40ab5fd0e40b853f5974e0736 [0,0,0,1,0,0|3,0,0]=4 1885 B12R1.7 CCCCNCc1coc(=O)o1 16b58ba33f1a516a6331889f6643fbcb [0,0,0,1,0,0|2,0,1]=4 1886 B12R1.7 CCCCOCC1=CC(=O)OC1 12db081900046f7742c01970c96c71e9 [0,0,0,1,0,0|1,0,0]=2 1887 B12R1.7 CCCCOCC1COC(=O)C1 e8b9fbace0fdc615e8b94cb0728c24c6 [0,0,0,1,0,0|1,0,2]=4 1888 B12R1.7 CCCCOCc1cc(on1)C 6f5089d3393acc55f14ed11ca633d405 [0,0,0,1,0,0|3,0,0]=4 1889 B12R1.7 CCCCOCc1coc(=O)o1 97db6795bb2f18cc4ca3661025bee14e [0,0,0,1,0,0|2,0,1]=4 1890 B12R1.7 CCCCOCc1coc(c1)Br ffaaa3349bfa396cc5aeabf6cfd1fe51 [0,0,0,1,0,0|2,0,1]=4 1891 B12R1.7 CCOCCOC1=CC(=O)CC1 355474c1b1e38998accec0670b44e12a [0,0,0,1,0,0|3,0,0]=4 1892 B12R1.7 CCOCCOC1=CC(=O)NC1 52ac63c5016471179c2eedbf79a75937 [0,0,0,1,0,0|3,0,0]=4 1893 B12R1.7 CCOCCOC1=CC(=O)OC1 b36e3a09570c2c09d3c4eb929b5a9e92 [0,0,0,1,0,0|2,0,0]=3 1894 B12R1.7 CCSCCOC1=CC(=O)NC1 a0de6b4276c028e5a4de22a14cf8d120 [0,0,0,1,0,0|3,0,0]=4 1895 B12R1.7 COCCCOC1=CC(=O)CC1 66b408292daa3a68294fd1953d9f88e8 [0,0,0,1,0,0|3,0,0]=4 1896 B12R1.7 COCCCOC1=CC(=O)NC1 cd16e9db8f3493b7c773cdb37e4ab99b [0,0,0,1,0,0|3,0,0]=4 1897 B12R1.7 COCCCOC1=CC(=O)OC1 5ed4834999c519f7237e7da7d1fca034 [0,0,0,1,0,0|2,0,0]=3 1898 B12R1.7 COCCNCC1=CC(=O)OC1 1b8d33078064cad2b5c91a828285c8ca [0,0,0,1,0,0|2,0,0]=3 1899 B12R1.7 COCCOCC1=CC(=O)OC1 62fe808d950bc229b98d1228b7fab41b [0,0,0,1,0,0|2,0,0]=3 1900 B12R1.7 CSCCCOC1=CC(=O)CC1 7302d0b6d50ee4dfb3c21838a6c7df0a [0,0,0,1,0,0|3,0,0]=4 1901 B12R1.7 CSCCCOC1=CC(=O)NC1 f5d59628b7257803eeeb3e9fee2b9d64 [0,0,0,1,0,0|3,0,0]=4 1902 B12R1.7 CSCCNCC1=CC(=O)OC1 bfbefe146a2d56a116c538cb8f831d76 [0,0,0,1,0,0|2,0,0]=3 1903 B12R1.7 CSCCOCC1=CC(=O)OC1 edc559de9e9df20e124c9fb4db364e0a [0,0,0,1,0,0|2,0,0]=3 1904 B12R1.7 N#CCCNCC1=CC(=O)OC1 e5c8a1e987aa9a4c97f570d0afd57cfa [0,0,0,1,0,0|2,0,1]=4 1905 B12R1.7 N#CCCOCC1=CC(=O)OC1 9e4024cdfe7bbe3879274d794f84e8fb [0,0,0,1,0,0|2,0,1]=4 1906 B12R1.7 NOCCNCC1=CC(=O)OC1 d5393966182d1bf88c8c66e31387ca3d [0,0,0,1,0,0|3,0,0]=4 1907 B12R1.7 O=C1C=C(CC1)OCCCCF 1d02eea8f383ca2bad3445c4e9e82ec0 [0,0,0,1,0,0|3,0,0]=4 1908 B12R1.7 O=C1C=C(CN1)OCCCCF 29e0e9ae66dcede35253010c61629797 [0,0,0,1,0,0|3,0,0]=4 1909 B12R1.7 O=C1C=C(CO1)CNCCCCl fd47943d00910c13ade68356cd08de3b [0,0,0,1,0,0|2,0,0]=3 1910 B12R1.7 O=C1C=C(CO1)CNCCCO 154bc398b984c19f45b720d2427f2382 [0,0,0,1,0,0|2,0,0]=3 1911 B12R1.7 O=C1C=C(CO1)COCCCF e281cd55de75eb2a61b210f3287eea12 [0,0,0,1,0,0|2,0,0]=3 1912 B12R1.7 O=C1C=C(CO1)COCCCS befef566c260bcd98c2ad0a003b6489e [0,0,0,1,0,0|2,0,0]=3 1913 B12R1.7 O=CCCCOC1=CC(=O)OC1 2239c9ca127f159944e9953a1b2ecbef [0,0,0,1,0,0|2,0,1]=4 1914 B12R1.7 O=CCCOCC1=CC(=O)OC1 b35b788fb39d53f2d95fc8b42f5f6068 [0,0,0,1,0,0|2,0,1]=4 1915 B12R1.27 C=C(COC1CCCCC1)OC 5b94496ea4c1c2cabdd1d2d0480661d2 [0,0,0,1,0,0|2,0,1]=4 1916 B12R1.27 CCC(=O)COC1CCCCC1 b08dae3654feebf4586bf4d8e9316d63 [0,0,0,1,0,0|2,0,1]=4 1917 B12R1.27 CCC(=O)NCC1CCCCC1 35e0fbdc611a9ce372d9ee9dc56fc820 [0,0,0,1,0,0|2,0,1]=4 1918 B12R1.27 CNC(=O)CNC1CCCCC1 380278a759fc11fc69c0b511fcbd84f7 [0,0,0,1,0,0|2,0,1]=4 1919 B12R1.27 CNC(=O)COC1CCCCC1 7dcbfcf91dc74c1477f6c4fccdba59b9 [0,0,0,1,0,0|2,0,1]=4 1920 B12R1.27 COC(=O)CNC1CCCCC1 4b70bca722d01b1da9df11b4ddcc9d3e [0,0,0,1,0,0|1,0,1]=3 1921 B12R1.27 COC(=O)CNC1CCCOC1 7747717f03d47b34aad74eb6f070aca0 [0,0,0,1,0,0|2,0,1]=4 1922 B12R1.27 COC(=O)CNC1CCOCC1 18be4fb20ccfc893f06901a21ea84661 [0,0,0,1,0,0|2,0,1]=4 1923 B12R1.27 COC(=O)CNC1CCSCC1 40bf7f98b89dd2d7671ab7558b70d683 [0,0,0,1,0,0|2,0,1]=4 1924 B12R1.27 COC(=O)CN[C@@H]1CCCOC1 f76ce2969a24a9ec2c2b3bf3b944d400 [0,0,0,1,0,0|2,0,1]=4 1925 B12R1.27 COC(=O)CN[C@H]1CCCOC1 ed6ea967e94c1cb63d5c4647b86d06d5 [0,0,0,1,0,0|2,0,1]=4 1926 B12R1.27 COC(=O)COC1CCCCC1 4bc78e624842236f620d5589ae24dfd7 [0,0,0,1,0,0|1,0,1]=3 1927 B12R1.27 COC(=O)COC1CCCCO1 dcb8fcbe121eabf4fab691572eae8e5e [0,0,0,1,0,0|2,0,1]=4 1928 B12R1.27 COC(=O)COC1CCCOC1 a3ca0e49ee1ca962719e623df7604c67 [0,0,0,1,0,0|2,0,1]=4 1929 B12R1.27 COC(=O)COC1CCCSC1 b009cb5de29212835b49a53b850dc769 [0,0,0,1,0,0|2,0,1]=4 1930 B12R1.27 COC(=O)COC1CCOCC1 8cba5ca03f118c7a7336a1f03839fa43 [0,0,0,1,0,0|2,0,1]=4 1931 B12R1.27 COC(=O)COC1CCSCC1 6ec467cfe4b8781c1bbe1be5592d4a43 [0,0,0,1,0,0|2,0,1]=4 1932 B12R1.27 COC(=O)CO[C@@H]1CCCOC1 3a29aa3ae815c37b90b42570ab26ae8f [0,0,0,1,0,0|2,0,1]=4 1933 B12R1.27 COC(=O)CO[C@H]1CCCOC1 2e3fbbdc152b5fcd91e26d4238f4937f [0,0,0,1,0,0|2,0,1]=4 1934 B12R1.77 CCC(=O)N1CCCCC1CC 8e233281dc557a2cc869d1b27acfd9a7 [0,0,0,1,0,0|2,0,1]=4 1935 B12R1.77 CCC(=O)N1CCCC[C@@H]1CC 259d6a2b81532ec73a88626b3dd0ab3a [0,0,0,1,0,0|2,0,1]=4 1936 B12R1.77 CCC(=O)N1CCCC[C@H]1CC 8422360ee3c5d6a0cc7b885acbd365e3 [0,0,0,1,0,0|2,0,1]=4 1937 B12R1.77 CCN1CCCCC1C(=O)OC 0542e68197df75d1e107e75a5466c997 [0,0,0,1,0,0|1,0,2]=4 1938 B12R1.77 CCN1CCCC[C@@H]1C(=O)OC 3af1388060cfd04a6ddc2c85696ae8c7 [0,0,0,1,0,0|1,0,2]=4 1939 B12R1.77 CCN1CCCC[C@H]1C(=O)OC e8ee2ce70ed95d27ef1662d4ea9138d5 [0,0,0,1,0,0|1,0,2]=4 1940 B12R1.82 C=C(CN1CCCC1CC)OC 787c1ab2ec7684db8ffe3392f3174492 [0,0,0,1,0,0|2,0,1]=4 1941 B12R1.82 C=C(CN1CCC[C@H]1CC)OC e9454263ad5647be32ec5ebc4252623d [0,0,0,1,0,0|2,0,1]=4 1942 B12R1.82 CCC(=O)CN1CCCC1CC bc5f41dacf6d2a7c73db1836d4689ecd [0,0,0,1,0,0|2,0,1]=4 1943 B12R1.82 CCC(=O)CN1CCC[C@H]1CC 9dd22e7a9e17bccf5ff94204d66a6a8a [0,0,0,1,0,0|2,0,1]=4 1944 B12R1.82 CCC(=O)N[C@@H]1CCC[C@H]1CC 70c8edb51eea07e360ddc6491b588371 [0,0,0,1,0,0|2,0,1]=4 1945 B12R1.82 CCC1CCCN1CC(=O)NC 3d65b264e0e49452174865530e9e0918 [0,0,0,1,0,0|2,0,1]=4 1946 B12R1.82 CCC1CCCN1CC(=O)OC 46005500e8fbdc1f770a3d5be08baa76 [0,0,0,1,0,0|1,0,1]=3 1947 B12R1.82 CC[C@@H]1CCCN1CC(=O)NC 9c17b5ed2ccaccc42572554345ca1e0b [0,0,0,1,0,0|2,0,1]=4 1948 B12R1.82 CC[C@@H]1CCCN1CC(=O)OC 83c6d1e9a3928dacb360299b30385d93 [0,0,0,1,0,0|1,0,1]=3 1949 B12R1.82 COC(=O)CN1CCCC1CO a062015439c39465d6a1406eac91f18c [0,0,0,1,0,0|2,0,1]=4 1950 B12R1.82 COC(=O)CN1CCCC1OC 3b067b6681f308fd458f6fc992c57b42 [0,0,0,1,0,0|2,0,1]=4 1951 B12R1.82 COC(=O)CN1CCC[C@@H]1CF a70f38486125e13c807fbbd707fd3d83 [0,0,0,1,0,0|2,0,1]=4 1952 B12R1.82 COC(=O)CN1CCC[C@@H]1CO ad61356d7c1ea60107d6d6935060164a [0,0,0,1,0,0|2,0,1]=4 1953 B12R1.82 COC(=O)CN1CCC[C@H]1CF 048733d3fbaa507c2bd462b05ab3e1c7 [0,0,0,1,0,0|2,0,1]=4 1954 B12R1.82 COC(=O)CN1CCC[C@H]1CO ea2b49927a31ac181848b7b405560f16 [0,0,0,1,0,0|2,0,1]=4 1955 B12R1.157 COC[C@@H]1C[C@@H]1NCC(=O)OC b0543de1c70573b8f46a4dcc4096132b [0,0,0,1,0,0|2,0,1]=4 1956 B12R1.157 COC[C@H]1C[C@@H]1NCC(=O)OC cd31a5bc2f9ae56caf60f7dfa0e36c2b [0,0,0,1,0,0|2,0,1]=4 1957 B12R1.163 COC(=O)CN1CCC1CCO 2fedeb6d3e89d46ca4d985fc527dce4b [0,0,0,1,0,0|2,0,1]=4 1958 B12R1.163 COCC1CCN1CC(=O)OC 1a8cd7f65777c1c43402b08b41cd4ce3 [0,0,0,1,0,0|2,0,1]=4 1959 B12R1.163 COC[C@@H]1CCN1CC(=O)OC 1c9374f891fa7dd3defd24d66cd5c5c1 [0,0,0,1,0,0|2,0,1]=4 1960 B12R1.163 COC[C@H]1CCN1CC(=O)OC c2be031faf99f85284a67f29c1058c1d [0,0,0,1,0,0|2,0,1]=4 1961 B12R1.291 CCCN1CCCC1C(=O)OC cf9b9ada7d3b6f3d8ed238e1ddf6a275 [0,0,0,1,0,0|1,0,2]=4 1962 B12R1.291 CCCN1CCC[C@H]1C(=O)OC c24415b97be2e79126f611ece7a1fb68 [0,0,0,1,0,0|1,0,2]=4 1963 B12R1.291 CCOC1CCCC1C(=O)OC 764d1e8c9be6cabc4c6441caf0bfa67e [0,0,0,1,0,0|1,0,2]=4 1964 B12R1.291 CCO[C@@H]1CCC[C@@H]1C(=O)OC 965f2a3d3b9a0dca1bc13bd6012de9ed [0,0,0,1,0,0|1,0,2]=4 1965 B12R1.291 CCO[C@H]1CCC[C@H]1C(=O)OC 9f5c126daca174afbb24b44113e25f6a [0,0,0,1,0,0|1,0,2]=4 1966 B12R1.327 CCCCN1CC[C@@H]1C(=O)OC 11e770304e2f4b8a38b9784ca4df778f [0,0,0,1,0,0|1,0,2]=4 1967 B12R1.327 CCOCC1CCC1C(=O)OC 451914b280a13836d6c068c275520916 [0,0,0,1,0,0|1,0,2]=4 1968 B12R1.353 C=C(COC1CCCC1C)OC 30217eb052fc416fe679af56a27c3cbd [0,0,0,1,0,0|2,0,1]=4 1969 B12R1.353 C=C(CO[C@@H]1CCC[C@@H]1C)OC 1f4c346555a66281d6c2c33810c6682f [0,0,0,1,0,0|2,0,1]=4 1970 B12R1.353 C=C(CO[C@@H]1CCC[C@H]1C)OC 39e035c458b0a094e29cb9d5f888f03b [0,0,0,1,0,0|2,0,1]=4 1971 B12R1.353 C=C(CO[C@H]1CCC[C@@H]1C)OC f6872d2815186fcfc71c2b0aada0bbed [0,0,0,1,0,0|2,0,1]=4 1972 B12R1.353 C=C(CO[C@H]1CCC[C@H]1C)OC fe89c660f7d583567f9f6c5d121696e6 [0,0,0,1,0,0|2,0,1]=4 1973 B12R1.353 CCC(=O)COC1CCCC1C 86ab1d0a96237a58d9951a7df77f1d96 [0,0,0,1,0,0|2,0,1]=4 1974 B12R1.353 CCC(=O)CO[C@@H]1CCC[C@@H]1C 0b478ff0a3e5f4f2333350271987a78f [0,0,0,1,0,0|2,0,1]=4 1975 B12R1.353 CCC(=O)CO[C@@H]1CCC[C@H]1C 900a89e389d5dc2474c4c9a1e816c40c [0,0,0,1,0,0|2,0,1]=4 1976 B12R1.353 CCC(=O)CO[C@H]1CCC[C@@H]1C ed4203b528da59cb5c5af891f6a2d6e7 [0,0,0,1,0,0|2,0,1]=4 1977 B12R1.353 CCC(=O)CO[C@H]1CCC[C@H]1C 10ee2c8d249454ec529953b400846820 [0,0,0,1,0,0|2,0,1]=4 1978 B12R1.353 CNC(=O)COC1CCCC1C 8ec5b765f9b26e3094b17139900621a1 [0,0,0,1,0,0|2,0,1]=4 1979 B12R1.353 CNC(=O)CO[C@@H]1CCC[C@@H]1C a22989ee1c61aafe8a64dcc1b0c06ddf [0,0,0,1,0,0|2,0,1]=4 1980 B12R1.353 CNC(=O)CO[C@@H]1CCC[C@H]1C 04049cebf2c5e6f456a01840dc23df5c [0,0,0,1,0,0|2,0,1]=4 1981 B12R1.353 CNC(=O)CO[C@H]1CCC[C@@H]1C cf2cacbc3db630d0be3dd3bf22764bbd [0,0,0,1,0,0|2,0,1]=4 1982 B12R1.353 CNC(=O)CO[C@H]1CCC[C@H]1C a1b7249f7e0b13ccc294da5bd9ec9ce4 [0,0,0,1,0,0|2,0,1]=4 1983 B12R1.353 COC(=O)CCN1CCCC1C 78da13008a363db22aa88c06f82b718e [0,0,0,1,0,0|1,0,2]=4 1984 B12R1.353 COC(=O)CCN1CCC[C@@H]1C 75b4a0610d27eda8c9bb7b0e1233084b [0,0,0,1,0,0|1,0,2]=4 1985 B12R1.353 COC(=O)CCN1CCC[C@H]1C 24a7bc4d7eddf95bbfae2d2dadf234c7 [0,0,0,1,0,0|1,0,2]=4 1986 B12R1.353 COC(=O)CNC1CCCC1O ef5b6e66a5708b51134d4fe4a0f65cf1 [0,0,0,1,0,0|2,0,1]=4 1987 B12R1.353 COC(=O)CN[C@@H]1CCC[C@@H]1O 8dcb0b31db3a5f78e10bc795951d6bd3 [0,0,0,1,0,0|2,0,1]=4 1988 B12R1.353 COC(=O)CN[C@@H]1CCC[C@H]1O 885a8d6afb11071509315e2e1f65a4e6 [0,0,0,1,0,0|2,0,1]=4 1989 B12R1.353 COC(=O)CN[C@H]1CCC[C@@H]1O deaf37e6af3a5b4531363f6d5a96078d [0,0,0,1,0,0|2,0,1]=4 1990 B12R1.353 COC(=O)CN[C@H]1CCC[C@H]1O d44b050607a89a3ea3011265363e5f3c [0,0,0,1,0,0|2,0,1]=4 1991 B12R1.353 COC(=O)COC1CCCC1C 0d28b709271fe028f67fcb1c41017c19 [0,0,0,1,0,0|1,0,1]=3 1992 B12R1.353 COC(=O)COC1COCC1C 1c116c443d4506936da90255f4554ba7 [0,0,0,1,0,0|2,0,1]=4 1993 B12R1.353 COC(=O)CO[C@@H]1CCC[C@@H]1C 5f234e7019ed91c13e8f9291d9a0904f [0,0,0,1,0,0|1,0,1]=3 1994 B12R1.353 COC(=O)CO[C@@H]1CCC[C@H]1C fcbb6e0de9f19b9f856088d2390aefe3 [0,0,0,1,0,0|1,0,1]=3 1995 B12R1.353 COC(=O)CO[C@@H]1CCC[C@H]1F 89927154e646676839ac6f04a1ee50fe [0,0,0,1,0,0|2,0,1]=4 1996 B12R1.353 COC(=O)CO[C@@H]1COC[C@@H]1C a4d9c49691ec74f1086263e4a9f76fcf [0,0,0,1,0,0|2,0,1]=4 1997 B12R1.353 COC(=O)CO[C@H]1CCC[C@@H]1C a66dae8aaeee0c7edc45763da58e3e8a [0,0,0,1,0,0|1,0,1]=3 1998 B12R1.353 COC(=O)CO[C@H]1CCC[C@H]1C 1c0794e0bfd982a56afdb1f88f01dd54 [0,0,0,1,0,0|1,0,1]=3 1999 B12R1.353 COC(=O)CO[C@H]1COC[C@@H]1C e23cffab739608aa8fc1e9dc0ebf0c25 [0,0,0,1,0,0|2,0,1]=4 2000 B12R1.353 COC(=O)CO[C@H]1COC[C@H]1C 521309007d3821cada269b94b87084f7 [0,0,0,1,0,0|2,0,1]=4 2001 B12R1.353 COC(=O)OCN1CCCC1C 03af4e306f88e34e55bf81495f1ceb63 [0,0,0,1,0,0|2,0,1]=4 2002 B12R1.353 COC(=O)OCN1CCC[C@@H]1C ccc7e0631286fc9bdb3c81b9a4110d2e [0,0,0,1,0,0|2,0,1]=4 2003 B12R1.353 COC(=O)OCN1CCC[C@H]1C 941935b25dc194a9b1a978f76d3fe80e [0,0,0,1,0,0|2,0,1]=4 2004 B12R1.355 COC(=O)/C=C/CNC1CC1C 2e8e1142cc7d41bbe1f2fd81e82ebc92 [0,0,0,1,0,0|1,0,0]=2 2005 B12R1.355 COC(=O)/C=C/CN[C@@H]1C[C@H]1F 9c2ddf6c5317d3533e0fc793f05a7272 [0,0,0,1,0,0|2,0,0]=3 2006 B12R1.355 COC(=O)/C=C/CN[C@H]1C[C@@H]1F 27eb5d2b6fbdfe17594123ee435679aa [0,0,0,1,0,0|2,0,0]=3 2007 B12R1.355 COC(=O)/C=C/CN[C@H]1C[C@H]1F 31737e728d6fd4f7673b75b58b2a0ea2 [0,0,0,1,0,0|2,0,0]=3 2008 B12R1.355 COC(=O)/C=C\CNC1CC1C db10456e4464e76fbca84163fb89fc93 [0,0,0,1,0,0|1,0,0]=2 2009 B12R1.355 COC(=O)/C=C\CN[C@@H]1C[C@H]1F 589074d25ccae95a16bb7f25972ea317 [0,0,0,1,0,0|2,0,0]=3 2010 B12R1.355 COC(=O)/C=C\CN[C@H]1C[C@@H]1F 043880b77af85ef19b8fd7785c28b277 [0,0,0,1,0,0|2,0,0]=3 2011 B12R1.355 COC(=O)/C=C\CN[C@H]1C[C@H]1F 583599beb01031a233cf08c203128c25 [0,0,0,1,0,0|2,0,0]=3 2012 B12R1.355 COC(=O)C#CCNC1CC1C b0c4f20ab964b85d8226e480c7579b3d [0,0,0,1,0,0|1,0,2]=4 2013 B12R1.355 COC(=O)C=CCNC1CC1C 46ccecf03a9561079c7ad8ec7a1be0a0 [0,0,0,1,0,0|1,0,0]=2 2014 B12R1.355 COC(=O)C=CCN[C@@H]1C[C@H]1F 50a3818b3be435e3488f931696fac406 [0,0,0,1,0,0|2,0,0]=3 2015 B12R1.355 COC(=O)C=CCN[C@H]1C[C@@H]1F fba8441a27d1dec8fc4cb515c39655ff [0,0,0,1,0,0|2,0,0]=3 2016 B12R1.355 COC(=O)C=CCN[C@H]1C[C@H]1F 69b9edc2cd7cb0df40cec1913a29d1f6 [0,0,0,1,0,0|2,0,0]=3 2017 B12R1.355 COC(=O)CCCNC1CC1C 991ea2f136b82bd2ae281d4f6fa9cf60 [0,0,0,1,0,0|1,0,2]=4 2018 B12R1.355 COC(=O)CCOCC1CC1C 2777ef149de82bae4105c17fac968151 [0,0,0,1,0,0|1,0,2]=4 2019 B12R1.355 COC(=O)CCOC[C@@H]1C[C@@H]1C 27037e7d06c1c065d7bece3f270f8422 [0,0,0,1,0,0|1,0,2]=4 2020 B12R1.355 COC(=O)CCOC[C@@H]1C[C@H]1C f26ecd01ea61c9822c507f85dff095a3 [0,0,0,1,0,0|1,0,2]=4 2021 B12R1.355 COC(=O)CCOC[C@H]1C[C@@H]1C 00640da3169be67da03304cc80b3fbb0 [0,0,0,1,0,0|1,0,2]=4 2022 B12R1.355 COC(=O)OCOCC1CC1C 53eb69fd492e55ac675a640f00974a65 [0,0,0,1,0,0|2,0,1]=4 2023 B12R1.355 COC(=O)OCOC[C@@H]1C[C@@H]1C 5aa7b5bfddda47a07c0ec3769724d910 [0,0,0,1,0,0|2,0,1]=4 2024 B12R1.355 COC(=O)OCOC[C@@H]1C[C@H]1C 16ff1c00f36bacce9fe8feeb3b2fc2fa [0,0,0,1,0,0|2,0,1]=4 2025 B12R1.355 COC(=O)OCOC[C@H]1C[C@@H]1C fa69dad975b7b18e97f6851d975c0a51 [0,0,0,1,0,0|2,0,1]=4 2026 B12R1.356 C=C(CNCCC1CCC1)OC 56bb211dc728938e0673c43dde03512d [0,0,0,1,0,0|2,0,1]=4 2027 B12R1.356 C=C(COCCC1CCC1)OC ebab6300f6c7fb6ce2d81131ff2772f8 [0,0,0,1,0,0|2,0,1]=4 2028 B12R1.356 CCC(=O)CNCCC1CCC1 4a454b881cc11e19d8e36a5d1fc8773b [0,0,0,1,0,0|2,0,1]=4 2029 B12R1.356 CCC(=O)COCCC1CCC1 e22b04848207f2d7813288ba5071668b [0,0,0,1,0,0|2,0,1]=4 2030 B12R1.356 CNC(=O)CNCCC1CCC1 0bb73345c71692e0e222995ceed38f0d [0,0,0,1,0,0|2,0,1]=4 2031 B12R1.356 CNC(=O)COCCC1CCC1 75ee1bd495c6f499e52865829d955479 [0,0,0,1,0,0|2,0,1]=4 2032 B12R1.356 COC(=O)/C=C/CNC1CCC1 8e9a0b08dde6a2bf996b165aef815a71 [0,0,0,1,0,0|1,0,0]=2 2033 B12R1.356 COC(=O)/C=C/CNC1COC1 15849deabeb960307ed27431b9ba31fd [0,0,0,1,0,0|2,0,0]=3 2034 B12R1.356 COC(=O)/C=C/COC1CCC1 a03e858ab5598cc21a0e59c46f36d352 [0,0,0,1,0,0|1,0,0]=2 2035 B12R1.356 COC(=O)/C=C/COC1COC1 d7521a2fc2103a85a8c865bebb0331bb [0,0,0,1,0,0|2,0,0]=3 2036 B12R1.356 COC(=O)/C=C/COC1CSC1 8830c34ba50e92e9d112639f4ee1dcc9 [0,0,0,1,0,0|2,0,0]=3 2037 B12R1.356 COC(=O)/C=C\CNC1CCC1 0f9eccd681abd1a35ab810f065b63f0d [0,0,0,1,0,0|1,0,0]=2 2038 B12R1.356 COC(=O)/C=C\CNC1COC1 f9a0841bad19ff8d2664d000581ecc8f [0,0,0,1,0,0|2,0,0]=3 2039 B12R1.356 COC(=O)/C=C\COC1CCC1 65deefabd0ebf714145b2803bd85d8c5 [0,0,0,1,0,0|1,0,0]=2 2040 B12R1.356 COC(=O)/C=C\COC1COC1 3de466556298a6737195163c6914971e [0,0,0,1,0,0|2,0,0]=3 2041 B12R1.356 COC(=O)/C=C\COC1CSC1 2c53d7f40a1c09e2ed1d9d2b799b4dc3 [0,0,0,1,0,0|2,0,0]=3 2042 B12R1.356 COC(=O)C#CCNC1CCC1 f0d5b24ad29c163ad5f73a8a8fddf958 [0,0,0,1,0,0|1,0,2]=4 2043 B12R1.356 COC(=O)C#CCOC1CCC1 bded3a1750bc61b637f6836481877487 [0,0,0,1,0,0|1,0,2]=4 2044 B12R1.356 COC(=O)C=CCNC1CCC1 c0933630232c1f1adf676133798a3f2a [0,0,0,1,0,0|1,0,0]=2 2045 B12R1.356 COC(=O)C=CCNC1COC1 3c87dced8658d48c9b0e23c405ea3739 [0,0,0,1,0,0|2,0,0]=3 2046 B12R1.356 COC(=O)C=CCOC1CCC1 f07a85c412892d201bfe33fb906dbce2 [0,0,0,1,0,0|1,0,0]=2 2047 B12R1.356 COC(=O)C=CCOC1COC1 2d16db10da8c6b92f7926f0f0354e056 [0,0,0,1,0,0|2,0,0]=3 2048 B12R1.356 COC(=O)C=CCOC1CSC1 02a3660f89c7969f4e696c487f4716c2 [0,0,0,1,0,0|2,0,0]=3 2049 B12R1.356 COC(=O)CCCCN1CCC1 b033ef599bbe9012977c8c2e32d8c842 [0,0,0,1,0,0|1,0,2]=4 2050 B12R1.356 COC(=O)CCCNC1CCC1 8687ed738d4ba701d4f7cef7e5faabcb [0,0,0,1,0,0|1,0,2]=4 2051 B12R1.356 COC(=O)CCCOC1CCC1 5bcf90ca7ea91094425674b3afed8e27 [0,0,0,1,0,0|1,0,2]=4 2052 B12R1.356 COC(=O)CCNCC1CCC1 c5ce53fc32fa2a48b3cc8793d39acf1c [0,0,0,1,0,0|1,0,2]=4 2053 B12R1.356 COC(=O)CCOCC1CCC1 9d9f9712ba1de4816cd902cdf63334de [0,0,0,1,0,0|1,0,2]=4 2054 B12R1.356 COC(=O)CNCCC1CCC1 6d75997ff90827b5fe01e17b983a6e64 [0,0,0,1,0,0|1,0,1]=3 2055 B12R1.356 COC(=O)CNCCC1CCO1 5db583608f2971b33ad2729f7cbca655 [0,0,0,1,0,0|2,0,1]=4 2056 B12R1.356 COC(=O)CNCCC1COC1 ebdbdd81ebe072a6ca5cb60aabeac6a3 [0,0,0,1,0,0|2,0,1]=4 2057 B12R1.356 COC(=O)CNCCN1CCC1 ec954bb58ea692bff3166abc76a0f582 [0,0,0,1,0,0|2,0,1]=4 2058 B12R1.356 COC(=O)CNCC[C@@H]1CCO1 e2528ae48c0aa26294ab982de8d5e8bd [0,0,0,1,0,0|2,0,1]=4 2059 B12R1.356 COC(=O)COCCC1CCC1 871456e4b05a5d48843ef9cbc4dafeb3 [0,0,0,1,0,0|1,0,1]=3 2060 B12R1.356 COC(=O)COCCC1CCO1 1273a14c78b86d56d75c9598014ad0b0 [0,0,0,1,0,0|2,0,1]=4 2061 B12R1.356 COC(=O)COCCC1COC1 2638b294c7d4e7ad1f2884a76546bcb5 [0,0,0,1,0,0|2,0,1]=4 2062 B12R1.356 COC(=O)COCCN1CCC1 7183294aa099d7649f011dbabc412715 [0,0,0,1,0,0|2,0,1]=4 2063 B12R1.356 COC(=O)COCC[C@@H]1CCO1 e8c2c88c0dcf8a73cc55a11383d66169 [0,0,0,1,0,0|2,0,1]=4 2064 B12R1.356 COC(=O)COCC[C@H]1CCO1 523d16ab3f9f6ab7f8dc46555807d217 [0,0,0,1,0,0|2,0,1]=4 2065 B12R1.356 COC(=O)OCCOC1CCC1 511ad9d538de32696e564da99a8fb652 [0,0,0,1,0,0|2,0,1]=4 2066 B12R1.356 COC(=O)OCNCC1CCC1 b6ced389133979d6b0b43092e6421ec4 [0,0,0,1,0,0|2,0,1]=4 2067 B12R1.356 COC(=O)OCOCC1CCC1 9c8db989a209967bfbe6380262d432d6 [0,0,0,1,0,0|2,0,1]=4 2068 B12R1.360 C=C(COCCCC1CC1)OC 1809d1c40c7c67b96c57161bc3801c28 [0,0,0,1,0,0|2,0,1]=4 2069 B12R1.360 CCC(=O)COCCCC1CC1 17c75975156ca61963ca01472bcc0eec [0,0,0,1,0,0|2,0,1]=4 2070 B12R1.360 CNC(=O)COCCCC1CC1 21dca2e849b2e2b592e00430cfa77d5f [0,0,0,1,0,0|2,0,1]=4 2071 B12R1.360 COC(=O)/C=C/CNCC1CC1 39cc6c760a2d22b860e3e6089b999f18 [0,0,0,1,0,0|1,0,0]=2 2072 B12R1.360 COC(=O)/C=C/COCC1CC1 1d7d1c59f0626522c4b2c50fb9cbbe76 [0,0,0,1,0,0|1,0,0]=2 2073 B12R1.360 COC(=O)/C=C\CNCC1CC1 4178f6ae08389566c1efee53a8b7f638 [0,0,0,1,0,0|1,0,0]=2 2074 B12R1.360 COC(=O)/C=C\COCC1CC1 13658cb98896d565ea2e6aa58e3c33b9 [0,0,0,1,0,0|1,0,0]=2 2075 B12R1.360 COC(=O)C#CCNCC1CC1 60255cf39715c908017057e1994681f3 [0,0,0,1,0,0|1,0,2]=4 2076 B12R1.360 COC(=O)C#CCOCC1CC1 7e1ef0bdc3f4817a85e6bb49389f231d [0,0,0,1,0,0|1,0,2]=4 2077 B12R1.360 COC(=O)C=CCNCC1CC1 2a0597c19bd4725b47e413e84733c985 [0,0,0,1,0,0|1,0,0]=2 2078 B12R1.360 COC(=O)C=CCOCC1CC1 47915094a75d1eac9c65e0fcd50e8f30 [0,0,0,1,0,0|1,0,0]=2 2079 B12R1.360 COC(=O)CCCCNC1CC1 05b4536934beb95943c580f219b93e50 [0,0,0,1,0,0|1,0,2]=4 2080 B12R1.360 COC(=O)CCCCOC1CC1 12fca4feb061c4cddca09f6491f94e06 [0,0,0,1,0,0|1,0,2]=4 2081 B12R1.360 COC(=O)CCCNCC1CC1 af617d8a77b122a093bfc04805ffffdf [0,0,0,1,0,0|1,0,2]=4 2082 B12R1.360 COC(=O)CCCOCC1CC1 593a163b4d42fcbf3595fd711a0b6a1c [0,0,0,1,0,0|1,0,2]=4 2083 B12R1.360 COC(=O)CCNCCC1CC1 4453d2f1264c17af4eb32cfddc19327d [0,0,0,1,0,0|1,0,2]=4 2084 B12R1.360 COC(=O)CCOCCC1CC1 811be3747c41913b2af0509f2f583a5f [0,0,0,1,0,0|1,0,2]=4 2085 B12R1.360 COC(=O)CNCCOC1CC1 3b555701673ea232df934622192c664c [0,0,0,1,0,0|2,0,1]=4 2086 B12R1.360 COC(=O)COCCCC1CC1 a7d04eff5cce144c153474ea7a1fdef5 [0,0,0,1,0,0|1,0,1]=3 2087 B12R1.360 COC(=O)COCCNC1CC1 e86f5feead89c38184bb450d7ef56c40 [0,0,0,1,0,0|2,0,1]=4 2088 B12R1.360 COC(=O)COCCOC1CC1 c6d9584d14000aa20cafae5a30a04f54 [0,0,0,1,0,0|2,0,1]=4 2089 B12R1.360 COC(=O)OCCOCC1CC1 5f29655709a5e6f641c924770c7f0c07 [0,0,0,1,0,0|2,0,1]=4 2090 B12R1.360 COC(=O)OCNCCC1CC1 23dd919e43c3246393f04d09d1b4fd7b [0,0,0,1,0,0|2,0,1]=4 2091 B12R1.360 COC(=O)OCOCCC1CC1 b9491c20993caaab7af45a54d20b07aa [0,0,0,1,0,0|2,0,1]=4 2092 B12R1.364 COC(=O)CCN[C@@H]1CC[C@H]1C 49a6bef235b71c2281fa1bdbe35cf45c [0,0,0,1,0,0|1,0,2]=4 2093 B12R1.364 COC(=O)CCN[C@H]1CC[C@H]1C edea97762804a0c89e56db6c95c9050f [0,0,0,1,0,0|1,0,2]=4 2094 B12R1.364 COC(=O)CNCC1CCN1C 06d8d47ecfa5b679efbc04173247101c [0,0,0,1,0,0|2,0,1]=4 2095 B12R1.364 COC(=O)COCC1CCC1F 7f157108ef7b0f97698144804d6691e2 [0,0,0,1,0,0|2,0,1]=4 2096 B12R1.364 COC(=O)COCC1CCN1C 8a3688643669a5822f0201c0da910821 [0,0,0,1,0,0|2,0,1]=4 2097 B12R1.364 COC(=O)COC[C@@H]1CCN1C 48c0ddf1cc1b200bc881df45b7612b09 [0,0,0,1,0,0|2,0,1]=4 2098 B12R1.364 COC(=O)COC[C@H]1CCN1C ceefd23cb988eb39af37a194de3b3a33 [0,0,0,1,0,0|2,0,1]=4 2099 B12R1.364 COC(=O)OCN[C@@H]1CC[C@H]1C 5c0010308a8be4def705a0c8a708c62c [0,0,0,1,0,0|2,0,1]=4 2100 B12R1.364 COC(=O)OCN[C@H]1CC[C@H]1C ab8260fd838c42aa3a9561881586fe74 [0,0,0,1,0,0|2,0,1]=4 2101 B12R1.365 CCC(=O)N1CCCCCC1C aced5a7e9c91dbc3cfbebe48cb0227e1 [0,0,0,1,0,0|2,0,1]=4 2102 B12R1.371 C=C(CN1CCCCC1C)OC 09101b025ed03783798cdef50b6bb1f1 [0,0,0,1,0,0|2,0,1]=4 2103 B12R1.371 C=C(CN1CCCC[C@@H]1C)OC 72a381625b3893a99ef547287223d747 [0,0,0,1,0,0|2,0,1]=4 2104 B12R1.371 C=C(CN1CCCC[C@H]1C)OC 7ca635d6728c1b18f06cee8a666888de [0,0,0,1,0,0|2,0,1]=4 2105 B12R1.371 CCC(=O)CN1CCCCC1C 947402d71b11ec73fd0fce93d036ed92 [0,0,0,1,0,0|2,0,1]=4 2106 B12R1.371 CCC(=O)CN1CCCC[C@@H]1C 9460a7288d62bb97588b0a75ff4502dc [0,0,0,1,0,0|2,0,1]=4 2107 B12R1.371 CCC(=O)CN1CCCC[C@H]1C 20834a0fbfb65fc23f08ead98f3f127e [0,0,0,1,0,0|2,0,1]=4 2108 B12R1.371 CCC(=O)NC1CCCCC1C 49ae2a73276f250ed23e1a20e874d7a0 [0,0,0,1,0,0|2,0,1]=4 2109 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@@H]1C ad1e235c2bdb5be6d06e9f757c8d05e8 [0,0,0,1,0,0|2,0,1]=4 2110 B12R1.371 CCC(=O)N[C@@H]1CCCC[C@H]1C a9d1e65296d3c851dcb489c997dbd768 [0,0,0,1,0,0|2,0,1]=4 2111 B12R1.371 CCC(=O)N[C@H]1CCCC[C@@H]1C 6a021d1f6d7dad7e32cab96f97f500ef [0,0,0,1,0,0|2,0,1]=4 2112 B12R1.371 CCC(=O)N[C@H]1CCCC[C@H]1C 707d34554a21b9963204cbdd87ceac15 [0,0,0,1,0,0|2,0,1]=4 2113 B12R1.371 CNC(=O)CN1CCCCC1C 1060fc494cb27564918e0ec10b91cbb7 [0,0,0,1,0,0|2,0,1]=4 2114 B12R1.371 CNC(=O)CN1CCCC[C@@H]1C a3b7a65ad7daac8365b25d8b4496b5e7 [0,0,0,1,0,0|2,0,1]=4 2115 B12R1.371 CNC(=O)CN1CCCC[C@H]1C c62af9d13f04e98b75d689ef4e7473e5 [0,0,0,1,0,0|2,0,1]=4 2116 B12R1.371 COC(=O)CN1CCCCC1C edf39580d9c6c4e014d47cc69b34f141 [0,0,0,1,0,0|1,0,1]=3 2117 B12R1.371 COC(=O)CN1CCCC[C@@H]1C 44f203a7642d009ab7fd0b0b0d168096 [0,0,0,1,0,0|1,0,1]=3 2118 B12R1.371 COC(=O)CN1CCCC[C@H]1C ec7346485b9eba4a1eab098e27eda2ed [0,0,0,1,0,0|1,0,1]=3 2119 B12R1.371 COC(=O)CN1CCOCC1C 59407c7c504c42e450b2a7d2fe25fee8 [0,0,0,1,0,0|2,0,1]=4 2120 B12R1.371 COC(=O)CN1CCOC[C@@H]1C 71f332d825a0ead1a377ec7f7bb79375 [0,0,0,1,0,0|2,0,1]=4 2121 B12R1.371 COC(=O)CN1CCOC[C@H]1C c344f938d3a8b1ac0a21e1da90beebcf [0,0,0,1,0,0|2,0,1]=4 2122 B12R1.383 CCCCCCN[C@H]1CNC1=O 34c4342e384e898c0bd9dbec064d9fd3 [0,0,0,1,0,0|2,0,1]=4 2123 B12R1.383 CCCCCCOC1CCC1=O fb3755ef5063eb81004edbf86e8d619b [0,0,0,1,0,0|2,0,1]=4 2124 B12R1.383 CCCCCNCC1COC1=O 89c9e2194f01b4aaa43a4ea26fcfaa9e [0,0,0,1,0,0|1,0,2]=4 2125 B12R1.383 CCCCCOCC1COC1=O 480a64f12b395abba4fb013ae6438163 [0,0,0,1,0,0|1,0,2]=4 2126 B12R1.396 COC(=O)CNCC1CC1CO a966a5827a996506cf9f25d02bd91fd7 [0,0,0,1,0,0|2,0,1]=4 2127 B12R1.402 CCC1CCN1CCC(=O)OC 62df155a9a954ae2ffe8cd76d7b48416 [0,0,0,1,0,0|1,0,2]=4 2128 B12R1.402 CCC1CCN1COC(=O)OC bb6ef469e3418449d3367751eb8a86e7 [0,0,0,1,0,0|2,0,1]=4 2129 B12R1.402 COC(=O)CNC1CCC1OC cac43e7ab43270cebfc7a1f2feec000d [0,0,0,1,0,0|2,0,1]=4 2130 B12R1.402 COC(=O)CN[C@@H]1CC[C@@H]1OC 3487da750ca01edb0b7bfb79f5aa5b5b [0,0,0,1,0,0|2,0,1]=4 2131 B12R1.402 COC(=O)CN[C@@H]1CC[C@H]1OC 5b3b87983e755ed0046f2e7fafb9942d [0,0,0,1,0,0|2,0,1]=4 2132 B12R1.402 COC(=O)CN[C@H]1CC[C@@H]1OC 9e91593ccbe2cfb7b8dd11de1abaa4fa [0,0,0,1,0,0|2,0,1]=4 2133 B12R1.402 COC(=O)CN[C@H]1CC[C@H]1OC c8c77c005c939297bf837e043083c32c [0,0,0,1,0,0|2,0,1]=4 2134 B12R1.455 CCCCNc1ccc(s1)OC 157c7bc18d0257da1ef3714752036ef1 [0,0,0,1,0,0|1,1,1]=4 2135 B12R1.477 C=C(CNCC1CCCC1)OC 07bbf693bc49f6ca1b7aaa97c077fa27 [0,0,0,1,0,0|2,0,1]=4 2136 B12R1.477 C=C(COCC1CCCC1)OC e3f2a7404aaae0aa8c123273e757d116 [0,0,0,1,0,0|2,0,1]=4 2137 B12R1.477 CCC(=O)CNCC1CCCC1 2af5053710eeb80541edd9fbad68b39d [0,0,0,1,0,0|2,0,1]=4 2138 B12R1.477 CCC(=O)COCC1CCCC1 c8562fd75fad6a35e585f68a8bed3581 [0,0,0,1,0,0|2,0,1]=4 2139 B12R1.477 CCC(=O)NCCC1CCCC1 b67cf06d1e0a23d3026b35a48b608ff0 [0,0,0,1,0,0|2,0,1]=4 2140 B12R1.477 CNC(=O)CNCC1CCCC1 01b8a3421decd7d426b1a46ac1db61b1 [0,0,0,1,0,0|2,0,1]=4 2141 B12R1.477 CNC(=O)COCC1CCCC1 84da474abc3ba7db49d4d7ae70ee776a [0,0,0,1,0,0|2,0,1]=4 2142 B12R1.477 COC(=O)/C=C/CN1CC=CC1 4b572da622766602df1f73ea09ca3720 [0,0,0,1,0,0|1,0,2]=4 2143 B12R1.477 COC(=O)/C=C/CN1CCSC1 92508acb1c7b0a085b088de146cb6100 [0,0,0,1,0,0|2,0,0]=3 2144 B12R1.477 COC(=O)/C=C\CN1CC=CC1 f34c98d67ebdab4a9d479695bd3f903f [0,0,0,1,0,0|1,0,2]=4 2145 B12R1.477 COC(=O)/C=C\CN1CCSC1 4bcae1a1d0abd551c23d8993f16d8cd8 [0,0,0,1,0,0|2,0,0]=3 2146 B12R1.477 COC(=O)C=CCN1CC=CC1 43b9fdfcd20ade775f34b02f3515ccf5 [0,0,0,1,0,0|1,0,2]=4 2147 B12R1.477 COC(=O)C=CCN1CCSC1 b3e1a8605afde477bc6e98b4d3df31e7 [0,0,0,1,0,0|2,0,0]=3 2148 B12R1.477 COC(=O)CCNC1CCCC1 c4b2842664eca5b647db2fe8d4345eb3 [0,0,0,1,0,0|1,0,2]=4 2149 B12R1.477 COC(=O)CCOC1CCCC1 41d99f7c621e9109f1f013725365133e [0,0,0,1,0,0|1,0,2]=4 2150 B12R1.477 COC(=O)CNCC1CCCC1 692c814c416947e44d12c088aefccadc [0,0,0,1,0,0|1,0,1]=3 2151 B12R1.477 COC(=O)CNCC1CCCO1 822d5a6c75d7f017f2b57ef1a64dfbca [0,0,0,1,0,0|2,0,1]=4 2152 B12R1.477 COC(=O)CNCC1CCOC1 738baf96ddbabf0d756db9c2d9cc391f [0,0,0,1,0,0|2,0,1]=4 2153 B12R1.477 COC(=O)CNC[C@@H]1CCCO1 aec82e2288587ddeb7bb624c9c7b557a [0,0,0,1,0,0|2,0,1]=4 2154 B12R1.477 COC(=O)CNC[C@@H]1CCOC1 c626b8301de69e632a8bf7792bceb95f [0,0,0,1,0,0|2,0,1]=4 2155 B12R1.477 COC(=O)CNC[C@H]1CCCO1 9d580e0519cc51401b6153e1698d2e94 [0,0,0,1,0,0|2,0,1]=4 2156 B12R1.477 COC(=O)CNC[C@H]1CCOC1 452d6e55fcb96ba14d75b946be279b3a [0,0,0,1,0,0|2,0,1]=4 2157 B12R1.477 COC(=O)COCC1CCCC1 4a84ec77ee1ef1fabaaa560f99e066bc [0,0,0,1,0,0|1,0,1]=3 2158 B12R1.477 COC(=O)COCC1CCCO1 f7c0ba7e2b26608f0e4bd8e3c4f9eb24 [0,0,0,1,0,0|2,0,1]=4 2159 B12R1.477 COC(=O)COCC1CCCS1 f1777d842bdca49aed1fe873fef0e789 [0,0,0,1,0,0|2,0,1]=4 2160 B12R1.477 COC(=O)COCC1CCOC1 4f9da43a09f90e821d909e3e23f6ec64 [0,0,0,1,0,0|2,0,1]=4 2161 B12R1.477 COC(=O)COCN1CCCC1 6d21cde373e9710f280ae9e418e09b9c [0,0,0,1,0,0|2,0,1]=4 2162 B12R1.477 COC(=O)COC[C@@H]1CCCO1 00c70f086359aea2056666989b4e290d [0,0,0,1,0,0|2,0,1]=4 2163 B12R1.477 COC(=O)COC[C@@H]1CCOC1 a80e380c8248c3c0fa1abd51b757e442 [0,0,0,1,0,0|2,0,1]=4 2164 B12R1.477 COC(=O)COC[C@H]1CCCO1 550359bec18cb8404f66f23f40e02bec [0,0,0,1,0,0|2,0,1]=4 2165 B12R1.477 COC(=O)COC[C@H]1CCOC1 eec13af091c3f42433c01a10e82a3eb6 [0,0,0,1,0,0|2,0,1]=4 2166 B12R1.477 COC(=O)OCNC1CCCC1 0f4e46742845637443ce2c99efedc9f2 [0,0,0,1,0,0|2,0,1]=4 2167 B12R1.477 COC(=O)OCOC1CCCC1 060a5b1821cf3f92c2e316db26c3c2ed [0,0,0,1,0,0|2,0,1]=4 2168 B12R1.1412 CCCCCN1CC1C(=O)OC 698be53b7e59ad4f25e4bede4432c8b6 [0,0,0,1,0,0|1,0,2]=4 2169 B12R1.1412 CCCCCN1C[C@H]1C(=O)OC 0fdce472605903e017f3b31c85562318 [0,0,0,1,0,0|1,0,2]=4 2170 B12R1.1412 CCCCNC1CC1C(=O)OC adf45f94dac98898c7160056f8bb1d7e [0,0,0,1,0,0|1,0,2]=4 2171 B12R1.1412 CCCCOC1CC1C(=O)OC 086da0da463463e3a5e87182dfe756f7 [0,0,0,1,0,0|1,0,2]=4 2172 B12R1.1412 CCCNC[C@@H]1C[C@H]1C(=O)OC aaa5a826b3a5852586e25dc880513813 [0,0,0,1,0,0|1,0,2]=4 2173 B12R1.1412 CCCOCC1CC1C(=O)OC a0d3d7af12125498d0a49efd54d2bc88 [0,0,0,1,0,0|1,0,2]=4 2174 B12R1.1412 CCCOC[C@@H]1C[C@@H]1C(=O)OC 3e0a95cf289610c464917fa0e180373b [0,0,0,1,0,0|1,0,2]=4 2175 B12R1.1412 CCCOC[C@@H]1C[C@H]1C(=O)OC 2843013c9808d383db3dfae0c7a7e6ce [0,0,0,1,0,0|1,0,2]=4 2176 B12R1.1412 CCCOC[C@H]1C[C@@H]1C(=O)OC d0e3b81a1ca834241da4f5830d73e857 [0,0,0,1,0,0|1,0,2]=4 2177 B12R1.1412 CCOCC[C@H]1C[C@@H]1C(=O)OC ee4d97e924ae0e3e3ce3e472acfa1576 [0,0,0,1,0,0|1,0,2]=4 2178 B12R1.1659 CCC(=O)N1CCCCCCC1 9af2e7f6306dea747b93f5f7a3212cc1 [0,0,0,1,0,0|2,0,1]=4 2179 B12R1.1748 C=C(CN1CCCCCC1)OC 5323552dca92fd31c2bf867915c7b2a3 [0,0,0,1,0,0|2,0,1]=4 2180 B12R1.1748 CCC(=O)CN1CCCCCC1 01f7e33a55a049d6fcd6d45325f23577 [0,0,0,1,0,0|2,0,1]=4 2181 B12R1.1748 CCC(=O)NC1CCCCCC1 1049289f282d61390cb51b1942468670 [0,0,0,1,0,0|2,0,1]=4 2182 B12R1.1748 CNC(=O)CN1CCCCCC1 7f8b41edccabcbd8df9ab4993f1c1a64 [0,0,0,1,0,0|2,0,1]=4 2183 B12R1.1748 COC(=O)CN1CCCCCC1 b49db2bbbbc56b7e752ba9b16b15891d [0,0,0,1,0,0|1,0,1]=3 2184 B12R1.1748 COC(=O)CN1CCCOCC1 0d351860c24f906956cf2e0011408a91 [0,0,0,1,0,0|2,0,1]=4 2185 B9R0.2 CC(=O)NCCCCCCl 9810fdb3b44bef22ae3578265fbb7e47 [2,0,0,0,0,0|2,0,0]=4 2186 B9R0.2 CC(=O)NCCCCCO 6528e540cd36869e25e869b54ef6b7c3 [2,0,0,0,0,0|2,0,0]=4 2187 B9R0.2 CCCCCCNC(=O)C 39216d9115deaeddca0efb3bbde5d8cb [2,0,0,0,0,0|1,0,0]=3 2188 B9R0.2 CCCCCNCC(=O)C 08234591298ac478e9a5e187e3c7cd4f [2,0,0,0,0,0|1,0,1]=4 2189 B9R0.2 CCCCCNCC(=O)O 50016d51731d942cf0c89f16645029e7 [2,0,0,0,0,0|1,0,1]=4 2190 B9R0.2 CCCCCOCC(=O)C 499380b88b419c17c81350fa0478ac8c [2,0,0,0,0,0|1,0,1]=4 2191 B9R0.2 CCCCCOCC(=O)O 880094d6a378029586dbdb044c20be8e [2,0,0,0,0,0|1,0,1]=4 2192 B9R0.2 CCCCNC/C=C(/C)\I 96ab734b7ce21482610c71b6ec7a0087 [2,0,0,0,0,0|2,0,0]=4 2193 B9R0.2 CCCCNC/C=C(\C)/Cl cc815245be4b93926fd334c586089c95 [2,0,0,0,0,0|2,0,0]=4 2194 B9R0.2 CCCCNCC=C(C)C fecf7e997f5d1af1b094a02b011b0ef1 [2,0,0,0,0,0|2,0,0]=4 2195 B9R0.2 CCCCNCC=C(C)Cl 2e3d05b023f03cd9b003c981af64ea51 [2,0,0,0,0,0|2,0,0]=4 2196 B9R0.2 CCCCNCC=C(C)I 30884b68d06af4a4b3dead6018681c13 [2,0,0,0,0,0|2,0,0]=4 2197 B9R0.2 CCCCNCCC(=O)C 23aeaf3a105e0d1d74c9a684b3a6ae92 [2,0,0,0,0,0|1,0,1]=4 2198 B9R0.2 CCCCNCCC(=O)O 2d9ff059f34708cc77b9165028ecaefa [2,0,0,0,0,0|1,0,1]=4 2199 B9R0.2 CCCCNCOC(=O)C f747ae8d75ae5077cb457c21af32c3d4 [2,0,0,0,0,0|2,0,0]=4 2200 B9R0.2 CCCCOC/C=C(/C)\Cl 960fdaf47adbe5ca8fe9706c44ec1044 [2,0,0,0,0,0|2,0,0]=4 2201 B9R0.2 CCCCOC/C=C(/C)\I b03bc4260bec39be9cf79aca08c38129 [2,0,0,0,0,0|2,0,0]=4 2202 B9R0.2 CCCCOC/C=C(\C)/Cl 743307406907de86af1ae076bd836ab4 [2,0,0,0,0,0|2,0,0]=4 2203 B9R0.2 CCCCOCC=C(C)C 761455161b359ecdf381fb2c7e2674d3 [2,0,0,0,0,0|2,0,0]=4 2204 B9R0.2 CCCCOCC=C(C)Cl 48d4f013d4d198147254b8b64c0376c6 [2,0,0,0,0,0|2,0,0]=4 2205 B9R0.2 CCCCOCC=C(C)I b84310eb2159cdbf6c2e4af756a6961c [2,0,0,0,0,0|2,0,0]=4 2206 B9R0.2 CCCCOCCC(=O)C 6113a5294b2f420804d815edd80f0f40 [2,0,0,0,0,0|1,0,1]=4 2207 B9R0.2 CCCCOCCC(=O)O f7b98599c570a58f82c0818a4675303f [2,0,0,0,0,0|1,0,1]=4 2208 B9R0.2 CCCCOCNC(=O)C c90275af9c3de9eb05be63b1efa3b4d9 [2,0,0,0,0,0|2,0,0]=4 2209 B9R0.2 CCCCOCOC(=O)C 52b453d7294c4b6acb8f00c70315374a [2,0,0,0,0,0|2,0,0]=4 2210 B9R0.2 CCCNC/C=C/C(=O)O 2dd1b47b43d39c78f5fbca7c7571ff45 [2,0,0,0,0,0|1,0,0]=3 2211 B9R0.2 CCCNCC=CC(=O)O f6d198a3c4819b4eb753a38590475072 [2,0,0,0,0,0|1,0,0]=3 2212 B9R0.2 CCCNCCC=C(C)C ced8054c93d3346fab5137bb99fb0f73 [2,0,0,0,0,0|2,0,0]=4 2213 B9R0.2 CCCNCCCC(=O)C 59b56db2c5ba6f2408c45d91cf5d07cf [2,0,0,0,0,0|1,0,1]=4 2214 B9R0.2 CCCNCCCC(=O)O 2c6599e2a5de3ceb0ce4fd582834477f [2,0,0,0,0,0|1,0,1]=4 2215 B9R0.2 CCCNCCNC(=O)C 8ec9c538248c1278a7a78c753f9b558d [2,0,0,0,0,0|2,0,0]=4 2216 B9R0.2 CCCNCCOC(=O)C 1f7e1f87180a6b7613488d41ed0bd627 [2,0,0,0,0,0|2,0,0]=4 2217 B9R0.2 CCCNCCSC(=O)C 9a734654dda6d6cb5b5c8675b98c7ffb [2,0,0,0,0,0|2,0,0]=4 2218 B9R0.2 CCCOC/C=C/C(=O)O 687938439e6711299f4c9234a05e83ff [2,0,0,0,0,0|1,0,0]=3 2219 B9R0.2 CCCOCC=CC(=O)O 08e8672bb8b818ca24be0e027803b17f [2,0,0,0,0,0|1,0,0]=3 2220 B9R0.2 CCCOCCC=C(C)C ff6fc9b7b0a2446d5a1ca048cc1d0112 [2,0,0,0,0,0|2,0,0]=4 2221 B9R0.2 CCCOCCCC(=O)C 3197867314079ee7d28a75ba48b024e1 [2,0,0,0,0,0|1,0,1]=4 2222 B9R0.2 CCCOCCCC(=O)O 0bf29d754b3e882141bfdc8089deee25 [2,0,0,0,0,0|1,0,1]=4 2223 B9R0.2 CCCOCCNC(=O)C 2d108407d153229ed52501407a328bfe [2,0,0,0,0,0|2,0,0]=4 2224 B9R0.2 CCCOCCOC(=O)C f41b865aa303cc7ca2bd22086d82154a [2,0,0,0,0,0|2,0,0]=4 2225 B9R0.2 CCCOCCSC(=O)C e5fbc3852cf2e5bc0f0d48122e1eb071 [2,0,0,0,0,0|2,0,0]=4 2226 B9R0.2 CCNCCCCC(=O)O c85642c501ae78ad2dab942f5836991c [2,0,0,0,0,0|1,0,1]=4 2227 B9R0.2 CCNCCCNC(=O)C 81f3181e8e4443de7d578da2748320f4 [2,0,0,0,0,0|2,0,0]=4 2228 B9R0.2 CCOCCCCC(=O)C ecee09a6206772fa3d500ecaf82261c4 [2,0,0,0,0,0|1,0,1]=4 2229 B9R0.2 CCOCCCCC(=O)O dd3c266ef7ca2d55081985bcebc78969 [2,0,0,0,0,0|1,0,1]=4 2230 B9R0.2 CCOCCCNC(=O)C c5dadd69f1df46bcde7d3d147d2b830b [2,0,0,0,0,0|2,0,0]=4 2231 B9R0.2 CCOCCCOC(=O)C 521ac746c4773e46268f3042c9c9e91c [2,0,0,0,0,0|2,0,0]=4 2232 B9R0.2 CCOCCCSC(=O)C c7c25084ef75859ffb4a847bdfcca873 [2,0,0,0,0,0|2,0,0]=4 2233 B9R0.2 COCCCCNC(=O)C 4f652cda1775947bb169784843d0beab [2,0,0,0,0,0|2,0,0]=4 2234 B9R0.2 COCNC/C=C/C(=O)O 0fa427a6486acbb4d373241fedb0a10e [2,0,0,0,0,0|2,0,0]=4 2235 B9R0.2 COCNCC=CC(=O)O 6df88093ebd1ff3e1f049de99a96ca09 [2,0,0,0,0,0|2,0,0]=4 2236 B9R0.2 COCOC/C=C/C(=O)O 54f81693b4cd346c35998d208561a80c [2,0,0,0,0,0|2,0,0]=4 2237 B9R0.2 COCOCC=CC(=O)O ad57febf4e8b32f0fa5c10f2425d4372 [2,0,0,0,0,0|2,0,0]=4 2238 B9R0.2 CSCCCCNC(=O)C fe724d5efdffb6641eb31ec001ed77cf [2,0,0,0,0,0|2,0,0]=4 2239 B9R0.2 CSCNC/C=C/C(=O)O 7c226f0048c34d5bb97b0870c0873d3b [2,0,0,0,0,0|2,0,0]=4 2240 B9R0.2 CSCNCC=CC(=O)O b8b6d8f69bf1687618553648a2d97d05 [2,0,0,0,0,0|2,0,0]=4 2241 B9R0.2 CSCOC/C=C/C(=O)O d0647dc68632bd0d847ac45201ae5914 [2,0,0,0,0,0|2,0,0]=4 2242 B9R0.2 CSCOCC=CC(=O)O 37540b99283d1f3b0431d790f6db1d9c [2,0,0,0,0,0|2,0,0]=4 2243 B9R0.2 O=C(O)/C=C/CNCCBr 9d755d7205a20dbe522663a089879b3a [2,0,0,0,0,0|2,0,0]=4 2244 B9R0.2 O=C(O)/C=C/CNCCF b3131ced97b234b1289a5013b1e1c61c [2,0,0,0,0,0|2,0,0]=4 2245 B9R0.2 O=C(O)/C=C/CNCCI ce769c9f0428b17440c76351c7e11247 [2,0,0,0,0,0|2,0,0]=4 2246 B9R0.2 O=C(O)/C=C/CNCCO 93a89649b619dea89e7c11dfa7f7aa9d [2,0,0,0,0,0|2,0,0]=4 2247 B9R0.2 O=C(O)/C=C/CNCCS 92abc05d6e84073df2dee1d135db5373 [2,0,0,0,0,0|2,0,0]=4 2248 B9R0.2 O=C(O)/C=C/COCCF db5f7eff06251f8978f4f7d07daa01c2 [2,0,0,0,0,0|2,0,0]=4 2249 B9R0.2 O=C(O)/C=C/COCCS 8a3013d354f5503b5682b578d368f0da [2,0,0,0,0,0|2,0,0]=4 2250 B9R0.2 O=C(O)C=CCNCCBr cf334d8d753b9386bfc69e4cfdf7de70 [2,0,0,0,0,0|2,0,0]=4 2251 B9R0.2 O=C(O)C=CCNCCF 777a9c85e85fbc73694a5651e8be607e [2,0,0,0,0,0|2,0,0]=4 2252 B9R0.2 O=C(O)C=CCNCCI 1b842602153f6c762c46e27cd24adee8 [2,0,0,0,0,0|2,0,0]=4 2253 B9R0.2 O=C(O)C=CCNCCO 9ade19e93c03b7906f649b0ba2e47aaa [2,0,0,0,0,0|2,0,0]=4 2254 B9R0.2 O=C(O)C=CCNCCS 6895181496316641d5fbe1ba3f2cbad9 [2,0,0,0,0,0|2,0,0]=4 2255 B9R0.2 O=C(O)C=CCOCCF 6a1cced9ceb263fe986a90f4d7cb48be [2,0,0,0,0,0|2,0,0]=4 2256 B9R0.2 O=C(O)C=CCOCCS 129f928d26e6fb7bee7caf0418eb6896 [2,0,0,0,0,0|2,0,0]=4 2257 B9R0.45 C/C=C/C=C/COCCC 8f1e48b4facc41411447438079f84a28 [2,0,0,0,0,0|1,0,1]=4 2258 B9R0.45 C/C=C/CCCOCCC 6078f7ffc27dfa8185f6236738ef681e [2,0,0,0,0,0|1,0,1]=4 2259 B9R0.45 C/C=C/CCOCCCC 34807d765a53dafaafda84290da499b4 [2,0,0,0,0,0|1,0,1]=4 2260 B9R0.45 C/C=C/CNCCCCC 173af57cfda70fbf416f0d5599bfa036 [2,0,0,0,0,0|1,0,1]=4 2261 B9R0.45 C/C=C/COCCCCC 802c5cbc78037013e3e1230ad72e88ef [2,0,0,0,0,0|1,0,1]=4 2262 B9R0.45 C/C=C\CCCNCCC bd38004b14a3ffe818d001cefe29aee7 [2,0,0,0,0,0|1,0,1]=4 2263 B9R0.45 C/C=C\CCCOCCC 083c73f409535e210af3eb7849dd56ad [2,0,0,0,0,0|1,0,1]=4 2264 B9R0.45 C/C=C\CNCCCCC 2ee64f407eb13d42c64dbdca505fc819 [2,0,0,0,0,0|1,0,1]=4 2265 B9R0.45 C/C=C\COCCCCC 49d9ba2c76d4226b734a25af963b3a40 [2,0,0,0,0,0|1,0,1]=4 2266 B9R0.45 C=C/C=C/CCNCCC 83f5e14c911827042616181b3195dbb3 [2,0,0,0,0,0|1,0,1]=4 2267 B9R0.45 CC/C=C/CCOCCC 0a76c2aa4cb5309f57046e961567e1f0 [2,0,0,0,0,0|1,0,1]=4 2268 B9R0.45 CC/C=C/CNCCCC 205e3a3cf2dfbd78bc9d1c77318f250d [2,0,0,0,0,0|1,0,1]=4 2269 B9R0.45 CC/C=C/COCCCC 9dcd55c6f51e3b003595f546e655282b [2,0,0,0,0,0|1,0,1]=4 2270 B9R0.45 CC/C=C\CCCOCC f3a75a504e13faa2cf8e35adf4ed3e3b [2,0,0,0,0,0|1,0,1]=4 2271 B9R0.45 CC/C=C\CCNCCC 3bbbe00683e3d998587775bf41dd95d1 [2,0,0,0,0,0|1,0,1]=4 2272 B9R0.45 CC/C=C\CCOCCC 5fdb5a65a47740420a9d274005a3115f [2,0,0,0,0,0|1,0,1]=4 2273 B9R0.45 CC/C=C\COCCCC 02179af6b133216a2e2f2900dac6b807 [2,0,0,0,0,0|1,0,1]=4 2274 B9R0.45 CC=C=CCCOCCC c98648b64a6bd61fce8033f3515764f0 [2,0,0,0,0,0|1,0,1]=4 2275 B9R0.45 CC=CC=CCOCCC 56450f7f936a8924869fea1d2e9622e7 [2,0,0,0,0,0|1,0,1]=4 2276 B9R0.45 CC=CCCCOCCC 544004ad9efa2af2fea80f1c7a474136 [2,0,0,0,0,0|1,0,1]=4 2277 B9R0.45 CC=CCNCCCCC 4ef4adafa1d8c573d6eb296bc442117e [2,0,0,0,0,0|1,0,1]=4 2278 B9R0.45 CC=CCOCCCCC 805449d8867d5a337059530a7812a078 [2,0,0,0,0,0|1,0,1]=4 2279 B9R0.45 CCCCCCCNC=O 9b073fb330d599f3dde0b2db41b840f2 [2,0,0,0,0,0|1,0,1]=4 2280 B9R0.45 CCCCCCNCC=O 7bf21a30ec03a5d95442fb7cb6f190b9 [2,0,0,0,0,0|1,0,1]=4 2281 B9R0.45 CCCCCCNCOC aba2e41598bd49d27de9d216a6960960 [2,0,0,0,0,0|1,0,1]=4 2282 B9R0.45 CCCCCCOCC=O bd855bb441849ecb00a1d491cea228b2 [2,0,0,0,0,0|1,0,1]=4 2283 B9R0.45 CCCCCCOCOC 6663dbbf181def3e6cf6b976451eb0e9 [2,0,0,0,0,0|1,0,1]=4 2284 B9R0.45 CCCCCNC/C=C\O a03bd9f596fd925d470752532a1e67bf [2,0,0,0,0,0|1,0,1]=4 2285 B9R0.45 CCCCOC/C=C/C=O 2da2f2ec693713191f08b0d2f08d4dd9 [2,0,0,0,0,0|1,0,0]=3 2286 B9R0.45 CCOCOC/C=C/C=O 7670264f072827a60bb468ebf074bc0c [2,0,0,0,0,0|2,0,0]=4 2287 B9R0.45 COCCOC/C=C/C=O 967f18e0ff39d9ac3e3f1923f75f6062 [2,0,0,0,0,0|2,0,0]=4 2288 B9R0.45 CSCCOC/C=C/C=O b4c56aba648070db4d17b4c5e68d691a [2,0,0,0,0,0|2,0,0]=4 2289 B9R0.45 O=C/C=C/COCCCF fcd18cdaba64e2c966479a4a46b113b7 [2,0,0,0,0,0|2,0,0]=4 2290 B9R0.45 O=C/C=C/COCCCS 4f5fd7cc130b52277441647b966078c4 [2,0,0,0,0,0|2,0,0]=4 2291 B9R0.46 C=C(CNCCCC)OC 9825a980fc85fa770a90f2c807e79cb3 [2,0,0,0,0,0|2,0,0]=4 2292 B9R0.46 C=C(COCCCC)OC 23a23683e3ff82dc0ce66f5c7735aae5 [2,0,0,0,0,0|2,0,0]=4 2293 B9R0.46 CCCCCNC(=O)CC 849a8920618781fdb82a0336e223971a [2,0,0,0,0,0|2,0,0]=4 2294 B9R0.46 CCCCNCC(=O)CC b2e0d743393b788f6d80972415374097 [2,0,0,0,0,0|2,0,0]=4 2295 B9R0.46 CCCCNCC(=O)NC 1e17cf9400576df78ba3d0bbd5e004b2 [2,0,0,0,0,0|2,0,0]=4 2296 B9R0.46 CCCCNCC(=O)OC 90edefb6d3a3ca213013f1f09af4da63 [2,0,0,0,0,0|1,0,0]=3 2297 B9R0.46 CCCCOCC(=O)CC 389316566cd1a1fc2f85978e15274242 [2,0,0,0,0,0|2,0,0]=4 2298 B9R0.46 CCCCOCC(=O)NC cf030b05ed543e346a9154767a28bae4 [2,0,0,0,0,0|2,0,0]=4 2299 B9R0.46 CCCCOCC(=O)OC 3a258f28efc16859d84bb30eb200cc4d [2,0,0,0,0,0|1,0,0]=3 2300 B9R0.46 CCCNCCC(=O)NC 15c9bd5d976b45d01c0fa363e53c356e [2,0,0,0,0,0|2,0,0]=4 2301 B9R0.46 CCCNCCC(=O)OC 05bc030a2f2408fd65b5ffca8abeab98 [2,0,0,0,0,0|1,0,0]=3 2302 B9R0.46 CCCNCOC(=O)OC f670b6fcf3cafadb01eab83cce01794d [2,0,0,0,0,0|2,0,0]=4 2303 B9R0.46 CCCOCCC(=O)NC 08e49cdbe7f26a9ed53ba2c0be49d187 [2,0,0,0,0,0|2,0,0]=4 2304 B9R0.46 CCCOCCC(=O)OC 630bff407b7c5972cdb6361bdad86547 [2,0,0,0,0,0|1,0,0]=3 2305 B9R0.46 CCCOCOC(=O)OC f08733c900934115c08d74dfad3e1662 [2,0,0,0,0,0|2,0,0]=4 2306 B9R0.46 CCNCCCC(=O)OC 8791db4546254853c1d2c8daf04e29f1 [2,0,0,0,0,0|1,0,0]=3 2307 B9R0.46 CCOC/C=C/C(=O)OC 768298698af36b745bc9dad60b33bf97 [2,0,0,0,0,0|1,0,0]=3 2308 B9R0.46 CCOCCCC(=O)NC 8b277ae760d242e65f64127caa0bf565 [2,0,0,0,0,0|2,0,0]=4 2309 B9R0.46 CCOCCOC(=O)OC b297131086651eb5dcd01a50837d46c4 [2,0,0,0,0,0|2,0,0]=4 2310 B9R0.46 CCOCNCC(=O)OC 27835f195b0bedba7d74a5f359d40b76 [2,0,0,0,0,0|2,0,0]=4 2311 B9R0.46 CCOCOCC(=O)OC 167c3e792b29957573aad87659d7bbe6 [2,0,0,0,0,0|2,0,0]=4 2312 B9R0.46 COC(=O)/C=C/COCF 14619ecef9c0e27816532aca1dafa54e [2,0,0,0,0,0|2,0,0]=4 2313 B9R0.46 COC(=O)CCCNCF e9250563d19357c2b217ddc01e5b54cc [2,0,0,0,0,0|2,0,0]=4 2314 B9R0.46 COC(=O)CCCNCO 7f4c543538d7d8c02923f8e5ee512b7d [2,0,0,0,0,0|2,0,0]=4 2315 B9R0.46 COC(=O)CCNCCBr 2e9d2d8ee2945dc03997f39ac9c22456 [2,0,0,0,0,0|2,0,0]=4 2316 B9R0.46 COC(=O)CCNCCF 2bfe6c663d75847c3cf0523a2f776449 [2,0,0,0,0,0|2,0,0]=4 2317 B9R0.46 COC(=O)CCNCCI f7228399f663e5c2847b83866d3779d1 [2,0,0,0,0,0|2,0,0]=4 2318 B9R0.46 COC(=O)CCNCCO 370144453eebf725a732ab3ac8cea44b [2,0,0,0,0,0|2,0,0]=4 2319 B9R0.46 COC(=O)CCNCCS 6b781ff091c75a1c77e9b99c78c0a8c2 [2,0,0,0,0,0|2,0,0]=4 2320 B9R0.46 COC(=O)CCNCSC f9cdc13e157a948defb075346b9d25c1 [2,0,0,0,0,0|2,0,0]=4 2321 B9R0.46 COC(=O)CCOCCF 628582c7630374a94e4bced8359c4233 [2,0,0,0,0,0|2,0,0]=4 2322 B9R0.46 COC(=O)CCOCCS 20528c74e4da9192ce01c8b31c16dba2 [2,0,0,0,0,0|2,0,0]=4 2323 B9R0.46 COC(=O)CCOCSC f8c9563c56621b9e36b8626b322b47d8 [2,0,0,0,0,0|2,0,0]=4 2324 B9R0.46 COC(=O)CNCCCCl 55e51726dd18a7f132b3e21305569abc [2,0,0,0,0,0|2,0,0]=4 2325 B9R0.46 COC(=O)CNCCCF e93d46be851bbddb3a2f9941aeed8ff2 [2,0,0,0,0,0|2,0,0]=4 2326 B9R0.46 COC(=O)CNCCCO 46abbcbf049316d92b11742c7ee09635 [2,0,0,0,0,0|2,0,0]=4 2327 B9R0.46 COC(=O)CNCCCS cea58286d3c1d454f8ec51cb225d8c9b [2,0,0,0,0,0|2,0,0]=4 2328 B9R0.46 COC(=O)CNCCSC 8c188a6ed92fc6374ee2a2dbcfcee1cb [2,0,0,0,0,0|2,0,0]=4 2329 B9R0.46 COC(=O)COCCCF eb4d08d12a32347963985a219a2436b3 [2,0,0,0,0,0|2,0,0]=4 2330 B9R0.46 COC(=O)COCCCS cead342093671334804d8e04218fd18f [2,0,0,0,0,0|2,0,0]=4 2331 B9R0.46 COC(=O)COCCSC f6bc7966168712e9ed4ac4cc1e9f6f92 [2,0,0,0,0,0|2,0,0]=4 2332 B9R0.46 COCCNCC(=O)OC c9c694c5a89b651170c8ff4da2275f98 [2,0,0,0,0,0|2,0,0]=4 2333 B9R0.46 COCCOCC(=O)OC 2c6ae10da48fe440860bfbd6b88c257a [2,0,0,0,0,0|2,0,0]=4 2334 B9R0.46 COCNCCC(=O)OC ce81a92d5ba5f01cc4823c162f22f501 [2,0,0,0,0,0|2,0,0]=4 2335 B9R0.46 COCOCCC(=O)OC 6aede0cdfec6dbd64f8c4300c142c36f [2,0,0,0,0,0|2,0,0]=4 2336 B11R0.2 CCCCCCC(C)NC(=O)C 7d2594c88fb8150c121e8324175f88c5 [1,1,0,0,0,0|1,0,1]=4 2337 B11R0.2 CCCCCCN(C)CC(=O)O fffbd83ababffa159958606d9a112cce [1,1,0,0,0,0|1,0,1]=4 2338 B11R0.2 CCCCCC[C@@H](C)NC(=O)C af528d8f66525ad70454e456f4855ab6 [1,1,0,0,0,0|1,0,1]=4 2339 B11R0.2 CCCCCC[C@H](C)NC(=O)C 4ac5ea84352b83ba49d889143f6264a1 [1,1,0,0,0,0|1,0,1]=4 2340 B11R0.2 CCCCCNC(=O)/C=C(/C)\Cl 8f94c10cdfeece593e76e19ea58097fa [1,1,0,0,0,0|2,0,0]=4 2341 B11R0.2 CCCCCNC(=O)/C=C(/C)\I 291c9e92043fb697d65a231eebee929e [1,1,0,0,0,0|2,0,0]=4 2342 B11R0.2 CCCCCNC(=O)/C=C(\C)/Cl f5f438e08f990cbca50a72e04eb83e74 [1,1,0,0,0,0|2,0,0]=4 2343 B11R0.2 CCCCCNC(=O)C=C(C)C dcf40b5f1c3e670ba807e767e8d9896a [1,1,0,0,0,0|2,0,0]=4 2344 B11R0.2 CCCCCNC(=O)C=C(C)I f7d7ee33b8c575fc7d4f840c0ffffbb0 [1,1,0,0,0,0|2,0,0]=4 2345 B11R0.2 CCCCCNC(=O)CC(=O)C b9f6fefcf600ebaa9b87d233da70a209 [1,1,0,0,0,0|1,0,1]=4 2346 B11R0.2 CCCCNCC(=O)CC(=O)O 924460e29012324689885e436a9da05b [1,1,0,0,0,0|1,0,1]=4 2347 B11R0.2 CCCCNCC(=O)NC(=O)C 3122c35763ea525e04ff40c5c237fa8f [1,1,0,0,0,0|2,0,0]=4 2348 B11R0.2 CCCCOCC(=O)CC(=O)O bee6e58f12e6a46c40700c754be2d5be [1,1,0,0,0,0|1,0,1]=4 2349 B11R0.2 CCCCOCC(=O)NC(=O)C 8fcc44ec0ea259ebb00ddb84e45f3341 [1,1,0,0,0,0|2,0,0]=4 2350 B11R0.30 C=C(C)CCNC/C=C/C(=O)O 92ccba483c2540e8af788f8c04881731 [1,1,0,0,0,0|1,0,1]=4 2351 B11R0.30 C=C(C)CCNCC=CC(=O)O 586d62fa3b178f4164b79863fa9a5a50 [1,1,0,0,0,0|1,0,1]=4 2352 B11R0.30 C=C(C)CCOC/C=C/C(=O)O e4be49c8174c9633890989c3132deffc [1,1,0,0,0,0|1,0,1]=4 2353 B11R0.30 C=C(C)CCOCC=CC(=O)O e7cbd028ee2db05e30b23a2b5a7789c6 [1,1,0,0,0,0|1,0,1]=4 2354 B11R0.30 CC(=O)CCNC/C=C/C(=O)O 7a4ebd59e5ad3afb9cf8df65ebf4eac8 [1,1,0,0,0,0|1,0,1]=4 2355 B11R0.30 CC(=O)CCNCC=CC(=O)O 0484146d167f36793199f5aa719b70a3 [1,1,0,0,0,0|1,0,1]=4 2356 B11R0.30 CC(=O)CCOC/C=C/C(=O)O d388876d0b84f9808b8712bb0816c66e [1,1,0,0,0,0|1,0,1]=4 2357 B11R0.30 CC(=O)CCOCC=CC(=O)O d983ebf27e9af0eefce348505ae76e32 [1,1,0,0,0,0|1,0,1]=4 2358 B11R0.30 CC(=O)CNCCCCC(C)C 3d35a05533fd3f24af80d939dcafa2e5 [1,1,0,0,0,0|1,0,1]=4 2359 B11R0.30 CC(=O)CNCCCCC(C)O 15573be76016b8f7bd0e839b5556feb2 [1,1,0,0,0,0|1,0,1]=4 2360 B11R0.30 CC(=O)CNCCCC[C@@H](C)O 873c419bc007215fffd2c2568d78654b [1,1,0,0,0,0|1,0,1]=4 2361 B11R0.30 CC(=O)COCCCCC(C)C d7852fa28391ec3ec73b1da98f42a6dc [1,1,0,0,0,0|1,0,1]=4 2362 B11R0.30 CC(=O)NCCCCCC(C)C 0c729d95049ba0127ccadd97d26dcf95 [1,1,0,0,0,0|1,0,1]=4 2363 B11R0.30 CC(C)CCCCNCC(=O)O 39a93d590261e532e6f29909d3f91c16 [1,1,0,0,0,0|1,0,1]=4 2364 B11R0.30 CC(C)CCCCOCC(=O)O 11166f2d7cea686a04aab0f10eb2bc17 [1,1,0,0,0,0|1,0,1]=4 2365 B11R0.30 CC(C)CCNC/C=C/C(=O)O fa63abb5997eabfb03710616e719a9b8 [1,1,0,0,0,0|1,0,0]=3 2366 B11R0.30 CC(C)CCNCC=CC(=O)O 5d064a4bf1b9a689999d5b018a17ab99 [1,1,0,0,0,0|1,0,0]=3 2367 B11R0.30 CC(C)CCOC/C=C/C(=O)O 94e0c1a3e10cd77e400f92e197de04cb [1,1,0,0,0,0|1,0,0]=3 2368 B11R0.30 CC(C)CCOCC=CC(=O)O 4d106b42924e0cfb160e498848c9ae36 [1,1,0,0,0,0|1,0,0]=3 2369 B11R0.30 CC(C)OCNC/C=C/C(=O)O e2d2b5250777cc9e10a235691540455f [1,1,0,0,0,0|2,0,0]=4 2370 B11R0.30 CC(C)OCNCC=CC(=O)O 20b7ba7a2d811825eeeae859d7100287 [1,1,0,0,0,0|2,0,0]=4 2371 B11R0.30 CC(C)OCOC/C=C/C(=O)O f46feed19e566a9439882ebe17e169c3 [1,1,0,0,0,0|2,0,0]=4 2372 B11R0.30 CC(C)OCOCC=CC(=O)O c930fc4688032b2d1ce0e95474c04904 [1,1,0,0,0,0|2,0,0]=4 2373 B11R0.30 CC(O)CCCCNCC(=O)O 8ace7019a75bd4e3f2fa1cdb39804ad3 [1,1,0,0,0,0|1,0,1]=4 2374 B11R0.30 CC(O)CCNC/C=C/C(=O)O ff4039671f1a2fe67eac4568eec990e2 [1,1,0,0,0,0|1,0,0]=3 2375 B11R0.30 CC(O)CCNCC=CC(=O)O 0bbfeaa4f635841b12779c3330dedf0d [1,1,0,0,0,0|1,0,0]=3 2376 B11R0.30 CN(C)CCNC/C=C/C(=O)O b59e1c48f62d20f8875fe4bc38b44d98 [1,1,0,0,0,0|2,0,0]=4 2377 B11R0.30 CN(C)CCNCC=CC(=O)O b2a4941c0c31339819e3d8f8740b11df [1,1,0,0,0,0|2,0,0]=4 2378 B11R0.30 CN(C)CCOC/C=C/C(=O)O 54a3c968d795fa762ca1d3cd4c05fd00 [1,1,0,0,0,0|2,0,0]=4 2379 B11R0.30 CN(C)CCOCC=CC(=O)O 0818ebda45a3f54e57dc80a6df7bb76e [1,1,0,0,0,0|2,0,0]=4 2380 B11R0.30 CS(=O)CCNC/C=C/C(=O)O 6d1925ee8f84319b7923216f0d088677 [1,1,0,0,0,0|2,0,0]=4 2381 B11R0.30 CS(=O)CCNCC=CC(=O)O e04492d846c7dba262e649e361bd27f3 [1,1,0,0,0,0|2,0,0]=4 2382 B11R0.30 CS(=O)CCOC/C=C/C(=O)O 29b5144ccb5de7d3f3167faaaf9907e9 [1,1,0,0,0,0|2,0,0]=4 2383 B11R0.30 CS(=O)CCOCC=CC(=O)O acf5cbf2669f576b9cb799915dc10d8a [1,1,0,0,0,0|2,0,0]=4 2384 B11R0.30 C[C@@H](O)CCCCNCC(=O)O 383e38e7bfaf5340113526b5bf38e00f [1,1,0,0,0,0|1,0,1]=4 2385 B11R0.30 C[C@@H](O)CCNC/C=C/C(=O)O 30b71662652ec825e0d2f410fdd87d6f [1,1,0,0,0,0|1,0,0]=3 2386 B11R0.30 C[C@@H](O)CCNCC=CC(=O)O f360a56877ffb450b663d0814aa189e7 [1,1,0,0,0,0|1,0,0]=3 2387 B11R0.30 C[C@H](O)CCNC/C=C/C(=O)O cc81c78642631427523d8805454150c6 [1,1,0,0,0,0|1,0,0]=3 2388 B11R0.30 C[C@H](O)CCNCC=CC(=O)O c5701a53f40362cdc009cd75637dd9ff [1,1,0,0,0,0|1,0,0]=3 2389 B11R0.30 O=C(O)/C=C/CNCCC(F)F eaad201ef39c00b053d5857fa2463051 [1,1,0,0,0,0|2,0,0]=4 2390 B11R0.30 O=C(O)/C=C/COCCC(F)F 2ef514b32914797f21dd596bd6653500 [1,1,0,0,0,0|2,0,0]=4 2391 B11R0.30 O=C(O)C=CCNCCC(F)F faed1578dfe4c42e323ce032db53aa42 [1,1,0,0,0,0|2,0,0]=4 2392 B11R0.30 O=C(O)C=CCOCCC(F)F cb71f00d4b093e938498ff4cdffeb005 [1,1,0,0,0,0|2,0,0]=4 2393 B11R0.42 C=C(C)C(=O)NCCCCCC 68147d1975557dda6de2c0965669be47 [1,1,0,0,0,0|2,0,0]=4 2394 B11R0.42 C=C(CNCCCCC)C(=O)O 3961ad8178fe871479ff4ea92189d193 [1,1,0,0,0,0|1,0,1]=4 2395 B11R0.42 C=C(COCCCCC)C(=O)O b11d9270348f2e3567924ca4886b501a [1,1,0,0,0,0|1,0,1]=4 2396 B11R0.42 CC(=O)C(=O)NCCCCCCl fddc07f285051e2dd59816de6471855e [1,1,0,0,0,0|2,0,0]=4 2397 B11R0.42 CC(=O)C(=O)NCCCCCO 28e907c50b388737fc62d14cbaaf3e94 [1,1,0,0,0,0|2,0,0]=4 2398 B11R0.42 CCCCCCCN(C)C(=O)C 1f4b637e30d478d227f74fe9a9d54418 [1,1,0,0,0,0|1,0,1]=4 2399 B11R0.42 CCCCCCNC(=O)C(=O)C b07a5b70d65808d226682db1c7b04c9b [1,1,0,0,0,0|1,0,0]=3 2400 B11R0.42 CCCCCCNC(=O)C(=O)N 5dbc13ca445f208f9832b31601bd8cbd [1,1,0,0,0,0|2,0,0]=4 2401 B11R0.42 CCCCCCNC(C)C(=O)C 7e4aea5d747cb726d6c6aeddee61064c [1,1,0,0,0,0|1,0,1]=4 2402 B11R0.42 CCCCCCNC(C)C(=O)O 50bfa12bfc8c95b1997dd92553c2e32b [1,1,0,0,0,0|1,0,1]=4 2403 B11R0.42 CCCCCCNC(O)C(=O)O d5631789bd7704646a19262486df8915 [1,1,0,0,0,0|1,0,1]=4 2404 B11R0.42 CCCCCCN[C@@H](C)C(=O)O 395de785801e54e5b92d8ae30cfb56de [1,1,0,0,0,0|1,0,1]=4 2405 B11R0.42 CCCCCCN[C@H](C)C(=O)O 49da1238680c9629cec61a676283fa13 [1,1,0,0,0,0|1,0,1]=4 2406 B11R0.42 CCCCCCOC(C)C(=O)C 3bdd6256cac5c3ad22aec5aadbdcce6a [1,1,0,0,0,0|1,0,1]=4 2407 B11R0.42 CCCCCCOC(C)C(=O)O ba21e8aa3b32a1583572a63691edc513 [1,1,0,0,0,0|1,0,1]=4 2408 B11R0.42 CCCCCCOC(F)C(=O)O 6513d7d3184867dd4d6531ac1435f34c [1,1,0,0,0,0|1,0,1]=4 2409 B11R0.42 CCCCCCO[C@@H](C)C(=O)O 71ae583b09335f51d5b93320f22a9636 [1,1,0,0,0,0|1,0,1]=4 2410 B11R0.42 CCCCCCO[C@@H](F)C(=O)O bc9bab01eee21fa811102268d0d068e6 [1,1,0,0,0,0|1,0,1]=4 2411 B11R0.42 CCCCCCO[C@H](C)C(=O)O 30eec93387a99e6543ce01b336b219ad [1,1,0,0,0,0|1,0,1]=4 2412 B11R0.42 CCCCCNCC(=O)C(=O)C 3fd0f918504fc1b0d0ce1bf4d6ea827b [1,1,0,0,0,0|1,0,1]=4 2413 B11R0.42 CCCCCNCC(=O)C(=O)O 334ba3ab0d0b0c071ce9583c7fda34fb [1,1,0,0,0,0|1,0,1]=4 2414 B11R0.42 CCCCCOCC(=O)C(=O)C ab756c609cd1243433b3bef61119a1b5 [1,1,0,0,0,0|1,0,1]=4 2415 B11R0.42 CCCOCCNC(=O)C(=O)C ad0cbc05777cd31baa3bb05ba09cc6bc [1,1,0,0,0,0|2,0,0]=4 2416 B11R0.42 CCOCCCNC(=O)C(=O)C c367a9826dd47a9dc7da2eb60617c78e [1,1,0,0,0,0|2,0,0]=4 2417 B11R0.42 COCCCCNC(=O)C(=O)C 0b6a17ec0be03d7863af8ad23856b4d1 [1,1,0,0,0,0|2,0,0]=4 2418 B11R0.42 CSCCCCNC(=O)C(=O)C 4252638cef315a5d40911f04e881eb63 [1,1,0,0,0,0|2,0,0]=4 2419 B11R0.46 CCCCCC(C)NCC(=O)C 3b744ffccb982ef0751d36a0d377f99f [1,1,0,0,0,0|1,0,1]=4 2420 B11R0.46 CCCCCC(C)NCC(=O)O 1bfdcef2296e34b5c0fe308e42cf1372 [1,1,0,0,0,0|1,0,1]=4 2421 B11R0.46 CCCCCC(C)OCC(=O)C f5ec04e321ea7339d1ec164595b99541 [1,1,0,0,0,0|1,0,1]=4 2422 B11R0.46 CCCCCC(C)OCC(=O)O 57324f0b00c57fa34b0ceda6a018e6d9 [1,1,0,0,0,0|1,0,1]=4 2423 B11R0.46 CCCCC[C@@H](C)OCC(=O)O 977fea29395a7a8bfc512e7fc52361b2 [1,1,0,0,0,0|1,0,1]=4 2424 B11R0.46 CCCCC[C@H](C)NCC(=O)C 2180a0169e98281e3cac31743e458333 [1,1,0,0,0,0|1,0,1]=4 2425 B11R0.46 CCCCC[C@H](C)NCC(=O)O 0380343a2030d4f567471addb377c0f8 [1,1,0,0,0,0|1,0,1]=4 2426 B11R0.46 CCCCC[C@H](C)OCC(=O)C 96ee3e27225025e413cc06c320c2b0ba [1,1,0,0,0,0|1,0,1]=4 2427 B11R0.46 CCCCC[C@H](C)OCC(=O)O 2b403272079d6041b1d247155ecbff7c [1,1,0,0,0,0|1,0,1]=4 2428 B11R0.46 CCCCNC(=O)/C=C/C(=O)C f2a1b7c0777bb55c2645997d25406829 [1,1,0,0,0,0|1,0,1]=4 2429 B11R0.46 CCCCNC(=O)C=CC(=O)C 299237cc5690da7af4c65824457c27a3 [1,1,0,0,0,0|1,0,1]=4 2430 B11R0.111 C=C(CC)CNC/C=C/C(=O)O 48848c3ebe29cad61af921429f245d9f [1,1,0,0,0,0|1,0,1]=4 2431 B11R0.111 C=C(CC)CNCC=CC(=O)O 0b17bb444bfe0b55cfb31b6abf60e392 [1,1,0,0,0,0|1,0,1]=4 2432 B11R0.111 C=C(CC)COC/C=C/C(=O)O a795f0e36c12baa3cee03e09c9019b3a [1,1,0,0,0,0|1,0,1]=4 2433 B11R0.111 C=C(CC)COCC=CC(=O)O d372919b7aab935edd40dc95d1868252 [1,1,0,0,0,0|1,0,1]=4 2434 B11R0.111 CC(CO)CNC/C=C/C(=O)O d557f9ed0ce1b096f5bc7d4449f10863 [1,1,0,0,0,0|2,0,0]=4 2435 B11R0.111 CC(CO)CNCC=CC(=O)O 33daca8ffc536091d2f94839caad47a5 [1,1,0,0,0,0|2,0,0]=4 2436 B11R0.111 CCC(=O)CNC/C=C/C(=O)O 67a00c3f7d7fc1e94af7af29943971c4 [1,1,0,0,0,0|1,0,1]=4 2437 B11R0.111 CCC(=O)CNCC=CC(=O)O 15a53e93d23ed9d997bc0e086e8b7631 [1,1,0,0,0,0|1,0,1]=4 2438 B11R0.111 CCC(=O)COC/C=C/C(=O)O 321ac298e220290ce5fb8066e66a278c [1,1,0,0,0,0|1,0,1]=4 2439 B11R0.111 CCC(=O)COCC=CC(=O)O e107ee59e6363e3e2537c876083e3105 [1,1,0,0,0,0|1,0,1]=4 2440 B11R0.111 CCC(C)CCCOCC(=O)O 0499bf36e08b4b6291cbe67911409c42 [1,1,0,0,0,0|1,0,1]=4 2441 B11R0.111 CCC(C)CNC/C=C/C(=O)O 0255b60ec070d03632a088f8c86b1dfe [1,1,0,0,0,0|1,0,0]=3 2442 B11R0.111 CCC(C)CNCC=CC(=O)O f38167d42e5ca61045151bdcb52bbc8c [1,1,0,0,0,0|1,0,0]=3 2443 B11R0.111 CCC(C)COC/C=C/C(=O)O 4c92d47bce625a2c9fce344a06a0ebce [1,1,0,0,0,0|1,0,0]=3 2444 B11R0.111 CCC(C)COCC=CC(=O)O 26458d91b1882576ae8bf839ba2f705c [1,1,0,0,0,0|1,0,0]=3 2445 B11R0.111 CCC(O)CNC/C=C/C(=O)O 8aeb611295105d615ce56505960fdf7a [1,1,0,0,0,0|1,0,0]=3 2446 B11R0.111 CCC(O)CNCC=CC(=O)O 3ef5cb0e7045d0f90786f1bb803a8b76 [1,1,0,0,0,0|1,0,0]=3 2447 B11R0.111 CC[C@@H](C)CNC/C=C/C(=O)O 66653f72f10f472206fb8f1215740f20 [1,1,0,0,0,0|1,0,0]=3 2448 B11R0.111 CC[C@@H](C)CNCC=CC(=O)O 4283fc0eb6b53923260f32bffcc3e900 [1,1,0,0,0,0|1,0,0]=3 2449 B11R0.111 CC[C@@H](C)COC/C=C/C(=O)O 098ee90133b1ace28eda75551862d410 [1,1,0,0,0,0|1,0,0]=3 2450 B11R0.111 CC[C@@H](C)COCC=CC(=O)O c315ff68d7e1ea1c6186424e615c29d4 [1,1,0,0,0,0|1,0,0]=3 2451 B11R0.111 CC[C@@H](O)CNC/C=C/C(=O)O b97d306281929e83a4cf68b00053347d [1,1,0,0,0,0|1,0,0]=3 2452 B11R0.111 CC[C@@H](O)CNCC=CC(=O)O da1ffd5e72cd7b8fe264fb6cef92a991 [1,1,0,0,0,0|1,0,0]=3 2453 B11R0.111 CC[C@H](C)CCCOCC(=O)O 650fab3a57b034a98a3481ab37720e3e [1,1,0,0,0,0|1,0,1]=4 2454 B11R0.111 CC[C@H](C)CNC/C=C/C(=O)O 3b22511fcc3bde06b8edcbb00ae18cd0 [1,1,0,0,0,0|1,0,0]=3 2455 B11R0.111 CC[C@H](C)CNCC=CC(=O)O 274e1879bf1bf0e64414aa40a266cab9 [1,1,0,0,0,0|1,0,0]=3 2456 B11R0.111 CC[C@H](C)COC/C=C/C(=O)O c70fa5f6d8f9632923a898fea1c1ed11 [1,1,0,0,0,0|1,0,0]=3 2457 B11R0.111 CC[C@H](C)COCC=CC(=O)O fa72e408e4268cb94fdc21f1e4932e24 [1,1,0,0,0,0|1,0,0]=3 2458 B11R0.111 COC(C)CNC/C=C/C(=O)O e391710691edb462633b98c1592dd3a7 [1,1,0,0,0,0|2,0,0]=4 2459 B11R0.111 COC(C)CNCC=CC(=O)O a9eee212ef641799c884e089ae2cede8 [1,1,0,0,0,0|2,0,0]=4 2460 B11R0.111 COC(C)COC/C=C/C(=O)O 61e17fd3918d274f0fcb19fd3614dd80 [1,1,0,0,0,0|2,0,0]=4 2461 B11R0.111 COC(C)COCC=CC(=O)O 9885bb5156c16b6c70730a1009517e77 [1,1,0,0,0,0|2,0,0]=4 2462 B11R0.111 CO[C@@H](C)CNC/C=C/C(=O)O bdbc2012cac056fcf91ce2490c98fda1 [1,1,0,0,0,0|2,0,0]=4 2463 B11R0.111 CO[C@@H](C)CNCC=CC(=O)O a486958f84ae38fb1b9c08f35e19991f [1,1,0,0,0,0|2,0,0]=4 2464 B11R0.111 CO[C@@H](C)COC/C=C/C(=O)O 14d921fb699530d61c5911c403f4a9cd [1,1,0,0,0,0|2,0,0]=4 2465 B11R0.111 CO[C@@H](C)COCC=CC(=O)O 3d7b93aae4c0d323fabdc882e6bf96dd [1,1,0,0,0,0|2,0,0]=4 2466 B11R0.111 CO[C@H](C)CNC/C=C/C(=O)O 23c8eea9379b20007693f676fb1b3d21 [1,1,0,0,0,0|2,0,0]=4 2467 B11R0.111 CO[C@H](C)CNCC=CC(=O)O 7d789211d3174aa613f33b19230bc063 [1,1,0,0,0,0|2,0,0]=4 2468 B11R0.111 CO[C@H](C)COC/C=C/C(=O)O e6e7e885100b4165a7e29655b1ba9190 [1,1,0,0,0,0|2,0,0]=4 2469 B11R0.111 CO[C@H](C)COCC=CC(=O)O a8bb5c5bf67ea29127a1e372bd57b7b6 [1,1,0,0,0,0|2,0,0]=4 2470 B11R0.111 C[C@@H](CO)CNC/C=C/C(=O)O 89ae846e44f8baf01a9da7696dfaeb2b [1,1,0,0,0,0|2,0,0]=4 2471 B11R0.111 C[C@@H](CO)CNCC=CC(=O)O 9d4b67330d936e35dce5c300e8a96c4c [1,1,0,0,0,0|2,0,0]=4 2472 B11R0.111 C[C@H](CO)CNC/C=C/C(=O)O 09e8f9fdd8ce051e85d4f532b3bd76a4 [1,1,0,0,0,0|2,0,0]=4 2473 B11R0.111 C[C@H](CO)CNCC=CC(=O)O 66dcacfb24f65972b1351c8af50e2ba9 [1,1,0,0,0,0|2,0,0]=4 2474 B11R0.111 O=C(O)/C=C/CNCC(Br)CBr 8a495986fc2e616e464c323193856788 [1,1,0,0,0,0|2,0,0]=4 2475 B11R0.111 O=C(O)/C=C/CNCC(F)CO 9b52e4dce0cf02cca6542cb88c364376 [1,1,0,0,0,0|2,0,0]=4 2476 B11R0.111 O=C(O)/C=C/CNCC(O)CF 440144fbeeae00e0dfc299ebcf6f1844 [1,1,0,0,0,0|2,0,0]=4 2477 B11R0.111 O=C(O)/C=C/CNCC(O)CO d2e3c5dc68d24c93f2fcaa8271fbacff [1,1,0,0,0,0|2,0,0]=4 2478 B11R0.111 O=C(O)/C=C/CNC[C@@H](F)CO 0d824748c60ceb1adbff5dbf8695be69 [1,1,0,0,0,0|2,0,0]=4 2479 B11R0.111 O=C(O)/C=C/CNC[C@@H](O)CO d00d29991ef15bd3c630606130e81519 [1,1,0,0,0,0|2,0,0]=4 2480 B11R0.111 O=C(O)/C=C/CNC[C@H](F)CO 034094fac7be5ed60863007fb2d60684 [1,1,0,0,0,0|2,0,0]=4 2481 B11R0.111 O=C(O)/C=C/CNC[C@H](O)CO ffac01ba20b665e4a9ffe978f4a5c661 [1,1,0,0,0,0|2,0,0]=4 2482 B11R0.111 O=C(O)/C=C/COCC(Br)CBr 7f040fb4917d48b7d14a212ffbb02188 [1,1,0,0,0,0|2,0,0]=4 2483 B11R0.111 O=C(O)/C=C/COCC(Cl)CCl 5b1adfc8958269d30c44fe20e59a0c3c [1,1,0,0,0,0|2,0,0]=4 2484 B11R0.111 O=C(O)/C=C/COCC(O)CO 5aaed627af4139209adcaa9edd049e4a [1,1,0,0,0,0|2,0,0]=4 2485 B11R0.111 O=C(O)/C=C/COCC(S)CS b02aeb5ee0123bf06e6c036adaebac15 [1,1,0,0,0,0|2,0,0]=4 2486 B11R0.111 O=C(O)/C=C/COC[C@@H](O)CO ebc16253ebe7677ac4eed7c2551b5396 [1,1,0,0,0,0|2,0,0]=4 2487 B11R0.111 O=C(O)/C=C/COC[C@H](O)CO 0eb99ff8ca0e8b8f8074c8c773565205 [1,1,0,0,0,0|2,0,0]=4 2488 B11R0.111 O=C(O)C=CCNCC(Br)CBr ef8ce8bcd8a94093a70da2b0a8fb5c31 [1,1,0,0,0,0|2,0,0]=4 2489 B11R0.111 O=C(O)C=CCNCC(F)CO 9d7bcdf4edee40a136fdf10e2fa5c4b1 [1,1,0,0,0,0|2,0,0]=4 2490 B11R0.111 O=C(O)C=CCNCC(O)CF 39e10f74b7acd914829da05afa9dc923 [1,1,0,0,0,0|2,0,0]=4 2491 B11R0.111 O=C(O)C=CCNCC(O)CO 436c8020cadfb8f76d35d85ff685e934 [1,1,0,0,0,0|2,0,0]=4 2492 B11R0.111 O=C(O)C=CCNC[C@@H](F)CO 3ca5fc438d209d2b8081cb3dfd656e1e [1,1,0,0,0,0|2,0,0]=4 2493 B11R0.111 O=C(O)C=CCNC[C@@H](O)CO d280b1d29d212c575386f5ef93b6651a [1,1,0,0,0,0|2,0,0]=4 2494 B11R0.111 O=C(O)C=CCNC[C@H](F)CO 035fa4b80a9f3774a2e3f1253dbc5f27 [1,1,0,0,0,0|2,0,0]=4 2495 B11R0.111 O=C(O)C=CCNC[C@H](O)CO f1c851552e5e30f03a6d6b5f704431b0 [1,1,0,0,0,0|2,0,0]=4 2496 B11R0.111 O=C(O)C=CCOCC(Br)CBr 57045059a17ed46cdd447ad9b4d96752 [1,1,0,0,0,0|2,0,0]=4 2497 B11R0.111 O=C(O)C=CCOCC(Cl)CCl 0a9bb674c994f7fb479739d103b1857c [1,1,0,0,0,0|2,0,0]=4 2498 B11R0.111 O=C(O)C=CCOCC(O)CO 29358225dc8b9418fca411908cae08c4 [1,1,0,0,0,0|2,0,0]=4 2499 B11R0.111 O=C(O)C=CCOCC(S)CS 228a0004d13a9ebc07ec59407de9ed42 [1,1,0,0,0,0|2,0,0]=4 2500 B11R0.111 O=C(O)C=CCOC[C@@H](O)CO b502ee5c0fe744976e8f4f2c438648d6 [1,1,0,0,0,0|2,0,0]=4 2501 B11R0.111 O=C(O)C=CCOC[C@H](O)CO db5bccf7c8d4c232433984fab9d45d3e [1,1,0,0,0,0|2,0,0]=4 2502 B11R0.147 CCCCC(C)COCC(=O)O 9ef64333eda5ab77446d850437b4b702 [1,1,0,0,0,0|1,0,1]=4 2503 B11R0.147 CCCCC(O)CNCC(=O)O 12d23a216214115c26b91a124bcfe6f6 [1,1,0,0,0,0|1,0,1]=4 2504 B11R0.147 CCCCN(C)C/C=C/C(=O)O 1468e44538bb2dcf9e68348869022de5 [1,1,0,0,0,0|1,0,0]=3 2505 B11R0.147 CCCCN(C)CC=CC(=O)O 91523936f35958628669ae3746fa7c61 [1,1,0,0,0,0|1,0,0]=3 2506 B11R0.147 CN(C/C=C/C(=O)O)CCCO c1f2d86f29c9d6c6b13fb17e5971e39f [1,1,0,0,0,0|2,0,0]=4 2507 B11R0.147 CN(CC=CC(=O)O)CCCO 768b3eaf55c06eb4d6d7500a8960cfab [1,1,0,0,0,0|2,0,0]=4 2508 B11R0.147 COCCN(C)C/C=C/C(=O)O 6a6f940a822d39721b48c8a2bfd5538c [1,1,0,0,0,0|2,0,0]=4 2509 B11R0.147 COCCN(C)CC=CC(=O)O 24b0da4c881f9e75deed9bb0944ffb33 [1,1,0,0,0,0|2,0,0]=4 2510 B11R0.147 CSCCN(C)C/C=C/C(=O)O eadc465c0c24ba3695cdb5b4dfa8e34e [1,1,0,0,0,0|2,0,0]=4 2511 B11R0.147 CSCCN(C)CC=CC(=O)O 1a7478ce6518a9f0744bf589f7503267 [1,1,0,0,0,0|2,0,0]=4 2512 B11R0.148 C#CCCCNC/C=C/C(=O)O f74687b1151ab5fd2880c5eac2d31684 [1,1,0,0,0,0|0,0,2]=4 2513 B11R0.148 C#CCCCNCC=CC(=O)O bfae833a7e6c388d59f0a66cfd3766e6 [1,1,0,0,0,0|0,0,2]=4 2514 B11R0.148 C#CCCCOC/C=C/C(=O)O 197143ae268ffddab3665bde5a2ffa39 [1,1,0,0,0,0|0,0,2]=4 2515 B11R0.148 C#CCCCOCC=CC(=O)O 8410a54feee04b8b7e86761984d08021 [1,1,0,0,0,0|0,0,2]=4 2516 B11R0.148 C/C=C/CCOC/C=C/C(=O)O 606d0f701a07c0c4475b91fdbdfc1a9a [1,1,0,0,0,0|0,0,2]=4 2517 B11R0.148 C/C=C/CCOCC=CC(=O)O 784eeb6c6290525c6fc12db91b8d922b [1,1,0,0,0,0|0,0,2]=4 2518 B11R0.148 C=CCCCNC/C=C/C(=O)O 695eb5b879ef112254d8472c5c81590f [1,1,0,0,0,0|0,0,2]=4 2519 B11R0.148 C=CCCCNCC=CC(=O)O 33c547c9b97867554b825bd3a114e821 [1,1,0,0,0,0|0,0,2]=4 2520 B11R0.148 C=CCCCOC/C=C/C(=O)O 7f5651032be352ae0f248e7ad12aeced [1,1,0,0,0,0|0,0,2]=4 2521 B11R0.148 C=CCCCOCC=CC(=O)O ad8d400e558020a645a644f4b1f1ac38 [1,1,0,0,0,0|0,0,2]=4 2522 B11R0.148 CC#CCCOC/C=C/C(=O)O c3fc375a643e7b71cab1c4cd0a3d217a [1,1,0,0,0,0|0,0,2]=4 2523 B11R0.148 CC#CCCOCC=CC(=O)O 5ad377f75fa067fdd7332bc816043b5f [1,1,0,0,0,0|0,0,2]=4 2524 B11R0.148 CC(=O)CNCCCCCCF e5220e4b1eb66b48d5fb2be647d0f093 [1,1,0,0,0,0|1,0,1]=4 2525 B11R0.148 CC(=O)CNCCCCCCO 5ae8b5dcf45a271724ef32cc715e5de7 [1,1,0,0,0,0|1,0,1]=4 2526 B11R0.148 CC(=O)COCCCCCCF f9ddf83656d1768dec73eb1308c462ef [1,1,0,0,0,0|1,0,1]=4 2527 B11R0.148 CC(=O)NCCCCCCCO 375247c5b76fff4f96757dfebee6b6e0 [1,1,0,0,0,0|1,0,1]=4 2528 B11R0.148 CC/C=C/CNC/C=C/C(=O)O 9edd9485d2f9b2479dbf056f07ca8262 [1,1,0,0,0,0|0,0,2]=4 2529 B11R0.148 CC/C=C/CNCC=CC(=O)O 4a12aba1e077762b686f208103d0481d [1,1,0,0,0,0|0,0,2]=4 2530 B11R0.148 CC/C=C/COC/C=C/C(=O)O b8dcf5244c49adb761a42bf218ba4ded [1,1,0,0,0,0|0,0,2]=4 2531 B11R0.148 CC/C=C/COCC=CC(=O)O 13d216e9aca2109b69dcffe44c2821ff [1,1,0,0,0,0|0,0,2]=4 2532 B11R0.148 CC/C=C\COC/C=C/C(=O)O 2ca5df9cb5d121cceb424d6fac1e5562 [1,1,0,0,0,0|0,0,2]=4 2533 B11R0.148 CC/C=C\COCC=CC(=O)O 69fa57298619c67031dde1e4922e761b [1,1,0,0,0,0|0,0,2]=4 2534 B11R0.148 CCC#CCNC/C=C/C(=O)O f10173323f8d0f673a0dbd892d82562a [1,1,0,0,0,0|0,0,2]=4 2535 B11R0.148 CCC#CCNCC=CC(=O)O 9f0e4b0073ecc1ed0afeef066660b3b3 [1,1,0,0,0,0|0,0,2]=4 2536 B11R0.148 CCC#CCOC/C=C/C(=O)O 6ef421b667d5b068641edf78a710de9b [1,1,0,0,0,0|0,0,2]=4 2537 B11R0.148 CCC#CCOCC=CC(=O)O c237e565c8319a0c2d1711e1e81e07be [1,1,0,0,0,0|0,0,2]=4 2538 B11R0.148 CCCCCCCCNC(=O)C 9209ef01a8d3ac54b45708fef3a289cf [1,1,0,0,0,0|0,0,2]=4 2539 B11R0.148 CCCCCCCNCC(=O)C ac5ad78030b2337dde4637cf4e637be8 [1,1,0,0,0,0|0,0,2]=4 2540 B11R0.148 CCCCCCCNCC(=O)O 604ac707776db9c80f9dbe81aba07aab [1,1,0,0,0,0|0,0,2]=4 2541 B11R0.148 CCCCCCCOCC(=O)C dc592c317774d5dcca7353cd0379c413 [1,1,0,0,0,0|0,0,2]=4 2542 B11R0.148 CCCCCCCOCC(=O)O 2e9c1bc97c278d8f4eec0fc057b4f886 [1,1,0,0,0,0|0,0,2]=4 2543 B11R0.148 CCCCCCNC/C=C(/C)\I de46a617e926fa7265c7ea6a0d6454b4 [1,1,0,0,0,0|1,0,1]=4 2544 B11R0.148 CCCCCCNC/C=C(\C)/Cl 5e1e5f5c0eae22e6ce2fa87264437d45 [1,1,0,0,0,0|1,0,1]=4 2545 B11R0.148 CCCCCCNCC=C(C)C 268cde1eac403971a29775244b20f6fb [1,1,0,0,0,0|1,0,1]=4 2546 B11R0.148 CCCCCCNCC=C(C)Cl 9b26f9313727dabf75856a169d7d9509 [1,1,0,0,0,0|1,0,1]=4 2547 B11R0.148 CCCCCCNCC=C(C)I 4649296a1e9af8c45e014cea46a02b0d [1,1,0,0,0,0|1,0,1]=4 2548 B11R0.148 CCCCCCNCCC(=O)C dae7d5a91b1ed61fc00f967bfae50950 [1,1,0,0,0,0|0,0,2]=4 2549 B11R0.148 CCCCCCNCCC(=O)O 8d33e817dab78094c47164cc7392c6c0 [1,1,0,0,0,0|0,0,2]=4 2550 B11R0.148 CCCCCCNCOC(=O)C 1c1a5627acb6c3fcacc91b183f2cb953 [1,1,0,0,0,0|1,0,1]=4 2551 B11R0.148 CCCCCCOC/C=C(/C)\Cl 3217da00020186109ac684268f3a4229 [1,1,0,0,0,0|1,0,1]=4 2552 B11R0.148 CCCCCCOC/C=C(/C)\I 42d6eaabbd9ccb5371b986581e746e3c [1,1,0,0,0,0|1,0,1]=4 2553 B11R0.148 CCCCCCOC/C=C(\C)/Cl fe5511dbc0d53edaf2e45e378bf83eb9 [1,1,0,0,0,0|1,0,1]=4 2554 B11R0.148 CCCCCCOCC=C(C)C 01521535f7ea090dd629b3eba93168e9 [1,1,0,0,0,0|1,0,1]=4 2555 B11R0.148 CCCCCCOCC=C(C)Cl 449202f9925926f3cc218782fb7d580a [1,1,0,0,0,0|1,0,1]=4 2556 B11R0.148 CCCCCCOCC=C(C)I 8716b7b87fe38c49ecc86d416f4d13fd [1,1,0,0,0,0|1,0,1]=4 2557 B11R0.148 CCCCCCOCCC(=O)C ba6ca6ffd5fb9c6cc4e8d129cf77ebb5 [1,1,0,0,0,0|0,0,2]=4 2558 B11R0.148 CCCCCCOCCC(=O)O 4717319825633e38fbcaeec5411785fc [1,1,0,0,0,0|0,0,2]=4 2559 B11R0.148 CCCCCCOCNC(=O)C 821b7a0837138668b121aff777d67519 [1,1,0,0,0,0|1,0,1]=4 2560 B11R0.148 CCCCCCOCOC(=O)C 7357a2b41ac7b5a18efb5ca4e2678b36 [1,1,0,0,0,0|1,0,1]=4 2561 B11R0.148 CCCCCNC/C=C/C(=O)O b8046f0d80c9ff3885cdfa6c42d71162 [1,1,0,0,0,0|0,0,0]=2 2562 B11R0.148 CCCCCNC/C=C/C(C)C d7d2cc7b858d16bae64842f05b6b9796 [1,1,0,0,0,0|1,0,1]=4 2563 B11R0.148 CCCCCNCC#CC(=O)O aed9235485305f99eb505497ed25180e [1,1,0,0,0,0|0,0,2]=4 2564 B11R0.148 CCCCCNCC=CC(=O)O 58813a84cba492cefaaec0f7c2af3ed6 [1,1,0,0,0,0|0,0,0]=2 2565 B11R0.148 CCCCCNCCC=C(C)C d6637617b4955445c507124ad86b540e [1,1,0,0,0,0|1,0,1]=4 2566 B11R0.148 CCCCCNCCCC(=O)C ae79e8ea156a5e770911e0ef57b141fd [1,1,0,0,0,0|0,0,2]=4 2567 B11R0.148 CCCCCNCCCC(=O)O ce92314d02facc18c8164866ccc58acb [1,1,0,0,0,0|0,0,2]=4 2568 B11R0.148 CCCCCNCCNC(=O)C 7ff8c0f5354f73956142fbe6902b9879 [1,1,0,0,0,0|1,0,1]=4 2569 B11R0.148 CCCCCNCCOC(=O)C 729f700d5178f65d822ba15d79799d97 [1,1,0,0,0,0|1,0,1]=4 2570 B11R0.148 CCCCCNCCSC(=O)C d915aac4f03ed25f4f02a1b6cd47cc5d [1,1,0,0,0,0|1,0,1]=4 2571 B11R0.148 CCCCCOC/C=C/C(=O)O 3d3460a3a6eee12116378f2de4d92d1f [1,1,0,0,0,0|0,0,0]=2 2572 B11R0.148 CCCCCOC/C=C/C(C)C afb911daeb4fd0404f914e7e073954e3 [1,1,0,0,0,0|1,0,1]=4 2573 B11R0.148 CCCCCOCC#CC(=O)O 5c208b4c2dc6a197983d39a5def0aeed [1,1,0,0,0,0|0,0,2]=4 2574 B11R0.148 CCCCCOCC=CC(=O)O ac6921bf081433b1f8d6059fbeb527c4 [1,1,0,0,0,0|0,0,0]=2 2575 B11R0.148 CCCCCOCCC=C(C)C 474567c7ad39799d75b5ca9d8bdddc96 [1,1,0,0,0,0|1,0,1]=4 2576 B11R0.148 CCCCCOCCCC(=O)C 2d5fb2796be532f83de2b588a833a781 [1,1,0,0,0,0|0,0,2]=4 2577 B11R0.148 CCCCCOCCNC(=O)C 89e6bc94e5e2df2872af87ea20002aa7 [1,1,0,0,0,0|1,0,1]=4 2578 B11R0.148 CCCCCOCCOC(=O)C ce892e28021cd219f16b0c1b93f354de [1,1,0,0,0,0|1,0,1]=4 2579 B11R0.148 CCCCCOCCSC(=O)C 381130fac5641be83bacac00ee2d726c [1,1,0,0,0,0|1,0,1]=4 2580 B11R0.148 CCCCNCCCCC(=O)C 544c9e2e2e33eb4d7d7343bae90cd58e [1,1,0,0,0,0|0,0,2]=4 2581 B11R0.148 CCCCNCCCCC(=O)O db2891a1a49d26c3dd9a356095c13ecb [1,1,0,0,0,0|0,0,2]=4 2582 B11R0.148 CCCCNCCCNC(=O)C 6d0de7a58670364332bd2c26e8ee7cdd [1,1,0,0,0,0|1,0,1]=4 2583 B11R0.148 CCCCNCCCOC(=O)C 7853525c1345bc50778fe7631411e66c [1,1,0,0,0,0|1,0,1]=4 2584 B11R0.148 CCCCNCCCSC(=O)C db939ed2d8d03cfa10c8f82ccb5505ff [1,1,0,0,0,0|1,0,1]=4 2585 B11R0.148 CCCCNCCOCC(=O)O c3ef0b6e39b500596a34f8201361fc3a [1,1,0,0,0,0|1,0,1]=4 2586 B11R0.148 CCCCNCCSCC(=O)O 19c0aa25c2747ad4736c5abc66ee689c [1,1,0,0,0,0|1,0,1]=4 2587 B11R0.148 CCCCOCCC#CC(=O)O 74d0efe4ad55f9a50fc1408fe4f834e6 [1,1,0,0,0,0|0,0,2]=4 2588 B11R0.148 CCCCOCCC=C=C(C)C 3d6e5040a241ac2b60e6d1f3621307e5 [1,1,0,0,0,0|1,0,1]=4 2589 B11R0.148 CCCCOCCCCC(=O)C a62f0819767c2537c037059a9981780c [1,1,0,0,0,0|0,0,2]=4 2590 B11R0.148 CCCCOCCCCC(=O)O 00e520501e14c3e825ffc7300146a3fe [1,1,0,0,0,0|0,0,2]=4 2591 B11R0.148 CCCCOCCCNC(=O)C 14281244af5a76ea832226605fbb85e4 [1,1,0,0,0,0|1,0,1]=4 2592 B11R0.148 CCCCOCCCOC(=O)C 477c462ef377d29beb78f95f82bb25eb [1,1,0,0,0,0|1,0,1]=4 2593 B11R0.148 CCCCOCCCSC(=O)C 614b19a166ecdbfad1b2d0cb89ad3484 [1,1,0,0,0,0|1,0,1]=4 2594 B11R0.148 CCCCOCCNCC(=O)C 223e03f8df314d1ffe7fa22f1e699f9f [1,1,0,0,0,0|1,0,1]=4 2595 B11R0.148 CCCCOCCNCC(=O)O 5e535394d6f535f6322b79b8b1a838be [1,1,0,0,0,0|1,0,1]=4 2596 B11R0.148 CCCCOCCOCC(=O)C a1059fc843b2eaa33e87055a6bc4e6be [1,1,0,0,0,0|1,0,1]=4 2597 B11R0.148 CCCCOCCOCC(=O)O f3952d347bddfc2dfd656d051a77ceb9 [1,1,0,0,0,0|1,0,1]=4 2598 B11R0.148 CCCCSCCOCC(=O)O ac797cbb248e6531ce12e2e37d4432b3 [1,1,0,0,0,0|1,0,1]=4 2599 B11R0.148 CCCNCCCCCC(=O)C 354cff2ef02214f278274b1186349715 [1,1,0,0,0,0|0,0,2]=4 2600 B11R0.148 CCCNCCCCCC(=O)O 040617eb9e641e6c46ed6e1b925655c5 [1,1,0,0,0,0|0,0,2]=4 2601 B11R0.148 CCCNCCCCNC(=O)C afc7cb87fbf2cd12eb8fe76075788aed [1,1,0,0,0,0|1,0,1]=4 2602 B11R0.148 CCCNCCCCOC(=O)C 5de6dd97eb13f02e3674c0a89f759217 [1,1,0,0,0,0|1,0,1]=4 2603 B11R0.148 CCCNCCCCSC(=O)C e67c14e897e8fe6720f2feb7de9105a1 [1,1,0,0,0,0|1,0,1]=4 2604 B11R0.148 CCCNCCCOCC(=O)O 0fe8426b6f63ee30bea77f979722006c [1,1,0,0,0,0|1,0,1]=4 2605 B11R0.148 CCCOCCCCCC(=O)C a9dd639cc488907d7b3255974d45f633 [1,1,0,0,0,0|0,0,2]=4 2606 B11R0.148 CCCOCCCCCC(=O)O fa333152e0beffd56620c1d14609917b [1,1,0,0,0,0|0,0,2]=4 2607 B11R0.148 CCCOCCCCOC(=O)C 76d456e7ca4c7cd8d390c54bbbefcd78 [1,1,0,0,0,0|1,0,1]=4 2608 B11R0.148 CCCOCCCCSC(=O)C 369c27db8c9be1ed6dd5c9b10da52191 [1,1,0,0,0,0|1,0,1]=4 2609 B11R0.148 CCCOCCCNCC(=O)C 4d98936bd08942b43acf72033a9b2c2f [1,1,0,0,0,0|1,0,1]=4 2610 B11R0.148 CCCOCCCNCC(=O)O 295a16ed1d6368a92e0dacd0d6a7c9c0 [1,1,0,0,0,0|1,0,1]=4 2611 B11R0.148 CCCOCCCOCC(=O)C 809ccbc1f7a0704a8f6d3af11b40fcaf [1,1,0,0,0,0|1,0,1]=4 2612 B11R0.148 CCCOCCCOCC(=O)O 1f8662db2650bfb91265d5551bc7d84a [1,1,0,0,0,0|1,0,1]=4 2613 B11R0.148 CCCSCCCCNC(=O)C b995a956a32500c52f19eeccf108b053 [1,1,0,0,0,0|1,0,1]=4 2614 B11R0.148 CCNCCCCCCC(=O)O e9a5c8afc11b12a621b1b3a6781fbc3e [1,1,0,0,0,0|0,0,2]=4 2615 B11R0.148 CCNCCCCCNC(=O)C 73d4870ba672365fcc36e846ca9b99bb [1,1,0,0,0,0|1,0,1]=4 2616 B11R0.148 CCOCCCCCCC(=O)O c60be55443aee57331a1445b50b93edc [1,1,0,0,0,0|0,0,2]=4 2617 B11R0.148 CCOCCNC/C=C/C(=O)O 180e79545ae63835752a114aad6ab053 [1,1,0,0,0,0|1,0,0]=3 2618 B11R0.148 CCOCCNCC=CC(=O)O 7ebe6156c1f494037b0a51305a268124 [1,1,0,0,0,0|1,0,0]=3 2619 B11R0.148 CCOCCOC/C=C/C(=O)O 067f6e854dcca2baddc1da5d8726b400 [1,1,0,0,0,0|1,0,0]=3 2620 B11R0.148 CCOCCOCC=CC(=O)O 27fccb562f0bdfd787e2068a9d95027e [1,1,0,0,0,0|1,0,0]=3 2621 B11R0.148 CCSCCCCNCC(=O)O 48d23c14c94084e7bff45772097aafd6 [1,1,0,0,0,0|1,0,1]=4 2622 B11R0.148 CCSCCNC/C=C/C(=O)O a6bc3438689a03ce49577c593d432733 [1,1,0,0,0,0|1,0,0]=3 2623 B11R0.148 CCSCCNCC=CC(=O)O 2a360c976885c82851dd967ffc9a3f91 [1,1,0,0,0,0|1,0,0]=3 2624 B11R0.148 CCSCCOC/C=C/C(=O)O e95eba37a36db3459c9c81e4d744903c [1,1,0,0,0,0|1,0,0]=3 2625 B11R0.148 CCSCCOCC=CC(=O)O e86d5911d8fee7e79b9905a1fae4f02a [1,1,0,0,0,0|1,0,0]=3 2626 B11R0.148 COCCCCCNCC(=O)C f14a0e7c6184fb994195ce1a50edd828 [1,1,0,0,0,0|1,0,1]=4 2627 B11R0.148 COCCCCCNCC(=O)O e9d365c9b641bfa544654729405f2968 [1,1,0,0,0,0|1,0,1]=4 2628 B11R0.148 COCCCCCOCC(=O)C d37277e1c0f5be693f57271e9f1f4394 [1,1,0,0,0,0|1,0,1]=4 2629 B11R0.148 COCCCCCOCC(=O)O 2ece8647978153469dc704b17fef017d [1,1,0,0,0,0|1,0,1]=4 2630 B11R0.148 COCCCNC/C=C/C(=O)O b9b1ed05b523aa74090b0170ba333231 [1,1,0,0,0,0|1,0,0]=3 2631 B11R0.148 COCCCNCC=CC(=O)O ffe4458a9d773fa0f5805fd16083945f [1,1,0,0,0,0|1,0,0]=3 2632 B11R0.148 COCCCOC/C=C/C(=O)O 0805cb03c3c7f2481256c9f7647a4e4f [1,1,0,0,0,0|1,0,0]=3 2633 B11R0.148 COCCCOCC=CC(=O)O c65c2be497ef9593c8bb24cb3e26e54d [1,1,0,0,0,0|1,0,0]=3 2634 B11R0.148 CSCCCNC/C=C/C(=O)O bcbf55149061f62ba5092a3b145b7f09 [1,1,0,0,0,0|1,0,0]=3 2635 B11R0.148 CSCCCNCC=CC(=O)O 5b844784e907b9c75f027b3c84adbd0c [1,1,0,0,0,0|1,0,0]=3 2636 B11R0.148 CSCCCOC/C=C/C(=O)O 8a99058dad6da5c274e4fd085728717d [1,1,0,0,0,0|1,0,0]=3 2637 B11R0.148 CSCCCOCC=CC(=O)O f2fcb73ed65b6922499affeea35fdfd5 [1,1,0,0,0,0|1,0,0]=3 2638 B11R0.148 N#CCCCNC/C=C/C(=O)O 0033be5c441d100b639021d2f814125b [1,1,0,0,0,0|1,0,1]=4 2639 B11R0.148 N#CCCCNCC=CC(=O)O 8a16412133d72757f6f5ed4108ffe266 [1,1,0,0,0,0|1,0,1]=4 2640 B11R0.148 N#CCCCOC/C=C/C(=O)O 25c10fdd920cfc5bbc8f7a0890206303 [1,1,0,0,0,0|1,0,1]=4 2641 B11R0.148 N#CCCCOCC=CC(=O)O ff6e1d075823766f7fb2b30f021e2dd3 [1,1,0,0,0,0|1,0,1]=4 2642 B11R0.148 O=C(O)/C=C/CNCCCCCl 0912bc0773986e5e1969c4a27bfdc07d [1,1,0,0,0,0|1,0,0]=3 2643 B11R0.148 O=C(O)/C=C/CNCCCCF 56f266d3a3f5fc5062552b4562e58214 [1,1,0,0,0,0|1,0,0]=3 2644 B11R0.148 O=C(O)/C=C/CNCCCCO 140b7288993f12dd80a706b21f40cfe1 [1,1,0,0,0,0|1,0,0]=3 2645 B11R0.148 O=C(O)/C=C/CNCCCCS fa83bbbbf41924ec133d28fec3c82b6c [1,1,0,0,0,0|1,0,0]=3 2646 B11R0.148 O=C(O)/C=C/COCCCCF 2a0c15a229f94b052b34765fd25399ce [1,1,0,0,0,0|1,0,0]=3 2647 B11R0.148 O=C(O)/C=C/COCCCCS 7686fa9506a78f47326a649578bd5bdd [1,1,0,0,0,0|1,0,0]=3 2648 B11R0.148 O=C(O)C=CCNCCCCCl 2297d9d87a648c4f9e8dec1f5784c06e [1,1,0,0,0,0|1,0,0]=3 2649 B11R0.148 O=C(O)C=CCNCCCCF b8af6c31e93fc6a20cd870d2837c5a2e [1,1,0,0,0,0|1,0,0]=3 2650 B11R0.148 O=C(O)C=CCNCCCCO 67026ef18bd90b4ddc10eaf215e2d38e [1,1,0,0,0,0|1,0,0]=3 2651 B11R0.148 O=C(O)C=CCNCCCCS ad2c43b1e490be01d5c3abc384dbbb20 [1,1,0,0,0,0|1,0,0]=3 2652 B11R0.148 O=C(O)C=CCOCCCCF c24ad3c8a0b1dcdb479219d723f0079f [1,1,0,0,0,0|1,0,0]=3 2653 B11R0.148 O=C(O)C=CCOCCCCS 1def563d19219a1128f275fb94d561ac [1,1,0,0,0,0|1,0,0]=3 2654 B11R0.148 O=C(O)CNCCCCCCCl dc32a566986ba7b34107464790e296cc [1,1,0,0,0,0|1,0,1]=4 2655 B11R0.148 O=C(O)CNCCCCCCF bce3f1514075f3d2f8204865ec56aef1 [1,1,0,0,0,0|1,0,1]=4 2656 B11R0.148 O=C(O)CNCCCCCCO d2379b6809e52a0c5093502cf3d19ff8 [1,1,0,0,0,0|1,0,1]=4 2657 B11R0.148 O=C(O)COCCCCCCF 225eb71627e39626696c7d9cbf9693d6 [1,1,0,0,0,0|1,0,1]=4 2658 B11R0.148 O=C(O)COCCCCCCS af996bea4ab4a7edbee11c3b6236257b [1,1,0,0,0,0|1,0,1]=4 2659 B11R0.148 O=CCCCNC/C=C/C(=O)O 3d293d6dfece3ea0e9341161b8e4c28f [1,1,0,0,0,0|1,0,1]=4 2660 B11R0.148 O=CCCCNCC=CC(=O)O b751b1f90cbc35d378982e0202b1f9f2 [1,1,0,0,0,0|1,0,1]=4 2661 B11R0.148 O=CCCCOC/C=C/C(=O)O 12e23bf5cb61892ae5d6ecb123ff4878 [1,1,0,0,0,0|1,0,1]=4 2662 B11R0.148 O=CCCCOCC=CC(=O)O 0f3820247b92515d10a37ebe317ec296 [1,1,0,0,0,0|1,0,1]=4 2663 B11R0.176 CC(CCO)NC/C=C/C(=O)O b275f66096e40c23f2b4e470051fca35 [1,1,0,0,0,0|2,0,0]=4 2664 B11R0.176 CC(CCO)NCC=CC(=O)O 48dac04f268b548e09c662191c6949bf [1,1,0,0,0,0|2,0,0]=4 2665 B11R0.176 CCCC(=S)OC/C=C/C(=O)O 220d394b4bb4a4e805fc1e52dab6726e [1,1,0,0,0,0|1,0,1]=4 2666 B11R0.176 CCCC(=S)OCC=CC(=O)O 614594a62dd4bc6f17d1ff326da0db3a [1,1,0,0,0,0|1,0,1]=4 2667 B11R0.176 CCCC(C)CCOCC(=O)O 58d54a522ab047b6bc16c21f6d8fc26f [1,1,0,0,0,0|1,0,1]=4 2668 B11R0.176 CCCC(C)NC/C=C/C(=O)O 10a4f4435db3c8e3e1ae7a6f6539d11d [1,1,0,0,0,0|1,0,0]=3 2669 B11R0.176 CCCC(C)NCC=CC(=O)O 3ec30c33745e98890c5f777cff12136e [1,1,0,0,0,0|1,0,0]=3 2670 B11R0.176 CCCC(C)OC/C=C/C(=O)O 3b15f7875b55ec0f4a0da46ef9dccc88 [1,1,0,0,0,0|1,0,0]=3 2671 B11R0.176 CCCC(C)OCC=CC(=O)O c94595b3bb649127b4f71cd98f8316cc [1,1,0,0,0,0|1,0,0]=3 2672 B11R0.176 CCCC(S)CCOCC(=O)O 82e8413d3a62e6cdf39de4a52bb4d7db [1,1,0,0,0,0|1,0,1]=4 2673 B11R0.176 CCC[C@@H](C)OC/C=C/C(=O)O 246a71f248af353c44802c0f462d20a4 [1,1,0,0,0,0|1,0,0]=3 2674 B11R0.176 CCC[C@@H](C)OCC=CC(=O)O 077e12004dabb96b9ba8ef1ab6df2688 [1,1,0,0,0,0|1,0,0]=3 2675 B11R0.176 CCC[C@H](C)NC/C=C/C(=O)O fc6efa77992a6f1f40d9d0169c4d668d [1,1,0,0,0,0|1,0,0]=3 2676 B11R0.176 CCC[C@H](C)NCC=CC(=O)O 07a87910c859aa2b7ef92a8b1f794362 [1,1,0,0,0,0|1,0,0]=3 2677 B11R0.176 CCC[C@H](C)OC/C=C/C(=O)O 15ac7d39373e9494e1746704b756be0a [1,1,0,0,0,0|1,0,0]=3 2678 B11R0.176 CCC[C@H](C)OCC=CC(=O)O 449175fa60695a9cc05227c2001c8870 [1,1,0,0,0,0|1,0,0]=3 2679 B11R0.176 COCC(C)NC/C=C/C(=O)O e5ee2cbc84f23c16fdbd008d9f1d76bb [1,1,0,0,0,0|2,0,0]=4 2680 B11R0.176 COCC(C)NCC=CC(=O)O 181ca35aae6b8cc9269a831e9adcc4df [1,1,0,0,0,0|2,0,0]=4 2681 B11R0.176 COCC(C)OC/C=C/C(=O)O 087f8f63defb5323deff2eb80022817a [1,1,0,0,0,0|2,0,0]=4 2682 B11R0.176 COCC(C)OCC=CC(=O)O 4edf07605a7d46961ea0cd70d2043995 [1,1,0,0,0,0|2,0,0]=4 2683 B11R0.176 COC[C@@H](C)NC/C=C/C(=O)O 87d019d0201e10bf901ef1d9ab073ccb [1,1,0,0,0,0|2,0,0]=4 2684 B11R0.176 COC[C@@H](C)NCC=CC(=O)O c330452976e5dc1928311a57208bb400 [1,1,0,0,0,0|2,0,0]=4 2685 B11R0.176 COC[C@@H](C)OC/C=C/C(=O)O a91e2ccb7a3510520cfcf57114e7516a [1,1,0,0,0,0|2,0,0]=4 2686 B11R0.176 COC[C@@H](C)OCC=CC(=O)O e5172256bdaa25c4769012ca3b58a5e4 [1,1,0,0,0,0|2,0,0]=4 2687 B11R0.176 COC[C@H](C)NC/C=C/C(=O)O e66b870cee12e379bbf5f93f6f1f145f [1,1,0,0,0,0|2,0,0]=4 2688 B11R0.176 COC[C@H](C)NCC=CC(=O)O b46c560766d8cb2da934bdf5f6d6de09 [1,1,0,0,0,0|2,0,0]=4 2689 B11R0.176 COC[C@H](C)OC/C=C/C(=O)O ce2639013d58bded6db5cafef8e300f0 [1,1,0,0,0,0|2,0,0]=4 2690 B11R0.176 COC[C@H](C)OCC=CC(=O)O 7880bc5a1bdc8e0d8d0a26c376de3b62 [1,1,0,0,0,0|2,0,0]=4 2691 B11R0.176 CSCC(C)OC/C=C/C(=O)O 2387ed8d16237043ddf901da1d50683f [1,1,0,0,0,0|2,0,0]=4 2692 B11R0.176 CSCC(C)OCC=CC(=O)O 18492b70a751f58485c4cfbfee22abf9 [1,1,0,0,0,0|2,0,0]=4 2693 B11R0.176 C[C@@H](CCO)NC/C=C/C(=O)O 613014fb111c00cc8dec7c9be6629da3 [1,1,0,0,0,0|2,0,0]=4 2694 B11R0.176 C[C@@H](CCO)NCC=CC(=O)O d44305f7472dacfdc12194680911846d [1,1,0,0,0,0|2,0,0]=4 2695 B11R0.176 C[C@H](CCO)NC/C=C/C(=O)O 7afb94b6f838f3d10c270dda2bfe956a [1,1,0,0,0,0|2,0,0]=4 2696 B11R0.176 C[C@H](CCO)NCC=CC(=O)O f685577b82a9ffdde10fd2f95c72faf3 [1,1,0,0,0,0|2,0,0]=4 2697 B11R0.3 C/C=C/C=C/COCCCCC 2667a603d2690530aadc1c08dc0a0108 [1,1,0,0,0,0|1,0,0]=3 2698 B11R0.3 C/C=C/C=C/COCCCCF f9b0bea8a57d8c815991d60921437de0 [1,1,0,0,0,0|2,0,0]=4 2699 B11R0.3 C/C=C/C=C/COCCCOC f0d0d5ce9be726a5ba4b02ddc8682e9f [1,1,0,0,0,0|2,0,0]=4 2700 B11R0.3 C/C=C/C=C/COCCCSC d0846e622cc1751358aaf0590280cd30 [1,1,0,0,0,0|2,0,0]=4 2701 B11R0.3 C/C=C/C=C/COCCOCC 88d3100c5affe368f898955571712e49 [1,1,0,0,0,0|2,0,0]=4 2702 B11R0.3 C/C=C/C=C/COCCSCC dc6f9cca8c481cf0cb210e6635dc9db2 [1,1,0,0,0,0|2,0,0]=4 2703 B11R0.3 CC/C=C/CCOCCCCC b53d7a6c46eb728d1471fa5f092df813 [1,1,0,0,0,0|1,0,1]=4 2704 B11R0.3 CC/C=C/CNCCCCCC 4ea6a89a67bd880060b4122692e295c2 [1,1,0,0,0,0|1,0,1]=4 2705 B11R0.3 CC/C=C/COCCCCCC eb90121bb3484ddc510c42f4817c7d41 [1,1,0,0,0,0|1,0,1]=4 2706 B11R0.3 CC/C=C\CCCCCOCC 3fcd157868f9d6a02a7d59a5bad0c445 [1,1,0,0,0,0|1,0,1]=4 2707 B11R0.3 CC/C=C\CCCCOCCC b91b66aedbd8d3f44f429a8b1d860578 [1,1,0,0,0,0|1,0,1]=4 2708 B11R0.3 CC/C=C\CCCOCCCC 4cdaf8803428e2d9f645148af5a0d0b2 [1,1,0,0,0,0|1,0,1]=4 2709 B11R0.3 CC/C=C\CCNCCCCC ca3a0d15ea7c79f615890d56cab14290 [1,1,0,0,0,0|1,0,1]=4 2710 B11R0.3 CC/C=C\CCOCCCCC 26ad29cfc366b08d786d9b655a0964e4 [1,1,0,0,0,0|1,0,1]=4 2711 B11R0.3 CC/C=C\COCCCCCC 9755557f3f5961e4b7217afb6d53fd2f [1,1,0,0,0,0|1,0,1]=4 2712 B11R0.3 CC=CC=CCOCCCCC 0a414855753f5c15a0899ce0a42b5368 [1,1,0,0,0,0|1,0,0]=3 2713 B11R0.3 CC=CC=CCOCCCCF 1336e1583fcd98d174cde0d1feae0435 [1,1,0,0,0,0|2,0,0]=4 2714 B11R0.3 CC=CC=CCOCCCOC c457231fed4c7f2195c839cf3cacd232 [1,1,0,0,0,0|2,0,0]=4 2715 B11R0.3 CC=CC=CCOCCCSC a555a4b45e559a7676b75fc34eea5cbc [1,1,0,0,0,0|2,0,0]=4 2716 B11R0.3 CC=CC=CCOCCOCC 2a20c8af486fa56d9680e1bd55ed6c53 [1,1,0,0,0,0|2,0,0]=4 2717 B11R0.3 CC=CC=CCOCCSCC dedbfb44dc1fdc100ca1601e4941f095 [1,1,0,0,0,0|2,0,0]=4 2718 B11R0.3 CCC/C=C/CCCOCCC dae1775eca5913317c5cd584ee8751c6 [1,1,0,0,0,0|1,0,1]=4 2719 B11R0.3 CCC/C=C/CNCCCCC 220ba6cf6d3871bb7347038a1b74977c [1,1,0,0,0,0|1,0,1]=4 2720 B11R0.3 CCC/C=C/COCCCCC 376fd1605555eb7afa40e728bdf19f2d [1,1,0,0,0,0|1,0,1]=4 2721 B11R0.3 CCC/C=C\CCCOCCC 9d2652818f4292c6bd7658d96bf7fce0 [1,1,0,0,0,0|1,0,1]=4 2722 B11R0.3 CCC/C=C\CCOCCCC 9e74787723b6c36b8e5fff0d11977396 [1,1,0,0,0,0|1,0,1]=4 2723 B11R0.3 CCC/C=C\CNCCCCC 019a7c473a2da7ebbb424bd7efd3e588 [1,1,0,0,0,0|1,0,1]=4 2724 B11R0.3 CCC/C=C\COCCCCC d379d1a8be0c42f6be0ab331a41b2209 [1,1,0,0,0,0|1,0,1]=4 2725 B11R0.3 CCC=CCCCCCOCC acb4ebc5d4b9da3999d78f72f192ac9b [1,1,0,0,0,0|1,0,1]=4 2726 B11R0.3 CCCCCC/C=C/COCC 1d564dbe762cb9f190a747403312f838 [1,1,0,0,0,0|0,0,1]=3 2727 B11R0.3 CCCCCC/C=C/COCF 91ebc248f7b4f728849745f48647afc4 [1,1,0,0,0,0|0,0,1]=3 2728 B11R0.3 CCCCCC/C=C\COCC 5a8a881f07f8a5e19b54364067beb581 [1,1,0,0,0,0|0,0,1]=3 2729 B11R0.3 CCCCCC/C=C\COCF 487281249c24753e3698304f4c3a6dd8 [1,1,0,0,0,0|0,0,1]=3 2730 B11R0.4 C/C=C/C(=O)NCCCCCC 377f28d02111af193298308d162007ca [1,1,0,0,0,0|2,0,0]=4 2731 B11R0.4 C/C=C/C=C/COC(C)CCC ab154f092b51630bd9577146a10f8fa6 [1,1,0,0,0,0|2,0,0]=4 2732 B11R0.4 CC=CC=CCOC(C)CCC ce1f29ff1daeb08dca680e1001b000fe [1,1,0,0,0,0|2,0,0]=4 2733 B11R0.4 CCCCCCNC(=O)COC 714e5a0281995088b6f3f1f962d227b2 [1,1,0,0,0,0|1,0,1]=4 2734 B11R0.81 CC/C=C/C(=O)NCCCCC 63095eac04d1c62a52939bfac6587eba [1,1,0,0,0,0|2,0,0]=4 2735 B11R0.81 CC/C=C\C(=O)NCCCCC 00a2c477e9b53f6a09878b7b0fed634a [1,1,0,0,0,0|2,0,0]=4 2736 B11R0.81 CCC=CC(=O)NCCCCC d5f9dee0e9e7159b1708be5a61788ec4 [1,1,0,0,0,0|2,0,0]=4 2737 B11R0.81 CCCCCNC(=O)/C=C/OC 7425a12715f801d68b5865f5b994b883 [1,1,0,0,0,0|1,0,0]=3 2738 B11R0.81 CCCCCNC(=O)C=COC b75738bd00a7e9032e8be9cd6d8628f6 [1,1,0,0,0,0|1,0,0]=3 2739 B11R0.81 CCOCCNC(=O)/C=C/OC df0852e9287f84ace30ec707c1590fcd [1,1,0,0,0,0|2,0,0]=4 2740 B11R0.81 CCOCCNC(=O)C=COC f24abc7ef9b31cd5b90715e1d1959bff [1,1,0,0,0,0|2,0,0]=4 2741 B11R0.81 CCSCCNC(=O)/C=C/OC d09cbc57dc08f183a4a24dd5a374807d [1,1,0,0,0,0|2,0,0]=4 2742 B11R0.81 CCSCCNC(=O)C=COC dfa688bc2ac9bec36a912b2fdefc5c31 [1,1,0,0,0,0|2,0,0]=4 2743 B11R0.81 CO/C=C/C(=O)NCCCCCl 1adeb57056c5300a3cd255ab4fb71af2 [1,1,0,0,0,0|2,0,0]=4 2744 B11R0.81 CO/C=C/C(=O)NCCCCO 6b3d80707f5101ed0c9079762e0f84f8 [1,1,0,0,0,0|2,0,0]=4 2745 B11R0.81 CO/C=C/C(=O)NCCCCS c7653137ed1e7fb2a5a8dbb925025da6 [1,1,0,0,0,0|2,0,0]=4 2746 B11R0.81 CO/C=C/C(=O)NCCCOC a3eac7ce52bc8b4c5d0184e04bbc99b2 [1,1,0,0,0,0|2,0,0]=4 2747 B11R0.81 CO/C=C/C(=O)NCCCSC e2bbf400826589ca87e706fb5fcf294a [1,1,0,0,0,0|2,0,0]=4 2748 B11R0.81 COC=CC(=O)NCCCCCl aa368e275e56d846e2f6d10e520c2c2a [1,1,0,0,0,0|2,0,0]=4 2749 B11R0.81 COC=CC(=O)NCCCCO 2d3b58a99d6a38f4f25f6dad93f9a92d [1,1,0,0,0,0|2,0,0]=4 2750 B11R0.81 COC=CC(=O)NCCCCS b8d6db026af246b973316df67292732e [1,1,0,0,0,0|2,0,0]=4 2751 B11R0.81 COC=CC(=O)NCCCOC 6881bdcd78c0803cc83dd7f345976b0c [1,1,0,0,0,0|2,0,0]=4 2752 B11R0.81 COC=CC(=O)NCCCSC 86a1cd56833ddcc0e52d8eeb794991c8 [1,1,0,0,0,0|2,0,0]=4 2753 B11R0.70 CCCCC(C)NCC(=O)OC dea370713a261b9db8561fcfadd7d635 [1,1,0,0,0,0|1,0,1]=4 2754 B11R0.70 CCCCC(C)OCC(=O)OC df4e5fb162716db8a526500670efe27c [1,1,0,0,0,0|1,0,1]=4 2755 B11R0.70 CCCCC(O)CNC(=O)CC a18614707b31b705fea3a9214509c6d7 [1,1,0,0,0,0|2,0,0]=4 2756 B11R0.70 CCCCN(C)CCC(=O)OC 1ad22cd2e476c7ec72932a232e75b1de [1,1,0,0,0,0|1,0,1]=4 2757 B11R0.70 CCCCN(C)COC(=O)OC cd7d2c3f82adbaf2330dfb58647703c3 [1,1,0,0,0,0|2,0,0]=4 2758 B11R0.70 CCCC[C@@H](C)NCC(=O)OC f9c205165d4d34d6b16662bb8057658f [1,1,0,0,0,0|1,0,1]=4 2759 B11R0.70 CCCC[C@@H](C)OCC(=O)OC d46ed4e6b264e4da227d681e0b482c0f [1,1,0,0,0,0|1,0,1]=4 2760 B11R0.70 CCCC[C@H](C)OCC(=O)OC 005217b48658963e7d8277039bb97993 [1,1,0,0,0,0|1,0,1]=4 2761 B11R0.70 CCCNC(=O)/C=C/C(=O)OC c88f68689fb876b0b45d2661738493b3 [1,1,0,0,0,0|1,0,1]=4 2762 B11R0.70 CCCNC(=O)/C=C\C(=O)OC 027d77d7c1ca60acbec9b7968ce773ca [1,1,0,0,0,0|1,0,1]=4 2763 B11R0.70 CCCNC(=O)C=CC(=O)OC bb1152f238e803ef41fad456bbc86a36 [1,1,0,0,0,0|1,0,1]=4 2764 B11R0.70 CCCNC(C)CCC(=O)OC 9f30ac298e6a52d4146f18e020d85cfd [1,1,0,0,0,0|1,0,1]=4 2765 B11R0.70 CCCOC(C)CCC(=O)OC fb37d2dab98ad3681fa9792c014dd77f [1,1,0,0,0,0|1,0,1]=4 2766 B11R0.106 CCC(C)CCNCC(=O)OC 55546b48ad802d407e44efd0891c77f0 [1,1,0,0,0,0|1,0,1]=4 2767 B11R0.106 CCC(C)CCOCC(=O)OC 04047e6aa53caf612115bdc052389946 [1,1,0,0,0,0|1,0,1]=4 2768 B11R0.106 CCC(C)CNCCC(=O)OC abb2e914f35de9229c3647dd0ab6e8e1 [1,1,0,0,0,0|1,0,1]=4 2769 B11R0.106 CCC(C)CNCOC(=O)OC 1b5b4f97764d129d74a4b3c8fd6c387b [1,1,0,0,0,0|2,0,0]=4 2770 B11R0.106 CCC(C)COCCC(=O)OC 90b61ecf8b1a10b5e1864fc256b29965 [1,1,0,0,0,0|1,0,1]=4 2771 B11R0.106 CCC(C)COCOC(=O)OC 2bd8b4d2ed4c7f583c2eddbba855b125 [1,1,0,0,0,0|2,0,0]=4 2772 B11R0.106 CCC(C)NC/C=C/C(=O)OC 3c42b7e13311139d678cabdd45bf852c [1,1,0,0,0,0|1,0,0]=3 2773 B11R0.106 CCC(C)NC/C=C\C(=O)OC 1299dfad013466c17a80950cd93023f1 [1,1,0,0,0,0|1,0,0]=3 2774 B11R0.106 CCC(C)NCC=CC(=O)OC a7dd658ecf47805a4bc55393acc30209 [1,1,0,0,0,0|1,0,0]=3 2775 B11R0.106 CCC(C)NCCCC(=O)OC d3018845f5d5d1bc753f56bd7f86b645 [1,1,0,0,0,0|1,0,1]=4 2776 B11R0.106 CCC(C)OC/C=C/C(=O)OC 08978ad307e31a8960b045adf1a9c525 [1,1,0,0,0,0|1,0,0]=3 2777 B11R0.106 CCC(C)OC/C=C\C(=O)OC f0e60369dc6cb3b9ac7960a04b08853a [1,1,0,0,0,0|1,0,0]=3 2778 B11R0.106 CCC(C)OCC=CC(=O)OC c809ac93e56d10740f0320950fe46a90 [1,1,0,0,0,0|1,0,0]=3 2779 B11R0.106 CCC(C)OCCCC(=O)OC 73c7d02713528c817e16ae2787ad1215 [1,1,0,0,0,0|1,0,1]=4 2780 B11R0.106 CCC(C)OCCOC(=O)OC a61ba394d28b03b1b7a19d066f8dfa4b [1,1,0,0,0,0|2,0,0]=4 2781 B11R0.106 CCC(O)CNCCC(=O)OC b38b6679c77734006520557e7c6ace4e [1,1,0,0,0,0|1,0,1]=4 2782 B11R0.106 CCC(O)CNCOC(=O)OC ce4ae85bbfc243148577b25bcaa909b0 [1,1,0,0,0,0|2,0,0]=4 2783 B11R0.106 CCC(S)CCOCC(=O)OC b15bbffda571936636baf3572a7482de [1,1,0,0,0,0|1,0,1]=4 2784 B11R0.106 CCN(C)CCCCC(=O)OC 52951c911bfbe4f74e1d442046d437c9 [1,1,0,0,0,0|1,0,1]=4 2785 B11R0.106 CC[C@@H](C)CNCCC(=O)OC ec64ec2d2e85b9c539660c4fc4513db1 [1,1,0,0,0,0|1,0,1]=4 2786 B11R0.106 CC[C@@H](C)COCCC(=O)OC 6ff164d42b9941a665594c3d04a64d46 [1,1,0,0,0,0|1,0,1]=4 2787 B11R0.106 CC[C@@H](C)COCOC(=O)OC 18a298c9654de34ee80c48d13a4e3aba [1,1,0,0,0,0|2,0,0]=4 2788 B11R0.106 CC[C@@H](C)NC/C=C/C(=O)OC f5dfdc3996288001348c24933c36e12b [1,1,0,0,0,0|1,0,0]=3 2789 B11R0.106 CC[C@@H](C)NC/C=C\C(=O)OC 964c71d3d080266c9170d2e1cb41ba59 [1,1,0,0,0,0|1,0,0]=3 2790 B11R0.106 CC[C@@H](C)NCC=CC(=O)OC 391893637cc2cd7fd395cf77c9bcbfdb [1,1,0,0,0,0|1,0,0]=3 2791 B11R0.106 CC[C@@H](C)NCCCC(=O)OC c5ab184a1828ac00951b4d5083f06f45 [1,1,0,0,0,0|1,0,1]=4 2792 B11R0.106 CC[C@@H](C)OC/C=C/C(=O)OC 913770d9654f70a76ed58fc4df64f9b3 [1,1,0,0,0,0|1,0,0]=3 2793 B11R0.106 CC[C@@H](C)OC/C=C\C(=O)OC 2cb27495f5c78057acfa658e9cef31ca [1,1,0,0,0,0|1,0,0]=3 2794 B11R0.106 CC[C@@H](C)OCC=CC(=O)OC f946e3617eda40244925a37868ddbe19 [1,1,0,0,0,0|1,0,0]=3 2795 B11R0.106 CC[C@@H](C)OCCCC(=O)OC 20116c6b5ae76c3d034784de4d52563a [1,1,0,0,0,0|1,0,1]=4 2796 B11R0.106 CC[C@@H](O)CNCCC(=O)OC 2b9a1efddd0dfd6840a473b5cd7841e2 [1,1,0,0,0,0|1,0,1]=4 2797 B11R0.106 CC[C@@H](O)CNCOC(=O)OC 0969d147c74c9771132277dcbe54766f [1,1,0,0,0,0|2,0,0]=4 2798 B11R0.106 CC[C@H](C)CCOCC(=O)OC bb5d1b620636b82254ccbb745e5db12b [1,1,0,0,0,0|1,0,1]=4 2799 B11R0.106 CC[C@H](C)CNCCC(=O)OC 84a33ab53460ddd972a70034900a1ff5 [1,1,0,0,0,0|1,0,1]=4 2800 B11R0.106 CC[C@H](C)CNCOC(=O)OC 44ea9c74081a990712c8b549cd09454b [1,1,0,0,0,0|2,0,0]=4 2801 B11R0.106 CC[C@H](C)COCCC(=O)OC 26dc8fd9b69a8d4a68fc0b44e6101e06 [1,1,0,0,0,0|1,0,1]=4 2802 B11R0.106 CC[C@H](C)COCOC(=O)OC 280b327297b86b841ec4cc1075740686 [1,1,0,0,0,0|2,0,0]=4 2803 B11R0.106 CC[C@H](C)NC/C=C/C(=O)OC 53f8e24663a3afb89b6985a9cc60b7f7 [1,1,0,0,0,0|1,0,0]=3 2804 B11R0.106 CC[C@H](C)NC/C=C\C(=O)OC f216cb7af4c1351c11c55c39a7242314 [1,1,0,0,0,0|1,0,0]=3 2805 B11R0.106 CC[C@H](C)NCC=CC(=O)OC 3af9d8f945b24bb39cd092f0ef3f436b [1,1,0,0,0,0|1,0,0]=3 2806 B11R0.106 CC[C@H](C)NCCCC(=O)OC 0d31d63cb2fa99d2857eb1759def4d2d [1,1,0,0,0,0|1,0,1]=4 2807 B11R0.106 CC[C@H](C)OC/C=C/C(=O)OC 36eb052444abde19985df1473b7683c5 [1,1,0,0,0,0|1,0,0]=3 2808 B11R0.106 CC[C@H](C)OC/C=C\C(=O)OC 9063a310b98cb79839e6f10890f8af5b [1,1,0,0,0,0|1,0,0]=3 2809 B11R0.106 CC[C@H](C)OCC=CC(=O)OC 114be4edf0a0c2351e237f1e827d4e70 [1,1,0,0,0,0|1,0,0]=3 2810 B11R0.106 CC[C@H](C)OCCCC(=O)OC e611334dbefda70672866dae633c5dd0 [1,1,0,0,0,0|1,0,1]=4 2811 B11R0.106 COC(=O)/C=C/CNC(C)CO 294e681b8e26f741d86e8c124b5ba823 [1,1,0,0,0,0|2,0,0]=4 2812 B11R0.106 COC(=O)/C=C/CN[C@@H](C)CO bf6355acdd2110d89585adc13d36ba8f [1,1,0,0,0,0|2,0,0]=4 2813 B11R0.106 COC(=O)/C=C/CN[C@H](C)CO 68e39681492b4e5965d4eebb20178a36 [1,1,0,0,0,0|2,0,0]=4 2814 B11R0.106 COC(=O)/C=C/COC(C)CF c1c72c9e1ab8ed4b77014db07049c51d [1,1,0,0,0,0|2,0,0]=4 2815 B11R0.106 COC(=O)/C=C\CNC(C)CO d629ee49ff55521faf618d2d8828d14f [1,1,0,0,0,0|2,0,0]=4 2816 B11R0.106 COC(=O)/C=C\CN[C@@H](C)CO c4f319f2bdbf6643843c257c9c5d0c88 [1,1,0,0,0,0|2,0,0]=4 2817 B11R0.106 COC(=O)/C=C\CN[C@H](C)CO d230559e2e443bb85507044ede852dfb [1,1,0,0,0,0|2,0,0]=4 2818 B11R0.106 COC(=O)/C=C\COC(C)CF 53f7e0d0db66a15d38d212970292e901 [1,1,0,0,0,0|2,0,0]=4 2819 B11R0.106 COC(=O)C=CCNC(C)CO a6d199db00f747c3ba99bd4ce5ad5522 [1,1,0,0,0,0|2,0,0]=4 2820 B11R0.106 COC(=O)C=CCN[C@@H](C)CO 69beed72b89c2f969933c7a6bbbeab19 [1,1,0,0,0,0|2,0,0]=4 2821 B11R0.106 COC(=O)C=CCN[C@H](C)CO f89aeacae2a1ebbfda196ae7d2f88c00 [1,1,0,0,0,0|2,0,0]=4 2822 B11R0.106 COC(=O)C=CCOC(C)CF 5de4323245d967bbb1a98375c8017287 [1,1,0,0,0,0|2,0,0]=4 2823 B11R0.142 C=C(CNCCCC)C(=O)OC 53c2de65fec0755bbe5ffc40b13b3a84 [1,1,0,0,0,0|1,0,0]=3 2824 B11R0.142 C=C(CNCCCCl)C(=O)OC ed0db35419722c18c569f1a40569859b [1,1,0,0,0,0|2,0,0]=4 2825 B11R0.142 C=C(CNCCCO)C(=O)OC 1ea636d9de24ba0cfd3d57117d468a59 [1,1,0,0,0,0|2,0,0]=4 2826 B11R0.142 C=C(CNCCOC)C(=O)OC db36715e7cf11334688fcb2bbb7435dc [1,1,0,0,0,0|2,0,0]=4 2827 B11R0.142 C=C(CNCCSC)C(=O)OC 89af5306ffe1a67e219a8992cc2383e8 [1,1,0,0,0,0|2,0,0]=4 2828 B11R0.142 C=C(COCCCC)C(=O)OC 2670a0bb6e62b0bce720cea99a8bf9ce [1,1,0,0,0,0|1,0,0]=3 2829 B11R0.142 C=C(COCCCF)C(=O)OC 39ed90427c8d6f3a19545c6ef45d29d1 [1,1,0,0,0,0|2,0,0]=4 2830 B11R0.142 C=C(COCCCS)C(=O)OC 97486e2f7112a5a8b417b34750beb08b [1,1,0,0,0,0|2,0,0]=4 2831 B11R0.142 C=C(COCCOC)C(=O)OC 462f1c6824be27a97cbda783abe25fa2 [1,1,0,0,0,0|2,0,0]=4 2832 B11R0.142 C=C(COCCSC)C(=O)OC 558b73c202fd9d745c35e02429d8000d [1,1,0,0,0,0|2,0,0]=4 2833 B11R0.142 C=C(COCOCC)C(=O)OC 69eb3396d662ddf43aa16dc4b19d7d05 [1,1,0,0,0,0|2,0,0]=4 2834 B11R0.142 CCCCCCN(C)C(=O)CC c25fee109e3505330a0f823c56988e5a [1,1,0,0,0,0|2,0,0]=4 2835 B11R0.142 CCCCCNC(=O)C(=O)CC 57b5d06cb5cb0aeeb53131d1de420ac6 [1,1,0,0,0,0|2,0,0]=4 2836 B11R0.142 CCCCCNC(=O)C(=O)NC c78c9d2fe1d4b73dbfca99b93822bbc2 [1,1,0,0,0,0|2,0,0]=4 2837 B11R0.142 CCCCCNC(=O)C(=O)OC 8111b1e6fb8bd2a57b809499c8b8e317 [1,1,0,0,0,0|1,0,0]=3 2838 B11R0.142 CCCCCNC(C)C(=O)OC ceda658c32f2717705b5753d95254732 [1,1,0,0,0,0|1,0,1]=4 2839 B11R0.142 CCCCCN[C@@H](C)C(=O)OC a70c734a04042f9e2c29976744ca1db7 [1,1,0,0,0,0|1,0,1]=4 2840 B11R0.142 CCCCCN[C@H](C)C(=O)OC f83769fcf8a52442a99a180792631049 [1,1,0,0,0,0|1,0,1]=4 2841 B11R0.142 CCCCCOC(C)C(=O)OC c98b88bf4ee6dc23e9db5b7a644cb7b3 [1,1,0,0,0,0|1,0,1]=4 2842 B11R0.142 CCCCCO[C@@H](C)C(=O)OC afd8f96c1d28270745640effa22059a9 [1,1,0,0,0,0|1,0,1]=4 2843 B11R0.142 CCCCCO[C@H](C)C(=O)OC ed1b03b86456edaec6348184ff47bcfd [1,1,0,0,0,0|1,0,1]=4 2844 B11R0.142 CCCCNCC(=O)C(=O)OC d0af9a9a17c911307996c52c1b603cc9 [1,1,0,0,0,0|1,0,0]=3 2845 B11R0.142 CCCCNCC(C)C(=O)OC b484220b46772cd5124cefc21e4c9a4c [1,1,0,0,0,0|1,0,1]=4 2846 B11R0.142 CCCCNCC(O)C(=O)OC de1110f46b4655a9b052a8c63538b994 [1,1,0,0,0,0|1,0,1]=4 2847 B11R0.142 CCCCNC[C@@H](C)C(=O)OC 243d0086fa7de32e5aa01dd763cc94fa [1,1,0,0,0,0|1,0,1]=4 2848 B11R0.142 CCCCNC[C@H](C)C(=O)OC d5fd048b54b76c390e88c9c8f93fa500 [1,1,0,0,0,0|1,0,1]=4 2849 B11R0.142 CCCCOC=C(F)C(=O)OC 189c72d8bec22630bf0c9a5aa54af5a5 [1,1,0,0,0,0|1,0,0]=3 2850 B11R0.142 CCCCOCC(=O)C(=O)OC a3b07f302c91d3009f4c5596fb58b4c0 [1,1,0,0,0,0|1,0,0]=3 2851 B11R0.142 CCCCOCC(C)C(=O)OC 2a428f13a16476db3c3646a1056d2697 [1,1,0,0,0,0|1,0,1]=4 2852 B11R0.142 CCCCOCC(F)C(=O)OC dcce8be3eb0b5248eab081b1171db910 [1,1,0,0,0,0|1,0,1]=4 2853 B11R0.142 CCCCOC[C@@H](C)C(=O)OC b94e575e56b960aca51d1d5ccfdeebf4 [1,1,0,0,0,0|1,0,1]=4 2854 B11R0.142 CCCCOC[C@H](C)C(=O)OC b41ada1bd4c1876a7499387b56903098 [1,1,0,0,0,0|1,0,1]=4 2855 B11R0.142 CCCNCCC(C)C(=O)OC 1c2ea45b264e72292927d13f97c0a2c0 [1,1,0,0,0,0|1,0,1]=4 2856 B11R0.142 CCCOCCC(C)C(=O)OC 16254c5922c3369c7e34436020a43f8f [1,1,0,0,0,0|1,0,1]=4 2857 B11R0.142 CCOCCNC(=O)C(=O)OC bf2cfe570b598298f5e38afc2a5602d8 [1,1,0,0,0,0|2,0,0]=4 2858 B11R0.142 CCOCOC=C(F)C(=O)OC f6b38d7e77d7e129d02a4e48cd65ae98 [1,1,0,0,0,0|2,0,0]=4 2859 B11R0.142 CCSCCNC(=O)C(=O)OC 1597b04073fc5f19ab39d0c07f841def [1,1,0,0,0,0|2,0,0]=4 2860 B11R0.142 COC(=O)C(=COCCCF)F 8c1bbbabc4106f312dc858db4bb7df0f [1,1,0,0,0,0|2,0,0]=4 2861 B11R0.142 COC(=O)C(=COCCCS)F 4aef3af84eb31075d4da7ff4207255df [1,1,0,0,0,0|2,0,0]=4 2862 B11R0.142 COC(=O)C(=COCCSC)F e583f7a9943a2470a2ef814af34bff6f [1,1,0,0,0,0|2,0,0]=4 2863 B11R0.142 COC(=O)C(=O)CNCCCCl 142420ccfa9c4e2b4614e2a7dc7818d0 [1,1,0,0,0,0|2,0,0]=4 2864 B11R0.142 COC(=O)C(=O)CNCCCO 188964fb880871c9c9e00442864e8bd4 [1,1,0,0,0,0|2,0,0]=4 2865 B11R0.142 COC(=O)C(=O)CNCCSC 805faff00828734b3bde0eddd8ace95d [1,1,0,0,0,0|2,0,0]=4 2866 B11R0.142 COC(=O)C(=O)COCCCF 9b683bb8f322c38d6c437c1ed2f8449d [1,1,0,0,0,0|2,0,0]=4 2867 B11R0.142 COC(=O)C(=O)COCCCS 3ee7b6a01009ddcd502880d61b3a7833 [1,1,0,0,0,0|2,0,0]=4 2868 B11R0.142 COC(=O)C(=O)COCCSC 9242a5623f5af44a88f032e84dcfa0de [1,1,0,0,0,0|2,0,0]=4 2869 B11R0.142 COC(=O)C(=O)NCCCCCl 817bee88a320d8ee68ace162fc06a9bb [1,1,0,0,0,0|2,0,0]=4 2870 B11R0.142 COC(=O)C(=O)NCCCCO 512a36de52b401209959c5ed8048d217 [1,1,0,0,0,0|2,0,0]=4 2871 B11R0.142 COC(=O)C(=O)NCCCCS 507564bab49da6deda62a020f3742ed1 [1,1,0,0,0,0|2,0,0]=4 2872 B11R0.142 COC(=O)C(=O)NCCCSC a4452b56863abc93fc05255dabbbbccb [1,1,0,0,0,0|2,0,0]=4 2873 B11R0.142 COCCCNC(=O)C(=O)OC 8062a92297aefb724d49e296a71d2b1d [1,1,0,0,0,0|2,0,0]=4 2874 B11R0.142 COCCNCC(=O)C(=O)OC edc934eac74b5747ed2e7502af616519 [1,1,0,0,0,0|2,0,0]=4 2875 B11R0.142 COCCOC=C(F)C(=O)OC 283e12b3b1b44332b98c91add27d3858 [1,1,0,0,0,0|2,0,0]=4 2876 B11R0.142 COCCOCC(=O)C(=O)OC e981aff5f1682301b699e6780ec0b64f [1,1,0,0,0,0|2,0,0]=4 2877 B11R0.154 C=C(CNCCC)CC(=O)OC de629e236d5601a4d987e4dc615a7c61 [1,1,0,0,0,0|1,0,1]=4 2878 B11R0.154 C=C(COCCC)CC(=O)OC 00a5f19cde265d05bbde596370a696b5 [1,1,0,0,0,0|1,0,1]=4 2879 B11R0.154 CCCCCC(C)NC(=O)CC bc630bcd14906e5f8a25eb9d61b6f9fa [1,1,0,0,0,0|2,0,0]=4 2880 B11R0.154 CCCCCN(C)CC(=O)OC 9a8201a1e606e55a693bfa48cb6672d4 [1,1,0,0,0,0|1,0,1]=4 2881 B11R0.154 CCCCC[C@H](C)NC(=O)CC 9adb0b9fb15364ba4605e72a32fe384f [1,1,0,0,0,0|2,0,0]=4 2882 B11R0.154 CCCCNC(=O)CC(=O)OC d7c856bb41edc47794a5068a73ff4ab4 [1,1,0,0,0,0|1,0,1]=4 2883 B11R0.154 CCCCNC(C)CC(=O)OC fa0a764000a9fa6989a18b1eae03a3c4 [1,1,0,0,0,0|1,0,1]=4 2884 B11R0.154 CCCCNC(C)OC(=O)OC ddd35a307d138888f4e47c318dd0505d [1,1,0,0,0,0|2,0,0]=4 2885 B11R0.154 CCCCN[C@@H](C)CC(=O)OC 735f46185c40863ef0fb135ba67d45d5 [1,1,0,0,0,0|1,0,1]=4 2886 B11R0.154 CCCCN[C@H](C)CC(=O)OC 3cc67f4b754a47c9de55b6947d2591a1 [1,1,0,0,0,0|1,0,1]=4 2887 B11R0.154 CCCCO/C(=C/C(=O)CC)/C e713b94fab11a24c412997c1939a38b0 [1,1,0,0,0,0|2,0,0]=4 2888 B11R0.154 CCCCOC(C)CC(=O)OC c821b97e61479eeb6f4d3918e3f6be55 [1,1,0,0,0,0|1,0,1]=4 2889 B11R0.154 CCCCOC(C)OC(=O)OC 6a9183201443b2593082d20e0b694152 [1,1,0,0,0,0|2,0,0]=4 2890 B11R0.154 CCCCO[C@@H](C)CC(=O)OC 6e8b570bf6e9c14ee3056bc55e9ea0f8 [1,1,0,0,0,0|1,0,1]=4 2891 B11R0.154 CCCCO[C@H](C)CC(=O)OC e37b033a1d682368876e963f16660675 [1,1,0,0,0,0|1,0,1]=4 2892 B11R0.154 CCCNCC(=O)CC(=O)OC 889928e59d9bde1602fefdcccb29af37 [1,1,0,0,0,0|1,0,1]=4 2893 B11R0.154 CCCNCC(C)CC(=O)OC 873a1d4d7be56471fc5c1c051c144d93 [1,1,0,0,0,0|1,0,1]=4 2894 B11R0.154 CCCNCC(O)CC(=O)OC 4ca6e79ee409bb8cd255af1ff469f21a [1,1,0,0,0,0|1,0,1]=4 2895 B11R0.154 CCCNC[C@@H](O)CC(=O)OC d64043de9b0bee5816ab64db2043bda0 [1,1,0,0,0,0|1,0,1]=4 2896 B11R0.154 CCCNC[C@H](O)CC(=O)OC dd619faf623e53ec29bac530a1d6ebe7 [1,1,0,0,0,0|1,0,1]=4 2897 B11R0.154 CCCOCC(=O)CC(=O)OC ced4a1a872c4212b2244d6ff8e4f0f52 [1,1,0,0,0,0|1,0,1]=4 2898 B11R0.154 CCCOCC(C)CC(=O)OC 2fdc7d4802e83652201ed75663d8570d [1,1,0,0,0,0|1,0,1]=4 2899 B11R0.154 CCOCCC(=O)CC(=O)OC 37bfcffbc5031418091ea574d1964205 [1,1,0,0,0,0|1,0,1]=4 2900 B11R0.174 CCCC(C)CNCC(=O)OC d94197d0b88a2b807c1a7f37d3ee1a25 [1,1,0,0,0,0|1,0,1]=4 2901 B11R0.174 CCCC(C)COCC(=O)OC c8cdc297b47c32fa9cddb65adece86bf [1,1,0,0,0,0|1,0,1]=4 2902 B11R0.174 CCCC(C)NCCC(=O)OC b1a1031e1f4ba318e932bfdc77e4bbf7 [1,1,0,0,0,0|1,0,1]=4 2903 B11R0.174 CCCC(C)NCOC(=O)OC 8200f3900fed417a21930cb37808b363 [1,1,0,0,0,0|2,0,0]=4 2904 B11R0.174 CCCC(C)OCCC(=O)OC 037e1108d805876d37178c6543ab693c [1,1,0,0,0,0|1,0,1]=4 2905 B11R0.174 CCCC(O)CNCC(=O)OC 58110736a5c625cd64b261c983eddab2 [1,1,0,0,0,0|1,0,1]=4 2906 B11R0.174 CCCN(C)C/C=C/C(=O)OC 4ba16909d04b778724e230455592cec0 [1,1,0,0,0,0|1,0,0]=3 2907 B11R0.174 CCCN(C)C/C=C\C(=O)OC 5e293a783da1a98c57ba6ffc19ef6607 [1,1,0,0,0,0|1,0,0]=3 2908 B11R0.174 CCCN(C)CC=CC(=O)OC 2bce6ab24884b088429951777f291dbb [1,1,0,0,0,0|1,0,0]=3 2909 B11R0.174 CCCN(C)CCCC(=O)OC 69d253e88d1e61d854220b1416f9e5a8 [1,1,0,0,0,0|1,0,1]=4 2910 B11R0.174 CCC[C@@H](C)OCCC(=O)OC 32237384edc5023d6814a4db0ac158df [1,1,0,0,0,0|1,0,1]=4 2911 B11R0.174 CCC[C@H](C)NCCC(=O)OC f5e14de7c9ec227b55f117b06e1e2b4c [1,1,0,0,0,0|1,0,1]=4 2912 B11R0.174 CCC[C@H](C)NCOC(=O)OC 95ab1a2d4cedcabf47b683615396f95f [1,1,0,0,0,0|2,0,0]=4 2913 B11R0.174 CCC[C@H](C)OCCC(=O)OC 74cc17c2b75c46a3b125dab63bb50b4b [1,1,0,0,0,0|1,0,1]=4 2914 B11R0.174 COC(=O)/C=C/CN(C)CCF c3c0027524738d8f3a32a62c8775638a [1,1,0,0,0,0|2,0,0]=4 2915 B11R0.174 COC(=O)/C=C/CN(C)CCO 491f5262993924bc6d341af2c9f687ed [1,1,0,0,0,0|2,0,0]=4 2916 B11R0.174 COC(=O)/C=C\CN(C)CCF 26e9e160a896bab3c1f19a58feb7aa75 [1,1,0,0,0,0|2,0,0]=4 2917 B11R0.174 COC(=O)/C=C\CN(C)CCO 30e1d2c3ad7b8f9538a16a565f653b62 [1,1,0,0,0,0|2,0,0]=4 2918 B11R0.174 COC(=O)C=CCN(C)CCF af6686cc9cbe724bbcd9e2ed5aeac5c3 [1,1,0,0,0,0|2,0,0]=4 2919 B11R0.174 COC(=O)C=CCN(C)CCO 30478512056b3ca73b92e469f1d2cc84 [1,1,0,0,0,0|2,0,0]=4 2920 B13R0.2 C#CCCCNC/C=C/C(=O)OCC 31052ce0564064a755decfff622c0a74 [0,2,0,0,0,0|0,0,2]=4 2921 B13R0.2 C#CCCCNCC=CC(=O)OCC 9ee24b22793ebf4e30ca9361a1e8749d [0,2,0,0,0,0|0,0,2]=4 2922 B13R0.2 C#CCCCOC/C=C/C(=O)OCC d37f29a419636e2252a407059b12dcb6 [0,2,0,0,0,0|0,0,2]=4 2923 B13R0.2 C#CCCCOCC=CC(=O)OCC 1829fa086c4efdbcddfc4056573facc9 [0,2,0,0,0,0|0,0,2]=4 2924 B13R0.2 C#CCCNCCC=CC(=O)OCC 3a36d106a6bced9c831c7ce9301d442b [0,2,0,0,0,0|0,0,2]=4 2925 B13R0.2 C#CCCOCC/C=C/C(=O)OCC 2b00b426b0e2e3d7a9964156df0347cf [0,2,0,0,0,0|0,0,2]=4 2926 B13R0.2 C#CCCOCCC=CC(=O)OCC 374ab69dcea9657c2737ae03a714362c [0,2,0,0,0,0|0,0,2]=4 2927 B13R0.2 C#CCNCCC/C=C/C(=O)OCC 8566634345eae4864cab993648a077a0 [0,2,0,0,0,0|0,0,2]=4 2928 B13R0.2 C#CCOCCC/C=C/C(=O)OCC 97bc270f9e73b997839d9d9b691c7534 [0,2,0,0,0,0|0,0,2]=4 2929 B13R0.2 C/C=C/CCOC/C=C/C(=O)OCC 1d7d9158413ce1be109447dd7022e6cf [0,2,0,0,0,0|0,0,2]=4 2930 B13R0.2 C/C=C/CCOCC=CC(=O)OCC 2c3efd5c15174f76c8f1618fc429254f [0,2,0,0,0,0|0,0,2]=4 2931 B13R0.2 C/C=C/COCC/C=C/C(=O)OCC 86c1c59f4f602b0cc42b2ef1e467fb78 [0,2,0,0,0,0|0,0,2]=4 2932 B13R0.2 C/C=C/COCCC=CC(=O)OCC b2e7e6399add43dafc3003a15df96b63 [0,2,0,0,0,0|0,0,2]=4 2933 B13R0.2 C/C=C\COCC/C=C/C(=O)OCC 267568d0f9d8a0bba96402defdcc6e6b [0,2,0,0,0,0|0,0,2]=4 2934 B13R0.2 C/C=C\COCCC=CC(=O)OCC 9e2e01b013850dd4121188f1dec07ab8 [0,2,0,0,0,0|0,0,2]=4 2935 B13R0.2 C=CCCCNC/C=C/C(=O)OCC 315f4ddb01b1f981845cfe40cfceced8 [0,2,0,0,0,0|0,0,2]=4 2936 B13R0.2 C=CCCCNCC=CC(=O)OCC d4cb62de03d77deed7a58b1fc12c4059 [0,2,0,0,0,0|0,0,2]=4 2937 B13R0.2 C=CCCCOC/C=C/C(=O)OCC cdaf33849319dc0863ff526064ab48b0 [0,2,0,0,0,0|0,0,2]=4 2938 B13R0.2 C=CCCCOCC=CC(=O)OCC 2032e0bd7a94123753a6a8e951373afd [0,2,0,0,0,0|0,0,2]=4 2939 B13R0.2 C=CCCNCCC=CC(=O)OCC 0e1077b0fd33b66a3f15566b516e1c8f [0,2,0,0,0,0|0,0,2]=4 2940 B13R0.2 C=CCCOCC/C=C/C(=O)OCC 381e7b10240b7d867bd1683602bacb55 [0,2,0,0,0,0|0,0,2]=4 2941 B13R0.2 C=CCCOCCC=CC(=O)OCC e74faa9436849670f62513ee6b46e233 [0,2,0,0,0,0|0,0,2]=4 2942 B13R0.2 CC#CCCOC/C=C/C(=O)OCC b30018cd9b8f842a00ff25d532eb4578 [0,2,0,0,0,0|0,0,2]=4 2943 B13R0.2 CC#CCCOCC=CC(=O)OCC 77da87ef6da1e9d84f12bededee175af [0,2,0,0,0,0|0,0,2]=4 2944 B13R0.2 CC#CCNCCC=CC(=O)OCC e2b697635d081efd0b1baf40fcde49e0 [0,2,0,0,0,0|0,0,2]=4 2945 B13R0.2 CC#CCOCCC=CC(=O)OCC 62cb6b6f40995b28dcdefe61893351c8 [0,2,0,0,0,0|0,0,2]=4 2946 B13R0.2 CC/C=C/COC/C=C/C(=O)OCC 8b133bbe31fa5bf2c3e90c0d3c45ddd3 [0,2,0,0,0,0|0,0,2]=4 2947 B13R0.2 CC/C=C/COCC=CC(=O)OCC 7d2b6916e5fcd97d78e86f4ca3e8be9b [0,2,0,0,0,0|0,0,2]=4 2948 B13R0.2 CC/C=C\COC/C=C/C(=O)OCC 8d5c511567a8ac72f6af3899f1c6272c [0,2,0,0,0,0|0,0,2]=4 2949 B13R0.2 CC/C=C\COCC=CC(=O)OCC f364beac7ada198b695ff92be1d7ee51 [0,2,0,0,0,0|0,0,2]=4 2950 B13R0.2 CC=CCNCCC=CC(=O)OCC 0a54d856b46402229044812210e18b5f [0,2,0,0,0,0|0,0,2]=4 2951 B13R0.2 CC=CCOCCC=CC(=O)OCC 33987a4f27834a9ef4d0f6f8615e8099 [0,2,0,0,0,0|0,0,2]=4 2952 B13R0.2 CCC#CCOC/C=C/C(=O)OCC a59ecdb2eb3a132c5df88e47da27b401 [0,2,0,0,0,0|0,0,2]=4 2953 B13R0.2 CCC#CCOCC=CC(=O)OCC c7a8bc1d322728062d77b0b73a9c58ea [0,2,0,0,0,0|0,0,2]=4 2954 B13R0.2 CCCCCC/C=C/CC(=O)NC#N a5c9605ecf6e524ff96deb67a1bab322 [0,2,0,0,0,0|1,0,1]=4 2955 B13R0.2 CCCCCCC/C=C/C(=O)NC#N b33f4e24c4bb0bc5c6f2e2b011e712e5 [0,2,0,0,0,0|1,0,1]=4 2956 B13R0.2 CCCCCCC/C=C\C(=O)NC#N 60608ac8b7d8b6b1e67c0b77049befee [0,2,0,0,0,0|1,0,1]=4 2957 B13R0.2 CCCCCCC=CCC(=O)NC#N f324d302091c27cb2a4639ee677ffe02 [0,2,0,0,0,0|1,0,1]=4 2958 B13R0.2 CCCCCCCC=CC(=O)NC#N e30cde15fb3743deb9535fa942ba8cbb [0,2,0,0,0,0|1,0,1]=4 2959 B13R0.2 CCCCCCCCNC(=O)COC 47f1d49276911c281e4e5d8541e891e0 [0,2,0,0,0,0|0,0,2]=4 2960 B13R0.2 CCCCCCCNCC(=O)COC 00a49161b46d585bb8c6643b00c1eee6 [0,2,0,0,0,0|0,0,2]=4 2961 B13R0.2 CCCCCCCNCC(=O)OCC abd85a7e37601b1753a0da1ffad8260f [0,2,0,0,0,0|0,0,2]=4 2962 B13R0.2 CCCCCCCOCC(=O)COC 3ec9fc8695c5218e1de632417c2b4180 [0,2,0,0,0,0|0,0,2]=4 2963 B13R0.2 CCCCCCCOCC(=O)OCC 4a05e6b375ec7268012afe5b15ef0517 [0,2,0,0,0,0|0,0,2]=4 2964 B13R0.2 CCCCCCNCCC(=O)OCC aff4c424081f16a0015b47b5c232fbec [0,2,0,0,0,0|0,0,2]=4 2965 B13R0.2 CCCCCCNCOC(=O)OCC 2ed6191aaa975defd5b3aff84168c385 [0,2,0,0,0,0|1,0,1]=4 2966 B13R0.2 CCCCCCOCCC(=O)OCC e54f3ab4d73e5d613afa1b2c27111033 [0,2,0,0,0,0|0,0,2]=4 2967 B13R0.2 CCCCCCOCOC(=O)OCC eafccfdaff2b2a4e9b3584568c95869c [0,2,0,0,0,0|1,0,1]=4 2968 B13R0.2 CCCCCNC/C=C/C(=O)OCC d3ec4e077699aa3d69496c98f5c6d794 [0,2,0,0,0,0|0,0,0]=2 2969 B13R0.2 CCCCCNCC=CC(=O)OCC 593c7a4c9e9b8fc51015837f03226595 [0,2,0,0,0,0|0,0,0]=2 2970 B13R0.2 CCCCCNCCCC(=O)OCC 0df93ab1587649687a4df691133aff68 [0,2,0,0,0,0|0,0,2]=4 2971 B13R0.2 CCCCCOC/C=C/C(=O)OCC 88512f6ce8d3cebe5c14fb691fe7b0f7 [0,2,0,0,0,0|0,0,0]=2 2972 B13R0.2 CCCCCOCC#CC(=O)OCC d3d79b535d4b195245e225078b6a6699 [0,2,0,0,0,0|0,0,2]=4 2973 B13R0.2 CCCCCOCC=CC(=O)OCC f6ef3abd95a9be811bb890aa858c203f [0,2,0,0,0,0|0,0,0]=2 2974 B13R0.2 CCCCCOCCCC(=O)OCC 35ede942d9fb4c8f0cd553d34e8d4c7e [0,2,0,0,0,0|0,0,2]=4 2975 B13R0.2 CCCCNCCC=CC(=O)OCC d5c0e4b8168d3422a63d07ab42daba49 [0,2,0,0,0,0|0,0,0]=2 2976 B13R0.2 CCCCNCCCCC(=O)OCC ddf10fa62cd2dab558dd66df1e4ec875 [0,2,0,0,0,0|0,0,2]=4 2977 B13R0.2 CCCCOCC/C=C/C(=O)OCC 1734e208992efde6e8faa09a03f1fbd5 [0,2,0,0,0,0|0,0,0]=2 2978 B13R0.2 CCCCOCCC=CC(=O)OCC 260db2c1db8dc6348d45ceb36d912022 [0,2,0,0,0,0|0,0,0]=2 2979 B13R0.2 CCCCOCCCCC(=O)OCC 2e19a20ec679fd1dc5239d756f3abbd1 [0,2,0,0,0,0|0,0,2]=4 2980 B13R0.2 CCCCOCCCNC(=O)COC 693e843cc58dd5fdcb04a0ef3c350060 [0,2,0,0,0,0|1,0,1]=4 2981 B13R0.2 CCCCOCCNCC(=O)COC b2e5c1af095e221756e783fbbd136e14 [0,2,0,0,0,0|1,0,1]=4 2982 B13R0.2 CCCCOCCNCC(=O)OCC 95f9cc46667b42d25e20cce8c692da5f [0,2,0,0,0,0|1,0,1]=4 2983 B13R0.2 CCCCOCCOCC(=O)COC 6bcb033c28459ad60149a9ea44a51917 [0,2,0,0,0,0|1,0,1]=4 2984 B13R0.2 CCCCOCCOCC(=O)OCC da37a26050796aa99dfde3b3c80011a0 [0,2,0,0,0,0|1,0,1]=4 2985 B13R0.2 CCCCSCCOCC(=O)COC 5cc0a90530fd102ecc7a8c1553dcef72 [0,2,0,0,0,0|1,0,1]=4 2986 B13R0.2 CCCCSCCOCC(=O)OCC 0dde3ebfaf53f2e0d736609af9408c53 [0,2,0,0,0,0|1,0,1]=4 2987 B13R0.2 CCCNCCC/C=C/C(=O)OCC 1cde9aa3f04c04ecc2f1a21293ddd571 [0,2,0,0,0,0|0,0,0]=2 2988 B13R0.2 CCCNCCCCCC(=O)OCC 2155c8508ea1d0a2cfa86b886eb73ca1 [0,2,0,0,0,0|0,0,2]=4 2989 B13R0.2 CCCNCCCOCC(=O)OCC 95c6f0fb32318675d666a7816b7fdc6e [0,2,0,0,0,0|1,0,1]=4 2990 B13R0.2 CCCOCCC/C=C/C(=O)OCC 5eabaae5a39a9f33921d4ac80eebea35 [0,2,0,0,0,0|0,0,0]=2 2991 B13R0.2 CCCOCCCCCC(=O)OCC 5ba0b8140b4acc736192f8bf133c0100 [0,2,0,0,0,0|0,0,2]=4 2992 B13R0.2 CCCOCCCNCC(=O)COC 9bf0f97b73ce002716ed88cfd5513bb1 [0,2,0,0,0,0|1,0,1]=4 2993 B13R0.2 CCCOCCCNCC(=O)OCC c31792c8623180e2b467ed3d101bd735 [0,2,0,0,0,0|1,0,1]=4 2994 B13R0.2 CCCOCCCOCC(=O)OCC ceceb5500726d3b7b6cec5cf17990f0e [0,2,0,0,0,0|1,0,1]=4 2995 B13R0.2 CCCSCCCCNC(=O)COC 7d7f1ef87f018886e82bd2448bc48244 [0,2,0,0,0,0|1,0,1]=4 2996 B13R0.2 CCOC(=O)/C=C/CCCCNC#N f7b7d0e693f802a6e1d10ae399162cf8 [0,2,0,0,0,0|1,0,1]=4 2997 B13R0.2 CCOC(=O)/C=C/CCCNCC#N bcfb1e6dc1ae188c3463deee1ada0f93 [0,2,0,0,0,0|1,0,1]=4 2998 B13R0.2 CCOC(=O)/C=C/CCCNCCBr 8f4f73ee0f9c1b2990cb032a8f81c9ac [0,2,0,0,0,0|1,0,0]=3 2999 B13R0.2 CCOC(=O)/C=C/CCCNCCF 179742a97c0ff0e1704ca3c81f5025a2 [0,2,0,0,0,0|1,0,0]=3 3000 B13R0.2 CCOC(=O)/C=C/CCCNCCI dc1e2871a952ad221b35d0b6d7553209 [0,2,0,0,0,0|1,0,0]=3 3001 B13R0.2 CCOC(=O)/C=C/CCCNCCO 4d754df55395cb5852cc6ec7d24be674 [0,2,0,0,0,0|1,0,0]=3 3002 B13R0.2 CCOC(=O)/C=C/CCCNCCS 96769188a77cf1f5e190eb09d03b359f [0,2,0,0,0,0|1,0,0]=3 3003 B13R0.2 CCOC(=O)/C=C/CCCOCC#N 6e52d90255f99288d9a8d35cbb39100e [0,2,0,0,0,0|1,0,1]=4 3004 B13R0.2 CCOC(=O)/C=C/CCCOCCF 62535fc1862b1229a4770eadbf3bc4db [0,2,0,0,0,0|1,0,0]=3 3005 B13R0.2 CCOC(=O)/C=C/CCCOCCS 1dc51bbe28b3060d08a244695d399682 [0,2,0,0,0,0|1,0,0]=3 3006 B13R0.2 CCOC(=O)/C=C/CCCOCOC 4f06af97a08dc29475813abc0e066406 [0,2,0,0,0,0|1,0,0]=3 3007 B13R0.2 CCOC(=O)/C=C/CCOCCC#N e45782f9c47a8286b41e4b30cc0c1b19 [0,2,0,0,0,0|1,0,1]=4 3008 B13R0.2 CCOC(=O)/C=C/CCOCCC=O 1abb4006508548008461d1c6dd1ff554 [0,2,0,0,0,0|1,0,1]=4 3009 B13R0.2 CCOC(=O)/C=C/CCOCCCF f914d410b123f49ad5ede678a2642921 [0,2,0,0,0,0|1,0,0]=3 3010 B13R0.2 CCOC(=O)/C=C/CCOCCCS 144e1b46a65ca1064de34c0fec8e4b45 [0,2,0,0,0,0|1,0,0]=3 3011 B13R0.2 CCOC(=O)/C=C/CCOCCOC 67b995abab95667f93ad5b39c6c0bf72 [0,2,0,0,0,0|1,0,0]=3 3012 B13R0.2 CCOC(=O)/C=C/CCOCCSC 3cbff5ba18024dae7f9182aace820fa7 [0,2,0,0,0,0|1,0,0]=3 3013 B13R0.2 CCOC(=O)/C=C/CNCCCC#N 8f259eba7ff216ef4055c55f3ccd36c5 [0,2,0,0,0,0|1,0,1]=4 3014 B13R0.2 CCOC(=O)/C=C/CNCCCCCl c5b2eb59a91d53f62051eb240a286a42 [0,2,0,0,0,0|1,0,0]=3 3015 B13R0.2 CCOC(=O)/C=C/CNCCCCO 0345674596e8c7fd736bcd19b31da5e0 [0,2,0,0,0,0|1,0,0]=3 3016 B13R0.2 CCOC(=O)/C=C/CNCCCCS e1f73258daf9dfe285e5f7f3d51daf8e [0,2,0,0,0,0|1,0,0]=3 3017 B13R0.2 CCOC(=O)/C=C/CNCCCOC dd2dc533d67af93d91eef29304b2a8fa [0,2,0,0,0,0|1,0,0]=3 3018 B13R0.2 CCOC(=O)/C=C/CNCCCSC 13f08479322c51d037f49269958f6c8f [0,2,0,0,0,0|1,0,0]=3 3019 B13R0.2 CCOC(=O)/C=C/CNCCSCC c672968b04decc3101d90c1a6e7ddb92 [0,2,0,0,0,0|1,0,0]=3 3020 B13R0.2 CCOC(=O)/C=C/COCCCC#N 676053cdc398af01de6405e768c25a5d [0,2,0,0,0,0|1,0,1]=4 3021 B13R0.2 CCOC(=O)/C=C/COCCCC=O 747ccca8e47e32508c3398527547f390 [0,2,0,0,0,0|1,0,1]=4 3022 B13R0.2 CCOC(=O)/C=C/COCCCCF c7587d1e17deb48fcd67cc38ae8f150a [0,2,0,0,0,0|1,0,0]=3 3023 B13R0.2 CCOC(=O)/C=C/COCCCCS 58d91caa91550cc298a75df94594adc0 [0,2,0,0,0,0|1,0,0]=3 3024 B13R0.2 CCOC(=O)/C=C/COCCCOC 9fbe16eab20671a3d27a3701ee00f64e [0,2,0,0,0,0|1,0,0]=3 3025 B13R0.2 CCOC(=O)/C=C/COCCCSC 53473646d6df843d118535f52b45598c [0,2,0,0,0,0|1,0,0]=3 3026 B13R0.2 CCOC(=O)/C=C/COCCSCC 60164d0c52875ba6e133bb33bd2cc545 [0,2,0,0,0,0|1,0,0]=3 3027 B13R0.2 CCOC(=O)C=CCCNCCC#N a117a3f56d61eb3f946bceb5c770cb1d [0,2,0,0,0,0|1,0,1]=4 3028 B13R0.2 CCOC(=O)C=CCCNCCCCl 41fd30eeff27604846f5141e7b2873d9 [0,2,0,0,0,0|1,0,0]=3 3029 B13R0.2 CCOC(=O)C=CCCNCCCO 19b6613448b43025a0db545eeec92f64 [0,2,0,0,0,0|1,0,0]=3 3030 B13R0.2 CCOC(=O)C=CCCNCCOC 368436eb05de7b097c45fffc4e78465e [0,2,0,0,0,0|1,0,0]=3 3031 B13R0.2 CCOC(=O)C=CCCNCCON a47f81eb36333c7dbd2e1594e08a39e8 [0,2,0,0,0,0|2,0,0]=4 3032 B13R0.2 CCOC(=O)C=CCCNCCSC 30df4a7afdce64f66d5eebe5540fe909 [0,2,0,0,0,0|1,0,0]=3 3033 B13R0.2 CCOC(=O)C=CCCOCCC#N e812abfe3e3ddaf58bc08c2613f5e59e [0,2,0,0,0,0|1,0,1]=4 3034 B13R0.2 CCOC(=O)C=CCCOCCC=O 9e40b7c72b3c1f39c10b6f14586a76af [0,2,0,0,0,0|1,0,1]=4 3035 B13R0.2 CCOC(=O)C=CCCOCCCF ee5e78b51f540159507dd82ca0b4df5b [0,2,0,0,0,0|1,0,0]=3 3036 B13R0.2 CCOC(=O)C=CCCOCCCS 0cbd97e39eb6db5f798de82e3f66045f [0,2,0,0,0,0|1,0,0]=3 3037 B13R0.2 CCOC(=O)C=CCCOCCOC 39a67069621096279dfb54785a155057 [0,2,0,0,0,0|1,0,0]=3 3038 B13R0.2 CCOC(=O)C=CCCOCCSC bad672424b5672c42488ff541e5391fc [0,2,0,0,0,0|1,0,0]=3 3039 B13R0.2 CCOC(=O)C=CCNCCCC#N c97c5e973a14d091f81845da8660ea81 [0,2,0,0,0,0|1,0,1]=4 3040 B13R0.2 CCOC(=O)C=CCNCCCCCl 48fe225f5215d6765d1613c9913c626a [0,2,0,0,0,0|1,0,0]=3 3041 B13R0.2 CCOC(=O)C=CCNCCCCO 9b4dcb0d6ce65c34779314d134ea5227 [0,2,0,0,0,0|1,0,0]=3 3042 B13R0.2 CCOC(=O)C=CCNCCCCS a4a6f4bc9d04ead1d92ff3c8dbd0224e [0,2,0,0,0,0|1,0,0]=3 3043 B13R0.2 CCOC(=O)C=CCNCCCOC dcfc1e1ae180cae5a212ad7f2338a6e2 [0,2,0,0,0,0|1,0,0]=3 3044 B13R0.2 CCOC(=O)C=CCNCCCSC 87b81e8d9adb0d07a0578e860c3b4398 [0,2,0,0,0,0|1,0,0]=3 3045 B13R0.2 CCOC(=O)C=CCNCCSCC 9936cfc267646c57eaa8e9bc377d35a4 [0,2,0,0,0,0|1,0,0]=3 3046 B13R0.2 CCOC(=O)C=CCOCCCC#N a6912d6a1b464fcfd2ee7b93a443a970 [0,2,0,0,0,0|1,0,1]=4 3047 B13R0.2 CCOC(=O)C=CCOCCCC=O 945a2581b080c9ca022bdd2879fb01f2 [0,2,0,0,0,0|1,0,1]=4 3048 B13R0.2 CCOC(=O)C=CCOCCCCF a41d5e5f2f9f83ef49d36f3512721af6 [0,2,0,0,0,0|1,0,0]=3 3049 B13R0.2 CCOC(=O)C=CCOCCCCS b8c82c9aa78284b8f8182e8802dd47e3 [0,2,0,0,0,0|1,0,0]=3 3050 B13R0.2 CCOC(=O)C=CCOCCCOC e4c709d7bf6187727b41474f08e475ef [0,2,0,0,0,0|1,0,0]=3 3051 B13R0.2 CCOC(=O)C=CCOCCCSC f3644318683f01ac5f2f9cdb87ebf498 [0,2,0,0,0,0|1,0,0]=3 3052 B13R0.2 CCOC(=O)C=CCOCCSCC 290ae6d0325f2d0a2334cbdb1038b57c [0,2,0,0,0,0|1,0,0]=3 3053 B13R0.2 CCOC(=O)CNCCCCCCCl e183d3377cbc5d5cfe302f04ade1525b [0,2,0,0,0,0|1,0,1]=4 3054 B13R0.2 CCOC(=O)CNCCCCCCF 9c7b3ac33ba7d4e72f32dbbf54b9d9ea [0,2,0,0,0,0|1,0,1]=4 3055 B13R0.2 CCOC(=O)CNCCCCCCO 2ab38fc69ba7745cc7e2ec867ea3986f [0,2,0,0,0,0|1,0,1]=4 3056 B13R0.2 CCOC(=O)CNCCCCCOC 89d5e5a744e3752c37074ca0be03333a [0,2,0,0,0,0|1,0,1]=4 3057 B13R0.2 CCOC(=O)CNCCCCSCC c74158c532cd088ab41a222392e344e6 [0,2,0,0,0,0|1,0,1]=4 3058 B13R0.2 CCOC(=O)COCCCCCCF 726acd625c604cb3966b769d2594ebab [0,2,0,0,0,0|1,0,1]=4 3059 B13R0.2 CCOC(=O)COCCCCCCS ded517fb7a162351c96ac923da6cfaaa [0,2,0,0,0,0|1,0,1]=4 3060 B13R0.2 CCOC(=O)COCCCCCOC ee6a56394b4514d5e2ef6b9ac93177a5 [0,2,0,0,0,0|1,0,1]=4 3061 B13R0.2 CCOCCCCCCC(=O)OCC 369101502abbabdd99c66bce4dd9ee99 [0,2,0,0,0,0|0,0,2]=4 3062 B13R0.2 CCOCCNC/C=C/C(=O)OCC 3ea2a43afe776da64de886c23c5c85c8 [0,2,0,0,0,0|1,0,0]=3 3063 B13R0.2 CCOCCNCC=CC(=O)OCC 31473d307d8aebe16b776e1a5b3b3a33 [0,2,0,0,0,0|1,0,0]=3 3064 B13R0.2 CCOCCOC/C=C/C(=O)OCC 79035302c2c408a8f854ff583aa7cf1d [0,2,0,0,0,0|1,0,0]=3 3065 B13R0.2 CCOCCOCC=CC(=O)OCC 492cb57b2d0dadcc333b32d491463014 [0,2,0,0,0,0|1,0,0]=3 3066 B13R0.2 CCOCOCC/C=C/C(=O)OCC f6b251b17448fb92415e9eee93ad11e3 [0,2,0,0,0,0|1,0,0]=3 3067 B13R0.2 CCSCCCCNCC(=O)COC 5526eeab82a8fb3d59791e13e35ffbc5 [0,2,0,0,0,0|1,0,1]=4 3068 B13R0.2 COCC(=O)CNCCCCCCCl d85e92ec80c610c510ecd9951e0d4e6d [0,2,0,0,0,0|1,0,1]=4 3069 B13R0.2 COCC(=O)CNCCCCCCO d059aaa69c5b3a9748970b2ad5c3af9a [0,2,0,0,0,0|1,0,1]=4 3070 B13R0.2 COCC(=O)COCCCCCCF 24ae892c96cdfb4ecff4e4e7785c5923 [0,2,0,0,0,0|1,0,1]=4 3071 B13R0.2 COCC(=O)COCCCCCCS d2105604e1fbc54b189e36d73236cdcc [0,2,0,0,0,0|1,0,1]=4 3072 B13R0.2 COCC(=O)NCCCCCCCO 1ea0500e0cbf2d54c18b4d34e33227a5 [0,2,0,0,0,0|1,0,1]=4 3073 B13R0.2 COCCCCCNCC(=O)COC 6928b7e488d1e7b08d0e47c930fabeac [0,2,0,0,0,0|1,0,1]=4 3074 B13R0.66 C#CCNC(=O)/C=C/CCCCCC 8d2cc620450cac76d3f0b6744835e73f [0,2,0,0,0,0|1,0,0]=3 3075 B13R0.66 C=CCOC(=O)CNCCCCCC b54609cac5c7a060c87555f23bc72611 [0,2,0,0,0,0|1,0,1]=4 3076 B13R0.66 C=CCOC(=O)COCCCCCC ec0c196f9aed959ee44d1a0f5a4adc0b [0,2,0,0,0,0|1,0,1]=4 3077 B13R0.66 CCCCCC/C=C/C(=O)NCC#N a67f1815221a8afd3dd331c655f8d094 [0,2,0,0,0,0|1,0,0]=3 3078 B13R0.66 CCCCCC/C=C/C(=O)NCCBr a5b5959c0679ae677db7b14fc787a46a [0,2,0,0,0,0|1,0,0]=3 3079 B13R0.66 CCCCCC/C=C/C(=O)NCCC a2fdcacb8b7a296109a2576e2dd77a90 [0,2,0,0,0,0|1,0,0]=3 3080 B13R0.66 CCCCCC/C=C/C(=O)NCCF e680f89061df424c398380164adb1ea8 [0,2,0,0,0,0|1,0,0]=3 3081 B13R0.66 CCCCCC/C=C/C(=O)NCCI 403bba85c63f426f93f4569d9f72edd6 [0,2,0,0,0,0|1,0,0]=3 3082 B13R0.66 CCCCCC/C=C/C(=O)NCCO 3fb84367aa88639d70cadd09a37c500d [0,2,0,0,0,0|1,0,0]=3 3083 B13R0.66 CCCCCC/C=C/C(=O)NCCS 76757fd31572441adad046cb6c7cdce1 [0,2,0,0,0,0|1,0,0]=3 3084 B13R0.66 CCCCCCCNC(=O)/C=C/OC 11e6d03a89907a332d7520d8da9dc736 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[0,2,0,0,0,0|0,0,2]=4 3118 B13R0.87 CCCC(S)CCOCCC(=O)OC ae50eb819366df340118059dbd936f4a [0,2,0,0,0,0|0,0,2]=4 3119 B13R0.87 CCCC(S)CCOCOC(=O)OC f58354f4acd9201e3089ebb441672f25 [0,2,0,0,0,0|1,0,1]=4 3120 B13R0.87 CCCN(C)C/C=C/C=C/C(=O)OC 26a8010969ab7a09b19305542dbc9314 [0,2,0,0,0,0|0,0,2]=4 3121 B13R0.87 CCCN(C)CC=CC=CC(=O)OC bedffa06f79a421a8d10a83ebbb34147 [0,2,0,0,0,0|0,0,2]=4 3122 B13R0.87 CCCN(C)CCCCCC(=O)OC ea7df2fe20199a3c52a1d3a0faf4a3af [0,2,0,0,0,0|0,0,2]=4 3123 B13R0.87 CCCN(C)CCCOCC(=O)OC 8ec4dea5e6a3238523ec59873b5f031f [0,2,0,0,0,0|1,0,1]=4 3124 B13R0.87 CCCN(C)CCCSCC(=O)OC ecc1a0c8e621d20a3eed364e5e4f7559 [0,2,0,0,0,0|1,0,1]=4 3125 B13R0.87 CCC[C@@H](C)OCCCCC(=O)OC f9d9a6f1303407865e21ca02d01529b8 [0,2,0,0,0,0|0,0,2]=4 3126 B13R0.87 CCC[C@@H](C)OCCOCC(=O)OC 4e92f130137f64065324a6360e3aa93a [0,2,0,0,0,0|1,0,1]=4 3127 B13R0.87 CCC[C@H](C)NCCCCC(=O)OC 229d0d5b3ed2d641e41f3cee77af741f [0,2,0,0,0,0|0,0,2]=4 3128 B13R0.87 CCC[C@H](C)NCCOCC(=O)OC 1e991ab570f1af0a8cd03e408a19e511 [0,2,0,0,0,0|1,0,1]=4 3129 B13R0.87 CCC[C@H](C)OCCCCC(=O)OC 2bbaceb1653359ccb0aa35f9a0b20765 [0,2,0,0,0,0|0,0,2]=4 3130 B13R0.87 CCC[C@H](C)OCCOCC(=O)OC 402ef604e50817b24471bf2e2da5c371 [0,2,0,0,0,0|1,0,1]=4 3131 B13R0.87 CCNC(=O)CNC/C=C/C(=O)OC 2ae95aa7f6eb3dfef247e3a0e4af751b [0,2,0,0,0,0|1,0,1]=4 3132 B13R0.87 CCNC(=O)CNC/C=C\C(=O)OC 330430b400b580409fd752a6b7ae219f [0,2,0,0,0,0|1,0,1]=4 3133 B13R0.87 CCNC(=O)CNCC=CC(=O)OC 7124707e22ac312cf8eefefd81da0086 [0,2,0,0,0,0|1,0,1]=4 3134 B13R0.87 CCNC(=O)COC/C=C/C(=O)OC 353a051548ea608a60d9f1d4b60af07d [0,2,0,0,0,0|1,0,1]=4 3135 B13R0.87 CCNC(=O)COC/C=C\C(=O)OC 5eeb91dc09887f06d1c758aae24d3f86 [0,2,0,0,0,0|1,0,1]=4 3136 B13R0.87 CCNC(=O)COCC=CC(=O)OC 1969530aa289154d371ef00288f0f112 [0,2,0,0,0,0|1,0,1]=4 3137 B13R0.87 CCOC(=O)/C=C/CCCN(C)CC 71ff3dda0d1e08245fd03e45c819bef5 [0,2,0,0,0,0|1,0,0]=3 3138 B13R0.87 CCOC(=O)/C=C/CCOC(C)CC 00f801fca5adfa3ee381df028a9d5caa [0,2,0,0,0,0|1,0,0]=3 3139 B13R0.87 CCOC(=O)/C=C/CNCC(Br)CBr 49ac3d0bfcc22aa04a5b085776bdabbe [0,2,0,0,0,0|2,0,0]=4 3140 B13R0.87 CCOC(=O)/C=C/CNCC(C)CC 5e755a1c2211cbac90ed1f2f44aa5234 [0,2,0,0,0,0|1,0,0]=3 3141 B13R0.87 CCOC(=O)/C=C/CNCC(C)CO 08cea0020c8216b7e592219eb2590556 [0,2,0,0,0,0|2,0,0]=4 3142 B13R0.87 CCOC(=O)/C=C/CNCC(F)CO 02ab1214d36f87119cb2fff7d03dd269 [0,2,0,0,0,0|2,0,0]=4 3143 B13R0.87 CCOC(=O)/C=C/CNCC(O)CC b1ee13c932626d8082a2917a7a6e9842 [0,2,0,0,0,0|1,0,0]=3 3144 B13R0.87 CCOC(=O)/C=C/CNCC(O)CO bb68abc858e12de6f9e76e480b3a26d2 [0,2,0,0,0,0|2,0,0]=4 3145 B13R0.87 CCOC(=O)/C=C/CNC[C@@H](C)CC 1a453f4d6391f6419325b217fbc806cf [0,2,0,0,0,0|1,0,0]=3 3146 B13R0.87 CCOC(=O)/C=C/CNC[C@@H](C)OC 357a09f5d215c7f6d116db7a6468d279 [0,2,0,0,0,0|2,0,0]=4 3147 B13R0.87 CCOC(=O)/C=C/CNC[C@@H](F)CO 6101e3e5dfa0b23d0d4921efb1ccd054 [0,2,0,0,0,0|2,0,0]=4 3148 B13R0.87 CCOC(=O)/C=C/CNC[C@@H](O)CO 29d966f1cc5cb59d3c4c1acc4be3f7cf [0,2,0,0,0,0|2,0,0]=4 3149 B13R0.87 CCOC(=O)/C=C/CNC[C@H](C)CO 0f9dda18aca8fb21807e7437ccd264d1 [0,2,0,0,0,0|2,0,0]=4 3150 B13R0.87 CCOC(=O)/C=C/CNC[C@H](C)OC 9e13af33c0270f1eac4c057bd9b59273 [0,2,0,0,0,0|2,0,0]=4 3151 B13R0.87 CCOC(=O)/C=C/CNC[C@H](F)CO 6145b08788b9471e709ac34112cd4bda [0,2,0,0,0,0|2,0,0]=4 3152 B13R0.87 CCOC(=O)/C=C/CNC[C@H](O)CC d602580be240786d98d66d687035f3dd [0,2,0,0,0,0|1,0,0]=3 3153 B13R0.87 CCOC(=O)/C=C/CNC[C@H](O)CO 1cb97ff96a08131000ec10f3b2ab2b7a [0,2,0,0,0,0|2,0,0]=4 3154 B13R0.87 CCOC(=O)/C=C/COCC(=O)CC 721f4aeb05e53b3f15c1b09bdd531081 [0,2,0,0,0,0|1,0,1]=4 3155 B13R0.87 CCOC(=O)/C=C/COCC(Br)CBr 6c85e4e62cebbf3a5b4bfc3490e050b4 [0,2,0,0,0,0|2,0,0]=4 3156 B13R0.87 CCOC(=O)/C=C/COCC(C)CC beeff923244ce88542d97572d330649b [0,2,0,0,0,0|1,0,0]=3 3157 B13R0.87 CCOC(=O)/C=C/COCC(C)OC b312011c7cbad9514710521b495ef285 [0,2,0,0,0,0|2,0,0]=4 3158 B13R0.87 CCOC(=O)/C=C/COCC(Cl)CCl 7482414f0e0076415d070ccd4a540712 [0,2,0,0,0,0|2,0,0]=4 3159 B13R0.87 CCOC(=O)/C=C/COCC(O)CO 11fa96f470dc7eca291bf99977ed0f0e [0,2,0,0,0,0|2,0,0]=4 3160 B13R0.87 CCOC(=O)/C=C/COCC(S)CS b34e7759aa931bc8b02f7d80e3feacf8 [0,2,0,0,0,0|2,0,0]=4 3161 B13R0.87 CCOC(=O)/C=C/COC[C@@H](C)CC 1f941aedf37e836f404c5853befa06f0 [0,2,0,0,0,0|1,0,0]=3 3162 B13R0.87 CCOC(=O)/C=C/COC[C@@H](C)OC 68985741facfe69775e5d0e1e7b76678 [0,2,0,0,0,0|2,0,0]=4 3163 B13R0.87 CCOC(=O)/C=C/COC[C@@H](O)CO 6cb52a610307794b3d94aa5a7b19605d [0,2,0,0,0,0|2,0,0]=4 3164 B13R0.87 CCOC(=O)/C=C/COC[C@H](C)CC 8e10e8edb9f7e9792a144b9e81b44d97 [0,2,0,0,0,0|1,0,0]=3 3165 B13R0.87 CCOC(=O)/C=C/COC[C@H](C)OC ea8318eef6da031825a70db9025d8ff1 [0,2,0,0,0,0|2,0,0]=4 3166 B13R0.87 CCOC(=O)/C=C/COC[C@H](O)CO 8cdcef0def44642aeeec102062a56959 [0,2,0,0,0,0|2,0,0]=4 3167 B13R0.87 CCOC(=O)C=CCCNC(C)CC 57864a8e2fcfc0aabc768b438a95e98f [0,2,0,0,0,0|1,0,0]=3 3168 B13R0.87 CCOC(=O)C=CCCNC(C)CO 527693a9670853d86394bf98b81b0b28 [0,2,0,0,0,0|2,0,0]=4 3169 B13R0.87 CCOC(=O)C=CCCN[C@@H](C)CC 58a5caa4ca79a8653a9016722b42a4e0 [0,2,0,0,0,0|1,0,0]=3 3170 B13R0.87 CCOC(=O)C=CCCN[C@@H](C)CO 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3d173341a77318d65ee119a1ae07c934 [0,2,0,0,0,0|1,0,0]=3 3267 B13R0.88 CCOC(=O)C=CCCOCC(C)S e11d2e1e3c88a84fca29772e5a63a302 [0,2,0,0,0,0|1,0,0]=3 3268 B13R0.88 CCOC(=O)C=CCCOCC(F)F 49fb59d014d11491e4fa46141f0d2f35 [0,2,0,0,0,0|2,0,0]=4 3269 B13R0.88 CCOC(=O)C=CCCOC[C@@H](C)F 7007a560cf62514dd3396f96a633d239 [0,2,0,0,0,0|1,0,0]=3 3270 B13R0.88 CCOC(=O)C=CCCOC[C@H](C)F 774b2597b2c96a7af7d63f12f747857b [0,2,0,0,0,0|1,0,0]=3 3271 B13R0.88 CCOC(=O)C=CCNCCC(C)C b6159a95e8cbc390fc25fd2b7abab007 [0,2,0,0,0,0|1,0,0]=3 3272 B13R0.88 CCOC(=O)C=CCNCCC(C)O ee5efcd67ce553b949cf2aef6df31693 [0,2,0,0,0,0|1,0,0]=3 3273 B13R0.88 CCOC(=O)C=CCNCCC(F)F ef8b7137874fbfeb4a98eeae8eac39cd [0,2,0,0,0,0|2,0,0]=4 3274 B13R0.88 CCOC(=O)C=CCNCCN(C)C 6651c50cc79b55c021622f37e267d99f [0,2,0,0,0,0|2,0,0]=4 3275 B13R0.88 CCOC(=O)C=CCNCCS(=O)C 12c614796d18b962f9735b4a57301e58 [0,2,0,0,0,0|2,0,0]=4 3276 B13R0.88 CCOC(=O)C=CCNCC[C@@H](C)O 87bea18611815743cfdfb7fb650790e7 [0,2,0,0,0,0|1,0,0]=3 3277 B13R0.88 CCOC(=O)C=CCNCC[C@H](C)O ff637b84042292b50fcd475efd8d91d6 [0,2,0,0,0,0|1,0,0]=3 3278 B13R0.88 CCOC(=O)C=CCOCCC(=O)C a96a3eb7e7798c6505f0ca46eebadf4b [0,2,0,0,0,0|1,0,1]=4 3279 B13R0.88 CCOC(=O)C=CCOCCC(C)C f397966bbb23fa4f1af4ad7c661a231f [0,2,0,0,0,0|1,0,0]=3 3280 B13R0.88 CCOC(=O)C=CCOCCC(F)F f3a3ba8bfc58e8de792e50410847b560 [0,2,0,0,0,0|2,0,0]=4 3281 B13R0.88 CCOC(=O)C=CCOCCN(C)C dd18d12983b994e893d69292d77c6760 [0,2,0,0,0,0|2,0,0]=4 3282 B13R0.88 CCOC(=O)C=CCOCCS(=O)C 2adf1abe25f88f96321e1316bf64f066 [0,2,0,0,0,0|2,0,0]=4 3283 B13R0.88 CCOC(=O)CNCCCCC(C)C 6b82839d529610ce38d67ede231966b8 [0,2,0,0,0,0|1,0,1]=4 3284 B13R0.88 CCOC(=O)CNCCCCC(C)O f8aed573a50a1c078422e9aae9db1a81 [0,2,0,0,0,0|1,0,1]=4 3285 B13R0.88 CCOC(=O)CNCCCC[C@@H](C)O 2894c1c2a01d8d1471ae3e9ecc66ea42 [0,2,0,0,0,0|1,0,1]=4 3286 B13R0.88 CCOC(=O)COCCCCC(C)C 4f78732b69d00994c43317c604a27ef7 [0,2,0,0,0,0|1,0,1]=4 3287 B13R0.88 COCC(=O)COCCCCC(C)C 5ca3c0fd285f5c969062076db3b3c5b9 [0,2,0,0,0,0|1,0,1]=4 3288 B13R0.88 COCC(=O)NCCCCCC(C)C 3f0394178858fd5b4111775f68851203 [0,2,0,0,0,0|1,0,1]=4 3289 B13R0.175 CCCCC(C)COCC(=O)COC fbfb4e879f8f65a949d648b803389c67 [0,2,0,0,0,0|1,0,1]=4 3290 B13R0.175 CCCCC(C)COCC(=O)OCC 75aa47bb6a97ded20d192917bbb01247 [0,2,0,0,0,0|1,0,1]=4 3291 B13R0.175 CCCCC(O)CNCC(=O)COC 615f52602f881b4d1024727a0bf48dd7 [0,2,0,0,0,0|1,0,1]=4 3292 B13R0.175 CCCCC(O)CNCC(=O)OCC 284d91f9211cae3b09ae64af74a5c906 [0,2,0,0,0,0|1,0,1]=4 3293 B13R0.175 CCCCN(C)C/C=C/C(=O)OCC 781c8933582890a9d53edb21b7a7c648 [0,2,0,0,0,0|1,0,0]=3 3294 B13R0.175 CCCCN(C)CC=CC(=O)OCC 5a27e5bc6f0af27112dafd9abcc7e0f5 [0,2,0,0,0,0|1,0,0]=3 3295 B13R0.175 CCOC(=O)/C=C/CN(C)CCCO d4f5ce7920d6c2494534d373971a1bf6 [0,2,0,0,0,0|2,0,0]=4 3296 B13R0.175 CCOC(=O)/C=C/CN(C)CCOC 0fcd8035d3a88e7d07fd8b3c785ca893 [0,2,0,0,0,0|2,0,0]=4 3297 B13R0.175 CCOC(=O)/C=C/CN(C)CCSC 907f96258acc02bc736b7589234f349a [0,2,0,0,0,0|2,0,0]=4 3298 B13R0.175 CCOC(=O)C=CCN(C)CCCO 938e8f193f27db0c8e527f2253c86fe6 [0,2,0,0,0,0|2,0,0]=4 3299 B13R0.175 CCOC(=O)C=CCN(C)CCOC f460b049ab24e4b5039c9f00ec46f0be [0,2,0,0,0,0|2,0,0]=4 3300 B13R0.175 CCOC(=O)C=CCN(C)CCSC cfd63c5efd9b175b4ac5c10cafbcca47 [0,2,0,0,0,0|2,0,0]=4 3301 B13R0.193 CCCCCC(C)NCC(=O)COC 342269ec8313fd4e86195a54c331bbbd [0,2,0,0,0,0|1,0,1]=4 3302 B13R0.193 CCCCCC(C)NCC(=O)OCC 8915589a430f620271906f5904ef46fa [0,2,0,0,0,0|1,0,1]=4 3303 B13R0.193 CCCCCC(C)OCC(=O)COC 116dd64d6c4e02acc3dc06824eeb5f33 [0,2,0,0,0,0|1,0,1]=4 3304 B13R0.193 CCCCCC(C)OCC(=O)OCC 358e541afbd48f2f3a8a8561e6de73e0 [0,2,0,0,0,0|1,0,1]=4 3305 B13R0.193 CCCCCC(O)/C=C/C(=O)NC#N bc7d3a087041289381e321efdfe6ad2d [0,2,0,0,0,0|1,0,1]=4 3306 B13R0.193 CCCCC[C@@H](C)OCC(=O)COC ad1bbb4043941a55ee9b93e0bc6447f9 [0,2,0,0,0,0|1,0,1]=4 3307 B13R0.193 CCCCC[C@@H](C)OCC(=O)OCC cbd403afa48a5e3e81d4b218292d20f4 [0,2,0,0,0,0|1,0,1]=4 3308 B13R0.193 CCCCC[C@H](C)NCC(=O)COC 1c7a7a98fe8bda6c8e8c3e4b4a337f4f [0,2,0,0,0,0|1,0,1]=4 3309 B13R0.193 CCCCC[C@H](C)NCC(=O)OCC 34130c13b516b6897ef288cd5672706a [0,2,0,0,0,0|1,0,1]=4 3310 B13R0.193 CCCCC[C@H](C)OCC(=O)COC ab65f4658c79adfc5883b3fe546dc9a3 [0,2,0,0,0,0|1,0,1]=4 3311 B13R0.193 CCCCC[C@H](C)OCC(=O)OCC a2647bbaf42012fe4279b2c658bcf753 [0,2,0,0,0,0|1,0,1]=4 3312 B13R0.193 CCCCNC(=O)/C=C/C(=O)OCC 0c84a9f2468944852525a8a55470d5a0 [0,2,0,0,0,0|1,0,1]=4 3313 B13R0.193 CCCCNC(=O)/C=C\C(=O)OCC 531537fda45caa777a982220c6db4648 [0,2,0,0,0,0|1,0,1]=4 3314 B13R0.193 CCCCNC(=O)C=CC(=O)OCC 4f782df3ee6748df27333880c288e202 [0,2,0,0,0,0|1,0,1]=4 3315 B13R0.275 C=C(CNCCCCC)C(=O)OCC 5b221ef6ac93e5f9e27860e5aff0760f [0,2,0,0,0,0|1,0,1]=4 3316 B13R0.275 C=C(COC)C(=O)NCCCCCC 82836de359d87bd3d1f61e86f9a067bd [0,2,0,0,0,0|2,0,0]=4 3317 B13R0.275 C=C(COCCCCC)C(=O)OCC 3b9d67ab738080aa46141c875779ddae [0,2,0,0,0,0|1,0,1]=4 3318 B13R0.275 CCCCCCCN(C)C(=O)COC 70a591dad6f19652cf272e28e9b9cc20 [0,2,0,0,0,0|1,0,1]=4 3319 B13R0.275 CCCCCCNC(=O)C(=O)CCC 480fd9f86b13317b17b243cc8665c935 [0,2,0,0,0,0|2,0,0]=4 3320 B13R0.275 CCCCCCNC(=O)C(=O)NCC 8b4fedcab32ca26bcf08aa5272c47941 [0,2,0,0,0,0|2,0,0]=4 3321 B13R0.275 CCCCCCNC(=O)C(=O)OCC 1fe1fa97555c777427f9ce047a2a563d [0,2,0,0,0,0|1,0,0]=3 3322 B13R0.275 CCCCCCNC(C)C(=O)OCC 0d8b1b650a5822e5bb867da89fa93e5f [0,2,0,0,0,0|1,0,1]=4 3323 B13R0.275 CCCCCCNC(F)C(=O)OCC 68b6b8f8ac9fe2f92d0c154051be8aa5 [0,2,0,0,0,0|1,0,1]=4 3324 B13R0.275 CCCCCCN[C@@H](C)C(=O)OCC e340a26cfbcb914c9225cb86d37994ca [0,2,0,0,0,0|1,0,1]=4 3325 B13R0.275 CCCCCCN[C@H](C)C(=O)OCC ac7a042837f608aaa1fef350ecf616c4 [0,2,0,0,0,0|1,0,1]=4 3326 B13R0.275 CCCCCCOC(C)C(=O)OCC d0d9adaea64398cc0452c6c7c6e02f3e [0,2,0,0,0,0|1,0,1]=4 3327 B13R0.275 CCCCCCOC(F)C(=O)OCC deb622ffa08f5c8c7fdd012005341c47 [0,2,0,0,0,0|1,0,1]=4 3328 B13R0.275 CCCCCCO[C@@H](C)C(=O)OCC 1089dbbcb1cbaed2dbe7b198063d2af9 [0,2,0,0,0,0|1,0,1]=4 3329 B13R0.275 CCCCCCO[C@H](C)C(=O)OCC 8797a500078b53d61babad3e4f0bd1f9 [0,2,0,0,0,0|1,0,1]=4 3330 B13R0.275 CCCOCCNC(=O)C(=O)OCC 496fdeecf81de88f500be6204b5afbbd [0,2,0,0,0,0|2,0,0]=4 3331 B13R0.275 CCOC(=O)C(=O)NCCCCCCl c304d759e25874e575a83bbd9842fe60 [0,2,0,0,0,0|2,0,0]=4 3332 B13R0.275 CCOC(=O)C(=O)NCCCCCO 0cb291199637fc5f6b44cc9f392f3795 [0,2,0,0,0,0|2,0,0]=4 3333 B13R0.275 CCOC(=O)C(=O)NCCCCOC 7a30cd551e5e75c3578526ee858b1208 [0,2,0,0,0,0|2,0,0]=4 3334 B13R0.275 CCOC(=O)C(=O)NCCCCSC debc390a71b8ccef7fdd25127cb3071b [0,2,0,0,0,0|2,0,0]=4 3335 B13R0.275 CCOCCCNC(=O)C(=O)OCC 7da038ecf2506aabca302be3fab91027 [0,2,0,0,0,0|2,0,0]=4 3336 B13R0.330 CCCCCCC(C)NC(=O)COC 0a5520280d3346f5701b1871eab84e48 [0,2,0,0,0,0|1,0,1]=4 3337 B13R0.330 CCCCCCN(C)CC(=O)COC a922da48bd0007ac169dc3321b539ec1 [0,2,0,0,0,0|1,0,1]=4 3338 B13R0.330 CCCCCCN(C)CC(=O)OCC 36fc3a22e1d497493de89e773577ede9 [0,2,0,0,0,0|1,0,1]=4 3339 B13R0.330 CCCCCC[C@@H](C)NC(=O)COC 673abebfb46d99c39fe887b3b718d4d0 [0,2,0,0,0,0|1,0,1]=4 3340 B13R0.330 CCCCCC[C@H](C)NC(=O)COC db857da7a88a7cf793d190f9a59593e7 [0,2,0,0,0,0|1,0,1]=4 3341 B13R0.330 CCCCCNC(=O)CC(=O)OCC b32e031ee7996d1d4c30e522118323c2 [0,2,0,0,0,0|1,0,1]=4 3342 B13R0.330 CCCCNC/C(=C/C(=O)OCC)/C 3880d004b0802715f6b43759d85fa7c9 [0,2,0,0,0,0|1,0,0]=3 3343 B13R0.330 CCCCOC/C(=C/C(=O)OCC)/C 53a456ec9651515d982ec32af4e5ec5a [0,2,0,0,0,0|1,0,0]=3 3344 B13R0.330 CCCCOCC(=O)CC(=O)OCC 6083b5d5811614074b14ae2207ed0a80 [0,2,0,0,0,0|1,0,1]=4 3345 B13R0.330 CCOC(=O)/C=C(\C)/CNCCCCl 4206616a97feb910509b31e9658378cc [0,2,0,0,0,0|2,0,0]=4 3346 B13R0.330 CCOC(=O)/C=C(\C)/CNCCCO 662de4d33293a59051967c7143466986 [0,2,0,0,0,0|2,0,0]=4 3347 B13R0.330 CCOC(=O)/C=C(\C)/CNCCOC a94089c09623780652893dc0b21a87b3 [0,2,0,0,0,0|2,0,0]=4 3348 B13R0.330 CCOC(=O)/C=C(\C)/CNCCSC 405061120bfa871f9fe8e9c8cdd0153e [0,2,0,0,0,0|2,0,0]=4 3349 B13R0.330 CCOC(=O)/C=C(\C)/COCCCF 2b1601cb4262b942be8fba46fc1edfe9 [0,2,0,0,0,0|2,0,0]=4 3350 B13R0.330 CCOC(=O)/C=C(\C)/COCCCS 3d29d0323b10fdc1a4b4478e3be18026 [0,2,0,0,0,0|2,0,0]=4 3351 B13R0.330 CCOC(=O)/C=C(\C)/COCCOC 4d5b9b9f44a996a59f374394f6399c26 [0,2,0,0,0,0|2,0,0]=4 3352 B13R0.330 CCOC(=O)/C=C(\C)/COCCSC edfcc7c81d7292cb35530baa577c4eb5 [0,2,0,0,0,0|2,0,0]=4 3353 B13R0.330 CCOCOC/C(=C/C(=O)OCC)/C 454fc4762f8ddd35edb36f5c4cd962bd [0,2,0,0,0,0|2,0,0]=4 3354 B13R0.335 CCCCCCNCC(=O)OC(C)C 8da1c034d4611b7d96a428d8ad9e826b [0,2,0,0,0,0|1,0,1]=4 3355 B13R0.335 CCCCCCOCC(=O)OC(C)C 507c24e4c058bb578d428888588fc848 [0,2,0,0,0,0|1,0,1]=4 3356 B13R0.340 C#CCCCCCNC(=O)C(=O)OC 0a9a8a2f34010f01eaad38d08223bbd4 [0,2,0,0,0,0|1,0,1]=4 3357 B13R0.340 C#CCCCCOC=C(F)C(=O)OC 775f4584d279ec9ff12fc3c18d0d345f [0,2,0,0,0,0|0,0,2]=4 3358 B13R0.340 C/C=C\CCCOC=C(F)C(=O)OC 2c7900ea6016c680ab6cd98f526db0f0 [0,2,0,0,0,0|0,0,2]=4 3359 B13R0.340 C=C(CNCCCCCC)C(=O)OC e7fd5476a29aff63f2bd0ea3295311a8 [0,2,0,0,0,0|0,0,1]=3 3360 B13R0.340 C=C(CNCCCCCCl)C(=O)OC e860647f1a9ef8850e9f886f8ebf0c0d [0,2,0,0,0,0|1,0,1]=4 3361 B13R0.340 C=C(CNCCCCCO)C(=O)OC 55c0a834ce9295e9db26a9993ab35ec0 [0,2,0,0,0,0|1,0,1]=4 3362 B13R0.340 C=C(CNCCCCOC)C(=O)OC adc20dfb072b818ce9383ee393807b8e [0,2,0,0,0,0|1,0,1]=4 3363 B13R0.340 C=C(CNCCCCSC)C(=O)OC 204db4b2ddcf5badd9421299c2d29a7a [0,2,0,0,0,0|1,0,1]=4 3364 B13R0.340 C=C(CNCCCOCC)C(=O)OC 1c2fadca9881be6f417bffc7c37232bd [0,2,0,0,0,0|1,0,1]=4 3365 B13R0.340 C=C(CNCCOCCC)C(=O)OC 66306cca91a20c90754ac9e4e1582352 [0,2,0,0,0,0|1,0,1]=4 3366 B13R0.340 C=C(COCCCCCC)C(=O)OC dd2d052c244bcb5ca1a0011378c16394 [0,2,0,0,0,0|0,0,1]=3 3367 B13R0.340 C=C(COCCCCCF)C(=O)OC b078016b732d575b5f8488326aaf0a2c [0,2,0,0,0,0|1,0,1]=4 3368 B13R0.340 C=C(COCCCCOC)C(=O)OC 66ad33b46fa91c36321cd95e875daed8 [0,2,0,0,0,0|1,0,1]=4 3369 B13R0.340 C=C(COCCCCSC)C(=O)OC 6f1234bf8701065b6dcda8b2612e7058 [0,2,0,0,0,0|1,0,1]=4 3370 B13R0.340 C=C(COCCCOCC)C(=O)OC 5462851b22d4d53017b490c7ef9a4ebb [0,2,0,0,0,0|1,0,1]=4 3371 B13R0.340 C=C(COCCCSCC)C(=O)OC c6bd698290ee14172441c1a25a5e426b [0,2,0,0,0,0|1,0,1]=4 3372 B13R0.340 C=C(COCCOCCC)C(=O)OC d2fe8ce7d5199517d3032df83e2c8a74 [0,2,0,0,0,0|1,0,1]=4 3373 B13R0.340 C=C(COCCSCCC)C(=O)OC 5783086314e883f6c71551dc2fffdcb6 [0,2,0,0,0,0|1,0,1]=4 3374 B13R0.340 C=C(COCOCCCC)C(=O)OC 709ef73e8e8ac50a3c36e5f8467a9641 [0,2,0,0,0,0|1,0,1]=4 3375 B13R0.340 C=CCCCCCNC(=O)C(=O)OC 9615b40addc61cfea59309721f252c53 [0,2,0,0,0,0|1,0,1]=4 3376 B13R0.340 C=CCCCCOC=C(F)C(=O)OC 2b87694e0425d568413a6c74e5d36738 [0,2,0,0,0,0|0,0,2]=4 3377 B13R0.340 CC/C=C\CCOC=C(F)C(=O)OC 72a8be994519522632e0a1b1e0a54776 [0,2,0,0,0,0|0,0,2]=4 3378 B13R0.340 CCC(=O)C(=O)NCCCCCCCl 8260a44addc6bf6af9d2aa2333ff33ef [0,2,0,0,0,0|2,0,0]=4 3379 B13R0.340 CCC(=O)C(=O)NCCCCCCO 66a8cbe1292d5f64f161aedcef803613 [0,2,0,0,0,0|2,0,0]=4 3380 B13R0.340 CCC(=O)C(=O)NCCCCCOC 3e5606ccc0cb1499c91df17ccb50913c [0,2,0,0,0,0|2,0,0]=4 3381 B13R0.340 CCC/C=C/COC=C(F)C(=O)OC 538f8446e22dfbd40ced77c96185f9b1 [0,2,0,0,0,0|0,0,2]=4 3382 B13R0.340 CCC/C=C\COC=C(F)C(=O)OC 38c4210ce70ea2e958bc823b752baaee [0,2,0,0,0,0|0,0,2]=4 3383 B13R0.340 CCCCCC/C=C/C(=O)N(C)CC 47873353513bb06f5ce86d214e7cabab [0,2,0,0,0,0|1,0,0]=3 3384 B13R0.340 CCCCCCCNC(=O)C(=O)CC 0e10c74afedeede919a60931ad69d212 [0,2,0,0,0,0|1,0,1]=4 3385 B13R0.340 CCCCCCCNC(=O)C(=O)NC 7e6cbb9ac89e8434911a05fabdce3da9 [0,2,0,0,0,0|1,0,1]=4 3386 B13R0.340 CCCCCCCNC(=O)C(=O)OC 002f1de669dd21d9b40f61682743777c [0,2,0,0,0,0|0,0,1]=3 3387 B13R0.340 CCCCCCCNC(=O)C(C)OC 11232c4d3d8f3931f5576e7ef8a74109 [0,2,0,0,0,0|1,0,1]=4 3388 B13R0.340 CCCCCCCNC(=O)[C@@H](C)OC 859fa5e81f6439739da74d45179b1327 [0,2,0,0,0,0|1,0,1]=4 3389 B13R0.340 CCCCCCCNC(=O)[C@H](C)OC 14554636ad925679ed8fdbd8b241c93d [0,2,0,0,0,0|1,0,1]=4 3390 B13R0.340 CCCCCCCNC(C)C(=O)OC cb8c0d9a2ae373ebb41b2afa899548e3 [0,2,0,0,0,0|0,0,2]=4 3391 B13R0.340 CCCCCCCN[C@@H](C)C(=O)OC f6ef5760545d2077a22b98d70c443f65 [0,2,0,0,0,0|0,0,2]=4 3392 B13R0.340 CCCCCCCN[C@H](C)C(=O)OC e41955eb6c1b68b7c786dadf8442b06b [0,2,0,0,0,0|0,0,2]=4 3393 B13R0.340 CCCCCCCOC(C)C(=O)OC 2e731a12cc3d0e3d45beef133debccc5 [0,2,0,0,0,0|0,0,2]=4 3394 B13R0.340 CCCCCCCO[C@@H](C)C(=O)OC a0fcfeafbc05e3b0bd89bdb0c09b8ce6 [0,2,0,0,0,0|0,0,2]=4 3395 B13R0.340 CCCCCCCO[C@H](C)C(=O)OC 6a3ab7d4244ebd3964d995ad95870440 [0,2,0,0,0,0|0,0,2]=4 3396 B13R0.340 CCCCCCNCC(=O)C(=O)OC e960ee7a2ef93acbe606006e87d48bda [0,2,0,0,0,0|0,0,1]=3 3397 B13R0.340 CCCCCCNCC(=O)N(C)OC 0c4c6ddaeb17327f3d02d61a28fca42d [0,2,0,0,0,0|1,0,1]=4 3398 B13R0.340 CCCCCCNCC(C)C(=O)OC 3555573cfe1b1378f23f8017202c21e3 [0,2,0,0,0,0|0,0,2]=4 3399 B13R0.340 CCCCCCNCC(O)C(=O)OC 622ecc0fee5c063d97cb0bea8e0d4335 [0,2,0,0,0,0|0,0,2]=4 3400 B13R0.340 CCCCCCNC[C@@H](C)C(=O)OC 58f31058fdd484b86e452992af39c0b5 [0,2,0,0,0,0|0,0,2]=4 3401 B13R0.340 CCCCCCNC[C@H](C)C(=O)OC 078d842f162c09c7bafa3a494a93b5f2 [0,2,0,0,0,0|0,0,2]=4 3402 B13R0.340 CCCCCCOC=C(F)C(=O)OC 1dd71602d24e68d8e2ae5b14381f11f4 [0,2,0,0,0,0|0,0,0]=2 3403 B13R0.340 CCCCCCOCC(=O)C(=O)OC fe4a91a430a21c1b7acd55c2e7c919c5 [0,2,0,0,0,0|0,0,1]=3 3404 B13R0.340 CCCCCCOCC(C)C(=O)OC 9e9680b889235bd2d16676dd8240cffe [0,2,0,0,0,0|0,0,2]=4 3405 B13R0.340 CCCCCCOCC(F)C(=O)OC 4f9e24af2cbfd6cc656e1842c97f9ebe [0,2,0,0,0,0|0,0,2]=4 3406 B13R0.340 CCCCCCOC[C@@H](C)C(=O)OC ccce413d07f990a66af12c45c06c6e28 [0,2,0,0,0,0|0,0,2]=4 3407 B13R0.340 CCCCCCOC[C@H](C)C(=O)OC 61a86aadd3937e2bb7c1de86386cf1db [0,2,0,0,0,0|0,0,2]=4 3408 B13R0.340 CCCCCNCCC(C)C(=O)OC 7b369d6d30d9364a463b50a7a9884e39 [0,2,0,0,0,0|0,0,2]=4 3409 B13R0.340 CCCCCOCCC(C)C(=O)OC 8722ce5268c3bfe6f3a84bfd849f1545 [0,2,0,0,0,0|0,0,2]=4 3410 B13R0.340 CCCCNCCCC(=O)C(=O)OC 4527f23c7582313db9d04093012357d8 [0,2,0,0,0,0|0,0,1]=3 3411 B13R0.340 CCCCNCCCC(C)C(=O)OC 5f349896528ee38ef5e8a4303c8dfa2d [0,2,0,0,0,0|0,0,2]=4 3412 B13R0.340 CCCCOCCCC(=O)C(=O)OC 3b8c2526411b841df0fa45bb3eb26ee9 [0,2,0,0,0,0|0,0,1]=3 3413 B13R0.340 CCCCOCCCC(C)C(=O)OC f4b71c8e9df8c308c05b7089750e2b21 [0,2,0,0,0,0|0,0,2]=4 3414 B13R0.340 CCCCOCCNC(=O)C(=O)CC 8d29d7c4546e67f3e12055cdf6311eb9 [0,2,0,0,0,0|2,0,0]=4 3415 B13R0.340 CCCCOCCNC(=O)C(=O)NC f72dda443bbf1e827bfc7c6bc9c589d9 [0,2,0,0,0,0|2,0,0]=4 3416 B13R0.340 CCCCOCCNC(=O)C(=O)OC ed18233bfbeb16f50e287c2e39d137ee [0,2,0,0,0,0|1,0,0]=3 3417 B13R0.340 CCCCOCCNC(C)C(=O)OC def755bfa825defe199b8249403b97be [0,2,0,0,0,0|1,0,1]=4 3418 B13R0.340 CCCCOCCN[C@@H](C)C(=O)OC c059a1074cf9b9849cf10ecf369d2821 [0,2,0,0,0,0|1,0,1]=4 3419 B13R0.340 CCCCOCCN[C@H](C)C(=O)OC 1b2ec5c824a59262dd5452e42a687f56 [0,2,0,0,0,0|1,0,1]=4 3420 B13R0.340 CCCCOCCOC(C)C(=O)OC e2f6b4c29c556b6d6e92e182932ab618 [0,2,0,0,0,0|1,0,1]=4 3421 B13R0.340 CCCCOCCO[C@@H](C)C(=O)OC 3667bae9c52b5b6f2c847131a5babfd3 [0,2,0,0,0,0|1,0,1]=4 3422 B13R0.340 CCCCOCCO[C@H](C)C(=O)OC bab1dd2735c3ddaf056c3ed51f1bfa95 [0,2,0,0,0,0|1,0,1]=4 3423 B13R0.340 CCCCOCOC=C(F)C(=O)OC 26460518d76ce350551407d889418d8c [0,2,0,0,0,0|1,0,0]=3 3424 B13R0.340 CCCOCCCNC(=O)C(=O)CC 46019548f7597cc8670f3fc29279438a [0,2,0,0,0,0|2,0,0]=4 3425 B13R0.340 CCCOCCCNC(=O)C(=O)NC d1b34f910229dfc2db0134d636049604 [0,2,0,0,0,0|2,0,0]=4 3426 B13R0.340 CCCOCCCNC(=O)C(=O)OC 368ff5bac10ba211554a125634b1f9dd [0,2,0,0,0,0|1,0,0]=3 3427 B13R0.340 CCCOCCCNC(C)C(=O)OC 8f3f7725bda30079e586fa2cfde7e3c8 [0,2,0,0,0,0|1,0,1]=4 3428 B13R0.340 CCCOCCCN[C@@H](C)C(=O)OC aea74f92dfee0b775e868848eb785571 [0,2,0,0,0,0|1,0,1]=4 3429 B13R0.340 CCCOCCCN[C@H](C)C(=O)OC e96c84b3d55f5d4268883fdb8d08ca1c [0,2,0,0,0,0|1,0,1]=4 3430 B13R0.340 CCCOCCCOC(C)C(=O)OC 6b283e74540435e277c7b73d9dcad199 [0,2,0,0,0,0|1,0,1]=4 3431 B13R0.340 CCCOCCCO[C@@H](C)C(=O)OC 775d0ab8efc5e304d33a4b967a033cec [0,2,0,0,0,0|1,0,1]=4 3432 B13R0.340 CCCOCCCO[C@H](C)C(=O)OC 4233e9a3f97e70fd75e20676ac7a1039 [0,2,0,0,0,0|1,0,1]=4 3433 B13R0.340 CCCOCCNCC(=O)C(=O)OC c7f85fe387ae249388ff35e0e1c025da [0,2,0,0,0,0|1,0,1]=4 3434 B13R0.340 CCCOCCOC=C(F)C(=O)OC d50a8042f69f0b2fe76a6dc8e27a153b [0,2,0,0,0,0|1,0,0]=3 3435 B13R0.340 CCCOCCOCC(=O)C(=O)OC 9012bf11d79c20fa67fb6988c735c816 [0,2,0,0,0,0|1,0,1]=4 3436 B13R0.340 CCCSCCOCC(=O)C(=O)OC 96782a2515c096e1cd0dd47883b297a1 [0,2,0,0,0,0|1,0,1]=4 3437 B13R0.340 CCOCCCNCC(=O)C(=O)OC 67d52b936e9b66dfd6ec43ac0058b3b2 [0,2,0,0,0,0|1,0,1]=4 3438 B13R0.340 CCOCCCOC=C(F)C(=O)OC 1acb63458f1c7d35421331b4c32ea9a2 [0,2,0,0,0,0|1,0,0]=3 3439 B13R0.340 CCOCCCOCC(=O)C(=O)OC 7c6b1b93b5a7ca992b467c7f47e6adf3 [0,2,0,0,0,0|1,0,1]=4 3440 B13R0.340 CCSCCCCNC(=O)C(=O)CC e2620759a12d445365c3dc963528cdb9 [0,2,0,0,0,0|2,0,0]=4 3441 B13R0.340 CCSCCCCNC(=O)C(=O)NC 0474df87beb3afc12e0b493f2e4fad4b [0,2,0,0,0,0|2,0,0]=4 3442 B13R0.340 CCSCCCCNC(=O)C(=O)OC ab924c98c4ef320d9056757c228b8f42 [0,2,0,0,0,0|1,0,0]=3 3443 B13R0.340 CCSCCCCNC(C)C(=O)OC 3ffe4da82f983c0d8f6385396e746331 [0,2,0,0,0,0|1,0,1]=4 3444 B13R0.340 CCSCCCCN[C@@H](C)C(=O)OC 26d516a4c564a301ecf481227db878ac [0,2,0,0,0,0|1,0,1]=4 3445 B13R0.340 CCSCCCCN[C@H](C)C(=O)OC a0ef4dd48d90afbc484f367f070eeafc [0,2,0,0,0,0|1,0,1]=4 3446 B13R0.340 CCSCCCOC=C(F)C(=O)OC a9850c241c2afdc8b1bda43c0770224a [0,2,0,0,0,0|1,0,0]=3 3447 B13R0.340 CCSCCCOCC(=O)C(=O)OC 1c47f6286229e9ec7a8235d90b88560a [0,2,0,0,0,0|1,0,1]=4 3448 B13R0.340 CNC(=O)C(=O)NCCCCCCCl 6b2db6a77889026752989ea1df1432ac [0,2,0,0,0,0|2,0,0]=4 3449 B13R0.340 CNC(=O)C(=O)NCCCCCCO 1e3531b0954f5e33c6491065ecf2ad24 [0,2,0,0,0,0|2,0,0]=4 3450 B13R0.340 CNC(=O)C(=O)NCCCCCOC 5a3e20f2a37375977905cb60af3f65fb [0,2,0,0,0,0|2,0,0]=4 3451 B13R0.340 COC(=O)C(=COCCCCC#N)F e4530d61123457b68a893f7f73c2dfc7 [0,2,0,0,0,0|1,0,1]=4 3452 B13R0.340 COC(=O)C(=COCCCCC=O)F 3f1ab2663f8587ce511d128395adef8b [0,2,0,0,0,0|1,0,1]=4 3453 B13R0.340 COC(=O)C(=COCCCCCF)F 413f87f4a4fc3c63cad3bf147c759601 [0,2,0,0,0,0|1,0,0]=3 3454 B13R0.340 COC(=O)C(=O)CCCNCCCCl 76d75b79d8954b54984725a8c8154365 [0,2,0,0,0,0|1,0,1]=4 3455 B13R0.340 COC(=O)C(=O)CCCNCCCO 2691ff19919a7754cbb9b9c8991fa217 [0,2,0,0,0,0|1,0,1]=4 3456 B13R0.340 COC(=O)C(=O)CCCNCCSC f5abd9b6c38514ca3b55de643514847a [0,2,0,0,0,0|1,0,1]=4 3457 B13R0.340 COC(=O)C(=O)CCCOCCCF 4c24c359549cef8832c26a699197de7b [0,2,0,0,0,0|1,0,1]=4 3458 B13R0.340 COC(=O)C(=O)CCCOCCCS b641ccca16fa21adf82dbbb73f2034b8 [0,2,0,0,0,0|1,0,1]=4 3459 B13R0.340 COC(=O)C(=O)CCCOCCSC bdc6bff4c98d82224de5d6f1c29e6487 [0,2,0,0,0,0|1,0,1]=4 3460 B13R0.340 COC(=O)C(=O)CNCCCCCCl 7e9a15c00d5416d2abda9ec6f7a95e25 [0,2,0,0,0,0|1,0,1]=4 3461 B13R0.340 COC(=O)C(=O)CNCCCCCO 1eb95f8315513b6ac581462ef8f308e9 [0,2,0,0,0,0|1,0,1]=4 3462 B13R0.340 COC(=O)C(=O)CNCCCCSC 049a88a6cf42f4b37d89e31c26d709fd [0,2,0,0,0,0|1,0,1]=4 3463 B13R0.340 COC(=O)C(=O)COCCCCSC 7192ad5c8bf7450d3d4e21f5186836ac [0,2,0,0,0,0|1,0,1]=4 3464 B13R0.340 COC(=O)C(=O)NCCCCCC#N 87b0b05cff8c0abfcfef150c954efdf2 [0,2,0,0,0,0|1,0,1]=4 3465 B13R0.340 COC(=O)C(=O)NCCCCCCCl 6e0aa8915a4d4112de3e980a886a5929 [0,2,0,0,0,0|1,0,0]=3 3466 B13R0.340 COC(=O)C(=O)NCCCCCCO 30c2a717efdc79bd5ea7b7dd49d293ed [0,2,0,0,0,0|1,0,0]=3 3467 B13R0.340 COC(=O)C(=O)NCCCOCCO a86c2993060c29307e637fab43069ff7 [0,2,0,0,0,0|2,0,0]=4 3468 B13R0.340 COC(=O)C(=O)NCCOCCCO 689a8fd9c7db3edab2426a9cd56b9daf [0,2,0,0,0,0|2,0,0]=4 3469 B13R0.340 COC(=O)C(C)NCCCCCCCl 2f6b45b5c5079a6843e3a8e919680162 [0,2,0,0,0,0|1,0,1]=4 3470 B13R0.340 COC(=O)C(C)NCCCCCCO 0afb95576df6d160208de979f4cae48a [0,2,0,0,0,0|1,0,1]=4 3471 B13R0.340 COC(=O)C(C)OCCCCCCF e6f4acdf05f89f6feb65b99ebf596e42 [0,2,0,0,0,0|1,0,1]=4 3472 B13R0.340 COC(=O)[C@@H](C)NCCCCCCCl cc0caedc4c57b952d6d8b8d315d7e677 [0,2,0,0,0,0|1,0,1]=4 3473 B13R0.340 COC(=O)[C@@H](C)NCCCCCCO 4b5207075791ca53363e7346dd7a178f [0,2,0,0,0,0|1,0,1]=4 3474 B13R0.340 COC(=O)[C@@H](C)OCCCCCCF ea98b8e7a89b5fdf4233b66ea397a8c0 [0,2,0,0,0,0|1,0,1]=4 3475 B13R0.340 COC(=O)[C@H](C)NCCCCCCCl 36545e3aa3bd9fdbdca9010b0c9fbe8a [0,2,0,0,0,0|1,0,1]=4 3476 B13R0.340 COC(=O)[C@H](C)NCCCCCCO bdef3895b666a28f3c7b470491366e56 [0,2,0,0,0,0|1,0,1]=4 3477 B13R0.340 COC(=O)[C@H](C)OCCCCCCF 7567a87b6bf16b6fbaeaedcdc5191225 [0,2,0,0,0,0|1,0,1]=4 3478 B13R0.340 COCCCCCNC(=O)C(=O)OC dae3572d19dae83364fcbfc5a13d01df [0,2,0,0,0,0|1,0,0]=3 3479 B13R0.340 COCCCCCNC(C)C(=O)OC 0e96cef1137408315d8c29c1b47ebb1d [0,2,0,0,0,0|1,0,1]=4 3480 B13R0.340 COCCCCCN[C@@H](C)C(=O)OC 628515c8f41642a92258b95bea522f5f [0,2,0,0,0,0|1,0,1]=4 3481 B13R0.340 COCCCCCN[C@H](C)C(=O)OC 10a523ee7db418abe74f0d43fa8e1c11 [0,2,0,0,0,0|1,0,1]=4 3482 B13R0.340 COCCCCCOC(C)C(=O)OC b071357b00ee56ebd4bd1bcace3a3254 [0,2,0,0,0,0|1,0,1]=4 3483 B13R0.340 COCCCCCO[C@@H](C)C(=O)OC 13bd785a6a10673fc6ffa7bd9841cb15 [0,2,0,0,0,0|1,0,1]=4 3484 B13R0.340 COCCCCCO[C@H](C)C(=O)OC f4c3db6d4ce9012a5bea8e62020202ba [0,2,0,0,0,0|1,0,1]=4 3485 B13R0.340 COCCCCNCC(=O)C(=O)OC b6b886a0d2107a9cff8b4ce190f0a8fa [0,2,0,0,0,0|1,0,1]=4 3486 B13R0.340 COCCCCOC=C(F)C(=O)OC f36dd491f4145ad15bcb4c7eda7bf586 [0,2,0,0,0,0|1,0,0]=3 3487 B13R0.340 COCCCCOCC(=O)C(=O)OC d94719a9d5f8e659247edebc52ca0e2e [0,2,0,0,0,0|1,0,1]=4 3488 B13R0.340 COCCNCCCC(=O)C(=O)OC d2c898e6f23dae92f1848d7a2daebf00 [0,2,0,0,0,0|1,0,1]=4 3489 B13R0.340 COCCOCCCC(=O)C(=O)OC 9c506e56f4b09868f8c9ff1ce3fee9fe [0,2,0,0,0,0|1,0,1]=4 3490 B13R0.340 COCCOCCNC(=O)C(=O)OC 0ecc12d62e9a42af58baf9e111fe7da3 [0,2,0,0,0,0|2,0,0]=4 3491 B13R0.340 COCCOCOC=C(F)C(=O)OC ff2f300053c0b4a36200047d38e26470 [0,2,0,0,0,0|2,0,0]=4 3492 B13R0.340 COCOCCOC=C(F)C(=O)OC bc58f3fadd2c8554e203e94da28763bf [0,2,0,0,0,0|2,0,0]=4 3493 B13R0.367 CCCC(=S)OC/C=C/C(=O)OCC 20456fce5bf3edb2b97b107e1a0c61d3 [0,2,0,0,0,0|1,0,1]=4 3494 B13R0.367 CCCC(=S)OCC=CC(=O)OCC fb4eb6607beb3b9c8dfecb921e26788f [0,2,0,0,0,0|1,0,1]=4 3495 B13R0.367 CCCC(C)CCOCC(=O)COC 6e4090bfb3affc994250cc83d9ca68e5 [0,2,0,0,0,0|1,0,1]=4 3496 B13R0.367 CCCC(C)CCOCC(=O)OCC 25a00036b65e47cdb3959c2e897a3626 [0,2,0,0,0,0|1,0,1]=4 3497 B13R0.367 CCCC(C)NC/C=C/C(=O)OCC 0068a002c5bac6a4c202a075e1168009 [0,2,0,0,0,0|1,0,0]=3 3498 B13R0.367 CCCC(C)NCC=CC(=O)OCC 6bf39fa957a41b423a632691ca4d0f5b [0,2,0,0,0,0|1,0,0]=3 3499 B13R0.367 CCCC(C)OC/C=C/C(=O)OCC a3c0270e595d9451b47ef4324c5c091d [0,2,0,0,0,0|1,0,0]=3 3500 B13R0.367 CCCC(C)OCC=CC(=O)OCC 81ae44e7db27e7163e56aa6c86907d10 [0,2,0,0,0,0|1,0,0]=3 3501 B13R0.367 CCCC(S)CCOCC(=O)COC 887ad3957eedba8399c5f0cdc34cef46 [0,2,0,0,0,0|1,0,1]=4 3502 B13R0.367 CCCC(S)CCOCC(=O)OCC db6d1a7c2538897c67ca469d7d2d0f36 [0,2,0,0,0,0|1,0,1]=4 3503 B13R0.367 CCCN(C)CCC=CC(=O)OCC f658f07e2b912b9b012d485828b0c8ec [0,2,0,0,0,0|1,0,0]=3 3504 B13R0.367 CCC[C@@H](C)OC/C=C/C(=O)OCC 6a82a024f98fe818959fadf3c8b6cb3c [0,2,0,0,0,0|1,0,0]=3 3505 B13R0.367 CCC[C@@H](C)OCC=CC(=O)OCC 613376896eece75ddd31260dbf8f4ef1 [0,2,0,0,0,0|1,0,0]=3 3506 B13R0.367 CCC[C@H](C)NC/C=C/C(=O)OCC 72313926692789af48f32f427998c804 [0,2,0,0,0,0|1,0,0]=3 3507 B13R0.367 CCC[C@H](C)NCC=CC(=O)OCC 189594f1109a1262eb6036061981cd54 [0,2,0,0,0,0|1,0,0]=3 3508 B13R0.367 CCC[C@H](C)OC/C=C/C(=O)OCC e6ea7b4ce9af90216a17c93498c9cee5 [0,2,0,0,0,0|1,0,0]=3 3509 B13R0.367 CCC[C@H](C)OCC=CC(=O)OCC e293cd489672bc006567aac88797f354 [0,2,0,0,0,0|1,0,0]=3 3510 B13R0.367 CCOC(=O)/C=C/CNC(C)CCO 1301d18e26e33d6b40ebb6b7e8e46c9b [0,2,0,0,0,0|2,0,0]=4 3511 B13R0.367 CCOC(=O)/C=C/CNC(C)COC e9e97c65cf867457eeebeb3bbbe02e0d [0,2,0,0,0,0|2,0,0]=4 3512 B13R0.367 CCOC(=O)/C=C/CN[C@@H](C)CCO f3e5a2135f4d1f66e27b09c362d47b38 [0,2,0,0,0,0|2,0,0]=4 3513 B13R0.367 CCOC(=O)/C=C/CN[C@@H](C)COC 9f2ea85c91a37914c5e3553eb6d27de2 [0,2,0,0,0,0|2,0,0]=4 3514 B13R0.367 CCOC(=O)/C=C/CN[C@H](C)CCO f61506697a47f65785649459e3cb8e92 [0,2,0,0,0,0|2,0,0]=4 3515 B13R0.367 CCOC(=O)/C=C/CN[C@H](C)COC a59352f324e128c49b6f154cc7aec437 [0,2,0,0,0,0|2,0,0]=4 3516 B13R0.367 CCOC(=O)/C=C/COC(C)COC 3222e8244fcabfb42a7b4c5143b0bcf2 [0,2,0,0,0,0|2,0,0]=4 3517 B13R0.367 CCOC(=O)/C=C/COC(C)CSC d8ffda4b1485ec8e25875c999360aba2 [0,2,0,0,0,0|2,0,0]=4 3518 B13R0.367 CCOC(=O)/C=C/CO[C@@H](C)COC 98d183a64eb3420c95d4594af77b9c3d [0,2,0,0,0,0|2,0,0]=4 3519 B13R0.367 CCOC(=O)/C=C/CO[C@H](C)COC 80646c37bacde4cfa79dc896e7bfb737 [0,2,0,0,0,0|2,0,0]=4 3520 B13R0.367 CCOC(=O)C=CCCN(C)CCF 1d43eb9a3b21344a0366f3f6d5e2c072 [0,2,0,0,0,0|2,0,0]=4 3521 B13R0.367 CCOC(=O)C=CCCN(C)CCO 56ef1c817127f342874a33556e51ea63 [0,2,0,0,0,0|2,0,0]=4 3522 B13R0.367 CCOC(=O)C=CCNC(C)CCO 3028622816603cfad3e65c1e7b16303e [0,2,0,0,0,0|2,0,0]=4 3523 B13R0.367 CCOC(=O)C=CCNC(C)COC aeeae4587e1e3ba67623af8609e82162 [0,2,0,0,0,0|2,0,0]=4 3524 B13R0.367 CCOC(=O)C=CCN[C@@H](C)CCO bffe45e178d19a0efa289cc1a9ee0459 [0,2,0,0,0,0|2,0,0]=4 3525 B13R0.367 CCOC(=O)C=CCN[C@@H](C)COC cbda767b31ba2355c7a9af56f26f3d25 [0,2,0,0,0,0|2,0,0]=4 3526 B13R0.367 CCOC(=O)C=CCN[C@H](C)CCO 3961ac699097a006c669ef35bbcc20e4 [0,2,0,0,0,0|2,0,0]=4 3527 B13R0.367 CCOC(=O)C=CCN[C@H](C)COC cbc8f065b157ada77ea460fdf8a4da3c [0,2,0,0,0,0|2,0,0]=4 3528 B13R0.367 CCOC(=O)C=CCOC(C)COC 2a3d3f819935e5db0ad32a6a3a1b9dd3 [0,2,0,0,0,0|2,0,0]=4 3529 B13R0.367 CCOC(=O)C=CCOC(C)CSC 679dd578f8c727f10b1bb35117effd46 [0,2,0,0,0,0|2,0,0]=4 3530 B13R0.367 CCOC(=O)C=CCO[C@@H](C)COC 789bf53fe766bec82fb947b8fa1fec41 [0,2,0,0,0,0|2,0,0]=4 3531 B13R0.367 CCOC(=O)C=CCO[C@H](C)COC 87db0d03e351b1131427bc743ca1194c [0,2,0,0,0,0|2,0,0]=4 3532 B13R0.60 C=CC(OCCCCCC)C(=O)OC 38d13648dd65b9a97b31b66089d2ee5d [0,2,0,0,0,0|1,0,1]=4 3533 B13R0.60 CCCCCCNC(C#N)C(=O)OC 34bbf99696b74d536e6baf1792266571 [0,2,0,0,0,0|1,0,1]=4 3534 B13R0.60 CCCCCCNC(C=O)C(=O)OC ad7ce12e0e4966b22ae2bf39e2fb34d5 [0,2,0,0,0,0|1,0,1]=4 3535 B13R0.60 CCCCCCNC(CC)C(=O)OC 8758569479ff6d6630284700bae9ffb6 [0,2,0,0,0,0|1,0,1]=4 3536 B13R0.60 CCCCCCNC(CO)C(=O)OC aee8dfa6c54be5b9bd8b7f87bdb893db [0,2,0,0,0,0|1,0,1]=4 3537 B13R0.60 CCCCCCN[C@@H](CC)C(=O)OC 05b8ce0c44676e7c88ade20ad00e81c2 [0,2,0,0,0,0|1,0,1]=4 3538 B13R0.60 CCCCCCN[C@@H](CO)C(=O)OC cfb97e00f09e1fd42c89841b6bcf8de6 [0,2,0,0,0,0|1,0,1]=4 3539 B13R0.60 CCCCCCN[C@@H](CS)C(=O)OC 274c4a8da4df29eeac4042720b4d8d7c [0,2,0,0,0,0|1,0,1]=4 3540 B13R0.60 CCCCCCN[C@H](CC)C(=O)OC 8cd49d0a64458e0f3e9c4d4c6c3605b5 [0,2,0,0,0,0|1,0,1]=4 3541 B13R0.60 CCCCCCN[C@H](CO)C(=O)OC 387cd3e98bd622083e591b3827479616 [0,2,0,0,0,0|1,0,1]=4 3542 B13R0.60 CCCCCCOC(C#N)C(=O)OC 8b0f7928b849f63509df766c6dfe5cd0 [0,2,0,0,0,0|1,0,1]=4 3543 B13R0.60 CCCCCCOC(C=O)C(=O)OC 092629df5c9eaaf0e134c7f4b8793021 [0,2,0,0,0,0|1,0,1]=4 3544 B13R0.60 CCCCCCOC(CC)C(=O)OC c2d8fd187f7a93673392ff72b7bc013b [0,2,0,0,0,0|1,0,1]=4 3545 B13R0.60 CCCCCCOC(OC)C(=O)OC 0c1db4e197d7270e8a904a8c3313cff4 [0,2,0,0,0,0|1,0,1]=4 3546 B13R0.60 CCCCCCO[C@@H](CC)C(=O)OC a8494ad0391e177dec73fee01d55bef2 [0,2,0,0,0,0|1,0,1]=4 3547 B13R0.60 CCCCCCO[C@H](CC)C(=O)OC 6a2899e609efef09c8ce6ebf227daba5 [0,2,0,0,0,0|1,0,1]=4 3548 B13R0.101 C=C(C)CCCOC=C(F)C(=O)OC 735a5b1ec7b2396a86ad68fa3b99a3c2 [0,2,0,0,0,0|1,0,1]=4 3549 B13R0.101 C=C(CNCCCC(C)C)C(=O)OC d25c0222dc8e12a7a55ae8052703473f [0,2,0,0,0,0|1,0,1]=4 3550 B13R0.101 C=C(COCCCC(C)C)C(=O)OC 7400d2c6fcac172165b40510df5fb429 [0,2,0,0,0,0|1,0,1]=4 3551 B13R0.101 COC(=O)C(=COCCCC(=O)C)F d900bcf9c7add722bf4d87ef0ad4a26e [0,2,0,0,0,0|1,0,1]=4 3552 B13R0.101 COC(=O)C(=COCCCC(C)C)F d568e473f0eb0a335e821089daee4b2b [0,2,0,0,0,0|1,0,0]=3 3553 B13R0.101 COC(=O)C(=COCCCN(C)C)F a980825f8f9e7ba4912373bf34402ff9 [0,2,0,0,0,0|2,0,0]=4 3554 B13R0.101 COC(=O)C(=COCCOC(C)C)F 1202f1c91c5dacea3e3683355ef495fc [0,2,0,0,0,0|2,0,0]=4 3555 B13R0.101 COC(=O)C(=COCCSC(C)C)F 9c4cbea61b6f178ee11f0bc1e54d421d [0,2,0,0,0,0|2,0,0]=4 3556 B13R0.101 COC(=O)C(=O)CCCNCC(C)C 6f9016771ea331be954f8ec416f68691 [0,2,0,0,0,0|1,0,1]=4 3557 B13R0.101 COC(=O)C(=O)CCCNCC(C)O ce9d08008ba70936fe7fa3a3f07618a0 [0,2,0,0,0,0|1,0,1]=4 3558 B13R0.101 COC(=O)C(=O)CCCNC[C@@H](C)O f948e9a1fc6c1c41f224a5f0a010b4de [0,2,0,0,0,0|1,0,1]=4 3559 B13R0.101 COC(=O)C(=O)CCCNC[C@H](C)O e546d765ddef0fa3aec6911b4ae11488 [0,2,0,0,0,0|1,0,1]=4 3560 B13R0.101 COC(=O)C(=O)CCCOCC(C)C 5c181f399ffac156e8c2fe068a4d95fa [0,2,0,0,0,0|1,0,1]=4 3561 B13R0.101 COC(=O)C(=O)CCCOCC(C)F e0e18a3f5ce8ffb3ae84c491fff69c32 [0,2,0,0,0,0|1,0,1]=4 3562 B13R0.101 COC(=O)C(=O)CCCOCC(C)S d83f5da1ea6cabf731009b9ef7cfb240 [0,2,0,0,0,0|1,0,1]=4 3563 B13R0.101 COC(=O)C(=O)CCCOC[C@@H](C)F fca104bbdc6f5567dcf813f71586d8f0 [0,2,0,0,0,0|1,0,1]=4 3564 B13R0.101 COC(=O)C(=O)CCCOC[C@H](C)F f930451c66f5b6ff90d4bca2ede64b0e [0,2,0,0,0,0|1,0,1]=4 3565 B13R0.101 COC(=O)C(=O)CNCCCC(C)C 23a8aabfb54932f497e8a1af2339d9e8 [0,2,0,0,0,0|1,0,1]=4 3566 B13R0.101 COC(=O)C(=O)COCCCC(C)C 64203a1dc1546b2a773416698821c40c [0,2,0,0,0,0|1,0,1]=4 3567 B13R0.101 COC(=O)C(=O)NCCCCC(F)F a80023253ddf5cd7b808b9cdb77db846 [0,2,0,0,0,0|2,0,0]=4 3568 B13R0.101 COC(=O)C(=O)NCCCCN(C)C 39729283aa72ab68391b067a7d3c9539 [0,2,0,0,0,0|2,0,0]=4 3569 B13R0.101 COC(=O)C(=O)NCCCOC(C)C 309f53524f53a1e6d3a02e697be7a792 [0,2,0,0,0,0|2,0,0]=4 3570 B13R0.101 COC(=O)C(=O)NCCCSC(C)C b131c77faa46d4ed78bf101633e0e83d [0,2,0,0,0,0|2,0,0]=4 3571 B13R0.101 COC(=O)C(C)OCCCCC(C)C 54f4274ab6dd1051ff58a131cdf8deb1 [0,2,0,0,0,0|1,0,1]=4 3572 B13R0.101 COC(=O)[C@@H](C)OCCCCC(C)C 826e8a5d1d0767896636e21884e1e6e4 [0,2,0,0,0,0|1,0,1]=4 3573 B13R0.101 COC(=O)[C@H](C)OCCCCC(C)C 4014f45fb4f6c538db6b19e9d39815d3 [0,2,0,0,0,0|1,0,1]=4 3574 B13R0.131 C=C(CNC(C)CCCC)C(=O)OC 46253ea3a1413cc3d2a45673d5f632f4 [0,2,0,0,0,0|1,0,1]=4 3575 B13R0.131 C=C(CN[C@H](C)CCCC)C(=O)OC c2a188201705b4536eb5585822c3ea81 [0,2,0,0,0,0|1,0,1]=4 3576 B13R0.131 C=C(COC(C)CCCC)C(=O)OC ddd0a6a22b6cf413804d27fb255d1073 [0,2,0,0,0,0|1,0,1]=4 3577 B13R0.131 C=C(CO[C@@H](C)CCCC)C(=O)OC 8b1c7fb6ccade42d7fbb60ab5a25d598 [0,2,0,0,0,0|1,0,1]=4 3578 B13R0.131 C=C(CO[C@H](C)CCCC)C(=O)OC 585495c3a4744a623647d60ae054bb78 [0,2,0,0,0,0|1,0,1]=4 3579 B13R0.131 CCCCC(C)COC(C)C(=O)OC 14363c9e3efb6bd12e4e36e516218af8 [0,2,0,0,0,0|1,0,1]=4 3580 B13R0.131 CCCCC(C)CO[C@@H](C)C(=O)OC 218000c46db2838b12608d821678e751 [0,2,0,0,0,0|1,0,1]=4 3581 B13R0.131 CCCCC(C)CO[C@H](C)C(=O)OC 6c6ff0eb2ec8b41374b64b9a54d24277 [0,2,0,0,0,0|1,0,1]=4 3582 B13R0.131 CCCCC(C)NCC(=O)C(=O)OC e5068985f28d6662d29786db65dfd6cb [0,2,0,0,0,0|1,0,1]=4 3583 B13R0.131 CCCCC(C)OC=C(F)C(=O)OC 6779a3d876a29beccbba3a1fffa949d1 [0,2,0,0,0,0|1,0,0]=3 3584 B13R0.131 CCCCC(O)CNC(=O)C(=O)CC 1ed4b77dd14ec8f8b49ad54c56c4832d [0,2,0,0,0,0|2,0,0]=4 3585 B13R0.131 CCCCC(O)CNC(=O)C(=O)NC 8bc154ad43ca6ac12d698d6a18dafe1f [0,2,0,0,0,0|2,0,0]=4 3586 B13R0.131 CCCCC(O)CNC(=O)C(=O)OC b73aebe53eb8938885fcbfd4857221ea [0,2,0,0,0,0|1,0,0]=3 3587 B13R0.131 CCCCC(O)CNC(C)C(=O)OC 56ae5f2cf6783f5f55e30569ccd5bd28 [0,2,0,0,0,0|1,0,1]=4 3588 B13R0.131 CCCCC(O)CN[C@@H](C)C(=O)OC 9672a2070857f32c124b2826b409e1ca [0,2,0,0,0,0|1,0,1]=4 3589 B13R0.131 CCCCC(O)CN[C@H](C)C(=O)OC f7edfcf300f7b2281343a7df39bf8799 [0,2,0,0,0,0|1,0,1]=4 3590 B13R0.131 CCCC[C@@H](C)NCC(=O)C(=O)OC 29a6c755c2baea567be5850caf8935ae [0,2,0,0,0,0|1,0,1]=4 3591 B13R0.131 CCOCC(O)CNC(=O)C(=O)OC 0ebf23efb27c5e633467fb5d1d43cc81 [0,2,0,0,0,0|2,0,0]=4 3592 B13R0.131 COC(=O)C(=O)NC[C@H](C)CCCO cb33aad1496bba408cde649626a3700c [0,2,0,0,0,0|2,0,0]=4 3593 B13R0.250 C=C(CNCCC(C)CC)C(=O)OC 372abfcb61090ace50f35110ff192022 [0,2,0,0,0,0|1,0,1]=4 3594 B13R0.250 C=C(COCCC(C)CC)C(=O)OC 707c0370de3c8511726fffabbf94b0e0 [0,2,0,0,0,0|1,0,1]=4 3595 B13R0.250 C=C(COCCC(S)CC)C(=O)OC 597839229e6a56f2b9753803ef18a1f2 [0,2,0,0,0,0|1,0,1]=4 3596 B13R0.250 C=C(COCC[C@@H](C)CC)C(=O)OC 01f85214158b7e6f1c9e2288f17b6fb9 [0,2,0,0,0,0|1,0,1]=4 3597 B13R0.250 CCC(C)C(C)NC/C=C/C(=O)OC 1a11c756173a1633c1a6e5148563260f [0,2,0,0,0,0|1,0,0]=3 3598 B13R0.250 CCC(C)C(C)NC/C=C\C(=O)OC b9c3b7b39597cbacc249623ea08eab65 [0,2,0,0,0,0|1,0,0]=3 3599 B13R0.250 CCC(C)C(C)NCC=CC(=O)OC 2d33f746fca8ceb8a1ba488802c99ab0 [0,2,0,0,0,0|1,0,0]=3 3600 B13R0.250 CCC(C)C(C)OC/C=C/C(=O)OC 5637332c107ecf2f87ba18fa881ff7bc [0,2,0,0,0,0|1,0,0]=3 3601 B13R0.250 CCC(C)C(C)OC/C=C\C(=O)OC 787002a74771aaf53a84d1a1862713a7 [0,2,0,0,0,0|1,0,0]=3 3602 B13R0.250 CCC(C)C(C)OCC=CC(=O)OC f8c8049eb0d4f70a5a09349bc0b748dd [0,2,0,0,0,0|1,0,0]=3 3603 B13R0.250 CCC(C)CCCOC(C)C(=O)OC abc848a410dc61692ce36f74abdd0cb4 [0,2,0,0,0,0|1,0,1]=4 3604 B13R0.250 CCC(C)CCCO[C@@H](C)C(=O)OC b904cc5c00d6fbf2ef4270f01decb3a6 [0,2,0,0,0,0|1,0,1]=4 3605 B13R0.250 CCC(C)CCCO[C@H](C)C(=O)OC a92ebbfe3f79aa0279cc1f3b3d4e77d2 [0,2,0,0,0,0|1,0,1]=4 3606 B13R0.250 CCC(C)CCNCC(=O)C(=O)OC c9846458a1de14a63ad930ffee5ecb51 [0,2,0,0,0,0|1,0,1]=4 3607 B13R0.250 CCC(C)CCOC=C(F)C(=O)OC 088bb8b1673834df6ad1cbe88cd117b5 [0,2,0,0,0,0|1,0,0]=3 3608 B13R0.250 CCC(C)CCOCC(=O)C(=O)OC 9b9a9e18c155453f5a16e622df378772 [0,2,0,0,0,0|1,0,1]=4 3609 B13R0.250 CCC(C)NCCCC(=O)C(=O)OC 8eebde71f8086f8180d6b561ecbf8f9f [0,2,0,0,0,0|1,0,1]=4 3610 B13R0.250 CCC(C)OCCCC(=O)C(=O)OC e9c05c4d32a0a71c454bf99c7e66b2dd [0,2,0,0,0,0|1,0,1]=4 3611 B13R0.250 CCC(S)CCOCC(=O)C(=O)OC 2e12735bda1664662e53ddcee013bd79 [0,2,0,0,0,0|1,0,1]=4 3612 B13R0.250 CCN(C)CCCNC(=O)C(=O)OC 76710d8e38025c7dc32fee0068ee7e66 [0,2,0,0,0,0|2,0,0]=4 3613 B13R0.250 CCS(=O)CCOC=C(F)C(=O)OC bfe67211e0452b45e2806da1b5e97289 [0,2,0,0,0,0|2,0,0]=4 3614 B13R0.250 CC[C@@H](C)NCCCC(=O)C(=O)OC b0a0f96ebef1d17d1dbaa549d65a7d2d [0,2,0,0,0,0|1,0,1]=4 3615 B13R0.250 CC[C@@H](C)OCCCC(=O)C(=O)OC 9b80d4ce9811ff9a8aba6baae8897793 [0,2,0,0,0,0|1,0,1]=4 3616 B13R0.250 CC[C@H](C)CCCOC(C)C(=O)OC 062e97ff4d136e4666ce438febd5bab1 [0,2,0,0,0,0|1,0,1]=4 3617 B13R0.250 CC[C@H](C)CCCO[C@@H](C)C(=O)OC de957edd4711bf78d4c1bd286c6bd1e2 [0,2,0,0,0,0|1,0,1]=4 3618 B13R0.250 CC[C@H](C)CCCO[C@H](C)C(=O)OC c9e7b2a201a07e1e7a5df138b1a569d0 [0,2,0,0,0,0|1,0,1]=4 3619 B13R0.250 CC[C@H](C)CCOCC(=O)C(=O)OC 0d4954f65eeabfcdd73baa6660432eaf [0,2,0,0,0,0|1,0,1]=4 3620 B13R0.250 CC[C@H](C)NCCCC(=O)C(=O)OC f6a312e94e6d4e946841548ee2c05bf9 [0,2,0,0,0,0|1,0,1]=4 3621 B13R0.250 CC[C@H](C)OCCCC(=O)C(=O)OC 59ab4c0e718215e9f966661dc646d6ba [0,2,0,0,0,0|1,0,1]=4 3622 B13R0.250 COC(=O)/C=C/COC(C)C(C)OC c543808977d66f0f1ba834a6a7367d9c [0,2,0,0,0,0|2,0,0]=4 3623 B13R0.250 COC(=O)/C=C\COC(C)C(C)OC 70fab30864ff2499298847dd7e1178c5 [0,2,0,0,0,0|2,0,0]=4 3624 B13R0.250 COC(=O)C(=O)NCCCC(C)CO fc5b64812932665686d2c8dfff020583 [0,2,0,0,0,0|2,0,0]=4 3625 B13R0.250 COC(=O)C=CCOC(C)C(C)OC e489b48e8218b8475783a0543de93b08 [0,2,0,0,0,0|2,0,0]=4 3626 B13R0.337 CCCCCCNC(=O)C(=O)C(C)C ea669963a9863236c084d6f7978f328e [0,2,0,0,0,0|2,0,0]=4 3627 B13R0.337 CCCCCCNC(=O)C(=O)N(C)C c3dd72016fd020e8f81a14c07b735b5e [0,2,0,0,0,0|2,0,0]=4 3628 B13R0.369 C=C(CNCC(O)CCC)C(=O)OC 1a84cc7c232edb6e832f881a7e310961 [0,2,0,0,0,0|1,0,1]=4 3629 B13R0.369 C=C(COCC(C)CCC)C(=O)OC e8a6a8985ef47469c9bf19a210633fc1 [0,2,0,0,0,0|1,0,1]=4 3630 B13R0.369 CCCC(=O)COC=C(F)C(=O)OC c6073bcdcbf956de03e8a10c033a1c85 [0,2,0,0,0,0|1,0,1]=4 3631 B13R0.369 CCCC(C)CCOC(C)C(=O)OC aab50e75fd8cde2e17eb63cb961d1307 [0,2,0,0,0,0|1,0,1]=4 3632 B13R0.369 CCCC(C)CCO[C@@H](C)C(=O)OC 9467f69b363b16aae9c1fa2a38e73c50 [0,2,0,0,0,0|1,0,1]=4 3633 B13R0.369 CCCC(C)CCO[C@H](C)C(=O)OC eaa190ea3cf491f8a28f33fd8875f692 [0,2,0,0,0,0|1,0,1]=4 3634 B13R0.369 CCCC(C)COC=C(F)C(=O)OC 916510238b30be6fa52e38d31e7106a8 [0,2,0,0,0,0|1,0,0]=3 3635 B13R0.369 CCCC(C)COCC(=O)C(=O)OC 931ab963a136a939fdab83aab86a14cc [0,2,0,0,0,0|1,0,1]=4 3636 B13R0.369 CCCC(O)CNCC(=O)C(=O)OC 7fbe5bc77350d312c5239a7b7475de18 [0,2,0,0,0,0|1,0,1]=4 3637 B13R0.369 CCCC(S)CCOC(C)C(=O)OC 332b9a2074c069415e348ac694aaa43c [0,2,0,0,0,0|1,0,1]=4 3638 B13R0.369 CCCC(S)CCO[C@@H](C)C(=O)OC fb6d000be8f5e249510304a4a7d02ee8 [0,2,0,0,0,0|1,0,1]=4 3639 B13R0.369 CCCC(S)CCO[C@H](C)C(=O)OC aab5c6b43ec7dc1745fa6bed9bfc90bb [0,2,0,0,0,0|1,0,1]=4 3640 B13R0.369 CCCN(C)CCCC(=O)C(=O)OC 2bddb777a8f9cbe800bbb4a7f1b006d9 [0,2,0,0,0,0|1,0,1]=4 3641 B13R0.369 COC(=O)C(=COC[C@@H](O)CCO)F 9d684a33116643a49174afa720fc0491 [0,2,0,0,0,0|2,0,0]=4 3642 B13R0.422 C=C(C(=O)OC)C(C)OCCCCC 73fb5cfaa7f477fd9626323de1e6bc30 [0,2,0,0,0,0|1,0,1]=4 3643 B13R0.422 CCCCCCN(C)C(=O)C(=O)CC 221a1436c763b8d87434154e2ae985d4 [0,2,0,0,0,0|2,0,0]=4 3644 B13R0.422 CCCCCCN(C)C(=O)C(=O)NC 5babf8be36db6bf175aeb0fbf2b6087c [0,2,0,0,0,0|2,0,0]=4 3645 B13R0.422 CCCCCCN(C)C(=O)C(=O)OC 8f5b0ff370f37b61945bb79278d62778 [0,2,0,0,0,0|1,0,0]=3 3646 B13R0.422 CCCCCCN(C)C(C)C(=O)OC de31e1e9c13fd15b3e8243ace8b69201 [0,2,0,0,0,0|1,0,1]=4 3647 B13R0.422 CCCCCCN(C)[C@@H](C)C(=O)OC c32c9ca473ae38bd23b317c5b81f8e81 [0,2,0,0,0,0|1,0,1]=4 3648 B13R0.422 CCCCCCN(C)[C@H](C)C(=O)OC c0cf0bfc89bf1d73cb30457876dddc4c [0,2,0,0,0,0|1,0,1]=4 3649 B13R0.422 CCCCCNC(C)C(=O)C(=O)OC d07621f11db8ceed28f74f7608bd25a6 [0,2,0,0,0,0|1,0,1]=4 3650 B13R0.422 CCCCCOC(C)C(=O)C(=O)OC 868df9e7482214e6fff64b53f63cc760 [0,2,0,0,0,0|1,0,1]=4 3651 B13R0.422 COC(=O)C(=O)N(C)CCCCCO a3ad0c565be69a6bff12850c47e030d6 [0,2,0,0,0,0|2,0,0]=4 3652 B13R0.422 COCCCCN(C)C(=O)C(=O)OC 963097c26d0b78e2179b028f9d495329 [0,2,0,0,0,0|2,0,0]=4 3653 B13R0.714 CCCCCCNC(C)(C)C(=O)OC 6c2bd93a71040a9ec5b879cde0b70aa2 [0,2,0,0,0,0|1,0,1]=4 3654 B13R0.1293 C=C(CN(C)CCCCC)C(=O)OC 111268bf3738232a67454d6d32b0ebc1 [0,2,0,0,0,0|1,0,1]=4 3655 B13R0.1293 CCCCCC(C)NC(=O)C(=O)CC 368c0cd7e7c1435c0d384150c27d5d39 [0,2,0,0,0,0|2,0,0]=4 3656 B13R0.1293 CCCCCC(C)NC(=O)C(=O)NC 660e93326e0cb84e56cab959102e2806 [0,2,0,0,0,0|2,0,0]=4 3657 B13R0.1293 CCCCCC(C)NC(=O)C(=O)OC 38078a030ecec1243ab9281f049dd0c5 [0,2,0,0,0,0|1,0,0]=3 3658 B13R0.1293 CCCCCC(C)NC(C)C(=O)OC 3940c98277fd8049b501f943ba75588d [0,2,0,0,0,0|1,0,1]=4 3659 B13R0.1293 CCCCCC(C)N[C@@H](C)C(=O)OC a05ef1d8e9e91e0a6f8d6df6fe6cb8db [0,2,0,0,0,0|1,0,1]=4 3660 B13R0.1293 CCCCCC(C)N[C@H](C)C(=O)OC 31d0a9a9e7d3b8ae70e3a044c45d0ef3 [0,2,0,0,0,0|1,0,1]=4 3661 B13R0.1293 CCCCCC(C)OC(C)C(=O)OC 426ccf5e89f89e2fc8fdeee3ecf4a5da [0,2,0,0,0,0|1,0,1]=4 3662 B13R0.1293 CCCCCC(C)O[C@@H](C)C(=O)OC e5884b29e81dd4177a3234ef3cc4d850 [0,2,0,0,0,0|1,0,1]=4 3663 B13R0.1293 CCCCCC(C)O[C@H](C)C(=O)OC 57fb29df7d3d96f80b7c31e0f822a845 [0,2,0,0,0,0|1,0,1]=4 3664 B13R0.1293 CCCCCN(C)CC(=O)C(=O)OC 498fdc82bcb96a40735b9b93adc083e3 [0,2,0,0,0,0|1,0,1]=4 3665 B13R0.1293 CCCCC[C@@H](C)OC(C)C(=O)OC 8844ed674c1f46ced8be29d9a29bcc57 [0,2,0,0,0,0|1,0,1]=4 3666 B13R0.1293 CCCCC[C@@H](C)O[C@@H](C)C(=O)OC 161fb755ca8fcd3f320dee32665ff457 [0,2,0,0,0,0|1,0,1]=4 3667 B13R0.1293 CCCCC[C@@H](C)O[C@H](C)C(=O)OC dbddc1a285c310e4c9c44d70b4898c41 [0,2,0,0,0,0|1,0,1]=4 3668 B13R0.1293 CCCCC[C@H](C)NC(=O)C(=O)CC f12b45f02fe132291ae8f242dd38ffb8 [0,2,0,0,0,0|2,0,0]=4 3669 B13R0.1293 CCCCC[C@H](C)NC(=O)C(=O)NC d6e9ad1847562bf0c27a268878e8ee9f [0,2,0,0,0,0|2,0,0]=4 3670 B13R0.1293 CCCCC[C@H](C)NC(=O)C(=O)OC 8a8523e3f5af3465f21e94582f906cf9 [0,2,0,0,0,0|1,0,0]=3 3671 B13R0.1293 CCCCC[C@H](C)NC(C)C(=O)OC fc83d27c8d20d358bbabfdccad01ba52 [0,2,0,0,0,0|1,0,1]=4 3672 B13R0.1293 CCCCC[C@H](C)N[C@@H](C)C(=O)OC 5759efc9674117f2746d7cd801698105 [0,2,0,0,0,0|1,0,1]=4 3673 B13R0.1293 CCCCC[C@H](C)N[C@H](C)C(=O)OC 0f708bdb4369a6cdbf5000e71aca4649 [0,2,0,0,0,0|1,0,1]=4 3674 B13R0.1293 CCCCC[C@H](C)OC(C)C(=O)OC 61629c74cc718a98a730e2bb8ba71e2d [0,2,0,0,0,0|1,0,1]=4 3675 B13R0.1293 CCCCC[C@H](C)O[C@@H](C)C(=O)OC 593fc50267a2954d97edfd6249558d51 [0,2,0,0,0,0|1,0,1]=4 3676 B13R0.1293 CCCCC[C@H](C)O[C@H](C)C(=O)OC 130de718d9fa248e6ebdf269dc504a08 [0,2,0,0,0,0|1,0,1]=4 3677 B13R0.1293 CCCCNC(=O)C=C(Br)C(=O)OC 4422f5cd438f0c1889e64b4c013e5c2f [0,2,0,0,0,0|1,0,1]=4 3678 B13R0.163 CCC(CC)CNC/C=C/C(=O)OC d7e4acf9ddfdf902ee383fa0cac82c10 [0,2,0,0,0,0|1,0,0]=3 3679 B13R0.163 CCC(CC)CNC/C=C\C(=O)OC 5b7453622c3ff59a7db2c0c913236ba3 [0,2,0,0,0,0|1,0,0]=3 3680 B13R0.163 CCC(CC)CNCC=CC(=O)OC 2c178abb581d191697fd2cf949cd12a5 [0,2,0,0,0,0|1,0,0]=3 3681 B13R0.163 CCC(CC)COC/C=C/C(=O)OC 7c2b658491ca483ed9789fac8a022717 [0,2,0,0,0,0|1,0,0]=3 3682 B13R0.163 CCC(CC)COC/C=C\C(=O)OC 0ce338a019b704ce816b2e6fd8e38e1b [0,2,0,0,0,0|1,0,0]=3 3683 B13R0.163 CCC(CC)COCC=CC(=O)OC f27f7a89ed0bb22f8bc2b186c5dad6e0 [0,2,0,0,0,0|1,0,0]=3 3684 B13R0.163 CCC(CO)CNC/C=C/C(=O)OC 25f76d742a23f618fc291ce4d9ef099c [0,2,0,0,0,0|1,0,0]=3 3685 B13R0.163 CCC(CO)CNC/C=C\C(=O)OC 897c5846d0a5825fbab4b54dfb3fff29 [0,2,0,0,0,0|1,0,0]=3 3686 B13R0.163 CCC(CO)CNCC=CC(=O)OC 4df635a3bf8ae4d72a97d3b7a82dac1d [0,2,0,0,0,0|1,0,0]=3 3687 B13R0.163 CCC(COC/C=C/C(=O)OC)OC 5e15fbdc450f947e2cb7805174f2a0ee [0,2,0,0,0,0|1,0,0]=3 3688 B13R0.163 CCC(COC/C=C\C(=O)OC)OC df786893921552aaad2b5e8d1bda02a5 [0,2,0,0,0,0|1,0,0]=3 3689 B13R0.163 CCC(COCC=CC(=O)OC)OC e0b866658d586850804785e81c66b541 [0,2,0,0,0,0|1,0,0]=3 3690 B13R0.163 CCN(CC)COC/C=C/C(=O)OC eb0b4a705300826e12882c126efa2c34 [0,2,0,0,0,0|2,0,0]=4 3691 B13R0.163 CCN(CC)COC/C=C\C(=O)OC 6dc3776cbda96eb11ea9c2f4835479b9 [0,2,0,0,0,0|2,0,0]=4 3692 B13R0.163 CCN(CC)COCC=CC(=O)OC 772f6b51cb29c75118672d1767d6e209 [0,2,0,0,0,0|2,0,0]=4 3693 B13R0.163 COC(=O)/C=C/CNCC(CO)CO b6eb7ca89461116d1da024ab0ab77fbe [0,2,0,0,0,0|2,0,0]=4 3694 B13R0.163 COC(=O)/C=C/CNCC(OC)OC 07d7ea53af6c493afce46dc63495bede [0,2,0,0,0,0|2,0,0]=4 3695 B13R0.163 COC(=O)/C=C/CNC[C@H](CO)OC 047798c45c09fdca7214d5aaeced8c22 [0,2,0,0,0,0|2,0,0]=4 3696 B13R0.163 COC(=O)/C=C/COCC(CBr)CBr 7acabc0fcfd9c665f6ad8b0c6651a285 [0,2,0,0,0,0|2,0,0]=4 3697 B13R0.163 COC(=O)/C=C/COCC(OC)OC f3bcb138de6adc9d6215101925ce97dd [0,2,0,0,0,0|2,0,0]=4 3698 B13R0.163 COC(=O)/C=C\CNCC(CO)CO dc9b7a8fcdf200c296fba01bb34dec7d [0,2,0,0,0,0|2,0,0]=4 3699 B13R0.163 COC(=O)/C=C\CNCC(OC)OC ee03d80a1b5ebb17464e0207687c8635 [0,2,0,0,0,0|2,0,0]=4 3700 B13R0.163 COC(=O)/C=C\CNC[C@H](CO)OC 28ae17dd768d8b29c4a539981b87b39f [0,2,0,0,0,0|2,0,0]=4 3701 B13R0.163 COC(=O)/C=C\COCC(CBr)CBr 6272ca06510662dbce5b13ac34fe6ba4 [0,2,0,0,0,0|2,0,0]=4 3702 B13R0.163 COC(=O)/C=C\COCC(OC)OC 80f4c1d992b86fda37ebb564f9882d18 [0,2,0,0,0,0|2,0,0]=4 3703 B13R0.163 COC(=O)C=CCNCC(CO)CO 5dc89aa46b9b2418df512bff28c29ae5 [0,2,0,0,0,0|2,0,0]=4 3704 B13R0.163 COC(=O)C=CCNCC(OC)OC c682f5599fadc6775aab6c0dc25ec486 [0,2,0,0,0,0|2,0,0]=4 3705 B13R0.163 COC(=O)C=CCNC[C@H](CO)OC 78f351c86a7ab2ffe13ecf598adfa63e [0,2,0,0,0,0|2,0,0]=4 3706 B13R0.163 COC(=O)C=CCOCC(CBr)CBr 84a641dbdc67e48f717dce890846aae7 [0,2,0,0,0,0|2,0,0]=4 3707 B13R0.163 COC(=O)C=CCOCC(OC)OC 7812d694730eb40c936f77ad19f2cbd7 [0,2,0,0,0,0|2,0,0]=4 3708 B13R0.40 CCCCN(C)C(=O)/C=C/C(=O)OC a030651e24ccb8750286a629baddd8bc [0,2,0,0,0,0|1,0,1]=4 3709 B13R0.40 CCCCN(C)C(=O)/C=C\C(=O)OC 19ddebedbd1a0da4cbe572985f9d91fe [0,2,0,0,0,0|1,0,1]=4 3710 B13R0.40 CCCCN(C)C(=O)C=CC(=O)OC ec0907b69c71cba648293aa311327f19 [0,2,0,0,0,0|1,0,1]=4 3711 B13R0.117 CCCCN(C)C/C=C/C(=O)N(C)C aa3a17d6b4a78c5eb40ed04a98b7ab4d [0,2,0,0,0,0|2,0,0]=4 3712 B13R0.118 C=C(CC(=O)OC)CN(C)CCCC 899c9887c75a9011873ef7bd32b1aaf2 [0,2,0,0,0,0|1,0,1]=4 3713 B13R0.118 CCCCC(C)NC(=O)CC(=O)OC 0efab6e320a2275e579303551a3e8359 [0,2,0,0,0,0|1,0,1]=4 3714 B13R0.118 CCCCC(C)O/C(=C/C(=O)CC)/C 6b6e49afeb4c2a5204784d0266b7c503 [0,2,0,0,0,0|2,0,0]=4 3715 B13R0.118 CCCCN(C)CC(=O)CC(=O)OC 7a81db989d5971d412173a9ded10ead0 [0,2,0,0,0,0|1,0,1]=4 3716 B13R0.118 CCCC[C@@H](C)NC(=O)CC(=O)OC ccc8f98d42f8999ef4b1006a4f904538 [0,2,0,0,0,0|1,0,1]=4 3717 B13R0.194 C=CCCCN(C)C/C=C/C(=O)OC 87113d7eea2ea22d966f92913c443d16 [0,2,0,0,0,0|0,0,2]=4 3718 B13R0.194 C=CCCCN(C)C/C=C\C(=O)OC 6d3a4cbc4365f6423396111fbbe15579 [0,2,0,0,0,0|0,0,2]=4 3719 B13R0.194 C=CCCCN(C)CC=CC(=O)OC c7ad4edc2caeec87f9723b2d126473db [0,2,0,0,0,0|0,0,2]=4 3720 B13R0.194 CCCCCC(=O)CNCC(=O)OC 1468b47e26b70aa6bcccda7247f2039c [0,2,0,0,0,0|1,0,1]=4 3721 B13R0.194 CCCCCC(=O)COCC(=O)OC e301c323b0e46ecb5934a2353b572642 [0,2,0,0,0,0|1,0,1]=4 3722 B13R0.194 CCCCCC(C)COCC(=O)OC 5b0135cb9bb188b01b0f9ef44adcfc62 [0,2,0,0,0,0|0,0,2]=4 3723 B13R0.194 CCCCCC(C)NCCC(=O)OC 98960115fc268049b31d11c676a70711 [0,2,0,0,0,0|0,0,2]=4 3724 B13R0.194 CCCCCC(C)NCOC(=O)OC 6ebd52272fdab591fb7f6229d514736d [0,2,0,0,0,0|1,0,1]=4 3725 B13R0.194 CCCCCC(C)OCCC(=O)OC 072957a6513c11279c4892977aa03bf4 [0,2,0,0,0,0|0,0,2]=4 3726 B13R0.194 CCCCCN(C)C/C=C/C(=O)OC 8c28827cd1b0822704ef509bd378658e [0,2,0,0,0,0|0,0,0]=2 3727 B13R0.194 CCCCCN(C)C/C=C\C(=O)OC da867075fa53698ef89e9ae0e2e29796 [0,2,0,0,0,0|0,0,0]=2 3728 B13R0.194 CCCCCN(C)CC=CC(=O)OC 874a634e41e50452d7c6c60e91a1b70f [0,2,0,0,0,0|0,0,0]=2 3729 B13R0.194 CCCCCN(C)CCCC(=O)OC d8679ad335704dc5fada9f0f3e1dcb2c [0,2,0,0,0,0|0,0,2]=4 3730 B13R0.194 CCCCC[C@@H](C)OCCC(=O)OC ceedba82f63534410cf89b7825a0b2c4 [0,2,0,0,0,0|0,0,2]=4 3731 B13R0.194 CCCCC[C@H](C)NCCC(=O)OC b1762e7a537ecefbd306926170fa96e1 [0,2,0,0,0,0|0,0,2]=4 3732 B13R0.194 CCCCC[C@H](C)NCOC(=O)OC 227193d689a124fb232eb4a00ea50863 [0,2,0,0,0,0|1,0,1]=4 3733 B13R0.194 CCCCC[C@H](C)OCCC(=O)OC 1b7d444e8493e5ff444a89307762e9c9 [0,2,0,0,0,0|0,0,2]=4 3734 B13R0.194 CCCCNC(C)CCCC(=O)OC 698631512860397d59499ea087d15ed2 [0,2,0,0,0,0|0,0,2]=4 3735 B13R0.194 CCCCOC(C)CCCC(=O)OC 039e0bb4c8ea4607ef38bc1b3e48b77b [0,2,0,0,0,0|0,0,2]=4 3736 B13R0.194 CCCOCC(C)COCC(=O)OC c412d62522b2bf47c8e850f3c18c6615 [0,2,0,0,0,0|1,0,1]=4 3737 B13R0.194 CCOCCN(C)C/C=C/C(=O)OC 7e4d54aa51e54f4e9319b0ab6b9a8026 [0,2,0,0,0,0|1,0,0]=3 3738 B13R0.194 CCOCCN(C)C/C=C\C(=O)OC 32f5f570839edaf2c316e1b06ab44de2 [0,2,0,0,0,0|1,0,0]=3 3739 B13R0.194 CCOCCN(C)CC=CC(=O)OC 78c5358d3fda15e2060243d7bd0e705e [0,2,0,0,0,0|1,0,0]=3 3740 B13R0.194 COC(=O)/C=C/CN(C)CCCCO d8433cb037623be26e73dc3e6237bd1b [0,2,0,0,0,0|1,0,0]=3 3741 B13R0.194 COC(=O)/C=C\CN(C)CCCCO 35d180d5f28ca6704f440abdbf7a3fd8 [0,2,0,0,0,0|1,0,0]=3 3742 B13R0.194 COC(=O)C=CCN(C)CCCCO ae614cc84125cb1b8b3183b83918ec9b [0,2,0,0,0,0|1,0,0]=3 3743 B13R0.194 COCCCN(C)C/C=C/C(=O)OC 5306066eb015beac73d279ede159e68d [0,2,0,0,0,0|1,0,0]=3 3744 B13R0.194 COCCCN(C)C/C=C\C(=O)OC 9c891afa4e5994b824f765c9adc49d6a [0,2,0,0,0,0|1,0,0]=3 3745 B13R0.194 COCCCN(C)CC=CC(=O)OC cb76e3489922454cbe3ccc1024505720 [0,2,0,0,0,0|1,0,0]=3 3746 B13R0.208 COC(=O)/C=C/CN(C)CCC(C)C a3082bd69ba7364e385b04c57fd49c72 [0,2,0,0,0,0|1,0,0]=3 3747 B13R0.208 COC(=O)/C=C/CN(C)CCC(C)O 382bd41caa43808ce975d71f0a2708f5 [0,2,0,0,0,0|1,0,0]=3 3748 B13R0.208 COC(=O)/C=C/CN(C)CCC(F)F e2d63fc406e5ea000eacb48a75c8d460 [0,2,0,0,0,0|2,0,0]=4 3749 B13R0.208 COC(=O)/C=C/CN(C)CCN(C)C 6642a590f2cfb0a2f542369224974f26 [0,2,0,0,0,0|2,0,0]=4 3750 B13R0.208 COC(=O)/C=C\CN(C)CCC(C)C 401a0c7a0849c55bfe6f44f5025c0a52 [0,2,0,0,0,0|1,0,0]=3 3751 B13R0.208 COC(=O)/C=C\CN(C)CCC(C)O 247eed8561217e116e09b2409a6e9a01 [0,2,0,0,0,0|1,0,0]=3 3752 B13R0.208 COC(=O)/C=C\CN(C)CCC(F)F d8181390dd5cdadd1bef6b2c7bfdc0af [0,2,0,0,0,0|2,0,0]=4 3753 B13R0.208 COC(=O)/C=C\CN(C)CCN(C)C 8f18d80605b630f30ad987e47628aade [0,2,0,0,0,0|2,0,0]=4 3754 B13R0.208 COC(=O)C=CCN(C)CCC(C)C 9e4c64a490648e5cf44ba91a9e4628ec [0,2,0,0,0,0|1,0,0]=3 3755 B13R0.208 COC(=O)C=CCN(C)CCC(C)O 7bdf51a36abddda94838536cccb2db49 [0,2,0,0,0,0|1,0,0]=3 3756 B13R0.208 COC(=O)C=CCN(C)CCC(F)F 09ae5c170a0807b88dbb3618cf30d35f [0,2,0,0,0,0|2,0,0]=4 3757 B13R0.208 COC(=O)C=CCN(C)CCN(C)C 3d7df9c9d1116f577f227f1e0e037ea0 [0,2,0,0,0,0|2,0,0]=4 3758 B13R0.208 COC(=O)CNCC(C)CCC(C)C 4afd58ffc1a569979192be20bc719320 [0,2,0,0,0,0|1,0,1]=4 3759 B13R0.208 COC(=O)COCC(C)CCC(C)C f8eccc4d4346cb3595afe0b2e01c6a31 [0,2,0,0,0,0|1,0,1]=4 3760 B13R0.267 COC(=O)/C=C/CN(C)C(C)CCO 90b575c2f0b1aa450c7410934d28d725 [0,2,0,0,0,0|2,0,0]=4 3761 B13R0.267 COC(=O)/C=C/CN(C)[C@@H](C)CCO ea59abb52b4560cc66f60ec40f20dc4e [0,2,0,0,0,0|2,0,0]=4 3762 B13R0.267 COC(=O)/C=C\CN(C)C(C)CCO 91378a5b5932a7105dc5c309831de12b [0,2,0,0,0,0|2,0,0]=4 3763 B13R0.267 COC(=O)/C=C\CN(C)[C@@H](C)CCO 6d88f55a1c736d05889d909937623109 [0,2,0,0,0,0|2,0,0]=4 3764 B13R0.267 COC(=O)C=CCN(C)C(C)CCO 5fe3f3da9e00011230f2ef27540daab9 [0,2,0,0,0,0|2,0,0]=4 3765 B13R0.267 COC(=O)C=CCN(C)[C@@H](C)CCO edf84a24285589f1793bdb14a4f22f37 [0,2,0,0,0,0|2,0,0]=4 3766 B13R0.306 CCCCC(CC)CNCC(=O)OC 3b8d1ddcd350c74a49562063b971c809 [0,2,0,0,0,0|1,0,1]=4 3767 B13R0.306 CCCCC(CC)COCC(=O)OC 9514a870cba2c90db3afbfbc8715b1e0 [0,2,0,0,0,0|1,0,1]=4 3768 B13R0.306 CCCCN(CC)C/C=C/C(=O)OC ff8b55001a75db20da3bec396fed6114 [0,2,0,0,0,0|1,0,0]=3 3769 B13R0.306 CCCCN(CC)C/C=C\C(=O)OC 07f2a57f40a5bb850c08603d3d98a121 [0,2,0,0,0,0|1,0,0]=3 3770 B13R0.306 CCCCN(CC)CC=CC(=O)OC 35a83eea4b4617b2c3745289c113bf0d [0,2,0,0,0,0|1,0,0]=3 3771 B13R0.306 CCCC[C@@H](CC)CNCC(=O)OC 1f21af3f8271e148a85d4b4b324c88f6 [0,2,0,0,0,0|1,0,1]=4 3772 B13R0.306 CCCC[C@@H](CC)COCC(=O)OC 03b9b05510d1b6f7283fe20d3eae709f [0,2,0,0,0,0|1,0,1]=4 3773 B13R0.306 CCN(C/C=C/C(=O)OC)CCCO f7f2f60e9e857eda1e3e40bb68ab6b84 [0,2,0,0,0,0|2,0,0]=4 3774 B13R0.306 CCN(C/C=C/C(=O)OC)CCOC 197a9d6e6c6a620fd3e02dd97530508b [0,2,0,0,0,0|2,0,0]=4 3775 B13R0.306 CCN(C/C=C\C(=O)OC)CCCO b51217c4d068313b309fc5059c843377 [0,2,0,0,0,0|2,0,0]=4 3776 B13R0.306 CCN(C/C=C\C(=O)OC)CCOC abfa0d16d806d62e5ca9ea9fbe340dcc [0,2,0,0,0,0|2,0,0]=4 3777 B13R0.306 CCN(CC=CC(=O)OC)CCCO 842277dd4b3d2d846698ef054088372a [0,2,0,0,0,0|2,0,0]=4 3778 B13R0.306 CCN(CC=CC(=O)OC)CCOC 236da32d8340e193f0c7d7d03a966da3 [0,2,0,0,0,0|2,0,0]=4 3779 B13R0.429 C=C(CNCC(C)CC)CC(=O)OC 4373c808591a465041eb616c1dc4194c [0,2,0,0,0,0|1,0,1]=4 3780 B13R0.429 C=C(CNCC(O)CC)CC(=O)OC 3e144ddf19deabb19c33152f0c81c42f [0,2,0,0,0,0|1,0,1]=4 3781 B13R0.429 C=C(CNC[C@@H](C)CC)CC(=O)OC 4dcbf7e1854edea59f8643d47c6b35c5 [0,2,0,0,0,0|1,0,1]=4 3782 B13R0.429 C=C(CNC[C@H](O)CC)CC(=O)OC ec753799c02697b3dfa7f8cace6601b4 [0,2,0,0,0,0|1,0,1]=4 3783 B13R0.429 C=C(COCC(C)CC)CC(=O)OC 24782591e6d56c34f4d64d1bc826fdc0 [0,2,0,0,0,0|1,0,1]=4 3784 B13R0.429 C=C(COC[C@@H](C)CC)CC(=O)OC 370f4c17364f12582498c9745d8cb1e1 [0,2,0,0,0,0|1,0,1]=4 3785 B13R0.429 C=C(COC[C@H](C)CC)CC(=O)OC 640518a9a9a9b69bc14e38d45c51b4a8 [0,2,0,0,0,0|1,0,1]=4 3786 B13R0.429 CCC(=O)/C=C(\C)/OCCC(C)CC 139226c7b87391708665e166c86172ad [0,2,0,0,0,0|2,0,0]=4 3787 B13R0.429 CCC(C)CCNC(=O)CC(=O)OC 70668ed31ad4ef91cc426f90f21c1103 [0,2,0,0,0,0|1,0,1]=4 3788 B13R0.429 CCC(C)CNCC(=O)CC(=O)OC ebf82f39b636a994ddc9f6f13e2d95a0 [0,2,0,0,0,0|1,0,1]=4 3789 B13R0.429 CCC(C)COCC(=O)CC(=O)OC 6f5787c1cd8bf4d63dcf49e00bac8842 [0,2,0,0,0,0|1,0,1]=4 3790 B13R0.429 CCC(C)OCCC(=O)CC(=O)OC d276a0eee800b19be0aa7d1c694df8f2 [0,2,0,0,0,0|1,0,1]=4 3791 B13R0.429 CCC(O)CN(C)C/C=C/C(=O)OC bcfd160d934585b9ca49314ea2130981 [0,2,0,0,0,0|1,0,0]=3 3792 B13R0.429 CCC(O)CN(C)C/C=C\C(=O)OC c627c9d49f045282998fd3d18409de45 [0,2,0,0,0,0|1,0,0]=3 3793 B13R0.429 CCC(O)CN(C)CC=CC(=O)OC 01d2bb082e7b27852ab4d538747716d2 [0,2,0,0,0,0|1,0,0]=3 3794 B13R0.429 CCC(O)CNCC(=O)CC(=O)OC e4e48a21842b223193c750e92c9e4fb7 [0,2,0,0,0,0|1,0,1]=4 3795 B13R0.429 CC[C@@H](C)COCC(=O)CC(=O)OC 64401a9e997613c4441fec52067d7410 [0,2,0,0,0,0|1,0,1]=4 3796 B13R0.429 CC[C@@H](O)CNCC(=O)CC(=O)OC f892d767f29fffa3f084800009c06198 [0,2,0,0,0,0|1,0,1]=4 3797 B13R0.429 CC[C@H](C)CNCC(=O)CC(=O)OC f3ad0c722cab8bfc4be7207a237f44e4 [0,2,0,0,0,0|1,0,1]=4 3798 B13R0.429 CC[C@H](C)COCC(=O)CC(=O)OC 7f6d8768723960678871666fe825a4c6 [0,2,0,0,0,0|1,0,1]=4 3799 B13R0.429 COC(=O)/C=C/CN(C)CC(C)CO 65ddd8d932722eccaa9f9c911b92f3bc [0,2,0,0,0,0|2,0,0]=4 3800 B13R0.429 COC(=O)/C=C/CN(C)CC(O)CO fcc772dc264f1d60716850b5a2348f83 [0,2,0,0,0,0|2,0,0]=4 3801 B13R0.429 COC(=O)/C=C\CN(C)CC(C)CO 727062f0a554b66b7552384e7df319a3 [0,2,0,0,0,0|2,0,0]=4 3802 B13R0.429 COC(=O)/C=C\CN(C)CC(O)CO 83aa39c30b0a1b9c12cb186e8308191b [0,2,0,0,0,0|2,0,0]=4 3803 B13R0.429 COC(=O)C=CCN(C)CC(C)CO 94e1f5cc911e7c7391ed86f558c68b95 [0,2,0,0,0,0|2,0,0]=4 3804 B13R0.429 COC(=O)C=CCN(C)CC(O)CO af235061fc0dee077fcb3806edcad44f [0,2,0,0,0,0|2,0,0]=4 3805 B13R0.17 C=C(CNC(C)CCC)CC(=O)OC a4267cbeafd80f29abdc9363426cfb24 [0,2,0,0,0,0|1,0,1]=4 3806 B13R0.17 C=C(CN[C@@H](C)CCC)CC(=O)OC eab70ec39d44d9ccc3500eccda0ed9fa [0,2,0,0,0,0|1,0,1]=4 3807 B13R0.17 C=C(COC(C)CCC)CC(=O)OC 388910f8861ecfc9361fb58440a993a6 [0,2,0,0,0,0|1,0,1]=4 3808 B13R0.17 C=C(CO[C@@H](C)CCC)CC(=O)OC 02bf8dcd7527e7192b4a13f21c22ecf0 [0,2,0,0,0,0|1,0,1]=4 3809 B13R0.17 C=C(CO[C@H](C)CCC)CC(=O)OC 1dfb85a294fa134002220b40e83f7808 [0,2,0,0,0,0|1,0,1]=4 3810 B13R0.17 CCCC(C)CO/C(=C/C(=O)CC)/C da6e55af3a4d9c06d5ee210f401b4486 [0,2,0,0,0,0|2,0,0]=4 3811 B13R0.17 CCCC(C)NCC(=O)CC(=O)OC a6e301758faf6ee1e5aba58d6b567623 [0,2,0,0,0,0|1,0,1]=4 3812 B13R0.17 CCCC(C)OCC(=O)CC(=O)OC 5271fa783522a1bf40e7767d7bc71e80 [0,2,0,0,0,0|1,0,1]=4 3813 B13R0.17 CCCC(O)CNC(=O)CC(=O)OC a233cb968984d98a215167b3026f5951 [0,2,0,0,0,0|1,0,1]=4 3814 B13R0.17 CCC[C@@H](C)OCC(=O)CC(=O)OC a5f7c31748c3004ca7a9b92f73bdc651 [0,2,0,0,0,0|1,0,1]=4 3815 B13R0.17 CCC[C@H](C)NCC(=O)CC(=O)OC 2c08382793a229ff696141490d105d11 [0,2,0,0,0,0|1,0,1]=4 3816 B13R0.17 CCC[C@H](C)OCC(=O)CC(=O)OC 09eb297a9d587615ae77b2c02c256aef [0,2,0,0,0,0|1,0,1]=4 3817 B13R0.71 C=C(CNCCC(C)C)CC(=O)OC 50f55f8615d306bca6c3a938e699b8fd [0,2,0,0,0,0|1,0,1]=4 3818 B13R0.71 C=C(CNCCC(C)O)CC(=O)OC 774226139bcc205221622b97638cf550 [0,2,0,0,0,0|1,0,1]=4 3819 B13R0.71 C=C(CNCC[C@@H](C)O)CC(=O)OC 147f767e93a191f52b0466e51503af4c [0,2,0,0,0,0|1,0,1]=4 3820 B13R0.71 C=C(CNCC[C@H](C)O)CC(=O)OC 078b303f27cb92a6181ecbafc4bb8b88 [0,2,0,0,0,0|1,0,1]=4 3821 B13R0.71 C=C(COCCC(C)C)CC(=O)OC 672ea22b2e4228170386c1938522a5ac [0,2,0,0,0,0|1,0,1]=4 3822 B13R0.71 CCC(=O)/C=C(\C)/OCCCC(C)C 6b24ff0ce22264a1ef864511659f6b7c [0,2,0,0,0,0|2,0,0]=4 3823 B13R0.71 COC(=O)CC(=O)CCOCC(C)C 3ae2614512fbe8badab558410350bbdc [0,2,0,0,0,0|1,0,1]=4 3824 B13R0.71 COC(=O)CC(=O)CNCCC(C)C 33b19d4a013cba49b0a5461aebfdaa4a [0,2,0,0,0,0|1,0,1]=4 3825 B13R0.71 COC(=O)CC(=O)CNCCC(C)O bdf1114e9eeea7c9aef6e97f688f5628 [0,2,0,0,0,0|1,0,1]=4 3826 B13R0.71 COC(=O)CC(=O)CNCC[C@@H](C)O 44d7121ce16e3c5a077c45e9173094ec [0,2,0,0,0,0|1,0,1]=4 3827 B13R0.71 COC(=O)CC(=O)CNCC[C@H](C)O 96bee5b326056db55309eb919a2fb6d7 [0,2,0,0,0,0|1,0,1]=4 3828 B13R0.71 COC(=O)CC(=O)COCCC(C)C a87d1a1b89ab0525c74d9c0664df6a70 [0,2,0,0,0,0|1,0,1]=4 3829 B13R0.71 COC(=O)CC(=O)NCCCC(C)C 5b96f8f9c2d203ffe32640890ed86a6b [0,2,0,0,0,0|1,0,1]=4 3830 B13R0.71 COC(=O)CN(C)CCCCC(C)C 6eaf7485b5e4e1d924fe01fbfc058167 [0,2,0,0,0,0|1,0,1]=4 3831 B13R0.71 COC(=O)CN(C)CCCCC(C)O a143c9c633b9aec0dc352a303c9358a1 [0,2,0,0,0,0|1,0,1]=4 3832 B13R0.71 COC(=O)CN(C)CCCC[C@@H](C)O aaada5f8400adae46c088629293dd298 [0,2,0,0,0,0|1,0,1]=4 3833 B13R0.151 CCCCCC(C)N(C)CC(=O)OC e5c2bbd806921c00fc5f922c83cc025a [0,2,0,0,0,0|1,0,1]=4 3834 B13R0.151 CCCCCN(C)C(=O)CC(=O)OC 97824e22fa278fbc8d31c4a58485a2d3 [0,2,0,0,0,0|1,0,1]=4 3835 B13R0.151 CCCCC[C@H](C)N(C)CC(=O)OC 2f77f6d0237cfe389f3b226a85f1e89f [0,2,0,0,0,0|1,0,1]=4 3836 B13R0.151 CCCCNC(C)C(=O)CC(=O)OC f821df8cdc34b1647ec16cc5217b0685 [0,2,0,0,0,0|1,0,1]=4 3837 B13R0.151 CCCCOC(C)C(=O)CC(=O)OC e945f55dee28a7ed6b1a70d80557d282 [0,2,0,0,0,0|1,0,1]=4 3838 B13R0.274 C=C(CNCCCCC)CC(=O)OC 52dcb0bda19e09ea079658a0b4ca4b56 [0,2,0,0,0,0|0,0,1]=3 3839 B13R0.274 C=C(CNCCCCCl)CC(=O)OC c4a0510ecf6cd680bcf092dd6ee7edfa [0,2,0,0,0,0|1,0,1]=4 3840 B13R0.274 C=C(CNCCCCO)CC(=O)OC 666360a4f1261a3ab981f89fb2c2a052 [0,2,0,0,0,0|1,0,1]=4 3841 B13R0.274 C=C(CNCCCCS)CC(=O)OC 46e031078c70efcb13e9127b5138b6a0 [0,2,0,0,0,0|1,0,1]=4 3842 B13R0.274 C=C(CNCCCOC)CC(=O)OC b9b7146e8282b3ee6f5ad86bcbed755b [0,2,0,0,0,0|1,0,1]=4 3843 B13R0.274 C=C(CNCCCSC)CC(=O)OC 318958c138cdfb0df809b3c46329aaf4 [0,2,0,0,0,0|1,0,1]=4 3844 B13R0.274 C=C(CNCCOCC)CC(=O)OC 7dbefb50885a1c7b9b0c1ebf861dc5ea [0,2,0,0,0,0|1,0,1]=4 3845 B13R0.274 C=C(CNCCSCC)CC(=O)OC 21e2150790e97f313f0a4a6c9661c57f [0,2,0,0,0,0|1,0,1]=4 3846 B13R0.274 C=C(COCCCCC)CC(=O)OC f6ca2f0ac93345affaf68bb7b9f233fa [0,2,0,0,0,0|0,0,1]=3 3847 B13R0.274 C=C(COCCCCF)CC(=O)OC c2d962da23a47c3c0590d7a24fd4389c [0,2,0,0,0,0|1,0,1]=4 3848 B13R0.274 C=C(COCCCCS)CC(=O)OC 7a754ac55bee971c07d4c31ccad117b1 [0,2,0,0,0,0|1,0,1]=4 3849 B13R0.274 C=C(COCCCOC)CC(=O)OC 7bb8126ce34eac33aed1f934ea44206d [0,2,0,0,0,0|1,0,1]=4 3850 B13R0.274 C=C(COCCCSC)CC(=O)OC 0c1c92ec7344fcd637ab3aca8fa67726 [0,2,0,0,0,0|1,0,1]=4 3851 B13R0.274 C=C(COCCOCC)CC(=O)OC 6f84a4606ca5e32afe80b356dd1a14f7 [0,2,0,0,0,0|1,0,1]=4 3852 B13R0.274 C=C(COCCSCC)CC(=O)OC eba2d785d91b866a2c2a42ad08ea8069 [0,2,0,0,0,0|1,0,1]=4 3853 B13R0.274 CCC(=O)/C=C(\C)/OCCCCCF 625b9d61b9a87ed258484774977d610e [0,2,0,0,0,0|2,0,0]=4 3854 B13R0.274 CCC(=O)/C=C(\C)/OCCCCOC ea7f8396bb5efb75fc2c80257e61d8c6 [0,2,0,0,0,0|2,0,0]=4 3855 B13R0.274 CCCCCCCN(C)CC(=O)OC 596190d2f5d736f4fd66125fd9744770 [0,2,0,0,0,0|0,0,2]=4 3856 B13R0.274 CCCCCCNC(=O)/C=C(/C)\CC a46d6547dc2aeaa6e6fa8323805ee21a [0,2,0,0,0,0|2,0,0]=4 3857 B13R0.274 CCCCCCNC(=O)/C=C(\C)/CC be135fb73b209db2a20e8b6c7fe3522e [0,2,0,0,0,0|2,0,0]=4 3858 B13R0.274 CCCCCCNC(=O)CC(=O)NC d926357ba03dee3f77746498282bc584 [0,2,0,0,0,0|1,0,1]=4 3859 B13R0.274 CCCCCCNC(=O)CC(=O)OC f91350f17e8090465cdacf985e4602e5 [0,2,0,0,0,0|0,0,1]=3 3860 B13R0.274 CCCCCCNC(C)CC(=O)OC 7a70574f8ef75d9e06f2b379ac2b0781 [0,2,0,0,0,0|0,0,2]=4 3861 B13R0.274 CCCCCCNC(C)OC(=O)OC 7dcc3c1e4802055566aaf7ee981d5187 [0,2,0,0,0,0|1,0,1]=4 3862 B13R0.274 CCCCCCN[C@@H](C)CC(=O)OC 3e1a0b3cf5bcbbd3f40d8dab95fa1048 [0,2,0,0,0,0|0,0,2]=4 3863 B13R0.274 CCCCCCN[C@H](C)CC(=O)OC b13b935782308901fd6970170eab2536 [0,2,0,0,0,0|0,0,2]=4 3864 B13R0.274 CCCCCCO/C(=C/C(=O)CC)/C 8efdd8b63cf74926e14849c4ea8059d8 [0,2,0,0,0,0|1,0,0]=3 3865 B13R0.274 CCCCCCOC(C)CC(=O)OC 7a0e192cb6ed70f7f4949714a2e9e9ef [0,2,0,0,0,0|0,0,2]=4 3866 B13R0.274 CCCCCCOC(C)OC(=O)OC c71a39b7cb01f6ca4d0a818b023de938 [0,2,0,0,0,0|1,0,1]=4 3867 B13R0.274 CCCCCCO[C@@H](C)CC(=O)OC 8d5637ec4cd8a3e0abfa025ae113ddef [0,2,0,0,0,0|0,0,2]=4 3868 B13R0.274 CCCCCCO[C@H](C)CC(=O)OC 561d72264c1f828400f06ff4b8521599 [0,2,0,0,0,0|0,0,2]=4 3869 B13R0.274 CCCCCNCC(=O)CC(=O)OC 2da419cbeb7694e6d22b1044332ba44c [0,2,0,0,0,0|0,0,1]=3 3870 B13R0.274 CCCCCNCC(C)CC(=O)OC a440ad2b72fa67f93a975f52fb505f72 [0,2,0,0,0,0|0,0,2]=4 3871 B13R0.274 CCCCCNCC(O)CC(=O)OC ae769c7aefdbba6a6283b56ee9628ea7 [0,2,0,0,0,0|0,0,2]=4 3872 B13R0.274 CCCCCNC[C@@H](O)CC(=O)OC abfe0cb10ef525f15b6a9f7e64f85145 [0,2,0,0,0,0|0,0,2]=4 3873 B13R0.274 CCCCCNC[C@H](O)CC(=O)OC 76183e31eb7af31599ff2d783d1eaa99 [0,2,0,0,0,0|0,0,2]=4 3874 B13R0.274 CCCCCOCC(=O)CC(=O)OC b7c38cb41a88b2caf98735264879916f [0,2,0,0,0,0|0,0,1]=3 3875 B13R0.274 CCCCCOCC(C)CC(=O)OC 2e72bfc3b250857f75724ca64f24e72a [0,2,0,0,0,0|0,0,2]=4 3876 B13R0.274 CCCCNCC[C@@H](C)CC(=O)OC 8f9c3c9d261bf579d5a4a3330c082caa [0,2,0,0,0,0|0,0,2]=4 3877 B13R0.274 CCCCOCCC(=O)CC(=O)OC c822b82ecaeb14f52e2087e6cf9bbad1 [0,2,0,0,0,0|0,0,1]=3 3878 B13R0.274 CCCCOCCN(C)CC(=O)OC 1e5e3be8b1d1bc2a02ad3f6d5e141aaf [0,2,0,0,0,0|1,0,1]=4 3879 B13R0.274 CCCCOCC[C@@H](C)CC(=O)OC 4b58065cbaddec064c8905e57d8606eb [0,2,0,0,0,0|0,0,2]=4 3880 B13R0.274 CCCCOCO/C(=C/C(=O)CC)/C 7c0677cbfb28fc0e14b18ed938f11ee5 [0,2,0,0,0,0|2,0,0]=4 3881 B13R0.274 CCCOCCCN(C)CC(=O)OC 8974dfb5e1f23491f6da6c6f13d9d53d [0,2,0,0,0,0|1,0,1]=4 3882 B13R0.274 CCCOCCNC(=O)CC(=O)OC 512911ba6b693f93fa83087158fe2afd [0,2,0,0,0,0|1,0,1]=4 3883 B13R0.274 CCCOCCO/C(=C/C(=O)CC)/C bb24c2b037f9869bbdfc157e34a3dd03 [0,2,0,0,0,0|2,0,0]=4 3884 B13R0.274 CCOCCCNC(=O)CC(=O)OC d857d42248e2664cf229d5c78ce6007f [0,2,0,0,0,0|1,0,1]=4 3885 B13R0.274 CCOCCCO/C(=C/C(=O)CC)/C 0002513679fed935edf0ea6e91aa2e04 [0,2,0,0,0,0|2,0,0]=4 3886 B13R0.274 CCOCCNCC(=O)CC(=O)OC 5fe102ca2500818837adeeef1e7cce05 [0,2,0,0,0,0|1,0,1]=4 3887 B13R0.274 CCOCCOCC(=O)CC(=O)OC f2cedf315d3cf9822c48c4412e595e6f [0,2,0,0,0,0|1,0,1]=4 3888 B13R0.274 CCOCOCCC(=O)CC(=O)OC 2b1a5fcd900a815c7331c0302c911b9b [0,2,0,0,0,0|1,0,1]=4 3889 B13R0.274 CCSCCCO/C(=C/C(=O)CC)/C 0ac26d042fcf20efc189ba8804884b5a [0,2,0,0,0,0|2,0,0]=4 3890 B13R0.274 CCSCCNCC(=O)CC(=O)OC 3e16696239b2d12b6c7fb580d4559805 [0,2,0,0,0,0|1,0,1]=4 3891 B13R0.274 CCSCCOCC(=O)CC(=O)OC 9c012784a9480a20a445465f221b00f5 [0,2,0,0,0,0|1,0,1]=4 3892 B13R0.274 COC(=O)CC(=O)CCOCCCF 27153b7d4af5573d91d84451ab32b0e5 [0,2,0,0,0,0|1,0,1]=4 3893 B13R0.274 COC(=O)CC(=O)CCOCCCS 8fa5a676ade6917bd190e9532a9ae36f [0,2,0,0,0,0|1,0,1]=4 3894 B13R0.274 COC(=O)CC(=O)CCOCCSC 23d5d551c7dad93e17ec01e0157479bb [0,2,0,0,0,0|1,0,1]=4 3895 B13R0.274 COC(=O)CC(=O)CNCCCCCl ebafb53b610b44b3969ba0f336208973 [0,2,0,0,0,0|1,0,1]=4 3896 B13R0.274 COC(=O)CC(=O)CNCCCCO 035b3f828ca1d06c7ceb09761a399171 [0,2,0,0,0,0|1,0,1]=4 3897 B13R0.274 COC(=O)CC(=O)CNCCCCS badafc15a0eb151d788c516dd3d9c454 [0,2,0,0,0,0|1,0,1]=4 3898 B13R0.274 COC(=O)CC(=O)CNCCCSC 260ea06737bc9376e5b1db9800625ec4 [0,2,0,0,0,0|1,0,1]=4 3899 B13R0.274 COC(=O)CC(=O)COCCCCF dab057897578d6da344b2d43a9eb814b [0,2,0,0,0,0|1,0,1]=4 3900 B13R0.274 COC(=O)CC(=O)COCCCCS e659351cacbaaa23013d2b9408634b1b [0,2,0,0,0,0|1,0,1]=4 3901 B13R0.274 COC(=O)CC(=O)COCCCSC ff72389991ec6d877d75b90053805a61 [0,2,0,0,0,0|1,0,1]=4 3902 B13R0.274 COC(=O)CC(=O)NCCCCCCl 00803430aad1659dc9f8e00faa257acc [0,2,0,0,0,0|1,0,1]=4 3903 B13R0.274 COC(=O)CC(=O)NCCCCCO 7b262da4f2d7c539a7b6db3b2b952ac6 [0,2,0,0,0,0|1,0,1]=4 3904 B13R0.274 COC(=O)CC(=O)NCCCCSC 1f0d3e7e28d983fc345ee2fbc21aa99c [0,2,0,0,0,0|1,0,1]=4 3905 B13R0.274 COC(=O)CN(C)CCCCCCF 66c012af046a85663c5143362af12cd8 [0,2,0,0,0,0|1,0,1]=4 3906 B13R0.274 COC(=O)CN(C)CCCCCCO 5e357df4676cb1171d6e20ac2282fc0f [0,2,0,0,0,0|1,0,1]=4 3907 B13R0.274 COCCCCCN(C)CC(=O)OC b724925844687427cc6d4a438bdc79b3 [0,2,0,0,0,0|1,0,1]=4 3908 B13R0.274 COCCCCNC(=O)CC(=O)OC b7967905110891ae5cdbd5c14aca74de [0,2,0,0,0,0|1,0,1]=4 3909 B13R0.274 COCCCNCC(=O)CC(=O)OC c38f129d08fe1e182c44b0a3338562a6 [0,2,0,0,0,0|1,0,1]=4 3910 B13R0.274 COCCCOCC(=O)CC(=O)OC fac44f06b72c853f5f9fcda874e70010 [0,2,0,0,0,0|1,0,1]=4 3911 B13R0.274 COCCOCCC(=O)CC(=O)OC 9e9775cd33e7602c0bf1b214b999c152 [0,2,0,0,0,0|1,0,1]=4 3912 B13R0.287 CCCCNC/C(=C\C(=O)OC)/OC feba0e78d7b71cf794f05299921c5e6d [0,2,0,0,0,0|1,0,0]=3 3913 B13R0.287 CCCCNCC(=CC(=O)OC)OC dbd7a28090d74e84f95cd64297cca8a7 [0,2,0,0,0,0|1,0,0]=3 3914 B13R0.287 CCCCOC/C(=C\C(=O)OC)/OC fa750f82186caaf002b5c20db77a7a4c [0,2,0,0,0,0|1,0,0]=3 3915 B13R0.287 CCCCOCC(=CC(=O)OC)OC 1bb27c4ad14bc126d93a0a9c5bcfe8ab [0,2,0,0,0,0|1,0,0]=3 3916 B13R0.287 COC(=O)/C=C(\CNCCCCl)/OC eaa4d2839a2c536f903458fb9af107ef [0,2,0,0,0,0|2,0,0]=4 3917 B13R0.287 COC(=O)/C=C(\CNCCCO)/OC ec9190080a5ed0b2aeef117fc811b1a1 [0,2,0,0,0,0|2,0,0]=4 3918 B13R0.287 COC(=O)/C=C(\CNCCSC)/OC f0b5019bc9dee4835badc7615ef6457d [0,2,0,0,0,0|2,0,0]=4 3919 B13R0.287 COC(=O)/C=C(\COCCCF)/OC 227c18534c2e87bf25e440d16cff6ac0 [0,2,0,0,0,0|2,0,0]=4 3920 B13R0.287 COC(=O)/C=C(\COCCCS)/OC 4d10bd0dd9ab87e2ca2e9f8c8f26f61e [0,2,0,0,0,0|2,0,0]=4 3921 B13R0.287 COC(=O)/C=C(\COCCSC)/OC a4eb62cfa61a9e8a4af2f2112075f07c [0,2,0,0,0,0|2,0,0]=4 3922 B13R0.287 COC(=O)C=C(CNCCCCl)OC d7f8c5720202a5a7268550336e695f70 [0,2,0,0,0,0|2,0,0]=4 3923 B13R0.287 COC(=O)C=C(CNCCCO)OC bb19f582593bd2aa7cc3a45f310cce29 [0,2,0,0,0,0|2,0,0]=4 3924 B13R0.287 COC(=O)C=C(CNCCSC)OC 7c2b597babfb9364cecbad067bd1ec14 [0,2,0,0,0,0|2,0,0]=4 3925 B13R0.287 COC(=O)C=C(COCCCF)OC cd55ba6834559b34c0af33ba77e78a66 [0,2,0,0,0,0|2,0,0]=4 3926 B13R0.287 COC(=O)C=C(COCCCS)OC f163379bdf8c3e69ece58975d5e2bf8f [0,2,0,0,0,0|2,0,0]=4 3927 B13R0.287 COC(=O)C=C(COCCSC)OC 36fa4cb96db87a84d6b663aceea6bf74 [0,2,0,0,0,0|2,0,0]=4 3928 B13R0.287 COCCNC/C(=C\C(=O)OC)/OC deaa9ac43d61fbf50a8312832022fcce [0,2,0,0,0,0|2,0,0]=4 3929 B13R0.287 COCCNCC(=CC(=O)OC)OC ca0e67d2274809464ca37defb92200c0 [0,2,0,0,0,0|2,0,0]=4 3930 B13R0.287 COCCOC/C(=C\C(=O)OC)/OC b50548ca9953015a245284fb1e46df44 [0,2,0,0,0,0|2,0,0]=4 3931 B13R0.287 COCCOCC(=CC(=O)OC)OC 9259a7f3b6c1b1536872a43d60925a96 [0,2,0,0,0,0|2,0,0]=4 3932 B13R0.493 COC(=O)/C=C/C(=O)NCCC(C)C e1c0fa74d595664a729c2017bd23eb2c [0,2,0,0,0,0|1,0,1]=4 3933 B13R0.493 COC(=O)/C=C/C(=O)NCCC(C)O adabccad98567606a6818386ac366227 [0,2,0,0,0,0|1,0,1]=4 3934 B13R0.493 COC(=O)/C=C/C(=O)NCC[C@@H](C)O 2dbf22ac2d7795b5340bd9b19f8f048f [0,2,0,0,0,0|1,0,1]=4 3935 B13R0.493 COC(=O)/C=C/C(=O)NCC[C@H](C)O fdcf565bfb48d80368970f34a9ecaf06 [0,2,0,0,0,0|1,0,1]=4 3936 B13R0.493 COC(=O)/C=C\C(=O)NCCC(C)C 07db724bb6a2006717efe88c60e1ee58 [0,2,0,0,0,0|1,0,1]=4 3937 B13R0.493 COC(=O)/C=C\C(=O)NCCC(C)O 882f68f266c3afdc0e562ea42269c23c [0,2,0,0,0,0|1,0,1]=4 3938 B13R0.493 COC(=O)/C=C\C(=O)NCC[C@@H](C)O 21f371fcb937945f4428a4248faa78f3 [0,2,0,0,0,0|1,0,1]=4 3939 B13R0.493 COC(=O)/C=C\C(=O)NCC[C@H](C)O c0d9ae0bf951ee19e25c1bcf6aca970f [0,2,0,0,0,0|1,0,1]=4 3940 B13R0.493 COC(=O)C=CC(=O)NCCC(C)C 3a68023d8a3f27aa1c697c8ee7e4216d [0,2,0,0,0,0|1,0,1]=4 3941 B13R0.493 COC(=O)C=CC(=O)NCCC(C)O 103776368d6e1758755ce793d81972de [0,2,0,0,0,0|1,0,1]=4 3942 B13R0.493 COC(=O)C=CC(=O)NCC[C@@H](C)O 0efbe45cac2e1065d61ca78b0b4a1abf [0,2,0,0,0,0|1,0,1]=4 3943 B13R0.493 COC(=O)C=CC(=O)NCC[C@H](C)O 9f8a48cdf6228d5810bc92a54b942592 [0,2,0,0,0,0|1,0,1]=4 3944 B13R0.493 COC(=O)CNC(C)CCCC(C)C 6bf008f261d7a9dcad879613298112cf [0,2,0,0,0,0|1,0,1]=4 3945 B13R0.493 COC(=O)COC(C)CCCC(C)C 73969a16054c5c69a9c1a613fe8b78b6 [0,2,0,0,0,0|1,0,1]=4 3946 B13R0.961 CCC(C)CCC(C)OCC(=O)OC fba889d51d684e6bd22957f00df9354d [0,2,0,0,0,0|1,0,1]=4 3947 B13R0.961 CCC(C)CNC(=O)/C=C/C(=O)OC a84df8b71c78b0c4ac0a5d4869a14f5d [0,2,0,0,0,0|1,0,1]=4 3948 B13R0.961 CCC(C)CNC(=O)/C=C\C(=O)OC c40fbdbacf3223b12a5ec9183e59313c [0,2,0,0,0,0|1,0,1]=4 3949 B13R0.961 CCC(C)CNC(=O)C=CC(=O)OC 62a5903f2949e84052c1db22feba7f53 [0,2,0,0,0,0|1,0,1]=4 3950 B13R0.961 CCC(O)CNC(=O)/C=C/C(=O)OC d7e730421c8a1a8ed31658498a890fe5 [0,2,0,0,0,0|1,0,1]=4 3951 B13R0.961 CCC(O)CNC(=O)/C=C\C(=O)OC 3c759a2b13acda20f7d05bdef57fe33e [0,2,0,0,0,0|1,0,1]=4 3952 B13R0.961 CCC(O)CNC(=O)C=CC(=O)OC c434b0e3433ebafffd8d8f64089c7b4e [0,2,0,0,0,0|1,0,1]=4 3953 B13R0.961 CC[C@@H](O)CNC(=O)/C=C/C(=O)OC ed08851555658c43921dcb28d7425835 [0,2,0,0,0,0|1,0,1]=4 3954 B13R0.961 CC[C@@H](O)CNC(=O)/C=C\C(=O)OC b46afebe21bbcf4040b6c9ef66c7193d [0,2,0,0,0,0|1,0,1]=4 3955 B13R0.961 CC[C@@H](O)CNC(=O)C=CC(=O)OC aa7f7daa4914ce14d8f7c07394289c91 [0,2,0,0,0,0|1,0,1]=4 3956 B13R0.961 CC[C@H](C)CNC(=O)/C=C/C(=O)OC 0cd4cf84cda066d6a461206bf80d58e0 [0,2,0,0,0,0|1,0,1]=4 3957 B13R0.961 CC[C@H](C)CNC(=O)/C=C\C(=O)OC b7a39b0f49a2f614b81a3967c6ac9180 [0,2,0,0,0,0|1,0,1]=4 3958 B13R0.961 CC[C@H](C)CNC(=O)C=CC(=O)OC f8bba68a09e5f79a86b59b5660d1c2bc [0,2,0,0,0,0|1,0,1]=4 3959 B13R0.1052 C#CC(CCCCC)OCC(=O)OC 7f21b7e0438e9ae74d587e68f4f6ce89 [0,2,0,0,0,0|1,0,1]=4 3960 B13R0.1052 C#C[C@H](CCCCC)OCC(=O)OC c13fc62d3b333067e50dfced9398a524 [0,2,0,0,0,0|1,0,1]=4 3961 B13R0.1052 C=CC(CCCCC)OCC(=O)OC 391c818630a08f20f1b56f23d4429a20 [0,2,0,0,0,0|1,0,1]=4 3962 B13R0.1052 C=C[C@H](CCCCC)OCC(=O)OC 0a7902661b9a4837163106d55c01e11f [0,2,0,0,0,0|1,0,1]=4 3963 B13R0.1052 CCCCCC(CC)OCC(=O)OC a98d105685bf4b1a3771d88781caa4d7 [0,2,0,0,0,0|1,0,1]=4 3964 B13R0.1052 CCCCC[C@H](CC)OCC(=O)OC 8a887ec9c8bf2b80063803e4e7471204 [0,2,0,0,0,0|1,0,1]=4 3965 B13R0.1170 CCCCCCC(=O)NCC(=O)NC 0645140695b357bb900955f32d26488d [0,2,0,0,0,0|1,0,1]=4 3966 B13R0.1170 CCCCCCC(=O)NCC(=O)OC 5891b7ec4cb8c14c623b87a6cccdec90 [0,2,0,0,0,0|0,0,1]=3 3967 B13R0.1170 CCCCCCC(C)NCC(=O)OC 5e0e1d67e2c4abcda96c242818f3f6e4 [0,2,0,0,0,0|0,0,2]=4 3968 B13R0.1170 CCCCCCC(C)OCC(=O)OC 8aa957f7783b2951975afc93a983f475 [0,2,0,0,0,0|0,0,2]=4 3969 B13R0.1170 CCCCCCN(C)CCC(=O)OC 89080b5d8116668c9e38aa31bd4bc48e [0,2,0,0,0,0|0,0,2]=4 3970 B13R0.1170 CCCCCCN(C)COC(=O)OC bfa8f51f011163bdadad867529369850 [0,2,0,0,0,0|1,0,1]=4 3971 B13R0.1170 CCCCCC[C@@H](C)NCC(=O)OC 34042de7ac5d56ff4bb3d6891bfcc530 [0,2,0,0,0,0|0,0,2]=4 3972 B13R0.1170 CCCCCC[C@@H](C)OCC(=O)OC 6537961b7f2fef829d05de7b8ecebc66 [0,2,0,0,0,0|0,0,2]=4 3973 B13R0.1170 CCCCCC[C@H](C)NCC(=O)OC 22f4b962a7a89031beca5127c0ea24d2 [0,2,0,0,0,0|0,0,2]=4 3974 B13R0.1170 CCCCCC[C@H](C)OCC(=O)OC 38002c510a4233f6f48e75682d596d3d [0,2,0,0,0,0|0,0,2]=4 3975 B13R0.1170 CCCCCNC(=O)/C=C/C(=O)OC 189329bf9ca94d652bc196dbc7fb8041 [0,2,0,0,0,0|0,0,1]=3 3976 B13R0.1170 CCCCCNC(=O)/C=C\C(=O)NC 17cbc58ce812213c01607347f77a41fc [0,2,0,0,0,0|1,0,1]=4 3977 B13R0.1170 CCCCCNC(=O)/C=C\C(=O)OC 274daf076a4d06c28b31185645ab9328 [0,2,0,0,0,0|0,0,1]=3 3978 B13R0.1170 CCCCCNC(=O)C=CC(=O)OC 1a09a2f5eb0e251a049232f340a15cfd [0,2,0,0,0,0|0,0,1]=3 3979 B13R0.1170 CCCCCNC(=O)CCC(=O)OC a75ba3cb955d807e37c68e2f1282180d [0,2,0,0,0,0|1,0,1]=4 3980 B13R0.1170 CCCCCNC(=O)NCC(=O)OC 3aae42fcf3bd93b5d48ed3d8e788b47e [0,2,0,0,0,0|1,0,1]=4 3981 B13R0.1170 CCCCCNC(=S)NCC(=O)OC 683c0576a9eb494d20f0039a214ac8be [0,2,0,0,0,0|1,0,1]=4 3982 B13R0.1170 CCCCCNC(C)CCC(=O)OC 31e31a33f5aeddbeb5236d35d7a09646 [0,2,0,0,0,0|0,0,2]=4 3983 B13R0.1170 CCCCCOC(C)CCC(=O)OC af265ba50cbadff28afee2325436493a [0,2,0,0,0,0|0,0,2]=4 3984 B13R0.1170 CCCCNCC(=O)CCC(=O)OC 4f10b04fd59078c3e879e1341cb5c3e5 [0,2,0,0,0,0|1,0,1]=4 3985 B13R0.1170 CCCCNCC(=O)NCC(=O)OC 143becfdfdcc73e9026eaac453830d76 [0,2,0,0,0,0|1,0,1]=4 3986 B13R0.1170 CCCCNCC(C)CCC(=O)OC 12f172c91b54e5a6a861b7b1439506e0 [0,2,0,0,0,0|0,0,2]=4 3987 B13R0.1170 CCCCOCC(=O)CCC(=O)OC 210b055e33e21049267e672049d80cde [0,2,0,0,0,0|1,0,1]=4 3988 B13R0.1170 CCCCOCC(=O)NCC(=O)OC 352d7056d3457d3ede7cab5238ef0e88 [0,2,0,0,0,0|1,0,1]=4 3989 B13R0.1170 CCCCOCC(C)CCC(=O)OC 556e40150898510530646ccdf357110d [0,2,0,0,0,0|0,0,2]=4 3990 B13R0.1170 CCCCOCC(C)OCC(=O)OC b325cbbd23e7cb36d84e8c7f65415325 [0,2,0,0,0,0|1,0,1]=4 3991 B13R0.1170 CCCCSCC(=O)NCC(=O)OC 916de1237acd17f803afe1164a9752f5 [0,2,0,0,0,0|1,0,1]=4 3992 B13R0.1170 CCCOCCC(=O)NCC(=O)OC a2993fd9b25ce3a263a9f1096f1b38fd [0,2,0,0,0,0|1,0,1]=4 3993 B13R0.1170 CCOCCNC(=O)/C=C/C(=O)OC 4ed3b951d356e20c17d7402258072eca [0,2,0,0,0,0|1,0,1]=4 3994 B13R0.1170 CCOCCNC(=O)/C=C\C(=O)OC cd579784cc46785d03dc73678f0375a1 [0,2,0,0,0,0|1,0,1]=4 3995 B13R0.1170 CCOCCNC(=O)C=CC(=O)OC 6032563013bc2d08b7d087055a41f2a8 [0,2,0,0,0,0|1,0,1]=4 3996 B13R0.1170 CCSCCNC(=O)/C=C/C(=O)OC 7bb04ae9128c233303635f23a7241692 [0,2,0,0,0,0|1,0,1]=4 3997 B13R0.1170 CCSCCNC(=O)/C=C\C(=O)OC 14de6b3234550c9786324d3773b55c17 [0,2,0,0,0,0|1,0,1]=4 3998 B13R0.1170 CCSCCNC(=O)C=CC(=O)OC d28c0d0428db3da132ad1b5e5017bbd6 [0,2,0,0,0,0|1,0,1]=4 3999 B13R0.1170 COC(=O)/C=C/C(=O)NCCCCCl 8765979af584ec9a05990a9b726c9d7a [0,2,0,0,0,0|1,0,1]=4 4000 B13R0.1170 COC(=O)/C=C/C(=O)NCCCCO 7b6c12f4bf62d81be22d49d43290117f [0,2,0,0,0,0|1,0,1]=4 4001 B13R0.1170 COC(=O)/C=C/C(=O)NCCCCS 6dedfbccc1f4d9f39030283bbc318d19 [0,2,0,0,0,0|1,0,1]=4 4002 B13R0.1170 COC(=O)/C=C/C(=O)NCCCSC 69b677a90a73a1d3328241ebbc0f4dd7 [0,2,0,0,0,0|1,0,1]=4 4003 B13R0.1170 COC(=O)/C=C\C(=O)NCCCCCl 0004e8ebd0a67d0a502c5c11f7d10aa8 [0,2,0,0,0,0|1,0,1]=4 4004 B13R0.1170 COC(=O)/C=C\C(=O)NCCCCO d30accad4b75177cceeb8c9e84031efc [0,2,0,0,0,0|1,0,1]=4 4005 B13R0.1170 COC(=O)/C=C\C(=O)NCCCCS 4e8045276c3fdc1b707885ab94731aa4 [0,2,0,0,0,0|1,0,1]=4 4006 B13R0.1170 COC(=O)/C=C\C(=O)NCCCSC c5e8f8b1a1871ae9876a436bbe13406e [0,2,0,0,0,0|1,0,1]=4 4007 B13R0.1170 COC(=O)C=CC(=O)NCCCCCl 2523707093d4029d86f26ed6b001307c [0,2,0,0,0,0|1,0,1]=4 4008 B13R0.1170 COC(=O)C=CC(=O)NCCCCO 2eeca41d73e23e075877f62026bda7f8 [0,2,0,0,0,0|1,0,1]=4 4009 B13R0.1170 COC(=O)C=CC(=O)NCCCCS cdc6b5ff2d28b244fe38a4b602803060 [0,2,0,0,0,0|1,0,1]=4 4010 B13R0.1170 COC(=O)C=CC(=O)NCCCSC 421676602f7517d152d047d45f578db6 [0,2,0,0,0,0|1,0,1]=4 4011 B13R0.1170 COC(=O)CNC(=O)CCCCCF 37c3dcd93b5058456cd3829a19fc642e [0,2,0,0,0,0|1,0,1]=4 4012 B13R0.1170 COC(=O)CNC(=O)CCCCCO f67968c4d2c85cf592aaeae661244603 [0,2,0,0,0,0|1,0,1]=4 4013 B13R0.1170 COC(=O)CNC(=O)CCCCCS e8ba112f3078b310b8dfa1573e9ed9b7 [0,2,0,0,0,0|1,0,1]=4 4014 B13R0.1170 COCCCNC(=O)/C=C/C(=O)OC 976447d00750bec51517b866ae92eadd [0,2,0,0,0,0|1,0,1]=4 4015 B13R0.1170 COCCCNC(=O)/C=C\C(=O)OC 348fe7e83043ae4755c5ad0faa42b4be [0,2,0,0,0,0|1,0,1]=4 4016 B13R0.1170 COCCCNC(=O)C=CC(=O)OC ec9dff424ecf8959b40b5fd8ba47fbc9 [0,2,0,0,0,0|1,0,1]=4 4017 B13R0.1521 CCCC(C)CC(C)OCC(=O)OC ed6dda0128ffbe02a57a71e7775c6bcc [0,2,0,0,0,0|1,0,1]=4 4018 B13R0.1521 CCCC(C)NC(=O)/C=C/C(=O)OC 1a73ec21f76830a7a465cccfe013c870 [0,2,0,0,0,0|1,0,1]=4 4019 B13R0.1521 CCCC(C)NC(=O)/C=C\C(=O)OC 34b358aed1c04bcf3ce0c7ea3e43ac5a [0,2,0,0,0,0|1,0,1]=4 4020 B13R0.1521 CCCC(C)NC(=O)C=CC(=O)OC 131dab530bfeba1ca250c21f2fdcca4b [0,2,0,0,0,0|1,0,1]=4 4021 B13R0.1521 CCC[C@H](C)NC(=O)/C=C/C(=O)OC d109259be1f8f4d3b03d4c2fac588efc [0,2,0,0,0,0|1,0,1]=4 4022 B13R0.1521 CCC[C@H](C)NC(=O)/C=C\C(=O)OC 1116a95f76590105266786fbd8409e12 [0,2,0,0,0,0|1,0,1]=4 4023 B13R0.1521 CCC[C@H](C)NC(=O)C=CC(=O)OC 88fb822776e6dd6152013f20905312cc [0,2,0,0,0,0|1,0,1]=4 4024 B13R0.204 CCC(C)CNC/C=C/C(=O)N(C)C 3aeb1da95bc22b32771566e8277a45a6 [0,2,0,0,0,0|2,0,0]=4 4025 B13R0.204 CCC(C)COC/C=C/C(=O)N(C)C 753ba0e0e306a62237848f7243840606 [0,2,0,0,0,0|2,0,0]=4 4026 B13R0.204 CCC(O)CNC/C=C/C(=O)N(C)C d1586d4898a98cb3141953b256070ed4 [0,2,0,0,0,0|2,0,0]=4 4027 B13R0.204 CC[C@@H](C)COC/C=C/C(=O)N(C)C 51869c5eba10f3d7cf3760c7c4bc0c46 [0,2,0,0,0,0|2,0,0]=4 4028 B13R0.204 CC[C@@H](O)CNC/C=C/C(=O)N(C)C c65e0dbfd96d8486c2a3086fe16789e8 [0,2,0,0,0,0|2,0,0]=4 4029 B13R0.204 CC[C@H](C)CNC/C=C/C(=O)N(C)C 70080b9b70651b618e440791f5039aca [0,2,0,0,0,0|2,0,0]=4 4030 B13R0.204 CC[C@H](C)COC/C=C/C(=O)N(C)C 1b8ad1785911eab6ea516bb1ee7d3870 [0,2,0,0,0,0|2,0,0]=4 4031 B13R0.204 COC(=O)/C=C/CNCC(C)N(C)C 9c77b79113dd659a0f1f64973ed04c47 [0,2,0,0,0,0|2,0,0]=4 4032 B13R0.204 COC(=O)/C=C/CNCC(O)C(C)C 2137d8c744c5530d93801e090ffbc785 [0,2,0,0,0,0|1,0,0]=3 4033 B13R0.204 COC(=O)/C=C/CNCC(O)C(F)F d2b074e26787fe4f4aec7caae3d36429 [0,2,0,0,0,0|2,0,0]=4 4034 B13R0.204 COC(=O)/C=C/COCC(=O)C(C)C 300b110fc53b76b77f30c4d626d0248e [0,2,0,0,0,0|1,0,1]=4 4035 B13R0.204 COC(=O)/C=C/COCC(C)C(=O)C c2c5aebeb8c25098682c8ea078dc8b5d [0,2,0,0,0,0|1,0,1]=4 4036 B13R0.204 COC(=O)/C=C/COCC(C)C(C)C 5d6d30eb12ba02fb8285dec2255cd598 [0,2,0,0,0,0|1,0,0]=3 4037 B13R0.204 COC(=O)/C=C/COCC(C)N(C)C defed318184f4e2d349400c9cdb7d6e5 [0,2,0,0,0,0|2,0,0]=4 4038 B13R0.204 COC(=O)/C=C/COC[C@@H](C)N(C)C 26c3c9d579c93b4b515600d4dfe208aa [0,2,0,0,0,0|2,0,0]=4 4039 B13R0.204 COC(=O)/C=C/COC[C@H](C)N(C)C e1e851f5c9d96e4bd6c5feba2ab2bec4 [0,2,0,0,0,0|2,0,0]=4 4040 B13R0.204 COC(=O)/C=C\CNCC(C)N(C)C d7c788ba04a00c1e558d0b331942134e [0,2,0,0,0,0|2,0,0]=4 4041 B13R0.204 COC(=O)/C=C\CNCC(O)C(C)C c3706934cac12670f3c185438d8be5a0 [0,2,0,0,0,0|1,0,0]=3 4042 B13R0.204 COC(=O)/C=C\CNCC(O)C(F)F 62e262b24dcbcfe9274f1cf8cb6b00a6 [0,2,0,0,0,0|2,0,0]=4 4043 B13R0.204 COC(=O)/C=C\COCC(C)C(=O)C d2915ef1073db802e2dc429d7f7dbbcc [0,2,0,0,0,0|1,0,1]=4 4044 B13R0.204 COC(=O)/C=C\COCC(C)C(C)C 0bd8c6d30717bcb496b6fb04d88643ab [0,2,0,0,0,0|1,0,0]=3 4045 B13R0.204 COC(=O)/C=C\COCC(C)N(C)C a1fe49329df717756e97fd07282043d6 [0,2,0,0,0,0|2,0,0]=4 4046 B13R0.204 COC(=O)/C=C\COC[C@@H](C)N(C)C f2bb77cc37a881d5926b2f4df3cb0e1d [0,2,0,0,0,0|2,0,0]=4 4047 B13R0.204 COC(=O)/C=C\COC[C@H](C)N(C)C 0e52747f780e8ebf405055380b4d461b [0,2,0,0,0,0|2,0,0]=4 4048 B13R0.204 COC(=O)C=CCNCC(C)N(C)C 31d92d096c487fd9931b4d372100ddd6 [0,2,0,0,0,0|2,0,0]=4 4049 B13R0.204 COC(=O)C=CCNCC(O)C(C)C c22b9c218097405c966d12cf6add2e3c [0,2,0,0,0,0|1,0,0]=3 4050 B13R0.204 COC(=O)C=CCNCC(O)C(F)F 25e07860aaaac623f344b3699a750fb1 [0,2,0,0,0,0|2,0,0]=4 4051 B13R0.204 COC(=O)C=CCOCC(C)C(=O)C 10b3b76b8f5d6c2732bb20bac630312c [0,2,0,0,0,0|1,0,1]=4 4052 B13R0.204 COC(=O)C=CCOCC(C)C(C)C 22288b47411817a6fcdc7a7cbf54392d [0,2,0,0,0,0|1,0,0]=3 4053 B13R0.204 COC(=O)C=CCOCC(C)N(C)C 2b85a5e081493106583608f3bf3b05af [0,2,0,0,0,0|2,0,0]=4 4054 B13R0.204 COC(=O)C=CCOC[C@@H](C)N(C)C 0f8ba16c50a05ff8c03e4775014f69f5 [0,2,0,0,0,0|2,0,0]=4 4055 B13R0.204 COC(=O)C=CCOC[C@H](C)N(C)C 73ee0405f6864f5b9d06f6392bb685a5 [0,2,0,0,0,0|2,0,0]=4 4056 B13R0.952 CCC(C)(C)CNC/C=C/C(=O)OC 33e7ec3d8eda54c5a4c1496d997b340a [0,2,0,0,0,0|1,0,0]=3 4057 B13R0.952 CCC(C)(C)CNC/C=C\C(=O)OC 39365e4d0afa16d99b5f5538091d84f8 [0,2,0,0,0,0|1,0,0]=3 4058 B13R0.952 CCC(C)(C)CNCC=CC(=O)OC 4e8755abf68d08b11822f06ca968e1a4 [0,2,0,0,0,0|1,0,0]=3 4059 B13R0.952 CCC(C)(O)CNC/C=C/C(=O)OC fbc27c2c202b8a3cffb41d8ad9626a35 [0,2,0,0,0,0|1,0,0]=3 4060 B13R0.952 CCC(C)(O)CNC/C=C\C(=O)OC 70e73d921f20e26c38bede7600a041e0 [0,2,0,0,0,0|1,0,0]=3 4061 B13R0.952 CCC(C)(O)CNCC=CC(=O)OC 8fceba8aaeef64c522948f2f056db926 [0,2,0,0,0,0|1,0,0]=3 4062 B13R0.952 CCC(F)(F)COC/C=C/C(=O)OC 2ad87ca831db73137824fc67e505abf9 [0,2,0,0,0,0|1,0,0]=3 4063 B13R0.952 CCC(F)(F)COC/C=C\C(=O)OC 0dbb31f2735e6829e4d3b324b3e1d8be [0,2,0,0,0,0|1,0,0]=3 4064 B13R0.952 CCC(F)(F)COCC=CC(=O)OC d7f770ecfb661684c480678c9c91ab0d [0,2,0,0,0,0|1,0,0]=3 4065 B13R0.952 CCS(=O)(=O)COC/C=C/C(=O)OC f8bf106865e8b4644daba7781719e913 [0,2,0,0,0,0|2,0,0]=4 4066 B13R0.952 COC(=O)/C=C/CNCC(C)(C)CF da3b8c13d2c3073c41cd710534c36455 [0,2,0,0,0,0|2,0,0]=4 4067 B13R0.952 COC(=O)/C=C/CNCC(C)(C)CO 8b02bdef6ac0e38b2b2abe70b2306e0e [0,2,0,0,0,0|2,0,0]=4 4068 B13R0.952 COC(=O)/C=C/CNCC(C)(C)OC 51d3a05bb5df8462271f8fd363fa3e18 [0,2,0,0,0,0|2,0,0]=4 4069 B13R0.952 COC(=O)/C=C/CNCC(F)(F)CO 57f9413720d3361a4ccfd2c5250b2cab [0,2,0,0,0,0|2,0,0]=4 4070 B13R0.952 COC(=O)/C=C/COCC(C)(C)CF 2e428418a807b6a987a8ec6083aee514 [0,2,0,0,0,0|2,0,0]=4 4071 B13R0.952 COC(=O)/C=C/COCC(C)(C)OC 8ec7b30b48a2adaa698d46c7c71e692f [0,2,0,0,0,0|2,0,0]=4 4072 B13R0.952 COC(=O)/C=C\CNCC(C)(C)CF ca0555a06723d0a3906bbc37c73dcf47 [0,2,0,0,0,0|2,0,0]=4 4073 B13R0.952 COC(=O)/C=C\CNCC(C)(C)CO 38bbacc87c078d81f25ff5313de86d06 [0,2,0,0,0,0|2,0,0]=4 4074 B13R0.952 COC(=O)/C=C\CNCC(C)(C)OC d35078be50018310bd4c3676dd58e8b2 [0,2,0,0,0,0|2,0,0]=4 4075 B13R0.952 COC(=O)/C=C\CNCC(F)(F)CO 2a28d152f6df600c56093d93f6a7d2d8 [0,2,0,0,0,0|2,0,0]=4 4076 B13R0.952 COC(=O)/C=C\COCC(C)(C)CF 170b59b633ff7c4c0e9bcdccb71e47dd [0,2,0,0,0,0|2,0,0]=4 4077 B13R0.952 COC(=O)/C=C\COCC(C)(C)OC 08d0207ac0e60a8b50ed34fb68522423 [0,2,0,0,0,0|2,0,0]=4 4078 B13R0.952 COC(=O)C=CCNCC(C)(C)CF c2678bbaf3c43b68dca428006302b536 [0,2,0,0,0,0|2,0,0]=4 4079 B13R0.952 COC(=O)C=CCNCC(C)(C)CO 5c8e144946c2d5561883efdaac0bbc7a [0,2,0,0,0,0|2,0,0]=4 4080 B13R0.952 COC(=O)C=CCNCC(C)(C)OC 93b2f7208d6f0c465ba11ed7810fde34 [0,2,0,0,0,0|2,0,0]=4 4081 B13R0.952 COC(=O)C=CCNCC(F)(F)CO 1cc3767c9c6169e9660adfe26d81c5e5 [0,2,0,0,0,0|2,0,0]=4 4082 B13R0.952 COC(=O)C=CCOCC(C)(C)CF f72c99642b95d92412f49e387d535417 [0,2,0,0,0,0|2,0,0]=4 4083 B13R0.952 COC(=O)C=CCOCC(C)(C)OC 2b7dff9b9bba65896be126477b1ad1f6 [0,2,0,0,0,0|2,0,0]=4 4084 B13R0.180 CC(C)CCNC/C=C/C(=O)N(C)C 30bd75b1bb875ab742c45102badd598d [0,2,0,0,0,0|2,0,0]=4 4085 B13R0.180 CC(C)CCOC/C=C/C(=O)N(C)C 2caec7cfcff69b7fd0d6207f22639bc2 [0,2,0,0,0,0|2,0,0]=4 4086 B13R0.180 CC(O)CCNC/C=C/C(=O)N(C)C cf051abc9770640139306053fba28cd2 [0,2,0,0,0,0|2,0,0]=4 4087 B13R0.180 C[C@@H](O)CCNC/C=C/C(=O)N(C)C 8d20e49714d0a7870eb7aa31dd21b1b3 [0,2,0,0,0,0|2,0,0]=4 4088 B13R0.180 C[C@H](O)CCNC/C=C/C(=O)N(C)C fca017b1bf1d084e5273558e487a5115 [0,2,0,0,0,0|2,0,0]=4 4089 B13R0.198 COC(=O)/C=C/CNC(C)CC(C)C 352068838f22bcf5244187defc5160a2 [0,2,0,0,0,0|1,0,0]=3 4090 B13R0.198 COC(=O)/C=C/CNC(C)CC(C)O 1696ebc08b129c52bfbfc42bbfd20025 [0,2,0,0,0,0|1,0,0]=3 4091 B13R0.198 COC(=O)/C=C/CNC(C)CN(C)C 199556991cfead49a92a6059ad7a4504 [0,2,0,0,0,0|2,0,0]=4 4092 B13R0.198 COC(=O)/C=C/CN[C@@H](C)CN(C)C 4d6b5d9dd1257ff6dd77c9025f257b24 [0,2,0,0,0,0|2,0,0]=4 4093 B13R0.198 COC(=O)/C=C/CN[C@H](C)CN(C)C 4b093aba6c204382492dee76a39183e4 [0,2,0,0,0,0|2,0,0]=4 4094 B13R0.198 COC(=O)/C=C/COC(C)CC(C)C 8e1f4afefd611d2a5260d5c4e8e4dffa [0,2,0,0,0,0|1,0,0]=3 4095 B13R0.198 COC(=O)/C=C/COC(C)CN(C)C 4aab4ee546a5f9234317d0158bf429e6 [0,2,0,0,0,0|2,0,0]=4 4096 B13R0.198 COC(=O)/C=C/CO[C@@H](C)CC(C)C c85bfddb5b15bfa79f562e7d2e58f1d4 [0,2,0,0,0,0|1,0,0]=3 4097 B13R0.198 COC(=O)/C=C/CO[C@@H](C)CN(C)C 404c965b8395300c0f033e96adbedb0e [0,2,0,0,0,0|2,0,0]=4 4098 B13R0.198 COC(=O)/C=C/CO[C@H](C)CC(C)C fb65a0f2e34468f10f4459512ee91652 [0,2,0,0,0,0|1,0,0]=3 4099 B13R0.198 COC(=O)/C=C/CO[C@H](C)CN(C)C 443e13cfdf572e7f1f2829e57f8ca383 [0,2,0,0,0,0|2,0,0]=4 4100 B13R0.198 COC(=O)/C=C\CNC(C)CC(C)C 9daa3a7e956da88cdb2a9d31ab042b4a [0,2,0,0,0,0|1,0,0]=3 4101 B13R0.198 COC(=O)/C=C\CNC(C)CC(C)O 698fea8a849c885b4395ac6261d8a66d [0,2,0,0,0,0|1,0,0]=3 4102 B13R0.198 COC(=O)/C=C\CNC(C)CN(C)C bb4dec7acd4b8b0b9d20c0392bb653ce [0,2,0,0,0,0|2,0,0]=4 4103 B13R0.198 COC(=O)/C=C\CN[C@@H](C)CN(C)C cb7536be6cbe23c8b58826019611d7a0 [0,2,0,0,0,0|2,0,0]=4 4104 B13R0.198 COC(=O)/C=C\CN[C@H](C)CN(C)C 7e2f511eb537a8cd0f9f8d110aec2f1c [0,2,0,0,0,0|2,0,0]=4 4105 B13R0.198 COC(=O)/C=C\COC(C)CC(C)C f836a2c4a7e0e5b7353f266761447c6d [0,2,0,0,0,0|1,0,0]=3 4106 B13R0.198 COC(=O)/C=C\COC(C)CN(C)C 506b222dec971977706bec9210436a0e [0,2,0,0,0,0|2,0,0]=4 4107 B13R0.198 COC(=O)/C=C\CO[C@@H](C)CC(C)C cf85024b3a5f69b9e903ee19bf1916e6 [0,2,0,0,0,0|1,0,0]=3 4108 B13R0.198 COC(=O)/C=C\CO[C@@H](C)CN(C)C f2a596540aea7a22dfd65d24371c0154 [0,2,0,0,0,0|2,0,0]=4 4109 B13R0.198 COC(=O)/C=C\CO[C@H](C)CC(C)C 368399482980ba23241b4bad10a6b032 [0,2,0,0,0,0|1,0,0]=3 4110 B13R0.198 COC(=O)/C=C\CO[C@H](C)CN(C)C b51bb0d7404b62998b26f2efcb2b59ae [0,2,0,0,0,0|2,0,0]=4 4111 B13R0.198 COC(=O)C=CCNC(C)CC(C)C 981d99928bd417047df2fe110c4bc7ad [0,2,0,0,0,0|1,0,0]=3 4112 B13R0.198 COC(=O)C=CCNC(C)CC(C)O 141876f24ef57a6485db6de2f7adcac0 [0,2,0,0,0,0|1,0,0]=3 4113 B13R0.198 COC(=O)C=CCNC(C)CN(C)C 9c3b5e6b8edff9a65e850d766b258382 [0,2,0,0,0,0|2,0,0]=4 4114 B13R0.198 COC(=O)C=CCN[C@@H](C)CN(C)C a564bce3ea752e6208e7e96f263da1d4 [0,2,0,0,0,0|2,0,0]=4 4115 B13R0.198 COC(=O)C=CCN[C@H](C)CN(C)C d573614002c04d463480c12767deb8d7 [0,2,0,0,0,0|2,0,0]=4 4116 B13R0.198 COC(=O)C=CCOC(C)CC(C)C a6846163b021bc0e8601bbaa73611bbc [0,2,0,0,0,0|1,0,0]=3 4117 B13R0.198 COC(=O)C=CCOC(C)CN(C)C b28f13d9b3357d51cb347fcc2c7d0378 [0,2,0,0,0,0|2,0,0]=4 4118 B13R0.198 COC(=O)C=CCO[C@@H](C)CC(C)C 7cb1d30ecbf972bcc932c526e189b040 [0,2,0,0,0,0|1,0,0]=3 4119 B13R0.198 COC(=O)C=CCO[C@@H](C)CN(C)C 535a3a5e326020de5d7be69b8adfc725 [0,2,0,0,0,0|2,0,0]=4 4120 B13R0.198 COC(=O)C=CCO[C@H](C)CC(C)C 1caf38ee351456ed2f37cd7771bfaacc [0,2,0,0,0,0|1,0,0]=3 4121 B13R0.198 COC(=O)C=CCO[C@H](C)CN(C)C 7dfd8b69bcbc727b9354f670e2bc94af [0,2,0,0,0,0|2,0,0]=4 4122 B13R0.198 COC(=O)COCCC(C)CC(C)C b7fa1220b3b5efe05a7e4dd32c7f480e [0,2,0,0,0,0|1,0,1]=4 4123 B13R0.201 CCC(=O)CCCCNCC(=O)OC cdc7efaf2562c4b547047796c923387e [0,2,0,0,0,0|1,0,1]=4 4124 B13R0.201 CCC(=O)CCCCOCC(=O)OC b1465b903cefe8b6623ee3a143badaf2 [0,2,0,0,0,0|1,0,1]=4 4125 B13R0.201 CCC(=O)OCOC/C=C/C(=O)OC 1d43454b2c9d8d5b61ec7bb0a385d91a [0,2,0,0,0,0|1,0,1]=4 4126 B13R0.201 CCC(C)CCCCOCC(=O)OC bca3936823c05c5b78ba2b03b07eed8e [0,2,0,0,0,0|0,0,2]=4 4127 B13R0.201 CCC(C)CCCOCCC(=O)OC ce11343cfb925f9ed65cb43393682f4a [0,2,0,0,0,0|0,0,2]=4 4128 B13R0.201 CCC(C)CCCOCOC(=O)OC b578e5f85345284bd14617fbf9568246 [0,2,0,0,0,0|1,0,1]=4 4129 B13R0.201 CCC(C)CCNC/C=C/C(=O)OC 74b25182a35fcfd4ba362b2ab0ac8be8 [0,2,0,0,0,0|0,0,0]=2 4130 B13R0.201 CCC(C)CCNC/C=C\C(=O)OC f78e120cb64933a31a62433ebfbd4b79 [0,2,0,0,0,0|0,0,0]=2 4131 B13R0.201 CCC(C)CCNCC#CC(=O)OC 821b434c960894dcaf282967612ddd8f [0,2,0,0,0,0|0,0,2]=4 4132 B13R0.201 CCC(C)CCNCC=CC(=O)OC 42a9a945a7e2245f7ecb4952d1c27d74 [0,2,0,0,0,0|0,0,0]=2 4133 B13R0.201 CCC(C)CCNCCCC(=O)OC 493a5638c72a96f250e24d13de568cb8 [0,2,0,0,0,0|0,0,2]=4 4134 B13R0.201 CCC(C)CCOC/C=C/C(=O)OC 4fbefebc5ceb570f62c34240faf4d937 [0,2,0,0,0,0|0,0,0]=2 4135 B13R0.201 CCC(C)CCOC/C=C\C(=O)OC 18cfb1c8db9b02a1ec00bb23dd14f5f2 [0,2,0,0,0,0|0,0,0]=2 4136 B13R0.201 CCC(C)CCOCC#CC(=O)OC bb2353f382e4a8be4111c0f62e029296 [0,2,0,0,0,0|0,0,2]=4 4137 B13R0.201 CCC(C)CCOCC=CC(=O)OC ea364c6f1dfa655fc01229e922d52657 [0,2,0,0,0,0|0,0,0]=2 4138 B13R0.201 CCC(C)CCOCCCC(=O)OC 0df3ab965814398cad4a2d4b6f62e922 [0,2,0,0,0,0|0,0,2]=4 4139 B13R0.201 CCC(C)CCOCCOC(=O)OC a2c45902f9ef4def3fdee0bd1014f6f6 [0,2,0,0,0,0|1,0,1]=4 4140 B13R0.201 CCC(C)CNCCCCC(=O)OC 8a29f44f5ce4a06f23dc556a5b098478 [0,2,0,0,0,0|0,0,2]=4 4141 B13R0.201 CCC(C)CNCCOCC(=O)OC 54014af58cc37212da2f46d92894f740 [0,2,0,0,0,0|1,0,1]=4 4142 B13R0.201 CCC(C)COCCCCC(=O)OC efa1be9fe557993b33bf85be46528a97 [0,2,0,0,0,0|0,0,2]=4 4143 B13R0.201 CCC(C)COCCOCC(=O)OC 6d645c571c9a798bd49cd2a58a86870a [0,2,0,0,0,0|1,0,1]=4 4144 B13R0.201 CCC(C)NC/C=C/C=C/C(=O)OC e6319fa776412c3b33fc5f801a2614f5 [0,2,0,0,0,0|0,0,2]=4 4145 B13R0.201 CCC(C)NCC=CC=CC(=O)OC 46e361de8ba08933ae8bb9b4da56f47a [0,2,0,0,0,0|0,0,2]=4 4146 B13R0.201 CCC(C)NCCCCCC(=O)OC e5955a19dbd5ec3f36f8ef6281ec897a [0,2,0,0,0,0|0,0,2]=4 4147 B13R0.201 CCC(C)NCCCOCC(=O)OC 9e8cefe6678d5cf4ab81a82a04deb456 [0,2,0,0,0,0|1,0,1]=4 4148 B13R0.201 CCC(C)NCCCSCC(=O)OC 5dd8c5360532916127838d52147bf9f6 [0,2,0,0,0,0|1,0,1]=4 4149 B13R0.201 CCC(C)OC/C=C/C=C/C(=O)OC e9e87ddd61a8432d44319da409b1a591 [0,2,0,0,0,0|0,0,2]=4 4150 B13R0.201 CCC(C)OCC=CC=CC(=O)OC b50fa98f39916d9bd7df99b9371f3c95 [0,2,0,0,0,0|0,0,2]=4 4151 B13R0.201 CCC(C)OCCCCCC(=O)OC d9648e988fcda489d3f4fd1c89ed88f5 [0,2,0,0,0,0|0,0,2]=4 4152 B13R0.201 CCC(C)OCCCOCC(=O)OC 3b99ba05adf6e82de3098f63677308b0 [0,2,0,0,0,0|1,0,1]=4 4153 B13R0.201 CCC(C)OCCCSCC(=O)OC 4b827780ddb9ea8ff830588ea608c987 [0,2,0,0,0,0|1,0,1]=4 4154 B13R0.201 CCC(O)CNCCCCC(=O)OC c652bcdbc32a5640bbd2d2832cdcd276 [0,2,0,0,0,0|0,0,2]=4 4155 B13R0.201 CCC(O)CNCCOCC(=O)OC 5646ad40c383bfab6540a4044b4bfb37 [0,2,0,0,0,0|1,0,1]=4 4156 B13R0.201 CCC(S)CCOC/C=C/C(=O)OC a57dbd8510483c85d73077783bdaef45 [0,2,0,0,0,0|0,0,0]=2 4157 B13R0.201 CCC(S)CCOC/C=C\C(=O)OC a85476132cf4e75c0dede3ec92b731c6 [0,2,0,0,0,0|0,0,0]=2 4158 B13R0.201 CCC(S)CCOCC#CC(=O)OC 8bfd357a46200648d238e5184216fd9e [0,2,0,0,0,0|0,0,2]=4 4159 B13R0.201 CCC(S)CCOCC=CC(=O)OC b64a2aae40809627a4d6a8fa49445776 [0,2,0,0,0,0|0,0,0]=2 4160 B13R0.201 CCC(S)CCOCCCC(=O)OC 8c33e7062d751a78834af76c4f3c6966 [0,2,0,0,0,0|0,0,2]=4 4161 B13R0.201 CCN(C)CCCCCCC(=O)OC 323fb31fd48116edaf46b11482775e1d [0,2,0,0,0,0|0,0,2]=4 4162 B13R0.201 CCS(=O)CCOC/C=C/C(=O)OC 9d83c671876bf99a57284215a193cea5 [0,2,0,0,0,0|1,0,0]=3 4163 B13R0.201 CC[C@@H](C)CNCCCCC(=O)OC de415fd12263b6ba125ae13469b6a8a0 [0,2,0,0,0,0|0,0,2]=4 4164 B13R0.201 CC[C@@H](C)COCCCCC(=O)OC 22363e4b277e0dd85027f62f2142fdc7 [0,2,0,0,0,0|0,0,2]=4 4165 B13R0.201 CC[C@@H](C)COCCOCC(=O)OC 0b2f697a382d22bf45de761d4325812f [0,2,0,0,0,0|1,0,1]=4 4166 B13R0.201 CC[C@@H](C)NC/C=C/C=C/C(=O)OC 1b2cdb9c1cbba20b5b691db08f9f0e91 [0,2,0,0,0,0|0,0,2]=4 4167 B13R0.201 CC[C@@H](C)NCC=CC=CC(=O)OC 70ca618c29906eef624ac5ed5f1a715e [0,2,0,0,0,0|0,0,2]=4 4168 B13R0.201 CC[C@@H](C)NCCCCCC(=O)OC af905aea145dd79b1edd9521327837eb [0,2,0,0,0,0|0,0,2]=4 4169 B13R0.201 CC[C@@H](C)NCCCOCC(=O)OC 0309c6000dcbf2d8841d545aa30ce5a1 [0,2,0,0,0,0|1,0,1]=4 4170 B13R0.201 CC[C@@H](C)NCCCSCC(=O)OC f36f85f15fefda41fdeb42a4381ad534 [0,2,0,0,0,0|1,0,1]=4 4171 B13R0.201 CC[C@@H](C)OC/C=C/C=C/C(=O)OC b7edca276e12cd7eeda56faa3d55ec38 [0,2,0,0,0,0|0,0,2]=4 4172 B13R0.201 CC[C@@H](C)OCC=CC=CC(=O)OC 1e2dedf16eb2a693dc4da4eb404c94f8 [0,2,0,0,0,0|0,0,2]=4 4173 B13R0.201 CC[C@@H](C)OCCCCCC(=O)OC 7f82b5ad5d8b75148f56f9afd6a0af9a [0,2,0,0,0,0|0,0,2]=4 4174 B13R0.201 CC[C@@H](C)OCCCOCC(=O)OC 920260f259b5238545971786a1b7fbea [0,2,0,0,0,0|1,0,1]=4 4175 B13R0.201 CC[C@@H](C)OCCCSCC(=O)OC 8c6ee1f136fe3210f604066419b84da8 [0,2,0,0,0,0|1,0,1]=4 4176 B13R0.201 CC[C@@H](O)CNCCCCC(=O)OC e8c09b8044de67a0e7ba7a0abd1c64b5 [0,2,0,0,0,0|0,0,2]=4 4177 B13R0.201 CC[C@@H](O)CNCCOCC(=O)OC 15356453407bb6070a716bf16eef49f0 [0,2,0,0,0,0|1,0,1]=4 4178 B13R0.201 CC[C@H](C)CCCCOCC(=O)OC 4ec1fca1bfce83266af7a8b752578806 [0,2,0,0,0,0|0,0,2]=4 4179 B13R0.201 CC[C@H](C)CCCOCCC(=O)OC 1ccbc044459c93db2a6730a226fc0862 [0,2,0,0,0,0|0,0,2]=4 4180 B13R0.201 CC[C@H](C)CCCOCOC(=O)OC 11cb67ce46425a59e4db1c9f6a0718e8 [0,2,0,0,0,0|1,0,1]=4 4181 B13R0.201 CC[C@H](C)CCOC/C=C/C(=O)OC 05753c8085e112d7b12ad3388a00e0d4 [0,2,0,0,0,0|0,0,0]=2 4182 B13R0.201 CC[C@H](C)CCOC/C=C\C(=O)OC 0ae2762e069009759deaf74f2d6f2460 [0,2,0,0,0,0|0,0,0]=2 4183 B13R0.201 CC[C@H](C)CCOCC#CC(=O)OC da0d794256b9928be9c01307eee24270 [0,2,0,0,0,0|0,0,2]=4 4184 B13R0.201 CC[C@H](C)CCOCC=CC(=O)OC 1e449d81f9027b479ce7def457ac034a [0,2,0,0,0,0|0,0,0]=2 4185 B13R0.201 CC[C@H](C)CCOCCCC(=O)OC 7625f68d562b9908d7862b647db5ef0a [0,2,0,0,0,0|0,0,2]=4 4186 B13R0.201 CC[C@H](C)CNCCCCC(=O)OC 755ed67394278788a30a2c2934e53013 [0,2,0,0,0,0|0,0,2]=4 4187 B13R0.201 CC[C@H](C)CNCCOCC(=O)OC de400c3fe760f3fb25ca81c92a6e7895 [0,2,0,0,0,0|1,0,1]=4 4188 B13R0.201 CC[C@H](C)COCCCCC(=O)OC cca1155d8410e74fe7b26ce7919002ce [0,2,0,0,0,0|0,0,2]=4 4189 B13R0.201 CC[C@H](C)COCCOCC(=O)OC c67e00bdd45275d47f6487b05fb38e5b [0,2,0,0,0,0|1,0,1]=4 4190 B13R0.201 CC[C@H](C)NC/C=C/C=C/C(=O)OC 4840001edc3a4789b8d339e22a46b689 [0,2,0,0,0,0|0,0,2]=4 4191 B13R0.201 CC[C@H](C)NCC=CC=CC(=O)OC 251bedff2eb1534b93d7f7b641280f7a [0,2,0,0,0,0|0,0,2]=4 4192 B13R0.201 CC[C@H](C)NCCCCCC(=O)OC 5d6e7590b8af6ae8839f6fba19fc53e7 [0,2,0,0,0,0|0,0,2]=4 4193 B13R0.201 CC[C@H](C)NCCCOCC(=O)OC cf3780139630b1bf515337363f9ddad5 [0,2,0,0,0,0|1,0,1]=4 4194 B13R0.201 CC[C@H](C)NCCCSCC(=O)OC 7f4b2a44c400fb149d9dedb43c9bd07c [0,2,0,0,0,0|1,0,1]=4 4195 B13R0.201 CC[C@H](C)OC/C=C/C=C/C(=O)OC 381fc3ae2c68165d01b1da69c0ea57ec [0,2,0,0,0,0|0,0,2]=4 4196 B13R0.201 CC[C@H](C)OCC=CC=CC(=O)OC cf2808ab694ed65b34ac867f91ebeddb [0,2,0,0,0,0|0,0,2]=4 4197 B13R0.201 CC[C@H](C)OCCCCCC(=O)OC 6c043af9e836750bfb4a85355a9f850a [0,2,0,0,0,0|0,0,2]=4 4198 B13R0.201 CC[C@H](C)OCCCOCC(=O)OC 7bc9dcf5061b22b1b1a5e2c416928d47 [0,2,0,0,0,0|1,0,1]=4 4199 B13R0.201 CC[C@H](C)OCCCSCC(=O)OC 4a50fbe0866a63fd6edf6c0bf9b86a7a [0,2,0,0,0,0|1,0,1]=4 4200 B13R0.201 CNC(=O)CCNC/C=C/C(=O)OC ba1b3d937c365212ab1be7fb9b8c66a8 [0,2,0,0,0,0|1,0,1]=4 4201 B13R0.201 CNC(=O)CCNC/C=C\C(=O)OC f92a149af85a6082f0d4f1cfeffef104 [0,2,0,0,0,0|1,0,1]=4 4202 B13R0.201 CNC(=O)CCNCC=CC(=O)OC af30f8d5907c75c64b1857bb982b8dc1 [0,2,0,0,0,0|1,0,1]=4 4203 B13R0.201 CNC(=O)CCOC/C=C/C(=O)OC c8ffe07cb42cb9a7a807ce47b2b17cc0 [0,2,0,0,0,0|1,0,1]=4 4204 B13R0.201 CNC(=O)CCOC/C=C\C(=O)OC 4ef7b06f618285fb112f3029e5cdcc64 [0,2,0,0,0,0|1,0,1]=4 4205 B13R0.201 CNC(=O)CCOCC=CC(=O)OC b58e0e7c14c78ccd5c7f0e771716bfb9 [0,2,0,0,0,0|1,0,1]=4 4206 B13R0.201 COC(=O)/C=C/CNCCC(=O)OC c65fc1203e2bf477898489ff9e0a64ec [0,2,0,0,0,0|1,0,1]=4 4207 B13R0.201 COC(=O)/C=C/CNCCC(C)CO f08603d0188a5883f77a0af4aca02e64 [0,2,0,0,0,0|1,0,0]=3 4208 B13R0.201 COC(=O)/C=C/CNCCC(O)CO 8ce1ffd53998583f6ca88bdb02073d1f [0,2,0,0,0,0|1,0,0]=3 4209 B13R0.201 COC(=O)/C=C/CNCC[C@@H](C)CO 6026498e7c419dc6a9b0820aad005f16 [0,2,0,0,0,0|1,0,0]=3 4210 B13R0.201 COC(=O)/C=C/COCCC(=O)OC 59aa03816b38805f572c6513db9db807 [0,2,0,0,0,0|1,0,1]=4 4211 B13R0.201 COC(=O)/C=C/COCCC(C)OC a8f74b86581c882e4c50eda8c03b3126 [0,2,0,0,0,0|1,0,0]=3 4212 B13R0.201 COC(=O)/C=C/COCCN(C)C#N 0f36b713869e62c770c0e629f21cbcce [0,2,0,0,0,0|2,0,0]=4 4213 B13R0.201 COC(=O)/C=C/COCCN(C)C=O 4f37d64c382d3a81964f690753a3ab92 [0,2,0,0,0,0|2,0,0]=4 4214 B13R0.201 COC(=O)/C=C\CNCCC(=O)OC 63f9fdda04069a22f12696d850e53361 [0,2,0,0,0,0|1,0,1]=4 4215 B13R0.201 COC(=O)/C=C\CNCCC(C)CO a97a2a4e9ee4106d409883d760e8ede3 [0,2,0,0,0,0|1,0,0]=3 4216 B13R0.201 COC(=O)/C=C\CNCCC(O)CO 6876fbbacf847840c386df40949a8719 [0,2,0,0,0,0|1,0,0]=3 4217 B13R0.201 COC(=O)/C=C\CNCC[C@@H](C)CO 8aabc12c145982868f0d3c320a322637 [0,2,0,0,0,0|1,0,0]=3 4218 B13R0.201 COC(=O)/C=C\COCCC(=O)OC 38198447162db4b572a591d750e9d456 [0,2,0,0,0,0|1,0,1]=4 4219 B13R0.201 COC(=O)/C=C\COCCC(C)OC d3778060f1134255dddb251000b5e7d4 [0,2,0,0,0,0|1,0,0]=3 4220 B13R0.201 COC(=O)/C=C\COCCN(C)C#N 35992bfc3564424d910568badc8b004a [0,2,0,0,0,0|2,0,0]=4 4221 B13R0.201 COC(=O)/C=C\COCCN(C)C=O bf622f03166b0a88ed1497420356074e [0,2,0,0,0,0|2,0,0]=4 4222 B13R0.201 COC(=O)C=CCNCCC(=O)OC 4de65399b6ff9a94809a8123861ddb41 [0,2,0,0,0,0|1,0,1]=4 4223 B13R0.201 COC(=O)C=CCNCCC(C)CO 7c15497f067b749fc4c9128bee6e7761 [0,2,0,0,0,0|1,0,0]=3 4224 B13R0.201 COC(=O)C=CCNCCC(O)CO afda7ebb30669975cba7e73fe2713542 [0,2,0,0,0,0|1,0,0]=3 4225 B13R0.201 COC(=O)C=CCNCC[C@@H](C)CO ddcb5814b1d00f2584966bee4aca19de [0,2,0,0,0,0|1,0,0]=3 4226 B13R0.201 COC(=O)C=CCOCCC(=O)OC 001fad22b45913d198a2f5dbf3189fec [0,2,0,0,0,0|1,0,1]=4 4227 B13R0.201 COC(=O)C=CCOCCC(C)OC 59280ac26bd6cab2fd9a8df517c13394 [0,2,0,0,0,0|1,0,0]=3 4228 B13R0.201 COC(=O)C=CCOCCN(C)C#N 0f24e4e3e9a2a5d8e85d8584d85cd5c2 [0,2,0,0,0,0|2,0,0]=4 4229 B13R0.201 COC(=O)C=CCOCCN(C)C=O e5d08a29134f938f2bd6793e51aa831d [0,2,0,0,0,0|2,0,0]=4 4230 B13R0.431 COC(=O)/C=C/CNCCC(C)(C)C b0581d8b85440b87c97232c5bd21cac8 [0,2,0,0,0,0|1,0,0]=3 4231 B13R0.431 COC(=O)/C=C/CNCCC(C)(C)F 810e5b42c6dff01fdd5bb659d1367346 [0,2,0,0,0,0|1,0,0]=3 4232 B13R0.431 COC(=O)/C=C/CNCCC(C)(C)O e07931eeb347d1526e7e35dbef28274f [0,2,0,0,0,0|1,0,0]=3 4233 B13R0.431 COC(=O)/C=C/CNCCC(F)(F)F d3c5b04bff06eb93b7d696f8f8ba9ccd [0,2,0,0,0,0|2,0,0]=4 4234 B13R0.431 COC(=O)/C=C/CNCCS(=O)(=O)C 54e3df01b556086f563a5020c3ec7dde [0,2,0,0,0,0|2,0,0]=4 4235 B13R0.431 COC(=O)/C=C/COCCC(C)(C)C 3b115f93d50a21f3a6a081c5006c7b0f [0,2,0,0,0,0|1,0,0]=3 4236 B13R0.431 COC(=O)/C=C/COCCC(C)(C)O 33320c4c1a2e908190d310fec0b9fe8c [0,2,0,0,0,0|1,0,0]=3 4237 B13R0.431 COC(=O)/C=C/COCCC(C)(C)S b8fe0215e571d9db672cb9bdcd762e32 [0,2,0,0,0,0|1,0,0]=3 4238 B13R0.431 COC(=O)/C=C/COCCC(C)(F)F 0447f27d98ee84d89af0a25f6b20f603 [0,2,0,0,0,0|1,0,0]=3 4239 B13R0.431 COC(=O)/C=C/COCCC(F)(F)F 1685da38b091a464f165263380ec4b62 [0,2,0,0,0,0|2,0,0]=4 4240 B13R0.431 COC(=O)/C=C/COCCS(=N)(=O)C 937c7275fa7a47fac4fa58cf480bf99c [0,2,0,0,0,0|2,0,0]=4 4241 B13R0.431 COC(=O)/C=C/COCCS(=O)(=O)C 4e11e01791cb1714983169a14ca19187 [0,2,0,0,0,0|2,0,0]=4 4242 B13R0.431 COC(=O)/C=C\CNCCC(C)(C)C 58e5ff5f04cdd07ac74be92f2d70789c [0,2,0,0,0,0|1,0,0]=3 4243 B13R0.431 COC(=O)/C=C\CNCCC(C)(C)F e058a78ea5cad13f7609edff5416e3cd [0,2,0,0,0,0|1,0,0]=3 4244 B13R0.431 COC(=O)/C=C\CNCCC(C)(C)O cf214da5e860dd3e39033dac6bf625d4 [0,2,0,0,0,0|1,0,0]=3 4245 B13R0.431 COC(=O)/C=C\CNCCC(F)(F)F 62121f0288960cd61f477ba33146cf83 [0,2,0,0,0,0|2,0,0]=4 4246 B13R0.431 COC(=O)/C=C\CNCCS(=O)(=O)C bd32fd4f0ad5aadd945cfee04a891fad [0,2,0,0,0,0|2,0,0]=4 4247 B13R0.431 COC(=O)/C=C\COCCC(C)(C)C 05d69310e97723a2defb45d268085f1d [0,2,0,0,0,0|1,0,0]=3 4248 B13R0.431 COC(=O)/C=C\COCCC(C)(C)S 8ae79b88979d177a67e369ad126ff64d [0,2,0,0,0,0|1,0,0]=3 4249 B13R0.431 COC(=O)/C=C\COCCC(C)(F)F f313a2ad068de50820c97461b90fdfe3 [0,2,0,0,0,0|1,0,0]=3 4250 B13R0.431 COC(=O)/C=C\COCCC(F)(F)F 4e49dad5024150f3ac67eedf8d58dbd7 [0,2,0,0,0,0|2,0,0]=4 4251 B13R0.431 COC(=O)/C=C\COCCS(=N)(=O)C 635f60c142d64c00b5626e6bde1e6ec7 [0,2,0,0,0,0|2,0,0]=4 4252 B13R0.431 COC(=O)/C=C\COCCS(=O)(=O)C 94e4340a628941bbbbe7f4c93c9f87c3 [0,2,0,0,0,0|2,0,0]=4 4253 B13R0.431 COC(=O)C=CCNCCC(C)(C)C 64e5f6ef3825fa600400ca8f28b6ad41 [0,2,0,0,0,0|1,0,0]=3 4254 B13R0.431 COC(=O)C=CCNCCC(C)(C)F aef214edf2892ef90033630ed8b76ddf [0,2,0,0,0,0|1,0,0]=3 4255 B13R0.431 COC(=O)C=CCNCCC(C)(C)O 0c330fd1d9cbefb001516d07763ccd40 [0,2,0,0,0,0|1,0,0]=3 4256 B13R0.431 COC(=O)C=CCNCCC(F)(F)F f39223e53d7c9cf21be526fec6621aae [0,2,0,0,0,0|2,0,0]=4 4257 B13R0.431 COC(=O)C=CCNCCS(=O)(=O)C 56cbdcb94081fda98b853e91ab3abc5b [0,2,0,0,0,0|2,0,0]=4 4258 B13R0.431 COC(=O)C=CCOCCC(C)(C)C 413673186b6f6f6c3a53bec19a242251 [0,2,0,0,0,0|1,0,0]=3 4259 B13R0.431 COC(=O)C=CCOCCC(C)(C)S 6fc72ef8b6fe04fb44fd7aeb6bb355ab [0,2,0,0,0,0|1,0,0]=3 4260 B13R0.431 COC(=O)C=CCOCCC(C)(F)F f0f2a28cff51142a9504a4aebc7d97f2 [0,2,0,0,0,0|1,0,0]=3 4261 B13R0.431 COC(=O)C=CCOCCC(F)(F)F ad7c9633b453ad5bbf36f06e80159f27 [0,2,0,0,0,0|2,0,0]=4 4262 B13R0.431 COC(=O)C=CCOCCS(=N)(=O)C 8697993d6a7ed1c96689ded52ab0bee0 [0,2,0,0,0,0|2,0,0]=4 4263 B13R0.431 COC(=O)C=CCOCCS(=O)(=O)C 7903ffe1d162ff309b24ac138441e743 [0,2,0,0,0,0|2,0,0]=4 4264 B13R0.431 COC(=O)COCCCCC(C)(C)C 162d1b670ed14ca9aa4c87a37c4b91ff [0,2,0,0,0,0|1,0,1]=4 4265 B13R0.113 C=CCCC(C)OC/C=C/C(=O)OC a996a7f31c55beddc4737b80f7a8c20c [0,2,0,0,0,0|0,0,2]=4 4266 B13R0.113 C=CCCC(C)OC/C=C\C(=O)OC 23ab0676c262127c3a09860678c4d228 [0,2,0,0,0,0|0,0,2]=4 4267 B13R0.113 C=CCCC(C)OCC=CC(=O)OC cd6d1c4161353e0138842eabba2d7530 [0,2,0,0,0,0|0,0,2]=4 4268 B13R0.113 C=CCC[C@@H](C)OC/C=C/C(=O)OC 0a1a349b186f04149b61a2e068645ee3 [0,2,0,0,0,0|0,0,2]=4 4269 B13R0.113 C=CCC[C@@H](C)OC/C=C\C(=O)OC c0e8d93069d58f5132ca49ac99e17a34 [0,2,0,0,0,0|0,0,2]=4 4270 B13R0.113 C=CCC[C@@H](C)OCC=CC(=O)OC 4cd4d5f9eddc9cb1b53c852234af8a12 [0,2,0,0,0,0|0,0,2]=4 4271 B13R0.113 CCC#CC(C)OC/C=C/C(=O)OC e915944b175d36cee63feeedf02207b3 [0,2,0,0,0,0|0,0,2]=4 4272 B13R0.113 CCC#CC(C)OC/C=C\C(=O)OC ef09ddfc3285f85b8a174ebee7a4e4de [0,2,0,0,0,0|0,0,2]=4 4273 B13R0.113 CCC#CC(C)OCC=CC(=O)OC c19ab5150bae94cf4320d66b913d3ef4 [0,2,0,0,0,0|0,0,2]=4 4274 B13R0.113 CCCCC(C)CCOCC(=O)OC bfc9db06c5ac4a9cb2040740c7705f78 [0,2,0,0,0,0|0,0,2]=4 4275 B13R0.113 CCCCC(C)COCCC(=O)OC bac3ddd77e3c0bd33e5812b27af0fb9f [0,2,0,0,0,0|0,0,2]=4 4276 B13R0.113 CCCCC(C)COCOC(=O)OC 6ee56e5ce1e0a1035d35f4590f4c14fd [0,2,0,0,0,0|1,0,1]=4 4277 B13R0.113 CCCCC(C)NC/C=C/C(=O)OC 61103b15cbb51c9da689fdf576e8ccaa [0,2,0,0,0,0|0,0,0]=2 4278 B13R0.113 CCCCC(C)NC/C=C\C(=O)OC a840be490f68a4437850b1efb56fe87f [0,2,0,0,0,0|0,0,0]=2 4279 B13R0.113 CCCCC(C)NCC#CC(=O)OC a1ba5261c6eac47be4736804cc9b45fc [0,2,0,0,0,0|0,0,2]=4 4280 B13R0.113 CCCCC(C)NCC=CC(=O)OC 3901389cc5813df1d6e7d5eafa768af2 [0,2,0,0,0,0|0,0,0]=2 4281 B13R0.113 CCCCC(C)NCCCC(=O)OC 9dff844de753c1b9ab7d9c9edfdf7567 [0,2,0,0,0,0|0,0,2]=4 4282 B13R0.113 CCCCC(C)OC/C=C/C(=O)OC b18279a840042a60b516f18a554d6703 [0,2,0,0,0,0|0,0,0]=2 4283 B13R0.113 CCCCC(C)OC/C=C\C(=O)OC 3a0ab83f580b8dd588653c0ade7a960f [0,2,0,0,0,0|0,0,0]=2 4284 B13R0.113 CCCCC(C)OCC#CC(=O)OC c3e181ea65e62fac6299b83541e817d9 [0,2,0,0,0,0|0,0,2]=4 4285 B13R0.113 CCCCC(C)OCC=CC(=O)OC 8e0e8fd4d130d4dc25960873baaa84e3 [0,2,0,0,0,0|0,0,0]=2 4286 B13R0.113 CCCCC(C)OCCCC(=O)OC b3b8c66de23c601d0807fddbebef7c6b [0,2,0,0,0,0|0,0,2]=4 4287 B13R0.113 CCCCC(C)OCCOC(=O)OC 03a3aa1fb9e9b9ccd4d01b0639846555 [0,2,0,0,0,0|1,0,1]=4 4288 B13R0.113 CCCCC(O)CNCCC(=O)OC c08f368333e9a42ba6c5570596ed3740 [0,2,0,0,0,0|0,0,2]=4 4289 B13R0.113 CCCCC(O)CNCOC(=O)OC cde28ad634289e1003ade3ebbd8d0882 [0,2,0,0,0,0|1,0,1]=4 4290 B13R0.113 CCCCN(C)CCCCC(=O)OC 5e458d4f2ed0f85d9b873a938ae9aa48 [0,2,0,0,0,0|0,0,2]=4 4291 B13R0.113 CCCCN(C)CCNCC(=O)OC 4caccedd4a613e4f2b1da8af04d0d022 [0,2,0,0,0,0|1,0,1]=4 4292 B13R0.113 CCCCN(C)CCOCC(=O)OC f2f763194d1251f69625ceab34ebbd28 [0,2,0,0,0,0|1,0,1]=4 4293 B13R0.113 CCCC[C@@H](C)NC/C=C/C(=O)OC 259e2e628daa5597c06bd1879f900300 [0,2,0,0,0,0|0,0,0]=2 4294 B13R0.113 CCCC[C@@H](C)NC/C=C\C(=O)OC e8604b078b3d9eb268858063267e469b [0,2,0,0,0,0|0,0,0]=2 4295 B13R0.113 CCCC[C@@H](C)NCC#CC(=O)OC 1334e639ddd20c383b741ee55b5e596b [0,2,0,0,0,0|0,0,2]=4 4296 B13R0.113 CCCC[C@@H](C)NCC=CC(=O)OC 030c2e26699f6d46c95e64e687b50df7 [0,2,0,0,0,0|0,0,0]=2 4297 B13R0.113 CCCC[C@@H](C)NCCCC(=O)OC 8440aecd67c5d91bd71807c9bcd4bcea [0,2,0,0,0,0|0,0,2]=4 4298 B13R0.113 CCCC[C@@H](C)OC/C=C/C(=O)OC 7bcc38824d025ee8c2785221f5e95836 [0,2,0,0,0,0|0,0,0]=2 4299 B13R0.113 CCCC[C@@H](C)OC/C=C\C(=O)OC d3f68e13aea3f966080968ab93f8a078 [0,2,0,0,0,0|0,0,0]=2 4300 B13R0.113 CCCC[C@@H](C)OCC#CC(=O)OC 737ca2dd40f21b15e0e7a4016a2e0a02 [0,2,0,0,0,0|0,0,2]=4 4301 B13R0.113 CCCC[C@@H](C)OCC=CC(=O)OC 983a3cb8f4b455644dd7740c0e1ae7be [0,2,0,0,0,0|0,0,0]=2 4302 B13R0.113 CCCC[C@@H](C)OCCCC(=O)OC 778779af1efb907e4997574b8153b404 [0,2,0,0,0,0|0,0,2]=4 4303 B13R0.113 CCCC[C@H](C)OC/C=C/C(=O)OC 3387772bdd437bf4d1203dc409e14ec9 [0,2,0,0,0,0|0,0,0]=2 4304 B13R0.113 CCCC[C@H](C)OC/C=C\C(=O)OC 7678a19f0de020f9d7be194122436aef [0,2,0,0,0,0|0,0,0]=2 4305 B13R0.113 CCCC[C@H](C)OCC#CC(=O)OC 2d27afd3bec2ea67486b519329e2d444 [0,2,0,0,0,0|0,0,2]=4 4306 B13R0.113 CCCC[C@H](C)OCC=CC(=O)OC 89248929589fe0a0f78d8fc8eedbfa25 [0,2,0,0,0,0|0,0,0]=2 4307 B13R0.113 CCCC[C@H](C)OCCCC(=O)OC 9f92a503694a9c7d15b82ce6c2798d57 [0,2,0,0,0,0|0,0,2]=4 4308 B13R0.113 CCOCC(C)OC/C=C/C(=O)OC e7a4612f25e812a3ee28e0bca0ea6876 [0,2,0,0,0,0|1,0,0]=3 4309 B13R0.113 CCOCC(C)OC/C=C\C(=O)OC 04a89bbe9711c26b8e82a334a0f549d6 [0,2,0,0,0,0|1,0,0]=3 4310 B13R0.113 CCOCC(C)OCC=CC(=O)OC d1cbc120359038ee480f69d7e400b965 [0,2,0,0,0,0|1,0,0]=3 4311 B13R0.113 COC(=O)/C=C/CNC(C)CCCO 899a5097d2e13baca936f0ac91f0235d [0,2,0,0,0,0|1,0,0]=3 4312 B13R0.113 COC(=O)/C=C/CN[C@H](C)CCCO b2979d1f0dad12ac8d37b9855b505206 [0,2,0,0,0,0|1,0,0]=3 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43c3f27a87232c386a716e5017c5737a [0,2,0,0,0,0|1,0,0]=3 4324 B13R0.147 C#CCCCCCCNCC(=O)OC 7c5b6f84fd323de12188248a10f1f965 [0,2,0,0,0,0|1,0,1]=4 4325 B13R0.147 C#CCCCCCCOCC(=O)OC 123852f7b7f20f28aae245564def7aa2 [0,2,0,0,0,0|1,0,1]=4 4326 B13R0.147 C#CCCCCNC/C=C/C(=O)OC 2074bdc1163de703ef07dcdf9051125e [0,2,0,0,0,0|0,0,1]=3 4327 B13R0.147 C#CCCCCNC/C=C\C(=O)OC 6918854f928fed124d139264b2aaba8e [0,2,0,0,0,0|0,0,1]=3 4328 B13R0.147 C#CCCCCNCC=CC(=O)OC 4a3a77de0d8107e2b63297b228609702 [0,2,0,0,0,0|0,0,1]=3 4329 B13R0.147 C#CCCCCOC/C=C/C(=O)OC cd7d614936b76509aef17fc20ca95c07 [0,2,0,0,0,0|0,0,1]=3 4330 B13R0.147 C#CCCCCOC/C=C\C(=O)OC 7b9adafa4e34d0f4a2b081e47b8bc9f5 [0,2,0,0,0,0|0,0,1]=3 4331 B13R0.147 C#CCCCCOCC=CC(=O)OC fd2086cc78ca94f5c1a3ffb3191996e3 [0,2,0,0,0,0|0,0,1]=3 4332 B13R0.147 C#CCOCCNC/C=C/C(=O)OC 6f33214865f24434a7791c1c01fcfa88 [0,2,0,0,0,0|0,0,2]=4 4333 B13R0.147 C#CCOCCNC/C=C\C(=O)OC 82439de599881791dcd2034a127153a4 [0,2,0,0,0,0|0,0,2]=4 4334 B13R0.147 C#CCOCCNCC=CC(=O)OC a546d6c45a22cc5c71d798841508d029 [0,2,0,0,0,0|0,0,2]=4 4335 B13R0.147 C#CCOCCOC/C=C/C(=O)OC 454e0d265569457f8bb1c5cc7c3acff2 [0,2,0,0,0,0|0,0,2]=4 4336 B13R0.147 C#CCOCCOC/C=C\C(=O)OC 444fb504af5cfa53225e50dd41bd52b4 [0,2,0,0,0,0|0,0,2]=4 4337 B13R0.147 C#CCOCCOCC=CC(=O)OC 21e202fb0fcd0e6e59045261bf9297a2 [0,2,0,0,0,0|0,0,2]=4 4338 B13R0.147 C/C=C/CCCOC/C=C/C(=O)OC 509af3d2cbbad8c6a8aee7775e5e6961 [0,2,0,0,0,0|0,0,1]=3 4339 B13R0.147 C/C=C/CCCOC/C=C\C(=O)OC 29671b56b5e2b71d97693cbb3a5b5083 [0,2,0,0,0,0|0,0,1]=3 4340 B13R0.147 C/C=C/CCCOCC=CC(=O)OC 27b6e2607ed9f18f99c37cd69dea3abb [0,2,0,0,0,0|0,0,1]=3 4341 B13R0.147 C/C=C\CCCOC/C=C/C(=O)OC d3aa37f9f92f5e5cc01fb541fd7b1821 [0,2,0,0,0,0|0,0,1]=3 4342 B13R0.147 C/C=C\CCCOC/C=C\C(=O)OC a26636045148c8787aaaecdfe35c6fe4 [0,2,0,0,0,0|0,0,1]=3 4343 B13R0.147 C/C=C\CCCOCC=CC(=O)OC 398c6da5802e6ecdcd631d9c29ed4f63 [0,2,0,0,0,0|0,0,1]=3 4344 B13R0.147 C=CCCCCCCNCC(=O)OC bc6993a9f15cb7a8a251cead61d029cd [0,2,0,0,0,0|1,0,1]=4 4345 B13R0.147 C=CCCCCCCOCC(=O)OC 6f489cdfc096a6a016b833330a6dac3c [0,2,0,0,0,0|1,0,1]=4 4346 B13R0.147 C=CCCCCNC/C=C/C(=O)OC d5222feb294df574d921896adb6705d7 [0,2,0,0,0,0|0,0,1]=3 4347 B13R0.147 C=CCCCCNC/C=C\C(=O)OC 870a721fd4306eafdc6ce8938e3297aa [0,2,0,0,0,0|0,0,1]=3 4348 B13R0.147 C=CCCCCNCC=CC(=O)OC 69f5f2f19f9d9e51c5fa1f49a6cc3eef [0,2,0,0,0,0|0,0,1]=3 4349 B13R0.147 C=CCCCCOC/C=C/C(=O)OC 2ff01a997a2f2cdee8dc5e3420a02e85 [0,2,0,0,0,0|0,0,1]=3 4350 B13R0.147 C=CCCCCOC/C=C\C(=O)OC 7b8bb11a77d935a0aaf880673971a304 [0,2,0,0,0,0|0,0,1]=3 4351 B13R0.147 C=CCCCCOCC=CC(=O)OC 086c544989ef611e34bac40ce36bc4bd [0,2,0,0,0,0|0,0,1]=3 4352 B13R0.147 C=CCOCCOC/C=C/C(=O)OC 715f778b0940e28db8dd93dff5184751 [0,2,0,0,0,0|0,0,2]=4 4353 B13R0.147 C=CCOCCOC/C=C\C(=O)OC 94b8d6dd3a2e05f8d1612692acdc7717 [0,2,0,0,0,0|0,0,2]=4 4354 B13R0.147 C=CCOCCOCC=CC(=O)OC 57a68a7b9147d480a7324b0a3bc85fb9 [0,2,0,0,0,0|0,0,2]=4 4355 B13R0.147 C=COCCCNC/C=C/C(=O)OC 6eda011513859e694d9ed0f601dd6e30 [0,2,0,0,0,0|0,0,2]=4 4356 B13R0.147 C=COCCCNC/C=C\C(=O)OC d9f5519aef9666516a9a82f7744a85f8 [0,2,0,0,0,0|0,0,2]=4 4357 B13R0.147 C=COCCCNCC=CC(=O)OC edcfc94953028e1b99fefa19b242eedf [0,2,0,0,0,0|0,0,2]=4 4358 B13R0.147 CC#CCCCOC/C=C/C(=O)OC ade7643eda80de7bbac4c3b4b2f4b5a3 [0,2,0,0,0,0|0,0,1]=3 4359 B13R0.147 CC#CCCCOC/C=C\C(=O)OC ede277a14c8133d8d9074156516e580e [0,2,0,0,0,0|0,0,1]=3 4360 B13R0.147 CC#CCCCOCC=CC(=O)OC bbae424fb144f083099f228989b5bea5 [0,2,0,0,0,0|0,0,1]=3 4361 B13R0.147 CC/C=C/CCOC/C=C/C(=O)OC dcceb579e3e49e378aa0be5f9ebaf340 [0,2,0,0,0,0|0,0,1]=3 4362 B13R0.147 CC/C=C/CCOC/C=C\C(=O)OC 1c8ab54942fa29825647310066fa2852 [0,2,0,0,0,0|0,0,1]=3 4363 B13R0.147 CC/C=C/CCOCC=CC(=O)OC 2437ff4331ae69f8ff0d6e75ce657b83 [0,2,0,0,0,0|0,0,1]=3 4364 B13R0.147 CC/C=C\CCCCOCC(=O)OC 1048987753bc07b39e8f47d9c29d81d3 [0,2,0,0,0,0|1,0,1]=4 4365 B13R0.147 CC/C=C\CCOC/C=C/C(=O)OC 6e68eb739f779ab521a8a9c55a3a9fee [0,2,0,0,0,0|0,0,1]=3 4366 B13R0.147 CC/C=C\CCOC/C=C\C(=O)OC 40821a90227497811e8f8354120a9db6 [0,2,0,0,0,0|0,0,1]=3 4367 B13R0.147 CC/C=C\CCOCC=CC(=O)OC a6c61f9e8aa2e17e888f3ec9f343d66c [0,2,0,0,0,0|0,0,1]=3 4368 B13R0.147 CC=C=CCCOC/C=C/C(=O)OC 30a9d0089a901bb3a2af6ebfed8a80aa [0,2,0,0,0,0|0,0,2]=4 4369 B13R0.147 CC=C=CCCOC/C=C\C(=O)OC 6e04dddc0a7de3f16630a9be48ac84f8 [0,2,0,0,0,0|0,0,2]=4 4370 B13R0.147 CC=C=CCCOCC=CC(=O)OC d04f4341809bc566df3d7c2288bb6569 [0,2,0,0,0,0|0,0,2]=4 4371 B13R0.147 CC=CCCCOC/C=C/C(=O)OC 8ffa3566d09556a115877253e68b8037 [0,2,0,0,0,0|0,0,1]=3 4372 B13R0.147 CC=CCCCOC/C=C\C(=O)OC c072b1fe26becd4589bd48d525df15d4 [0,2,0,0,0,0|0,0,1]=3 4373 B13R0.147 CC=CCCCOCC=CC(=O)OC b4105d3a76a5de7037a8e3dff9850f09 [0,2,0,0,0,0|0,0,1]=3 4374 B13R0.147 CCC#CCCOC/C=C/C(=O)OC ef838c23419d337bcdbfd0717c7ba212 [0,2,0,0,0,0|0,0,1]=3 4375 B13R0.147 CCC#CCCOC/C=C\C(=O)OC d6b0eb4ecf3a5947cceed0aeab7088b5 [0,2,0,0,0,0|0,0,1]=3 4376 B13R0.147 CCC#CCCOCC=CC(=O)OC cfba6145885a826bf19a6d2b46d9c790 [0,2,0,0,0,0|0,0,1]=3 4377 B13R0.147 CCC/C=C/CCCOCC(=O)OC 94c145a76b69f639541f9691c61bc10b [0,2,0,0,0,0|1,0,1]=4 4378 B13R0.147 CCC/C=C/COC/C=C/C(=O)OC a00882f3c66274d7b0b23293261cc011 [0,2,0,0,0,0|0,0,1]=3 4379 B13R0.147 CCC/C=C/COC/C=C\C(=O)OC 401fd98f18035ac6b81e65c2ee9f67e0 [0,2,0,0,0,0|0,0,1]=3 4380 B13R0.147 CCC/C=C/COCC=CC(=O)OC 417c74d529b46f24f187ddd14345aea6 [0,2,0,0,0,0|0,0,1]=3 4381 B13R0.147 CCC/C=C\CCCOCC(=O)OC 97a2859f02e6d4bc437cc3398bfeb3d8 [0,2,0,0,0,0|1,0,1]=4 4382 B13R0.147 CCC/C=C\COC/C=C/C(=O)OC c3d04b74f4689a7c8f12545b2a088dbb [0,2,0,0,0,0|0,0,1]=3 4383 B13R0.147 CCC/C=C\COC/C=C\C(=O)OC 863e08223a23d00c1b281321beef6fa5 [0,2,0,0,0,0|0,0,1]=3 4384 B13R0.147 CCC/C=C\COCC=CC(=O)OC 67b0f00ba99e220ba9b7ac514a5138cb [0,2,0,0,0,0|0,0,1]=3 4385 B13R0.147 CCCC#CCOC/C=C/C(=O)OC 5b2da8cf9c3befbd40d8b5777ac3d727 [0,2,0,0,0,0|0,0,1]=3 4386 B13R0.147 CCCC#CCOC/C=C\C(=O)OC c7d19e811ffb9a3a5ca3ab3f5779fada [0,2,0,0,0,0|0,0,1]=3 4387 B13R0.147 CCCC#CCOCC=CC(=O)OC 429b4441b2fe03280ca55af0060e2b45 [0,2,0,0,0,0|0,0,1]=3 4388 B13R0.147 CCCC/C=C\CCOCC(=O)OC 647f3fb6b9fb857c1ee949f0aaee7a7b [0,2,0,0,0,0|1,0,1]=4 4389 B13R0.147 CCCCC#CCCOCC(=O)OC b05bf0972f110d2b67651f58d582b7a6 [0,2,0,0,0,0|1,0,1]=4 4390 B13R0.147 CCCCC/C=C/COCC(=O)OC 768a84171437a38e10ec8b7710c94731 [0,2,0,0,0,0|0,0,2]=4 4391 B13R0.147 CCCCCC#CCOCC(=O)OC 0f815a0634cf1143ff8296ea96b45088 [0,2,0,0,0,0|1,0,1]=4 4392 B13R0.147 CCCCCCCCNCC(=O)OC 2ae9ea9c59c8976c9984601465b5b02d [0,2,0,0,0,0|0,0,2]=4 4393 B13R0.147 CCCCCCCCOCC(=O)OC 28a5946e499ca9a413bae6ef00eed1eb [0,2,0,0,0,0|0,0,2]=4 4394 B13R0.147 CCCCCCCNCCC(=O)OC 7d2596dcada6929b32da4dc69c088282 [0,2,0,0,0,0|0,0,2]=4 4395 B13R0.147 CCCCCCCNCOC(=O)OC ef744a9924168dd75498307a54023295 [0,2,0,0,0,0|0,0,2]=4 4396 B13R0.147 CCCCCCCOCCC(=O)OC 71cd9b89c3422aa8005afc8ac30b8e5e [0,2,0,0,0,0|0,0,2]=4 4397 B13R0.147 CCCCCCCOCOC(=O)OC 8f744e5c0921058dd60487b0b34e1586 [0,2,0,0,0,0|0,0,2]=4 4398 B13R0.147 CCCCCCNC/C=C/C(=O)OC da65ca5fca4de657aadbe3d855541080 [0,2,0,0,0,0|0,0,0]=2 4399 B13R0.147 CCCCCCNC/C=C\C(=O)OC 417afe7fbdae5499ca563b2962e78af7 [0,2,0,0,0,0|0,0,0]=2 4400 B13R0.147 CCCCCCNCC#CC(=O)OC d836ee9d0380a1a145644f2da52fdd9b [0,2,0,0,0,0|0,0,2]=4 4401 B13R0.147 CCCCCCNCC=CC(=O)OC 86a086a24c5c088422f5a0ecb3e0f6c7 [0,2,0,0,0,0|0,0,0]=2 4402 B13R0.147 CCCCCCNCCCC(=O)OC 78467be93127cc6a8620ff69cb262067 [0,2,0,0,0,0|0,0,2]=4 4403 B13R0.147 CCCCCCOC/C=C/C(=O)OC 0b65a61de6b5df8ca86801402fff08df [0,2,0,0,0,0|0,0,0]=2 4404 B13R0.147 CCCCCCOC/C=C\C(=O)OC ff086bc80eb704cc5bf67d9b169606cc [0,2,0,0,0,0|0,0,0]=2 4405 B13R0.147 CCCCCCOCC#CC(=O)OC 5bf4c78e62aad92beffcac182c03b2c4 [0,2,0,0,0,0|0,0,2]=4 4406 B13R0.147 CCCCCCOCC=CC(=O)OC 187d143181422d47aa30aa1184b9a897 [0,2,0,0,0,0|0,0,0]=2 4407 B13R0.147 CCCCCCOCCCC(=O)OC 83b21499363d4744613a93318c3a0fe3 [0,2,0,0,0,0|0,0,2]=4 4408 B13R0.147 CCCCCCOCCOC(=O)OC ca0c8312f5970ba6379358a47a0bf4a7 [0,2,0,0,0,0|0,0,2]=4 4409 B13R0.147 CCCCCNCCCCC(=O)OC 46a7e105511c0c93f9cb151aa4f15e47 [0,2,0,0,0,0|0,0,2]=4 4410 B13R0.147 CCCCCNCCOCC(=O)OC a99720efb337f3a99f05f18b9d1adf0a [0,2,0,0,0,0|0,0,2]=4 4411 B13R0.147 CCCCCOCCCCC(=O)OC 980807aea6e63d008afe797fc55d3688 [0,2,0,0,0,0|0,0,2]=4 4412 B13R0.147 CCCCCOCCOCC(=O)OC 0878aa26c2805e739923d92740a69332 [0,2,0,0,0,0|0,0,2]=4 4413 B13R0.147 CCCCNC/C=C/C=C/C(=O)OC be3210a4408168cbafcb5f1e0d92a791 [0,2,0,0,0,0|0,0,1]=3 4414 B13R0.147 CCCCNCC=CC=CC(=O)OC 19f126566b4c4002914eb3ce3ebfd2a6 [0,2,0,0,0,0|0,0,1]=3 4415 B13R0.147 CCCCNCCCCCC(=O)OC a815ffae1e1916161e83c058cacea182 [0,2,0,0,0,0|0,0,2]=4 4416 B13R0.147 CCCCNCCCOCC(=O)OC 8807eb8490eaeee4675d5567d5ec35f1 [0,2,0,0,0,0|0,0,2]=4 4417 B13R0.147 CCCCNCCCSCC(=O)OC 3922c1148c4b9eedb1071ee5fd759fb5 [0,2,0,0,0,0|0,0,2]=4 4418 B13R0.147 CCCCOC/C=C/C=C/C(=O)OC 2b21f11bf5e7495998f7fd63f03a3aa8 [0,2,0,0,0,0|0,0,1]=3 4419 B13R0.147 CCCCOCC=CC=CC(=O)OC ad3a2710956ab5578d1723f1c43d8f9e [0,2,0,0,0,0|0,0,1]=3 4420 B13R0.147 CCCCOCCCCCC(=O)OC 970a443bfeac90c9af69acf488d88f4a [0,2,0,0,0,0|0,0,2]=4 4421 B13R0.147 CCCCOCCCNCC(=O)OC 024098cb3d06922ee02681a4f6ab3892 [0,2,0,0,0,0|0,0,2]=4 4422 B13R0.147 CCCCOCCCOCC(=O)OC a6e60ce4775ff488082b3fb910f71a7c [0,2,0,0,0,0|0,0,2]=4 4423 B13R0.147 CCCCOCCCSCC(=O)OC d8e748891611d5e8033485af8eb5aa49 [0,2,0,0,0,0|0,0,2]=4 4424 B13R0.147 CCCCOCCNCCC(=O)OC 3e70946ee01dab70d6f363ff1acb7a5d [0,2,0,0,0,0|0,0,2]=4 4425 B13R0.147 CCCCOCCNCOC(=O)OC 8ac29e1c190bca969236a0c4634acd5e [0,2,0,0,0,0|1,0,1]=4 4426 B13R0.147 CCCCOCCOCCC(=O)OC 1d4e0c844077f26b296288803bc12926 [0,2,0,0,0,0|0,0,2]=4 4427 B13R0.147 CCCCOCCOCOC(=O)OC 7c10dc80a579663c95da5db2d0db7da1 [0,2,0,0,0,0|1,0,1]=4 4428 B13R0.147 CCCCOCNCCCC(=O)OC 2157e5d379a01a8fc2aa0fe3ae11ff9a [0,2,0,0,0,0|0,0,2]=4 4429 B13R0.147 CCCCOCOC/C=C/C(=O)OC 97f95a7947f81abab4cd917157beeb7d [0,2,0,0,0,0|0,0,0]=2 4430 B13R0.147 CCCCOCOCC#CC(=O)OC ccf528e0b6eee1ac6ccf12dffdc85bd3 [0,2,0,0,0,0|0,0,2]=4 4431 B13R0.147 CCCCOCOCCOC(=O)OC 5215a4a99a143422ad4922f94038223a [0,2,0,0,0,0|1,0,1]=4 4432 B13R0.147 CCCCSCCOCCC(=O)OC b37e61833de65a56088831f6085d00d9 [0,2,0,0,0,0|0,0,2]=4 4433 B13R0.147 CCCCSCCOCOC(=O)OC 6fd6df1791e577b60298985f75c35302 [0,2,0,0,0,0|1,0,1]=4 4434 B13R0.147 CCCNCCCCCCC(=O)OC 62f8a1b7de961688139cc6bfc52af8c3 [0,2,0,0,0,0|0,0,2]=4 4435 B13R0.147 CCCOCCCCCCC(=O)OC f22704949f18012fcce5f0588f5c567c [0,2,0,0,0,0|0,0,2]=4 4436 B13R0.147 CCCOCCCNCCC(=O)OC 44292ab72f0f0ab9ac8dd53f3ce4f620 [0,2,0,0,0,0|0,0,2]=4 4437 B13R0.147 CCCOCCCNCOC(=O)OC 4b55313fde6f4fa9b00f47ec979514cb [0,2,0,0,0,0|1,0,1]=4 4438 B13R0.147 CCCOCCCOCCC(=O)OC 113264964a3acc4a6b06d77361e4af5a [0,2,0,0,0,0|0,0,2]=4 4439 B13R0.147 CCCOCCNC/C=C/C(=O)OC 14cfc87e69b229b39ecfcb08598679ae [0,2,0,0,0,0|0,0,0]=2 4440 B13R0.147 CCCOCCNC/C=C\C(=O)OC 77120db74c41db42b92e96e715af7e01 [0,2,0,0,0,0|0,0,0]=2 4441 B13R0.147 CCCOCCNCC#CC(=O)OC ef14759a5fb0702b807df7c7360c3ee5 [0,2,0,0,0,0|0,0,2]=4 4442 B13R0.147 CCCOCCNCC=CC(=O)OC 189dfc24281c875ae3a9b4dc36ae7db7 [0,2,0,0,0,0|0,0,0]=2 4443 B13R0.147 CCCOCCNCCCC(=O)OC f87e411d154823d260bce14713fe773f [0,2,0,0,0,0|0,0,2]=4 4444 B13R0.147 CCCOCCOC/C=C/C(=O)OC 4268c63cf9f00056858bfc538c49cfea [0,2,0,0,0,0|0,0,0]=2 4445 B13R0.147 CCCOCCOC/C=C\C(=O)OC 39671ce28538bb35e05034417a33e75b [0,2,0,0,0,0|0,0,0]=2 4446 B13R0.147 CCCOCCOCC#CC(=O)OC b7b6b687623939e1f8d7a199df0f4e06 [0,2,0,0,0,0|0,0,2]=4 4447 B13R0.147 CCCOCCOCC=CC(=O)OC 4b498c7837249279bef1b340b21fb923 [0,2,0,0,0,0|0,0,0]=2 4448 B13R0.147 CCCOCCOCCCC(=O)OC 84aa2ca0afab435a31a348ef148418be [0,2,0,0,0,0|0,0,2]=4 4449 B13R0.147 CCCOCCOCCOC(=O)OC c07717e100b5f378e7e5b75210c35d37 [0,2,0,0,0,0|1,0,1]=4 4450 B13R0.147 CCCSCCCCNCC(=O)OC 06322cc889b5d231cf670e3b262ed658 [0,2,0,0,0,0|0,0,2]=4 4451 B13R0.147 CCCSCCOC/C=C/C(=O)OC 453020b1861c989f96788d18615d7dec [0,2,0,0,0,0|0,0,0]=2 4452 B13R0.147 CCCSCCOC/C=C\C(=O)OC 0115d1964607b4081fb108953992f4e9 [0,2,0,0,0,0|0,0,0]=2 4453 B13R0.147 CCCSCCOCC#CC(=O)OC 1da229198489fe709a3fa5f01b25735a [0,2,0,0,0,0|0,0,2]=4 4454 B13R0.147 CCCSCCOCC=CC(=O)OC 1411f9ab8cfa0ccae7c73dd6b3b7ab2d [0,2,0,0,0,0|0,0,0]=2 4455 B13R0.147 CCCSCCOCCCC(=O)OC 4cf3a02cfa7c32a6367dcbd98a87b1b1 [0,2,0,0,0,0|0,0,2]=4 4456 B13R0.147 CCNCCCCCCCC(=O)OC 7489671079ef4bbb11b756d13d5984fb [0,2,0,0,0,0|0,0,2]=4 4457 B13R0.147 CCNCCOCCOCC(=O)OC cb0d5789ceed3fded9cffae307f58277 [0,2,0,0,0,0|1,0,1]=4 4458 B13R0.147 CCOCCCCCCCC(=O)OC f0bf047e1cf69e0c5d7b51c202029115 [0,2,0,0,0,0|0,0,2]=4 4459 B13R0.147 CCOCCCNC/C=C/C(=O)OC 2a63316e0b221c9011deeff56a32731f [0,2,0,0,0,0|0,0,0]=2 4460 B13R0.147 CCOCCCNC/C=C\C(=O)OC 0361bedb6700a88470f687bcc7ee4a53 [0,2,0,0,0,0|0,0,0]=2 4461 B13R0.147 CCOCCCNCC#CC(=O)OC 32f44e798ce10c2c775eec984e503e97 [0,2,0,0,0,0|0,0,2]=4 4462 B13R0.147 CCOCCCNCC=CC(=O)OC 795cb3bb89b63788bce740e2ba6bd28b [0,2,0,0,0,0|0,0,0]=2 4463 B13R0.147 CCOCCCNCCCC(=O)OC 4b3c9307afbfbc4bd49664de3ba940a8 [0,2,0,0,0,0|0,0,2]=4 4464 B13R0.147 CCOCCCOC/C=C/C(=O)OC 5a66168a74d2aa4ec8ac912989790123 [0,2,0,0,0,0|0,0,0]=2 4465 B13R0.147 CCOCCCOC/C=C\C(=O)OC 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349013e30799659976273f1f8e820ce4 [0,2,0,0,0,0|0,0,2]=4 4477 B13R0.147 CCOCOCCCOCC(=O)OC 2989227bc5d95d869c919e89b3ca411f [0,2,0,0,0,0|1,0,1]=4 4478 B13R0.147 CCSCCCCNCCC(=O)OC 4a33f4f044bf51fc248ee6c23ed0509e [0,2,0,0,0,0|0,0,2]=4 4479 B13R0.147 CCSCCCCNCOC(=O)OC 372d0ce0a6630758224cc6ece4351202 [0,2,0,0,0,0|1,0,1]=4 4480 B13R0.147 CCSCCCNCCCC(=O)OC fe4cbcbc67ef9c351cbba6579b6b34fa [0,2,0,0,0,0|0,0,2]=4 4481 B13R0.147 CCSCCCOC/C=C/C(=O)OC 9585ce729183f014a8c5adb3c00b6777 [0,2,0,0,0,0|0,0,0]=2 4482 B13R0.147 CCSCCCOC/C=C\C(=O)OC 71d00011a5545bdf85fde8d3779c44eb [0,2,0,0,0,0|0,0,0]=2 4483 B13R0.147 CCSCCCOCC#CC(=O)OC 9c294805889beafc376a1145ae151552 [0,2,0,0,0,0|0,0,2]=4 4484 B13R0.147 CCSCCCOCC=CC(=O)OC a9af8a78fe237672026ea4176ee9eaa8 [0,2,0,0,0,0|0,0,0]=2 4485 B13R0.147 CCSCCCOCCCC(=O)OC 4dec2d7036da25097c4bf3b604afebbd [0,2,0,0,0,0|0,0,2]=4 4486 B13R0.147 CCSCCCOCCOC(=O)OC f6bbf27127c98ca3a66d6a91c7aa52c6 [0,2,0,0,0,0|1,0,1]=4 4487 B13R0.147 CCSCCNCCCCC(=O)OC 19ba0eea8562f2866468a02bbc42f471 [0,2,0,0,0,0|0,0,2]=4 4488 B13R0.147 CCSCCNCCOCC(=O)OC ab4d8f7e9ed8f93a1cd4108f8982581c [0,2,0,0,0,0|1,0,1]=4 4489 B13R0.147 CCSCCOCCCCC(=O)OC 6eec5c8866be9f6433f6c6f357b018fa [0,2,0,0,0,0|0,0,2]=4 4490 B13R0.147 CCSCCOCCOCC(=O)OC 08ee523f722ea6d497ca058fe813f443 [0,2,0,0,0,0|1,0,1]=4 4491 B13R0.147 COC(=O)/C=C/C=C/CNCCCCl 5b5071e61575052a296fdd945768b691 [0,2,0,0,0,0|0,0,2]=4 4492 B13R0.147 COC(=O)/C=C/C=C/CNCCCO d194ec792f7449f7f27d6358d63d4025 [0,2,0,0,0,0|0,0,2]=4 4493 B13R0.147 COC(=O)/C=C/C=C/CNCCSC d7cfc6250622e331c1bc22a52ce2e3fa [0,2,0,0,0,0|0,0,2]=4 4494 B13R0.147 COC(=O)/C=C/C=C/COCCCF 1a826b0655572769d10668ace0bbae59 [0,2,0,0,0,0|0,0,2]=4 4495 B13R0.147 COC(=O)/C=C/C=C/COCCCS 5ba532482254cd143b2007484190f943 [0,2,0,0,0,0|0,0,2]=4 4496 B13R0.147 COC(=O)/C=C/C=C/COCCSC 6f2cd58c026b8a225c6e300b62f94c13 [0,2,0,0,0,0|0,0,2]=4 4497 B13R0.147 COC(=O)/C=C/CNCCCCC#N 21d7724acac851d74785b352d6c4c995 [0,2,0,0,0,0|0,0,1]=3 4498 B13R0.147 COC(=O)/C=C/CNCCCCCCl 97e01282742e1d3f35c04bde5f4adb70 [0,2,0,0,0,0|0,0,0]=2 4499 B13R0.147 COC(=O)/C=C/CNCCCCCO 38ded3ec96741f4a6eb51aada62c5e84 [0,2,0,0,0,0|0,0,0]=2 4500 B13R0.147 COC(=O)/C=C/CNCCCCSC 5a5f596767e8c3cdbfd3bc501ac732f1 [0,2,0,0,0,0|0,0,0]=2 4501 B13R0.147 COC(=O)/C=C/CNCCOCCO 6586cf9b9e4fcd766118b3a9479fd506 [0,2,0,0,0,0|1,0,0]=3 4502 B13R0.147 COC(=O)/C=C/CNCCOCCS cccc144e185ba6aa5c4a350c060b6bd6 [0,2,0,0,0,0|1,0,0]=3 4503 B13R0.147 COC(=O)/C=C/CNCCSCCO a3f3b538918d1f288d0bff2054395105 [0,2,0,0,0,0|1,0,0]=3 4504 B13R0.147 COC(=O)/C=C/COCCCCC#N af7bfceaaac7bf631696ae2e2df22253 [0,2,0,0,0,0|0,0,1]=3 4505 B13R0.147 COC(=O)/C=C/COCCCCC=O 7d079dfb28548962121d21838d222a05 [0,2,0,0,0,0|0,0,1]=3 4506 B13R0.147 COC(=O)/C=C/COCCCCCF 354358d87563d514938186c425472fcc [0,2,0,0,0,0|0,0,0]=2 4507 B13R0.147 COC(=O)/C=C/COCCCCSC 50faf198a2776e89c8fb6ea3859b62e5 [0,2,0,0,0,0|0,0,0]=2 4508 B13R0.147 COC(=O)/C=C/COCCOCC#N a65e9b744e1d723972c219bb5ce25a2e [0,2,0,0,0,0|1,0,1]=4 4509 B13R0.147 COC(=O)/C=C/COCCOCC=O d33489fa006f64f4402ff0fb54a4bf69 [0,2,0,0,0,0|1,0,1]=4 4510 B13R0.147 COC(=O)/C=C/COCCOCCF 68751b85543804b345ad3daf7c7a924c [0,2,0,0,0,0|1,0,0]=3 4511 B13R0.147 COC(=O)/C=C/COCCOCCS acf5385885578616793477fc32136fcd [0,2,0,0,0,0|1,0,0]=3 4512 B13R0.147 COC(=O)/C=C\CNCCCCC#N 5a0b1ac47dd48cfdc8d1434c072dfe1f [0,2,0,0,0,0|0,0,1]=3 4513 B13R0.147 COC(=O)/C=C\CNCCCCCCl 8f059036f1548c2ab094f6b1e87186bf [0,2,0,0,0,0|0,0,0]=2 4514 B13R0.147 COC(=O)/C=C\CNCCCCCO 90a6b8b3c5f3dcbff19c749d73132ad3 [0,2,0,0,0,0|0,0,0]=2 4515 B13R0.147 COC(=O)/C=C\CNCCCCSC c15a420cdc88d6480745fe698adf3e86 [0,2,0,0,0,0|0,0,0]=2 4516 B13R0.147 COC(=O)/C=C\CNCCOCCO 8ad3a7011b2d53547d170210bfc5ee88 [0,2,0,0,0,0|1,0,0]=3 4517 B13R0.147 COC(=O)/C=C\CNCCOCCS 5c232fc84c9773c05eb7d6b11512a943 [0,2,0,0,0,0|1,0,0]=3 4518 B13R0.147 COC(=O)/C=C\CNCCSCCO 0aa5984a99b6df02a02a935100aab84a [0,2,0,0,0,0|1,0,0]=3 4519 B13R0.147 COC(=O)/C=C\COCCCCC#N 5065f94a73b520c3cede2cf6049fe405 [0,2,0,0,0,0|0,0,1]=3 4520 B13R0.147 COC(=O)/C=C\COCCCCC=O babd2591e9fd937b1cb0c69e4bb12ed7 [0,2,0,0,0,0|0,0,1]=3 4521 B13R0.147 COC(=O)/C=C\COCCCCSC 52ee1068b1d5769923b0af458cd20738 [0,2,0,0,0,0|0,0,0]=2 4522 B13R0.147 COC(=O)/C=C\COCCOCC=O 9fee4c3b7531502af39d880f8c3bc5b7 [0,2,0,0,0,0|1,0,1]=4 4523 B13R0.147 COC(=O)/C=C\COCCOCCF dbbf7af4f0b47434b1744dca9a7f2471 [0,2,0,0,0,0|1,0,0]=3 4524 B13R0.147 COC(=O)/C=C\COCCOCCS 4ea6222d286c788a873f7a7c097c6265 [0,2,0,0,0,0|1,0,0]=3 4525 B13R0.147 COC(=O)C#CCNCCCCCCl 2ac7eefd601a0c14a23b9a839443f111 [0,2,0,0,0,0|0,0,2]=4 4526 B13R0.147 COC(=O)C#CCNCCCCCO 77f4446cea67f17f6a5ad98d8e321d2c [0,2,0,0,0,0|0,0,2]=4 4527 B13R0.147 COC(=O)C#CCNCCCCSC ee2005144f9e30469010e2203b99e780 [0,2,0,0,0,0|0,0,2]=4 4528 B13R0.147 COC(=O)C#CCOCCCCCF 94a664ed99ee842360990a0410dd0f54 [0,2,0,0,0,0|0,0,2]=4 4529 B13R0.147 COC(=O)C#CCOCCCCSC 9dcfb054231d27b5fcaeafb5b7f4570d [0,2,0,0,0,0|0,0,2]=4 4530 B13R0.147 COC(=O)C=CC=CCNCCCCl 33eb3120f8181c231ea8062ba3f40a84 [0,2,0,0,0,0|0,0,2]=4 4531 B13R0.147 COC(=O)C=CC=CCNCCCO 5fff29eccbc9ad17b73c7dd09a4b78c9 [0,2,0,0,0,0|0,0,2]=4 4532 B13R0.147 COC(=O)C=CC=CCNCCSC f54b9559d3eca69abcb05bedc5f0434b [0,2,0,0,0,0|0,0,2]=4 4533 B13R0.147 COC(=O)C=CC=CCOCCCF 45964f23a4ac5ece41964d278faca43f [0,2,0,0,0,0|0,0,2]=4 4534 B13R0.147 COC(=O)C=CC=CCOCCCS a3330c4ed38d23deb7d86768d7de012f [0,2,0,0,0,0|0,0,2]=4 4535 B13R0.147 COC(=O)C=CC=CCOCCSC 779fb1b44fbde0f231a4fbd06757d26e [0,2,0,0,0,0|0,0,2]=4 4536 B13R0.147 COC(=O)C=CCNCCCCC#N 881224ee218a5a9cebdaa4a7ed701526 [0,2,0,0,0,0|0,0,1]=3 4537 B13R0.147 COC(=O)C=CCNCCCCCCl 5471908545b00521855b31aedad77ae2 [0,2,0,0,0,0|0,0,0]=2 4538 B13R0.147 COC(=O)C=CCNCCCCCO 8519555062ba40fae648d489db29dd90 [0,2,0,0,0,0|0,0,0]=2 4539 B13R0.147 COC(=O)C=CCNCCCCSC e5ce8312407e7fa07f5e884f17a408bd [0,2,0,0,0,0|0,0,0]=2 4540 B13R0.147 COC(=O)C=CCNCCOCCO cc946693be1d2288ed339e02ee31083f [0,2,0,0,0,0|1,0,0]=3 4541 B13R0.147 COC(=O)C=CCNCCOCCS f328539f3d357d1d2f9969279a4ca429 [0,2,0,0,0,0|1,0,0]=3 4542 B13R0.147 COC(=O)C=CCNCCSCCO af8c34db870227f932e39dd58696edb9 [0,2,0,0,0,0|1,0,0]=3 4543 B13R0.147 COC(=O)C=CCOCCCCC#N 5fae770ba3c777e807902406ab150783 [0,2,0,0,0,0|0,0,1]=3 4544 B13R0.147 COC(=O)C=CCOCCCCC=O b54d608c5d3b6f2cebc7f06233707981 [0,2,0,0,0,0|0,0,1]=3 4545 B13R0.147 COC(=O)C=CCOCCCCSC a33b4daa4c0ded6d200b6742d790e9f1 [0,2,0,0,0,0|0,0,0]=2 4546 B13R0.147 COC(=O)C=CCOCCOCC=O b5da1a29c40e80728d26158d5350a8c8 [0,2,0,0,0,0|1,0,1]=4 4547 B13R0.147 COC(=O)C=CCOCCOCCF 0286935b8a07e2736e7b3a8b4de0377a [0,2,0,0,0,0|1,0,0]=3 4548 B13R0.147 COC(=O)C=CCOCCOCCS 20ece7a1baf3cbc6120286e605e3e08d [0,2,0,0,0,0|1,0,0]=3 4549 B13R0.147 COC(=O)CCCCCCCNCF a8ee8da366a75f8b9904c72aa34a6e9a [0,2,0,0,0,0|0,0,2]=4 4550 B13R0.147 COC(=O)CCCCCCCNCO e9ffd08bcc13f1bc24e9e035718898d1 [0,2,0,0,0,0|0,0,2]=4 4551 B13R0.147 COC(=O)CCCCCCCOCF d69c2f6e240d3e0270efb38199ff319b [0,2,0,0,0,0|0,0,2]=4 4552 B13R0.147 COC(=O)CCCCCCNCCBr 4373850f450c665fc093e62ad21addad [0,2,0,0,0,0|0,0,2]=4 4553 B13R0.147 COC(=O)CCCCCCNCCF 1ee7d55485d0ef0d0bcfce8fc2dcc494 [0,2,0,0,0,0|0,0,2]=4 4554 B13R0.147 COC(=O)CCCCCCNCCI 3fb8db4404a1474976955247c8350071 [0,2,0,0,0,0|0,0,2]=4 4555 B13R0.147 COC(=O)CCCCCCNCCO 2f24700e49e8f363609dc28431116cef [0,2,0,0,0,0|0,0,2]=4 4556 B13R0.147 COC(=O)CCCCCCNCCS 06db1d056d9126aa82cc5c6183392f77 [0,2,0,0,0,0|0,0,2]=4 4557 B13R0.147 COC(=O)CCCCCCNCSC 4271a8a2929dde83064fc44507f666c1 [0,2,0,0,0,0|0,0,2]=4 4558 B13R0.147 COC(=O)CCCCCCOCCF bf5f616cb32262d861730bb10fc3b3f6 [0,2,0,0,0,0|0,0,2]=4 4559 B13R0.147 COC(=O)CCCCCCOCCS a3362ae7175f3ce2c4afece78e40185a [0,2,0,0,0,0|0,0,2]=4 4560 B13R0.147 COC(=O)CCCCCCOCSC 0adda32d5b6bbfefb0f1a0b5c2e6e997 [0,2,0,0,0,0|0,0,2]=4 4561 B13R0.147 COC(=O)CCCCCNCCCCl e7f2355ee871e73e1048b21bf57fa728 [0,2,0,0,0,0|0,0,2]=4 4562 B13R0.147 COC(=O)CCCCCNCCCF d788a9b2c6269ad20834645d61c13516 [0,2,0,0,0,0|0,0,2]=4 4563 B13R0.147 COC(=O)CCCCCNCCCO 0a435806f24fab99402538b5f3f82cda [0,2,0,0,0,0|0,0,2]=4 4564 B13R0.147 COC(=O)CCCCCNCCCS 81b1117264a03b86b146bfaf3bd05ec1 [0,2,0,0,0,0|0,0,2]=4 4565 B13R0.147 COC(=O)CCCCCNCCSC 9da0291d557d1a37a989ebb22f464780 [0,2,0,0,0,0|0,0,2]=4 4566 B13R0.147 COC(=O)CCCCCOCCCF 8d5234544a95e0f24db572fe433d1a24 [0,2,0,0,0,0|0,0,2]=4 4567 B13R0.147 COC(=O)CCCCCOCCCS 6cfd6992d68e6f19a560f1b91fc7d192 [0,2,0,0,0,0|0,0,2]=4 4568 B13R0.147 COC(=O)CCCCCOCCSC ee286d98d6bc4def5949dc7336628b00 [0,2,0,0,0,0|0,0,2]=4 4569 B13R0.147 COC(=O)CCCCNCCCCCl 7f629bfce31e778bb48187fa620d0b45 [0,2,0,0,0,0|0,0,2]=4 4570 B13R0.147 COC(=O)CCCCNCCCCF a34c7bace4ad7d8f27ec753a6b660535 [0,2,0,0,0,0|0,0,2]=4 4571 B13R0.147 COC(=O)CCCCNCCCCO 6d14c174f81081eb42ac77efdaaf40dc [0,2,0,0,0,0|0,0,2]=4 4572 B13R0.147 COC(=O)CCCCNCCCCS e2d19bf1e4aa9a5180e40a6e19049fa6 [0,2,0,0,0,0|0,0,2]=4 4573 B13R0.147 COC(=O)CCCCNCCCSC 37e049a533038ef7bf4c4600d967db3f [0,2,0,0,0,0|0,0,2]=4 4574 B13R0.147 COC(=O)CCCCOCCCCF 0efbc1d65709e779f9ccb56e51329210 [0,2,0,0,0,0|0,0,2]=4 4575 B13R0.147 COC(=O)CCCCOCCCCS 4ecdb6068328aa5af866af98c80c0b6e [0,2,0,0,0,0|0,0,2]=4 4576 B13R0.147 COC(=O)CCCCOCCCSC 568379774f8735ff054d2e6a26cde05e [0,2,0,0,0,0|0,0,2]=4 4577 B13R0.147 COC(=O)CCCNCCCCCCl 92b8d42bde55596360295292791b0a4d [0,2,0,0,0,0|0,0,2]=4 4578 B13R0.147 COC(=O)CCCNCCCCCF 2d5b3184337ad247a84aee3c902672be [0,2,0,0,0,0|0,0,2]=4 4579 B13R0.147 COC(=O)CCCNCCCCCO 250a1cda49a64bd3576c13f04d140e31 [0,2,0,0,0,0|0,0,2]=4 4580 B13R0.147 COC(=O)CCCNCCCCSC 063db6ac72a5450fa4470c27b3f3db87 [0,2,0,0,0,0|0,0,2]=4 4581 B13R0.147 COC(=O)CCCOCCCCSC 8d53c4e579ab51d40a3241cd62f85732 [0,2,0,0,0,0|0,0,2]=4 4582 B13R0.147 COC(=O)CCNCCCCCCCl 280b6b0216e78004bb536809897815e6 [0,2,0,0,0,0|0,0,2]=4 4583 B13R0.147 COC(=O)CCNCCCCCCF 1e479df305ecd71d1b4354ac4c774e2c [0,2,0,0,0,0|0,0,2]=4 4584 B13R0.147 COC(=O)CCNCCCCCCO 878f7a49b19a5764826e990aa73b971b [0,2,0,0,0,0|0,0,2]=4 4585 B13R0.147 COC(=O)CCOCCCCCCF b81e59a8c5bb1df36a633e82402d2859 [0,2,0,0,0,0|0,0,2]=4 4586 B13R0.147 COC(=O)CCOCCCCCCS 3e63a97fea5fda8477468610df11c71a [0,2,0,0,0,0|0,0,2]=4 4587 B13R0.147 COC(=O)CNCCCCCCC#N cf6d0b40970040c9e5ccfc22a3053e1a [0,2,0,0,0,0|1,0,1]=4 4588 B13R0.147 COC(=O)CNCCCCCCC=O 9bfa2e585df5f27598d213af25067690 [0,2,0,0,0,0|1,0,1]=4 4589 B13R0.147 COC(=O)CNCCCCCCCO a5725d89c9913041ef4969e7d64532c8 [0,2,0,0,0,0|0,0,2]=4 4590 B13R0.147 COC(=O)CNCCCCSCCO 9a72b216b94d863bb9946bc61ba1e10e [0,2,0,0,0,0|1,0,1]=4 4591 B13R0.147 COC(=O)CNCCCOCCCO af0a3f907bd1ba8ca3559ba509de2526 [0,2,0,0,0,0|1,0,1]=4 4592 B13R0.147 COC(=O)CNCCCOCCSC b9960eb6e6f43e40bc3d7d2c88aa6e30 [0,2,0,0,0,0|1,0,1]=4 4593 B13R0.147 COC(=O)COCCCCCCC#N be1d4edff018911ff86eb9dfabc594b3 [0,2,0,0,0,0|1,0,1]=4 4594 B13R0.147 COC(=O)COCCCCCCC=O fbbb7ea68f1342c000efa48dfcf7cc7f [0,2,0,0,0,0|1,0,1]=4 4595 B13R0.147 COC(=O)COCCCNCCCCl 7aee53a4a8fe426ef0641a577de35024 [0,2,0,0,0,0|1,0,1]=4 4596 B13R0.147 COC(=O)COCCCNCCCO c91dae3c972ca43a2fb759cf6d46432d [0,2,0,0,0,0|1,0,1]=4 4597 B13R0.147 COC(=O)COCCCNCCSC 62be8a35641bcd3547913bd0f7472c75 [0,2,0,0,0,0|1,0,1]=4 4598 B13R0.147 COC(=O)COCCCOCCCF 12ee2bca135004434665646c437216ae [0,2,0,0,0,0|1,0,1]=4 4599 B13R0.147 COC(=O)COCCCOCCCS e3974673549a9f04bd1c178913c272cf [0,2,0,0,0,0|1,0,1]=4 4600 B13R0.147 COC(=O)COCCCOCCSC 3f0304b8ad27212fc144a74fcaaf7986 [0,2,0,0,0,0|1,0,1]=4 4601 B13R0.147 COC(=O)COCCNCCCCCl ed91558ef782e90e41601bbbd36df991 [0,2,0,0,0,0|1,0,1]=4 4602 B13R0.147 COC(=O)COCCNCCCCO 3737d29ae9b941f1f3905ec0237c6604 [0,2,0,0,0,0|1,0,1]=4 4603 B13R0.147 COC(=O)COCCNCCCCS 7d911fcfbd0646bd5f5c20789ac6d581 [0,2,0,0,0,0|1,0,1]=4 4604 B13R0.147 COC(=O)COCCNCCCSC 2e4eb362aefb0c0231c6873678f18ca2 [0,2,0,0,0,0|1,0,1]=4 4605 B13R0.147 COC(=O)COCCOCCCCF 88445d97166edc79da021332dcd06ae2 [0,2,0,0,0,0|1,0,1]=4 4606 B13R0.147 COC(=O)COCCOCCCCS 18b860c5ca3ef497de89a3242b9c05d0 [0,2,0,0,0,0|1,0,1]=4 4607 B13R0.147 COC(=O)COCCOCCCSC 85137d55238878ae74df06aef604f986 [0,2,0,0,0,0|1,0,1]=4 4608 B13R0.147 COC(=O)CSCCCNCCCCl 9a0e0b4a2089415455c5facda036d3a2 [0,2,0,0,0,0|1,0,1]=4 4609 B13R0.147 COC(=O)CSCCCNCCCO 6f1512f7a3d1e30c3c660bc1c02fdfe9 [0,2,0,0,0,0|1,0,1]=4 4610 B13R0.147 COC(=O)CSCCCNCCSC 9eed9c43bc33b7a27707a86e9a329227 [0,2,0,0,0,0|1,0,1]=4 4611 B13R0.147 COC(=O)CSCCCOCCCF f70ed597a2507f202c1ada5c455d23de [0,2,0,0,0,0|1,0,1]=4 4612 B13R0.147 COC(=O)CSCCCOCCSC fd047d9312c3d867cedef6e389cb50f5 [0,2,0,0,0,0|1,0,1]=4 4613 B13R0.147 COC(=O)OCCOCCCCCF 13e0481e8f5a414ea41f361d0eadd572 [0,2,0,0,0,0|1,0,1]=4 4614 B13R0.147 COC(=O)OCNCCCCCCCl 89c74ff3f18905dafda629dc88e1055d [0,2,0,0,0,0|1,0,1]=4 4615 B13R0.147 COC(=O)OCNCCCCCCO a7ecaa9ed13d761e557d4395b1c59162 [0,2,0,0,0,0|1,0,1]=4 4616 B13R0.147 COC(=O)OCOCCCCCCF 65a8775a0109c5597b7dad71b9a6391c [0,2,0,0,0,0|1,0,1]=4 4617 B13R0.147 COC(=O)OCOCCCCCCS d381fdbe27413007582eb3406b84003e [0,2,0,0,0,0|1,0,1]=4 4618 B13R0.147 COCCCCCCNCC(=O)OC 34e4487486ecc30918ee88041384d091 [0,2,0,0,0,0|0,0,2]=4 4619 B13R0.147 COCCCCCCOCC(=O)OC b2838f12f25082f21060caf4064646cc [0,2,0,0,0,0|0,0,2]=4 4620 B13R0.147 COCCCCCNCCC(=O)OC 8a32fc7790de00ac7616d4061abd3ed6 [0,2,0,0,0,0|0,0,2]=4 4621 B13R0.147 COCCCCCNCOC(=O)OC f9ebaafb0f0fc79edcd88367d4fb5349 [0,2,0,0,0,0|1,0,1]=4 4622 B13R0.147 COCCCCCOCCC(=O)OC 3b4e45d866e3d3f9e61ed6fe54dbd3a2 [0,2,0,0,0,0|0,0,2]=4 4623 B13R0.147 COCCCCNC/C=C/C(=O)OC 643fd4dff5740842b03ca691c653830a [0,2,0,0,0,0|0,0,0]=2 4624 B13R0.147 COCCCCNC/C=C\C(=O)OC 9cccfab55288349ea96a102b1e1119be [0,2,0,0,0,0|0,0,0]=2 4625 B13R0.147 COCCCCNCC#CC(=O)OC beb98b8e28299aed806748a9bd57f266 [0,2,0,0,0,0|0,0,2]=4 4626 B13R0.147 COCCCCNCC=CC(=O)OC 935bf3b917c96a8ea498f92444f8c3f3 [0,2,0,0,0,0|0,0,0]=2 4627 B13R0.147 COCCCCNCCCC(=O)OC ca3daeaa93448d38fd958af1c10489f6 [0,2,0,0,0,0|0,0,2]=4 4628 B13R0.147 COCCCCOC/C=C/C(=O)OC a250e92b584d68a5cab0bd94419c374f [0,2,0,0,0,0|0,0,0]=2 4629 B13R0.147 COCCCCOC/C=C\C(=O)OC b9ab5a4115de3c4ab0bf556f4f0d5cfc [0,2,0,0,0,0|0,0,0]=2 4630 B13R0.147 COCCCCOCC#CC(=O)OC c0016ea068cc7747a963b03a2039d63a [0,2,0,0,0,0|0,0,2]=4 4631 B13R0.147 COCCCCOCC=CC(=O)OC 3ecaf30a3447834781d7be96dec01d0e [0,2,0,0,0,0|0,0,0]=2 4632 B13R0.147 COCCCCOCCCC(=O)OC 472f460c33f2a9399143721ad4c3566b [0,2,0,0,0,0|0,0,2]=4 4633 B13R0.147 COCCCCOCCOC(=O)OC 0ca635165f32dba6f774ba3395d77599 [0,2,0,0,0,0|1,0,1]=4 4634 B13R0.147 COCCCNCCCCC(=O)OC 8e5d48acf4635d34fb343ddd451735f3 [0,2,0,0,0,0|0,0,2]=4 4635 B13R0.147 COCCCNCCOCC(=O)OC c832367ee3559fe056a8383a80fe3029 [0,2,0,0,0,0|1,0,1]=4 4636 B13R0.147 COCCCOCCCCC(=O)OC 06072ba6e249e9354b3c2eb4b661ad27 [0,2,0,0,0,0|0,0,2]=4 4637 B13R0.147 COCCCOCCOCC(=O)OC 22de46e85c9fc4df92896229adc29101 [0,2,0,0,0,0|1,0,1]=4 4638 B13R0.147 COCCNC/C=C/C=C/C(=O)OC ff6339108fddac0e62827c4865b3cc6c [0,2,0,0,0,0|0,0,2]=4 4639 B13R0.147 COCCNCC=CC=CC(=O)OC 2d38761f8f2215e2959d8de7dfafa8ea [0,2,0,0,0,0|0,0,2]=4 4640 B13R0.147 COCCNCCCCCC(=O)OC 5bd0f9d2840cb6d3af7a16845b100640 [0,2,0,0,0,0|0,0,2]=4 4641 B13R0.147 COCCNCCCOCC(=O)OC 49316728f903ae763a25a892adea8847 [0,2,0,0,0,0|1,0,1]=4 4642 B13R0.147 COCCNCCCSCC(=O)OC 61a157583b04d136c708c509c4bf711f [0,2,0,0,0,0|1,0,1]=4 4643 B13R0.147 COCCOC/C=C/C=C/C(=O)OC ce284f02730f69400f0bc12f9ac34194 [0,2,0,0,0,0|0,0,2]=4 4644 B13R0.147 COCCOCC=CC=CC(=O)OC d7a169f2297d94d47b0ae6d2f1dc90c8 [0,2,0,0,0,0|0,0,2]=4 4645 B13R0.147 COCCOCCCCCC(=O)OC 0c515bd5689aa9ed5cff4a9039ede81f [0,2,0,0,0,0|0,0,2]=4 4646 B13R0.147 COCCOCCCNCC(=O)OC 20158cff804df40977e962ab8e27f096 [0,2,0,0,0,0|1,0,1]=4 4647 B13R0.147 COCCOCCCOCC(=O)OC 9fc9373e374336db6548bf302f09fc5d [0,2,0,0,0,0|1,0,1]=4 4648 B13R0.147 COCCOCCCSCC(=O)OC 04fee114452e80f4fc81a63f5c65d45c [0,2,0,0,0,0|1,0,1]=4 4649 B13R0.147 COCCOCOC/C=C/C(=O)OC f8f28fb07c84d31b2990a3a10d4a0084 [0,2,0,0,0,0|1,0,0]=3 4650 B13R0.147 COCNCCCCCCC(=O)OC 4cf74e039fcb8b492b9da5f27a851827 [0,2,0,0,0,0|0,0,2]=4 4651 B13R0.147 COCOCCCCCCC(=O)OC 2df60893279da50dc1b65e1a65700094 [0,2,0,0,0,0|0,0,2]=4 4652 B13R0.147 COCOCCOC/C=C/C(=O)OC a309ec96f0ba390cd66b321bca861bf5 [0,2,0,0,0,0|1,0,0]=3 4653 B13R0.150 CCCCCNC/C=C/C(=O)N(C)C 98877a041ba931f1ca39119104704500 [0,2,0,0,0,0|1,0,0]=3 4654 B13R0.150 CCCCCOC/C=C/C(=O)N(C)C 59a4b8cce83ac2862f2c7adbe1333f4a [0,2,0,0,0,0|1,0,0]=3 4655 B13R0.150 CCOCCNC/C=C/C(=O)N(C)C f2bc17375ffe51b22e0cbeabbf1dd348 [0,2,0,0,0,0|2,0,0]=4 4656 B13R0.150 CCOCCOC/C=C/C(=O)N(C)C f9f271ace192018574d1266f6b24c386 [0,2,0,0,0,0|2,0,0]=4 4657 B13R0.150 CCSCCNC/C=C/C(=O)N(C)C 143c00ea7bd6e344a9eb847501d11f3c [0,2,0,0,0,0|2,0,0]=4 4658 B13R0.150 CCSCCOC/C=C/C(=O)N(C)C b8ac8c66f95237f895bd58ed1ceb85cf [0,2,0,0,0,0|2,0,0]=4 4659 B13R0.150 CN(C)C(=O)/C=C/CNCCCCCl 84b798c043b7a422e047891cfc6e8506 [0,2,0,0,0,0|2,0,0]=4 4660 B13R0.150 CN(C)C(=O)/C=C/CNCCCCO 39c10cf6103f00a33c2ffbe739a157be [0,2,0,0,0,0|2,0,0]=4 4661 B13R0.150 CN(C)C(=O)/C=C/CNCCCCS 2b4808ff77e8e7eaba44656ddfa959fa [0,2,0,0,0,0|2,0,0]=4 4662 B13R0.150 CN(C)C(=O)/C=C/COCCCCF 1f63f6e69692ee9e8b0c22d6dccd83be [0,2,0,0,0,0|2,0,0]=4 4663 B13R0.150 CN(C)C(=O)/C=C/COCCCCS bfeebd0852e0266a59d1f913e56e3d62 [0,2,0,0,0,0|2,0,0]=4 4664 B13R0.150 COCCCNC/C=C/C(=O)N(C)C 073038d32a851feb6dd48456b13e5479 [0,2,0,0,0,0|2,0,0]=4 4665 B13R0.150 COCCCOC/C=C/C(=O)N(C)C 4de36c7d783fee75474daa6c37587ad1 [0,2,0,0,0,0|2,0,0]=4 4666 B13R0.150 CSCCCNC/C=C/C(=O)N(C)C ca914c3c6b5ea35ee0a4b68f2584403c [0,2,0,0,0,0|2,0,0]=4 4667 B13R0.150 CSCCCOC/C=C/C(=O)N(C)C d8fccfebfd21f7235c4a6e63556ab9d9 [0,2,0,0,0,0|2,0,0]=4 4668 B13R0.202 C=C(C)CCCOC/C=C/C(=O)OC 7e995604e40a305a754851df98c817b5 [0,2,0,0,0,0|0,0,1]=3 4669 B13R0.202 C=C(C)CCCOC/C=C\C(=O)OC 9e5739c01b9c415ae62bf3a1f64f6c78 [0,2,0,0,0,0|0,0,1]=3 4670 B13R0.202 C=C(C)CCCOCC=CC(=O)OC 9ebe1ae8c89781209819cd02c9e40234 [0,2,0,0,0,0|0,0,1]=3 4671 B13R0.202 COC(=O)/C=C/C=C/CNCC(C)C 9d7196f9c77ddc03087d47bb68806ce4 [0,2,0,0,0,0|0,0,2]=4 4672 B13R0.202 COC(=O)/C=C/C=C/CNCC(C)O 9c17be7210da27d17ddb3cfd9857c6ac [0,2,0,0,0,0|0,0,2]=4 4673 B13R0.202 COC(=O)/C=C/C=C/CNC[C@@H](C)O 73ec36b4282ed2365b416a932c69b438 [0,2,0,0,0,0|0,0,2]=4 4674 B13R0.202 COC(=O)/C=C/C=C/CNC[C@H](C)O 737946cf843d71d1ae7d52434849f8c4 [0,2,0,0,0,0|0,0,2]=4 4675 B13R0.202 COC(=O)/C=C/C=C/COCC(C)C e1730df8aa0bb155aea60300603dbf2b [0,2,0,0,0,0|0,0,2]=4 4676 B13R0.202 COC(=O)/C=C/C=C/COCC(C)F 1b3d5be0be82e820881861b0286bddae [0,2,0,0,0,0|0,0,2]=4 4677 B13R0.202 COC(=O)/C=C/C=C/COCC(C)S 50688f7a2bb468b835de0f7661bde9b4 [0,2,0,0,0,0|0,0,2]=4 4678 B13R0.202 COC(=O)/C=C/C=C/COC[C@@H](C)F 3d49937699212ac4f4338e67de66ec37 [0,2,0,0,0,0|0,0,2]=4 4679 B13R0.202 COC(=O)/C=C/C=C/COC[C@H](C)F 8e08d5852db7ed9926bf1fc4394f9d66 [0,2,0,0,0,0|0,0,2]=4 4680 B13R0.202 COC(=O)/C=C/CNCCCC(=O)N e298cb3e2ae7fc1068dfc7a976b7eb6b [0,2,0,0,0,0|1,0,1]=4 4681 B13R0.202 COC(=O)/C=C/CNCCCC(=O)O c6072006185928d8ecb76d8ad4922159 [0,2,0,0,0,0|1,0,1]=4 4682 B13R0.202 COC(=O)/C=C/CNCCCC(C)C 6d51c164e86d1256252100ba745c33b1 [0,2,0,0,0,0|0,0,0]=2 4683 B13R0.202 COC(=O)/C=C/CNCCCN(C)C 23c668b4cdd94a73ec2e2af5c7a23f02 [0,2,0,0,0,0|1,0,0]=3 4684 B13R0.202 COC(=O)/C=C/CNCCCS(=O)C d3b2e78ac01a02fa5922d9328d2690a7 [0,2,0,0,0,0|1,0,0]=3 4685 B13R0.202 COC(=O)/C=C/CNCCNC(=O)C 1dd3582d6a772ca236f8c036819fa53c [0,2,0,0,0,0|1,0,1]=4 4686 B13R0.202 COC(=O)/C=C/CNCCOC(C)C adc1891272187bef5b4b80d637d7626c [0,2,0,0,0,0|1,0,0]=3 4687 B13R0.202 COC(=O)/C=C/CNCCOC(F)F 142b597805a27e1af45e39d4c3fa67f1 [0,2,0,0,0,0|2,0,0]=4 4688 B13R0.202 COC(=O)/C=C/COC/C=C/C(C)C 765310e6da663faf33fff0e8f53323b7 [0,2,0,0,0,0|0,0,2]=4 4689 B13R0.202 COC(=O)/C=C/COCCC=C(C)C 571b9c3e113ab885e21701ed30d8274a [0,2,0,0,0,0|0,0,2]=4 4690 B13R0.202 COC(=O)/C=C/COCCCC(=O)C 56261de74921d296c478a6514227a371 [0,2,0,0,0,0|0,0,1]=3 4691 B13R0.202 COC(=O)/C=C/COCCCC(=O)N 72b81c8d730f290c70ca5b8625c4642b [0,2,0,0,0,0|1,0,1]=4 4692 B13R0.202 COC(=O)/C=C/COCCCC(=O)O dfbf52be59628c26c7a8b94cfe00d070 [0,2,0,0,0,0|1,0,1]=4 4693 B13R0.202 COC(=O)/C=C/COCCCC(C)C dd93bf2f90170e03e56988a8542d311e [0,2,0,0,0,0|0,0,0]=2 4694 B13R0.202 COC(=O)/C=C/COCCCN(C)C 049d153085244b685be0dee0e40e600c [0,2,0,0,0,0|1,0,0]=3 4695 B13R0.202 COC(=O)/C=C/COCCC[N+](=O)[O-] 462b379a10c7f497e832066a76183f06 [0,2,0,0,0,0|2,0,0]=4 4696 B13R0.202 COC(=O)/C=C/COCCNC(=O)C f5a104ea76122b8ce45e5e2a7f368fd4 [0,2,0,0,0,0|1,0,1]=4 4697 B13R0.202 COC(=O)/C=C/COCCOC(=O)C e2aab618e161adb39d738deb3c0a8988 [0,2,0,0,0,0|1,0,1]=4 4698 B13R0.202 COC(=O)/C=C/COCCOC(C)C 9a14a5a6f429f0e764ba5801dd9bf348 [0,2,0,0,0,0|1,0,0]=3 4699 B13R0.202 COC(=O)/C=C/COCCOC(F)F c35d26ba5f1547c021d595436837026d [0,2,0,0,0,0|2,0,0]=4 4700 B13R0.202 COC(=O)/C=C/COCCSC(=O)C 99ed6fabaf179fcdeb54cf4c9a3cd6b5 [0,2,0,0,0,0|1,0,1]=4 4701 B13R0.202 COC(=O)/C=C/COCCSC(C)C 1bd006ede7e0e15d1ee01f6d9ca39db9 [0,2,0,0,0,0|1,0,0]=3 4702 B13R0.202 COC(=O)/C=C\CNCCCC(=O)N 8dc5d06be0511390d89499a3c7cb410c [0,2,0,0,0,0|1,0,1]=4 4703 B13R0.202 COC(=O)/C=C\CNCCCC(=O)O b2be40cb48fa878fb8aaa55aaf87907c [0,2,0,0,0,0|1,0,1]=4 4704 B13R0.202 COC(=O)/C=C\CNCCCC(C)C 9c66ddd559eab4b80753e6ff57dbf23b [0,2,0,0,0,0|0,0,0]=2 4705 B13R0.202 COC(=O)/C=C\CNCCCN(C)C 0836d8fbe0cacae8b653d79b69492c9d [0,2,0,0,0,0|1,0,0]=3 4706 B13R0.202 COC(=O)/C=C\CNCCCS(=O)C d98468deffab53d011c433d848d55c79 [0,2,0,0,0,0|1,0,0]=3 4707 B13R0.202 COC(=O)/C=C\CNCCNC(=O)C 7dca7cb64a90fd0fd63c4cfb8d689465 [0,2,0,0,0,0|1,0,1]=4 4708 B13R0.202 COC(=O)/C=C\CNCCOC(C)C c68f84d4d6b4e6a1f801eeb33e02fcaf [0,2,0,0,0,0|1,0,0]=3 4709 B13R0.202 COC(=O)/C=C\CNCCOC(F)F 6d2292433f852518baea8b76c94b8191 [0,2,0,0,0,0|2,0,0]=4 4710 B13R0.202 COC(=O)/C=C\COCCCC(=O)C 4726d5247c518e0cc4174d163faff07b [0,2,0,0,0,0|0,0,1]=3 4711 B13R0.202 COC(=O)/C=C\COCCCC(=O)N 593ef2e1ef1616952a50ddc82cad0294 [0,2,0,0,0,0|1,0,1]=4 4712 B13R0.202 COC(=O)/C=C\COCCCC(C)C 5dd16fd9b9864443125c1ac4787533c7 [0,2,0,0,0,0|0,0,0]=2 4713 B13R0.202 COC(=O)/C=C\COCCCN(C)C faf7917cd79fda30190edb5dc9768404 [0,2,0,0,0,0|1,0,0]=3 4714 B13R0.202 COC(=O)/C=C\COCCC[N+](=O)[O-] baa6653a5a183d376cfb5cf56841d714 [0,2,0,0,0,0|2,0,0]=4 4715 B13R0.202 COC(=O)/C=C\COCCNC(=O)C cdd1f6d95f35f7959cc683345fc78bda [0,2,0,0,0,0|1,0,1]=4 4716 B13R0.202 COC(=O)/C=C\COCCOC(=O)C 29551db7fd63aa857216f309c43a803e [0,2,0,0,0,0|1,0,1]=4 4717 B13R0.202 COC(=O)/C=C\COCCOC(C)C 8eec77e215d4e77a51ad8ff27c0f1156 [0,2,0,0,0,0|1,0,0]=3 4718 B13R0.202 COC(=O)/C=C\COCCOC(F)F be3cf7e25972e9214d0992b6c27d6baa [0,2,0,0,0,0|2,0,0]=4 4719 B13R0.202 COC(=O)/C=C\COCCSC(C)C 328790502eb006b08b2d10a6b097e102 [0,2,0,0,0,0|1,0,0]=3 4720 B13R0.202 COC(=O)C#CCNCCCC(C)C 101e5d148599943500939dcf2e02e2c2 [0,2,0,0,0,0|0,0,2]=4 4721 B13R0.202 COC(=O)C#CCOCCCC(C)C c799e6d96d5da7058a8f82a7321688cc [0,2,0,0,0,0|0,0,2]=4 4722 B13R0.202 COC(=O)C=CC=CCNCC(C)C 55b1e3ee8c76dda8a85cb5e1b4cc7ddc [0,2,0,0,0,0|0,0,2]=4 4723 B13R0.202 COC(=O)C=CC=CCNCC(C)O f97cd87f851b2f3f00bfd3e23a8fcc8e [0,2,0,0,0,0|0,0,2]=4 4724 B13R0.202 COC(=O)C=CC=CCNC[C@@H](C)O 07f926fbd8a7c8afe88c0b96c68b6af9 [0,2,0,0,0,0|0,0,2]=4 4725 B13R0.202 COC(=O)C=CC=CCNC[C@H](C)O d68268ada1f745df0db39ef2da0689ec [0,2,0,0,0,0|0,0,2]=4 4726 B13R0.202 COC(=O)C=CC=CCOCC(C)C 9b44c66013747b619245a2d3e92fb13c [0,2,0,0,0,0|0,0,2]=4 4727 B13R0.202 COC(=O)C=CC=CCOCC(C)F 044b9f03141cb2075f9c4a9778983e7b [0,2,0,0,0,0|0,0,2]=4 4728 B13R0.202 COC(=O)C=CC=CCOCC(C)S 0c195c128a54e37ad9d905ec911d2dda [0,2,0,0,0,0|0,0,2]=4 4729 B13R0.202 COC(=O)C=CC=CCOC[C@@H](C)F 9e4d1243d9468d814e00cb25a1d8549f [0,2,0,0,0,0|0,0,2]=4 4730 B13R0.202 COC(=O)C=CC=CCOC[C@H](C)F 365199b67cdfb6fcfcec0ff7e4b42cdc [0,2,0,0,0,0|0,0,2]=4 4731 B13R0.202 COC(=O)C=CCNCCCC(=O)N 511a3a3b1bafae2f78e0852f28f05083 [0,2,0,0,0,0|1,0,1]=4 4732 B13R0.202 COC(=O)C=CCNCCCC(=O)O 85e82de9d2e595eca5eb519eb54dc691 [0,2,0,0,0,0|1,0,1]=4 4733 B13R0.202 COC(=O)C=CCNCCCC(C)C 78bc184f0d1321d13e3e515678582b11 [0,2,0,0,0,0|0,0,0]=2 4734 B13R0.202 COC(=O)C=CCNCCCN(C)C f8e7e561da98c33e8181755c274b902f [0,2,0,0,0,0|1,0,0]=3 4735 B13R0.202 COC(=O)C=CCNCCCS(=O)C 578ea7a95751ef4ded0e77f6f4696016 [0,2,0,0,0,0|1,0,0]=3 4736 B13R0.202 COC(=O)C=CCNCCNC(=O)C c579388dfa75f32064d051e0e7300f18 [0,2,0,0,0,0|1,0,1]=4 4737 B13R0.202 COC(=O)C=CCNCCOC(C)C 1dc16e6c2f5b5905c553c1725d123634 [0,2,0,0,0,0|1,0,0]=3 4738 B13R0.202 COC(=O)C=CCNCCOC(F)F e8723c276ef2a21302ea2d4267274c97 [0,2,0,0,0,0|2,0,0]=4 4739 B13R0.202 COC(=O)C=CCOCCCC(=O)C 6447de1edc5fea614ee198c894a1f147 [0,2,0,0,0,0|0,0,1]=3 4740 B13R0.202 COC(=O)C=CCOCCCC(=O)N 38421dac76a2a89c72265230b35e9314 [0,2,0,0,0,0|1,0,1]=4 4741 B13R0.202 COC(=O)C=CCOCCCC(C)C 29505c27e9ffadc79e06a06cb0c1f4c4 [0,2,0,0,0,0|0,0,0]=2 4742 B13R0.202 COC(=O)C=CCOCCCN(C)C fbc1fd8e3169a7519aaa2af9018215b8 [0,2,0,0,0,0|1,0,0]=3 4743 B13R0.202 COC(=O)C=CCOCCC[N+](=O)[O-] 83ed0ac9cae4be550dd20e7b5fb430b5 [0,2,0,0,0,0|2,0,0]=4 4744 B13R0.202 COC(=O)C=CCOCCNC(=O)C 5dd53047986968ec63e96fca41b38d05 [0,2,0,0,0,0|1,0,1]=4 4745 B13R0.202 COC(=O)C=CCOCCOC(=O)C d41575907a98d9686b50e09284d4c0d3 [0,2,0,0,0,0|1,0,1]=4 4746 B13R0.202 COC(=O)C=CCOCCOC(C)C ca3b888427bc0734ae30c59b685d200c [0,2,0,0,0,0|1,0,0]=3 4747 B13R0.202 COC(=O)C=CCOCCOC(F)F e340faadc8412396eeafe7ac64d1bff9 [0,2,0,0,0,0|2,0,0]=4 4748 B13R0.202 COC(=O)C=CCOCCSC(C)C f948a41ee1e94c82a6bab5c8c9e579b9 [0,2,0,0,0,0|1,0,0]=3 4749 B13R0.202 COC(=O)CCCCCCNC(C)C 4d2ca2479cb70fe6092abfa64325b3da [0,2,0,0,0,0|0,0,2]=4 4750 B13R0.202 COC(=O)CCCCCCOC(C)C 50476f4df7f786cdce203e12a5766bc0 [0,2,0,0,0,0|0,0,2]=4 4751 B13R0.202 COC(=O)CCCCCNCC(C)C faa43aa37302709e874122dab872a96d [0,2,0,0,0,0|0,0,2]=4 4752 B13R0.202 COC(=O)CCCCCNCC(C)O 044ce6e17a4ce5ac4cfe65b1fb9f2436 [0,2,0,0,0,0|0,0,2]=4 4753 B13R0.202 COC(=O)CCCCCNC[C@@H](C)O f930ca8614e6bd54dff6e74cf2d37d4e [0,2,0,0,0,0|0,0,2]=4 4754 B13R0.202 COC(=O)CCCCCNC[C@H](C)O 1024404445b933d891a09b8cb6dba741 [0,2,0,0,0,0|0,0,2]=4 4755 B13R0.202 COC(=O)CCCCCOCC(C)C 8fa9650897e815305842043c3d95f7da [0,2,0,0,0,0|0,0,2]=4 4756 B13R0.202 COC(=O)CCCCCOCC(C)F 164a9c34d1cbe103dca862bc798f765f [0,2,0,0,0,0|0,0,2]=4 4757 B13R0.202 COC(=O)CCCCCOCC(C)S 37170b88a91f531c41320b046c170ffd [0,2,0,0,0,0|0,0,2]=4 4758 B13R0.202 COC(=O)CCCCCOC[C@@H](C)F 99068248c91a5e77c98234aa2c4fac77 [0,2,0,0,0,0|0,0,2]=4 4759 B13R0.202 COC(=O)CCCCCOC[C@H](C)F 1ef98289b271a06ca1ed8a3b6cc917f2 [0,2,0,0,0,0|0,0,2]=4 4760 B13R0.202 COC(=O)CCCCNCCC(C)C a94e41ef9c84d68e8701fe55c6a9470f [0,2,0,0,0,0|0,0,2]=4 4761 B13R0.202 COC(=O)CCCCNCCC(C)O 3b0970821808f5ed8d3b303c537ff3b9 [0,2,0,0,0,0|0,0,2]=4 4762 B13R0.202 COC(=O)CCCCNCC[C@@H](C)O 6bc8af2beaf59b3378aff3ca3ae1abdf [0,2,0,0,0,0|0,0,2]=4 4763 B13R0.202 COC(=O)CCCCNCC[C@H](C)O b642393821d9c9c490af818b5404b312 [0,2,0,0,0,0|0,0,2]=4 4764 B13R0.202 COC(=O)CCCCOCCC(C)C 928b6325eefb3f94d3224f15575e8c28 [0,2,0,0,0,0|0,0,2]=4 4765 B13R0.202 COC(=O)CCCNCCCC(C)C 6ee72d14c5a990fcb3a5d385bb0ad8ae [0,2,0,0,0,0|0,0,2]=4 4766 B13R0.202 COC(=O)CCCNCCCC(C)O bcf11727ef3f28e63ac8f3d62d987e56 [0,2,0,0,0,0|0,0,2]=4 4767 B13R0.202 COC(=O)CCCOCCCC(C)C 8c472026c949280040a990d25f3e15f3 [0,2,0,0,0,0|0,0,2]=4 4768 B13R0.202 COC(=O)CCNCCCCC(C)C 9b504bf85687d56adaa09dcf2587c40d [0,2,0,0,0,0|0,0,2]=4 4769 B13R0.202 COC(=O)CCNCCCCC(C)O b6275be8e4bc39fbba2119e165cac213 [0,2,0,0,0,0|0,0,2]=4 4770 B13R0.202 COC(=O)CCNCCCC[C@@H](C)O 726ecf9fce18bd8583f55f9bc9eb9eca [0,2,0,0,0,0|0,0,2]=4 4771 B13R0.202 COC(=O)CCOCCCCC(C)C 21e2aee5a99a518d2a9c526acb6fb4e5 [0,2,0,0,0,0|0,0,2]=4 4772 B13R0.202 COC(=O)CNCCCCCC(=O)C 11d41d1148adb1302b4d00c643183044 [0,2,0,0,0,0|1,0,1]=4 4773 B13R0.202 COC(=O)CNCCCCCC(C)C 49f053a36134f8bf298e616455c385ee [0,2,0,0,0,0|0,0,2]=4 4774 B13R0.202 COC(=O)CNCCCCCC(F)F 7ad9a8db4517fd122fd2de9e652ee2f8 [0,2,0,0,0,0|1,0,1]=4 4775 B13R0.202 COC(=O)CNCCCCCN(C)C 5c1ad95ead8a30d7d942a60452ba2ba2 [0,2,0,0,0,0|1,0,1]=4 4776 B13R0.202 COC(=O)CNCCCOCC(C)C ccb52fa1664bf75bcb2a10d8d38315f9 [0,2,0,0,0,0|1,0,1]=4 4777 B13R0.202 COC(=O)COCCCCCC(=O)C 7352ae172b5ec6c823dc4355df0aac2b [0,2,0,0,0,0|1,0,1]=4 4778 B13R0.202 COC(=O)COCCCCCC(C)C c4c5e89dc6d09efe1d5e314387267d9f [0,2,0,0,0,0|0,0,2]=4 4779 B13R0.202 COC(=O)COCCCCCC(F)F f1db4266e69a2066ab0e9ee5c9387685 [0,2,0,0,0,0|1,0,1]=4 4780 B13R0.202 COC(=O)COCCCCCN(C)C 8d7dbee2a51b7a0b7106bc532d73d1fd [0,2,0,0,0,0|1,0,1]=4 4781 B13R0.202 COC(=O)COCCCNCC(C)C 72d4c864e8f5eba361519422c844489b [0,2,0,0,0,0|1,0,1]=4 4782 B13R0.202 COC(=O)COCCCNCC(C)O 5757ad2c570c54a500c88d7aae8203f3 [0,2,0,0,0,0|1,0,1]=4 4783 B13R0.202 COC(=O)COCCCNC[C@@H](C)O 46d3541329e424ade287bca2ac8056bc [0,2,0,0,0,0|1,0,1]=4 4784 B13R0.202 COC(=O)COCCCNC[C@H](C)O 3193e52be099d1158701fed82f758bd2 [0,2,0,0,0,0|1,0,1]=4 4785 B13R0.202 COC(=O)COCCCOCC(C)C 28ba199867e1b9d1c8cae9a1a78a1c3a [0,2,0,0,0,0|1,0,1]=4 4786 B13R0.202 COC(=O)COCCCOCC(C)F 9ca22cffdcdcf49a8b995e7529347dbe [0,2,0,0,0,0|1,0,1]=4 4787 B13R0.202 COC(=O)COCCCOCC(C)S 7b458f4b5ea032182d74a502bc601a7f [0,2,0,0,0,0|1,0,1]=4 4788 B13R0.202 COC(=O)COCCCOC[C@@H](C)F 1bde5507aab6ff46e7235959c5427278 [0,2,0,0,0,0|1,0,1]=4 4789 B13R0.202 COC(=O)COCCCOC[C@H](C)F 2ba1868e388cf2828556386430291a5e [0,2,0,0,0,0|1,0,1]=4 4790 B13R0.202 COC(=O)COCCCSCC(C)C 83ac2ed091b53c9dc2e6eaf2bccf4bad [0,2,0,0,0,0|1,0,1]=4 4791 B13R0.202 COC(=O)COCCNCCC(C)C 230ba23f048c3d4258a65ab563b622dc [0,2,0,0,0,0|1,0,1]=4 4792 B13R0.202 COC(=O)COCCNCCC(C)O 662c635a066327153102981c744d9fc4 [0,2,0,0,0,0|1,0,1]=4 4793 B13R0.202 COC(=O)COCCNCC[C@@H](C)O 283c33d5c7f9a01ec555ef3f6cd027fe [0,2,0,0,0,0|1,0,1]=4 4794 B13R0.202 COC(=O)COCCNCC[C@H](C)O 84edeba600e3f3efe5788dfa68e3930c [0,2,0,0,0,0|1,0,1]=4 4795 B13R0.202 COC(=O)COCCOCCC(C)C 702fe894302946532de4e6854b82124b [0,2,0,0,0,0|1,0,1]=4 4796 B13R0.202 COC(=O)CSCCCNCC(C)C e4121fd7966b978387680bf5d80dec05 [0,2,0,0,0,0|1,0,1]=4 4797 B13R0.202 COC(=O)CSCCCNCC(C)O 4b17578764dace6972179b2bb4dfab47 [0,2,0,0,0,0|1,0,1]=4 4798 B13R0.202 COC(=O)CSCCCNC[C@@H](C)O dbfef3a8c99b9d2c19704d9bfe3635a0 [0,2,0,0,0,0|1,0,1]=4 4799 B13R0.202 COC(=O)CSCCCNC[C@H](C)O 17f3a960912d8b238beb94af14a2f51c [0,2,0,0,0,0|1,0,1]=4 4800 B13R0.202 COC(=O)CSCCCOCC(C)C d8e8d588c711481fadaf057ec3359f72 [0,2,0,0,0,0|1,0,1]=4 4801 B13R0.202 COC(=O)CSCCCOCC(C)F 91584a950215b50090483ee9384247e0 [0,2,0,0,0,0|1,0,1]=4 4802 B13R0.202 COC(=O)CSCCCOCC(C)S 7743767acf244865f7b3f911ec15f213 [0,2,0,0,0,0|1,0,1]=4 4803 B13R0.202 COC(=O)CSCCCOC[C@@H](C)F 1988bda40af68c2b6119e3ac12c4eec4 [0,2,0,0,0,0|1,0,1]=4 4804 B13R0.202 COC(=O)CSCCCOC[C@H](C)F f8f99c2dd7ff260e381adeb1e888a79d [0,2,0,0,0,0|1,0,1]=4 4805 B13R0.202 COC(=O)OCCOCCCC(C)C 3960d3c33d4bc2aea6aab1d92892857e [0,2,0,0,0,0|1,0,1]=4 4806 B13R0.202 COC(=O)OCOCCCCC(C)C 9102e972d06cce91f8112864e01e8679 [0,2,0,0,0,0|1,0,1]=4 4807 B13R0.91 CCCC(C)NC/C=C/C(=O)N(C)C 14a46e2089db2ceda6b7bf321457be96 [0,2,0,0,0,0|2,0,0]=4 4808 B13R0.91 CCCC(C)OC/C=C/C(=O)N(C)C 9ce79dfcfb79ae58f2cf22477acb59c6 [0,2,0,0,0,0|2,0,0]=4 4809 B13R0.91 CCC[C@@H](C)OC/C=C/C(=O)N(C)C ee34daad7a5b4aa90a4b4f9f92b21f65 [0,2,0,0,0,0|2,0,0]=4 4810 B13R0.91 CCC[C@H](C)NC/C=C/C(=O)N(C)C a51ba26a606b1b566f0814cfdf80bbf9 [0,2,0,0,0,0|2,0,0]=4 4811 B13R0.91 CCC[C@H](C)OC/C=C/C(=O)N(C)C 5d7e2fc7887049ae246364a5e1dca96b [0,2,0,0,0,0|2,0,0]=4 4812 B13R0.226 CCCC(C)(S)CCOCC(=O)OC b777460a74a3b1ad65bc42810cd05259 [0,2,0,0,0,0|1,0,1]=4 4813 B13R0.226 COC(=O)/C=C/CNC(C)(C)CCO ba0ac2fc91770d46f7fa4d1dc7c0d40e [0,2,0,0,0,0|2,0,0]=4 4814 B13R0.226 COC(=O)/C=C/CNC(C)(C)CSC a46ebf43d7bca3af4503d3d69fc3328a [0,2,0,0,0,0|2,0,0]=4 4815 B13R0.226 COC(=O)/C=C\CNC(C)(C)CCO 2540bc355d5f4287306d283a83c530b0 [0,2,0,0,0,0|2,0,0]=4 4816 B13R0.226 COC(=O)/C=C\CNC(C)(C)CSC ae57c7a6bf9a11d2eee02398dc8b502c [0,2,0,0,0,0|2,0,0]=4 4817 B13R0.226 COC(=O)C=CCNC(C)(C)CCO 9943152ec68f27c3bf72106503626787 [0,2,0,0,0,0|2,0,0]=4 4818 B13R0.226 COC(=O)C=CCNC(C)(C)CSC dbce071010d0ac23885bd14172701995 [0,2,0,0,0,0|2,0,0]=4 4819 B13R0.226 COCC(C)(C)NC/C=C/C(=O)OC 21bdf085bf0f405cf7231c4ca86e9aff [0,2,0,0,0,0|2,0,0]=4 4820 B13R0.226 COCC(C)(C)NC/C=C\C(=O)OC ae6f48c1589a4ad0d729e220d5fd14d1 [0,2,0,0,0,0|2,0,0]=4 4821 B13R0.226 COCC(C)(C)NCC=CC(=O)OC 9f3dc17e47e08d84013c3255c0db7153 [0,2,0,0,0,0|2,0,0]=4 4822 B13R0.308 C#CC(CCC)OC/C=C/C(=O)OC c521c7c92d814745386b5a5cbdefa073 [0,2,0,0,0,0|1,0,0]=3 4823 B13R0.308 C#CC(CCC)OC/C=C\C(=O)OC 34e01e8f2fe67da88b0f85982c28e0a6 [0,2,0,0,0,0|1,0,0]=3 4824 B13R0.308 C#CC(CCC)OCC=CC(=O)OC eb49024e7e9ed21aa36c9e930233ffb3 [0,2,0,0,0,0|1,0,0]=3 4825 B13R0.308 C=CC(CCC)OC/C=C/C(=O)OC 8ca600bbc496c0dcbfd169ad6dad8d35 [0,2,0,0,0,0|1,0,0]=3 4826 B13R0.308 C=CC(CCC)OC/C=C\C(=O)OC 843a0293e27920936839af5d10e87bbd [0,2,0,0,0,0|1,0,0]=3 4827 B13R0.308 C=CC(CCC)OCC=CC(=O)OC b14a401c6f455a9f2d4685b8ae4a2525 [0,2,0,0,0,0|1,0,0]=3 4828 B13R0.308 CCC(COC)NC/C=C/C(=O)OC 4672ebbd3e5aa2cb160839ad97ff179a [0,2,0,0,0,0|2,0,0]=4 4829 B13R0.308 CCC(COC)NC/C=C\C(=O)OC 17ab35ab422820f3ff3c0a235e63ed55 [0,2,0,0,0,0|2,0,0]=4 4830 B13R0.308 CCC(COC)NCC=CC(=O)OC d3e902edb6fa03f88e03cb2d5b15dc08 [0,2,0,0,0,0|2,0,0]=4 4831 B13R0.308 CCC(COC)OC/C=C/C(=O)OC 11184ef3b0153ed7531ffeeff6e08f1a [0,2,0,0,0,0|2,0,0]=4 4832 B13R0.308 CCC(COC)OC/C=C\C(=O)OC 91220fe6a03d0e93bdc60c347d44b767 [0,2,0,0,0,0|2,0,0]=4 4833 B13R0.308 CCC(COC)OCC=CC(=O)OC aa16cd83acc6d622637a4003e9775649 [0,2,0,0,0,0|2,0,0]=4 4834 B13R0.308 CCC(CSC)OC/C=C/C(=O)OC 8399442f9b418ea3312884a83b191465 [0,2,0,0,0,0|2,0,0]=4 4835 B13R0.308 CCC(CSC)OC/C=C\C(=O)OC a32ee22c09f12994e46c2bcec27b14bc [0,2,0,0,0,0|2,0,0]=4 4836 B13R0.308 CCC(CSC)OCC=CC(=O)OC cff61cc942968961cc338b822fb48f93 [0,2,0,0,0,0|2,0,0]=4 4837 B13R0.308 CCCC(C#N)OC/C=C/C(=O)OC 1af6bcfb184c1e4498402198319b3434 [0,2,0,0,0,0|1,0,0]=3 4838 B13R0.308 CCCC(C#N)OC/C=C\C(=O)OC 465771c04f22b3f7022ead1244683bda [0,2,0,0,0,0|1,0,0]=3 4839 B13R0.308 CCCC(C#N)OCC=CC(=O)OC 79e71272882cabeb96feec41cf9215aa [0,2,0,0,0,0|1,0,0]=3 4840 B13R0.308 CCCC(CC)OC/C=C/C(=O)OC ac1647263fb5ae271fe5f6a5c2a64b1f [0,2,0,0,0,0|1,0,0]=3 4841 B13R0.308 CCCC(CC)OC/C=C\C(=O)OC a3bd3220eea855e147b4ebc4bf7e2b5d [0,2,0,0,0,0|1,0,0]=3 4842 B13R0.308 CCCC(CC)OCC=CC(=O)OC db309f566e65573cc50d7ee130118121 [0,2,0,0,0,0|1,0,0]=3 4843 B13R0.308 CCCC(CCOCC(=O)OC)SC d5ca12aa55cf356770cf32a6d56385db [0,2,0,0,0,0|1,0,1]=4 4844 B13R0.308 CCCC(CO)NC/C=C/C(=O)OC 608363ef7e59ea2cd53832609e700020 [0,2,0,0,0,0|1,0,0]=3 4845 B13R0.308 CCCC(CO)NC/C=C\C(=O)OC e56bbfce8dfb660f1dea5a82566c10b1 [0,2,0,0,0,0|1,0,0]=3 4846 B13R0.308 CCCC(CO)NCC=CC(=O)OC a0b4c7a2816dda60cc37a3b56e3fc5c9 [0,2,0,0,0,0|1,0,0]=3 4847 B13R0.308 CCC[C@@H](CC)OC/C=C/C(=O)OC 929cd5fb57b7b05e055d200d238c9201 [0,2,0,0,0,0|1,0,0]=3 4848 B13R0.308 CCC[C@@H](CC)OC/C=C\C(=O)OC 9de1a7b49bf847a60249dc9911315e70 [0,2,0,0,0,0|1,0,0]=3 4849 B13R0.308 CCC[C@@H](CC)OCC=CC(=O)OC 47dd60abd4c8defe961856b6f0c8b023 [0,2,0,0,0,0|1,0,0]=3 4850 B13R0.308 CCC[C@@H](CO)NC/C=C/C(=O)OC c760edc026a561aa56181602800ca85a [0,2,0,0,0,0|1,0,0]=3 4851 B13R0.308 CCC[C@@H](CO)NC/C=C\C(=O)OC 41dc0570cbdaf4a1f350b5b6b4f8d9ef [0,2,0,0,0,0|1,0,0]=3 4852 B13R0.308 CCC[C@@H](CO)NCC=CC(=O)OC d97812e5386e656a30cb68a0fae17b1d [0,2,0,0,0,0|1,0,0]=3 4853 B13R0.308 CCC[C@H](CO)NC/C=C/C(=O)OC 37a70c75597b8df7eee732cf8cf211ce [0,2,0,0,0,0|1,0,0]=3 4854 B13R0.308 CCC[C@H](CO)NC/C=C\C(=O)OC 46758b659f572a16c4345d5da82b8c33 [0,2,0,0,0,0|1,0,0]=3 4855 B13R0.308 CCC[C@H](CO)NCC=CC(=O)OC 4674b1869d97bbeb87017d0dd4c93378 [0,2,0,0,0,0|1,0,0]=3 4856 B13R0.308 COC(=O)/C=C/CNC(CO)CCO b1d7f639810ab1575347fd8539be1260 [0,2,0,0,0,0|2,0,0]=4 4857 B13R0.308 COC(=O)/C=C/CNC(CO)CSC 626bebcb4dc8bcc34ace18a5b00997a5 [0,2,0,0,0,0|2,0,0]=4 4858 B13R0.308 COC(=O)/C=C/CN[C@@H](CO)CCO 0df5dd0b9d5b860b732f404e6013a0e7 [0,2,0,0,0,0|2,0,0]=4 4859 B13R0.308 COC(=O)/C=C/COC(CBr)CCBr e19b6d6e15906de5ca6471f417bcb1ca [0,2,0,0,0,0|2,0,0]=4 4860 B13R0.308 COC(=O)/C=C/COC(CCl)CCCl 9e39289ec969a78c67a3891b65cf85e6 [0,2,0,0,0,0|2,0,0]=4 4861 B13R0.308 COC(=O)/C=C/CO[C@@H](CO)CCO 39ba552cdbaf06ee02133a7cd2236950 [0,2,0,0,0,0|2,0,0]=4 4862 B13R0.308 COC(=O)/C=C\CNC(CO)CCO 518b14d88268142e4f0196fe612f4afc [0,2,0,0,0,0|2,0,0]=4 4863 B13R0.308 COC(=O)/C=C\CNC(CO)CSC 8eaf14ff0e8f29beadee4fcd522598ad [0,2,0,0,0,0|2,0,0]=4 4864 B13R0.308 COC(=O)/C=C\CN[C@@H](CO)CCO cbe0d1adf4272bffc331f171d82d4f47 [0,2,0,0,0,0|2,0,0]=4 4865 B13R0.308 COC(=O)/C=C\COC(CBr)CCBr 3ff83a1c06233532cc74f59e019fb3a9 [0,2,0,0,0,0|2,0,0]=4 4866 B13R0.308 COC(=O)/C=C\COC(CCl)CCCl 10fd81921382501499dfab50789e3228 [0,2,0,0,0,0|2,0,0]=4 4867 B13R0.308 COC(=O)C=CCNC(CO)CCO 30ec61fab585364de9a0f5e651033c76 [0,2,0,0,0,0|2,0,0]=4 4868 B13R0.308 COC(=O)C=CCNC(CO)CSC 522dd5a069d2084ce545ffd706ff027b [0,2,0,0,0,0|2,0,0]=4 4869 B13R0.308 COC(=O)C=CCN[C@@H](CO)CCO 65dc623753fd7b54bc952ac6979b1322 [0,2,0,0,0,0|2,0,0]=4 4870 B13R0.308 COC(=O)C=CCOC(CBr)CCBr e5c31a321623857bdd96233743e7f216 [0,2,0,0,0,0|2,0,0]=4 4871 B13R0.308 COC(=O)C=CCOC(CCl)CCCl 7342d1ef8d0f843d43a30cc22f4f63d9 [0,2,0,0,0,0|2,0,0]=4 4872 B13R0.308 COCC(CO)NC/C=C/C(=O)OC a391e38ac3a62993660576ef55acd08f [0,2,0,0,0,0|2,0,0]=4 4873 B13R0.308 COCC(CO)NC/C=C\C(=O)OC 1c82cd1634275808a69b53b317b64810 [0,2,0,0,0,0|2,0,0]=4 4874 B13R0.308 COCC(CO)NCC=CC(=O)OC 8de1fd1da56e009bdc5d682715c04b1f [0,2,0,0,0,0|2,0,0]=4 4875 B11R1.27 CCCCOC1C=CC(=O)C1 0d98e3380264e96c82b51496b84e5007 [1,0,0,1,0,0|1,0,0]=3 4876 B11R1.27 CCCCOC1C=CC(=O)O1 8de5a6aabb96fa2068f232a13afea463 [1,0,0,1,0,0|1,0,0]=3 4877 B11R1.27 CCCCO[C@H]1C=CC(=O)C1 207af7052b82c543be52becc1f233bfc [1,0,0,1,0,0|1,0,0]=3 4878 B11R1.27 CCCOCC1C=CC(=O)O1 9dadb827d673d8628bb482617f675d16 [1,0,0,1,0,0|1,0,0]=3 4879 B11R1.27 CCCOC[C@@H]1C=CC(=O)O1 7531c118a29ea18e38da49b72ee790bd [1,0,0,1,0,0|1,0,0]=3 4880 B11R1.27 CCOCOC1C=CC(=O)O1 38e4d2e758a31263b409a5c86d75ed03 [1,0,0,1,0,0|2,0,0]=4 4881 B11R1.27 COCCOC1C=CC(=O)C1 d8218f5e250b384f2f0874d2a65e8c28 [1,0,0,1,0,0|2,0,0]=4 4882 B11R1.27 COCCOC1C=CC(=O)O1 fa97a0b73c5560e648fb76c89bd0a969 [1,0,0,1,0,0|2,0,0]=4 4883 B11R1.27 COCCO[C@H]1C=CC(=O)C1 258f4c160bb2c2749f3a8f5b0da185c3 [1,0,0,1,0,0|2,0,0]=4 4884 B11R1.27 COCOCC1C=CC(=O)O1 a1bad1d455370d36cc2a3ef93e03231d [1,0,0,1,0,0|2,0,0]=4 4885 B11R1.27 COCOC[C@@H]1C=CC(=O)O1 feda368e49cd4e447834d2c99ad1224e [1,0,0,1,0,0|2,0,0]=4 4886 B11R1.27 CSCCOC1C=CC(=O)C1 a813ae3c929e0e45ef278a3e17c4718b [1,0,0,1,0,0|2,0,0]=4 4887 B11R1.27 CSCCOC1C=CC(=O)O1 ac00a57dcc0d765fa19178c1aeebf610 [1,0,0,1,0,0|2,0,0]=4 4888 B11R1.27 CSCCO[C@H]1C=CC(=O)C1 7041a79fe6a7922051e3553b4f1701a3 [1,0,0,1,0,0|2,0,0]=4 4889 B11R1.27 O=C1C=CC(C1)OCCCF b321ca28f693c740375ffc4a00b94356 [1,0,0,1,0,0|2,0,0]=4 4890 B11R1.27 O=C1C=CC(C1)OCCCS 3d714283c3b9cf2ef284f116ab242ccd [1,0,0,1,0,0|2,0,0]=4 4891 B11R1.27 O=C1C=CC(O1)COCCF 9430dcf102588d87ee9e85ae7e754592 [1,0,0,1,0,0|2,0,0]=4 4892 B11R1.27 O=C1C=CC(O1)COCCS 33903e6f0ed96541ce8898b3fc31e7e4 [1,0,0,1,0,0|2,0,0]=4 4893 B11R1.27 O=C1C=CC(O1)OCCCF ea7e371b9634d75cd255904015258c80 [1,0,0,1,0,0|2,0,0]=4 4894 B11R1.27 O=C1C=CC(O1)OCCCS f620c6449632bc996c7a1e22d29a3cc5 [1,0,0,1,0,0|2,0,0]=4 4895 B11R1.27 O=C1C=C[C@@H](C1)OCCCF 5f250ddff080b3a54f97fc0311633408 [1,0,0,1,0,0|2,0,0]=4 4896 B11R1.27 O=C1C=C[C@@H](C1)OCCCS 37867833965405a6c3f6e73cd76207fb [1,0,0,1,0,0|2,0,0]=4 4897 B11R1.27 O=C1C=C[C@H](O1)COCCF d494a1f66d1c4b989f0e63083485cdec [1,0,0,1,0,0|2,0,0]=4 4898 B11R1.27 O=C1C=C[C@H](O1)COCCS 5a1f217c33b88acbfe3f48ec7a8ed758 [1,0,0,1,0,0|2,0,0]=4 4899 B11R1.53 CCC1CCCCN1C(=O)C 8d91af042ec3ee454d245c12958ebfeb [1,0,0,1,0,0|1,0,1]=4 4900 B11R1.53 CC[C@@H]1CCCCN1C(=O)C 6739e20465d74f218273c8bb16bd22bb [1,0,0,1,0,0|1,0,1]=4 4901 B11R1.53 CC[C@H]1CCCCN1C(=O)C 3f882d1db31c87fd415fbe582bfecb93 [1,0,0,1,0,0|1,0,1]=4 4902 B11R1.57 CCC1CCCN1CC(=O)O c31ac8bd4b3eeed7b5beb09db1545ade [1,0,0,1,0,0|1,0,1]=4 4903 B11R1.57 CC[C@@H]1CCCN1CC(=O)O fcbfc0397f95ebb582b031ed6c75b8f9 [1,0,0,1,0,0|1,0,1]=4 4904 B11R1.57 CC[C@@H]1CCC[C@H]1NC(=O)C 3e0e1d15d776c3dcd038aea6de3e4dfb [1,0,0,1,0,0|1,0,1]=4 4905 B11R1.86 CC(=O)NC1CCCCC1C 670701ef37830c881dfd98f284b6eaef [1,0,0,1,0,0|1,0,1]=4 4906 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1C 2bac565059009b92e61af1d1f0ba1ffd [1,0,0,1,0,0|1,0,1]=4 4907 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1C 479fb6aae9438e2010ab8b66de7f20cf [1,0,0,1,0,0|1,0,1]=4 4908 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1C 18a83c7bce0c6708eeacbe02f36aa7ad [1,0,0,1,0,0|1,0,1]=4 4909 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1C c4b6727756a1c9df9d0de80b9b0690de [1,0,0,1,0,0|1,0,1]=4 4910 B11R1.86 CC1CCCCN1CC(=O)O ae84160ac6931f8f66d20194a2549691 [1,0,0,1,0,0|1,0,1]=4 4911 B11R1.86 C[C@@H]1CCCCN1CC(=O)O e977167422de3a18af9f7c21c4b88fdb [1,0,0,1,0,0|1,0,1]=4 4912 B11R1.86 C[C@H]1CCCCN1CC(=O)O b00078cb16b191d42880e0e45b0eac26 [1,0,0,1,0,0|1,0,1]=4 4913 B11R1.90 CC1CCCC1OCC(=O)O 8b302fdcccb2e5b0cbc05eb78f61b043 [1,0,0,1,0,0|1,0,1]=4 4914 B11R1.90 C[C@@H]1CCC[C@@H]1OCC(=O)O 735a45401cd3b3bbab8ed3fa02f5be83 [1,0,0,1,0,0|1,0,1]=4 4915 B11R1.90 C[C@@H]1CCC[C@H]1OCC(=O)O 1c7967d6457face00634b93870635bd7 [1,0,0,1,0,0|1,0,1]=4 4916 B11R1.90 C[C@H]1CCC[C@@H]1OCC(=O)O 1011d83d813a08e7d91c46348c016f66 [1,0,0,1,0,0|1,0,1]=4 4917 B11R1.90 C[C@H]1CCC[C@H]1OCC(=O)O 41f392f14989d15a78b37a9a4a93f045 [1,0,0,1,0,0|1,0,1]=4 4918 B11R1.91 CC(=O)CNC1CCCCC1 41f3bbc8aa0b0ee4d56e1bb353997307 [1,0,0,1,0,0|1,0,1]=4 4919 B11R1.91 CC(=O)COC1CCCCC1 763ec2b1245af52120f0b3066af09e15 [1,0,0,1,0,0|1,0,1]=4 4920 B11R1.91 CC(=O)NCC1CCCCC1 13ef8179cc48c409da15977c5ecf76d3 [1,0,0,1,0,0|1,0,1]=4 4921 B11R1.91 O=C(O)CNC1CCCCC1 6170fa39da854f2ae539e4442d25e354 [1,0,0,1,0,0|1,0,1]=4 4922 B11R1.91 O=C(O)COC1CCCCC1 c56b55e54d9cc9b734edcd0ed0978f43 [1,0,0,1,0,0|1,0,1]=4 4923 B11R1.102 CC1CC1NC/C=C/C(=O)O 8074935ca92cab8b0a61a569ff537f39 [1,0,0,1,0,0|1,0,0]=3 4924 B11R1.102 CC1CC1NCC=CC(=O)O 51f0aa27a68549ff6dc569b531f3943f [1,0,0,1,0,0|1,0,0]=3 4925 B11R1.102 O=C(O)/C=C/CN[C@@H]1C[C@H]1F 59fcf9eccbe4c5d0a12c0e318a9d8930 [1,0,0,1,0,0|2,0,0]=4 4926 B11R1.102 O=C(O)/C=C/CN[C@H]1C[C@@H]1F cc90b5155f9235fc47c0af46d1405924 [1,0,0,1,0,0|2,0,0]=4 4927 B11R1.102 O=C(O)/C=C/CN[C@H]1C[C@H]1F a4cea8ab89b9cb86b31a17b6b43861ec [1,0,0,1,0,0|2,0,0]=4 4928 B11R1.102 O=C(O)C=CCN[C@@H]1C[C@H]1F 05a8fb9bc4be8ad0bab448830e152439 [1,0,0,1,0,0|2,0,0]=4 4929 B11R1.102 O=C(O)C=CCN[C@H]1C[C@@H]1F 0c78767f5b277233447c6ada8b5a084e [1,0,0,1,0,0|2,0,0]=4 4930 B11R1.102 O=C(O)C=CCN[C@H]1C[C@H]1F 93d0bdf62b89f98a7c56938417683b28 [1,0,0,1,0,0|2,0,0]=4 4931 B11R1.143 CC(=O)N1CCCCCC1C 0b0f11c018b77ceb673643adf08c2408 [1,0,0,1,0,0|1,0,1]=4 4932 B11R1.172 CC(=O)CNCC1CCCC1 800b82f192e6095478611556b2672a2c [1,0,0,1,0,0|1,0,1]=4 4933 B11R1.172 CC(=O)COCC1CCCC1 87780bcc9709eef0316afed28b298097 [1,0,0,1,0,0|1,0,1]=4 4934 B11R1.172 CC(=O)NCCC1CCCC1 fbc141d594a57736dbd8cf80bf081fad [1,0,0,1,0,0|1,0,1]=4 4935 B11R1.172 O=C(O)/C=C/CN1CCSC1 d412ae0cc8da611ddbfb710a2e386027 [1,0,0,1,0,0|2,0,0]=4 4936 B11R1.172 O=C(O)C=CCN1CCSC1 b77747584fac9c90f5546d63db37bc26 [1,0,0,1,0,0|2,0,0]=4 4937 B11R1.172 O=C(O)CNCC1CCCC1 a418b6153ed46a2a6f91546a4f64b56b [1,0,0,1,0,0|1,0,1]=4 4938 B11R1.172 O=C(O)COCC1CCCC1 1a12f19c6aab26de4be4dc52bf7172ec [1,0,0,1,0,0|1,0,1]=4 4939 B11R1.174 CC(=O)CNCCC1CCC1 a6c0b7b56e06a8c8bc7cd1a55bab585e [1,0,0,1,0,0|1,0,1]=4 4940 B11R1.174 CC(=O)COCCC1CCC1 4944e2be1bb1a139c0b12602f14dd179 [1,0,0,1,0,0|1,0,1]=4 4941 B11R1.174 O=C(O)/C=C/CNC1CCC1 a3c37c4af58919d5567657503948b1d6 [1,0,0,1,0,0|1,0,0]=3 4942 B11R1.174 O=C(O)/C=C/CNC1COC1 230f801b45fe9539bba41e2abf34239a [1,0,0,1,0,0|2,0,0]=4 4943 B11R1.174 O=C(O)/C=C/COC1CCC1 eba3782a4e4cc66a5bfb29dc81eae30b [1,0,0,1,0,0|1,0,0]=3 4944 B11R1.174 O=C(O)/C=C/COC1COC1 e600e0e913179a19d0b7cc9965c1bbc7 [1,0,0,1,0,0|2,0,0]=4 4945 B11R1.174 O=C(O)/C=C/COC1CSC1 999917d1d38c17ed3ef4ac169a6526da [1,0,0,1,0,0|2,0,0]=4 4946 B11R1.174 O=C(O)C=CCNC1CCC1 59828b30656f6afe7f7831c7b759c254 [1,0,0,1,0,0|1,0,0]=3 4947 B11R1.174 O=C(O)C=CCNC1COC1 05e0f2487891bcbc8ac379ad283c80c0 [1,0,0,1,0,0|2,0,0]=4 4948 B11R1.174 O=C(O)C=CCOC1CCC1 a8981b98cb4b4a8155d006c6c810d681 [1,0,0,1,0,0|1,0,0]=3 4949 B11R1.174 O=C(O)C=CCOC1COC1 9acc62368830e4d83e9316ed5e36453a [1,0,0,1,0,0|2,0,0]=4 4950 B11R1.174 O=C(O)C=CCOC1CSC1 53be77af2d292e863c2e62fcd2f916eb [1,0,0,1,0,0|2,0,0]=4 4951 B11R1.174 O=C(O)CNCCC1CCC1 84612f195dec18bf1f89fbacb630f1f5 [1,0,0,1,0,0|1,0,1]=4 4952 B11R1.174 O=C(O)COCCC1CCC1 21d3e323d3716ddd98978256d1ef52c5 [1,0,0,1,0,0|1,0,1]=4 4953 B11R1.176 O=C(O)/C=C/CNCC1CC1 5809f6053394f5d2e14f65e9b148c738 [1,0,0,1,0,0|1,0,0]=3 4954 B11R1.176 O=C(O)/C=C/COCC1CC1 6a90aff4a4691358b10059906d4ee908 [1,0,0,1,0,0|1,0,0]=3 4955 B11R1.176 O=C(O)C=CCNCC1CC1 46988aaf59e617e7d6a68f9b414e55e6 [1,0,0,1,0,0|1,0,0]=3 4956 B11R1.176 O=C(O)C=CCOCC1CC1 157d4798fdcecff16644b75d8f00ca28 [1,0,0,1,0,0|1,0,0]=3 4957 B11R1.176 O=C(O)COCCCC1CC1 811bc90ad70ebad21f64225f344212bf [1,0,0,1,0,0|1,0,1]=4 4958 B11R1.706 CC(=O)N1CCCCCCC1 ff71a082476683b4f8504acf30a24baa [1,0,0,1,0,0|1,0,1]=4 4959 B11R1.742 CC(=O)NC1CCCCCC1 980c21986259e09356273dbf1a23f9df [1,0,0,1,0,0|1,0,1]=4 4960 B11R1.742 O=C(O)CN1CCCCCC1 d9f9edaddb25360088e69733dfba1666 [1,0,0,1,0,0|1,0,1]=4 4961 B11R1.4 CCCCCNc1ccoc1 873754c10feb0cec44bbaccf311bec49 [1,0,0,1,0,0|1,0,1]=4 4962 B11R1.4 CCCCCNc1ccon1 d671983adccc0fc95a3d5df61f1f0ab1 [1,0,0,1,0,0|2,0,0]=4 4963 B11R1.4 CCCCNCc1ccoc1 ab8253f518ded2d472c649b3f9cb4c45 [1,0,0,1,0,0|1,0,1]=4 4964 B11R1.4 CCCCNCc1ccon1 b62c6732cea5c05c18494a7f8bbe2930 [1,0,0,1,0,0|2,0,0]=4 4965 B11R1.4 CCCCOCc1ccoc1 1cadfa682bb5a9af12fa0ba0bf74414e [1,0,0,1,0,0|1,0,1]=4 4966 B11R1.4 CCCCOCc1ccon1 f54ac0bd5644c2d9e71697f56ba64fb7 [1,0,0,1,0,0|2,0,0]=4 4967 B11R1.4 CCCOCCc1ccoc1 bc991c92cafa29c358102c9d241d422b [1,0,0,1,0,0|1,0,1]=4 4968 B11R1.4 CCCOCCc1ccon1 fb90bcf3e81f1f8e1cf2ba4638065286 [1,0,0,1,0,0|2,0,0]=4 4969 B11R1.47 C/C=C/C=C/COC1CCC1 6b634755da4890c0823a82e2f17143a4 [1,0,0,1,0,0|2,0,0]=4 4970 B11R1.47 CC=CC=CCOC1CCC1 a017f3879422ef9922207e9373629d03 [1,0,0,1,0,0|2,0,0]=4 4971 B11R1.1 CCCOC1CCC(=O)OC1 14f68677ebd93dd79e6aff031f73ae29 [1,0,0,1,0,0|1,0,1]=4 4972 B11R1.25 CCC(=O)NCC1CCCC1 c4f7a0ef14d38131f5bfe5b834523fe9 [1,0,0,1,0,0|2,0,0]=4 4973 B11R1.25 COC(=O)CNC1CCCC1 b87ff11671c5cc80045ee4f67f2c7d8b [1,0,0,1,0,0|1,0,1]=4 4974 B11R1.25 COC(=O)COC1CCCC1 085020e1b123128ec3ee74cb59ea108d [1,0,0,1,0,0|1,0,1]=4 4975 B11R1.59 CCC(=O)N1CCCC1CC 2ce87378127394d65266906acf474f6e [1,0,0,1,0,0|2,0,0]=4 4976 B11R1.59 CCC(=O)N1CCC[C@H]1CC 6dd4884ad62ec61fc10830857b5556fa [1,0,0,1,0,0|2,0,0]=4 4977 B11R1.59 CCN1CCCC1C(=O)OC 57fe510e52d7fd74edb8165001a3cb0f [1,0,0,1,0,0|1,0,1]=4 4978 B11R1.59 CCN1CCC[C@H]1C(=O)OC dadddfa392d6d0edd0fd11c46811b3b9 [1,0,0,1,0,0|1,0,1]=4 4979 B11R1.115 CCCN1CC[C@@H]1C(=O)OC c4d0d2b7afd55bcbcd4477409e2cf1ae [1,0,0,1,0,0|1,0,1]=4 4980 B11R1.218 CCCCN1CC1C(=O)OC 44c7d158c595a9ae51b842328cff690c [1,0,0,1,0,0|1,0,1]=4 4981 B11R1.218 CCCCN1C[C@H]1C(=O)OC f02e02ebaf3226844e1a140d5706d93b [1,0,0,1,0,0|1,0,1]=4 4982 B11R1.218 CCCNC1CC1C(=O)OC 9595ea4e4784e12ebc0f81aca48c0c41 [1,0,0,1,0,0|1,0,1]=4 4983 B11R1.218 CCCOC1CC1C(=O)OC 59b5d33cee1671ee5db2fc6a97a054ed [1,0,0,1,0,0|1,0,1]=4 4984 B11R1.218 CCOCC1CC1C(=O)OC 993cad79d75e436dd18401df44904722 [1,0,0,1,0,0|1,0,1]=4 4985 B11R1.218 CCOC[C@@H]1C[C@@H]1C(=O)OC 57b83ee718142465e26e034265afb97d [1,0,0,1,0,0|1,0,1]=4 4986 B11R1.218 CCOC[C@@H]1C[C@H]1C(=O)OC ab694afdbd6926b26b6b10dc47f5a938 [1,0,0,1,0,0|1,0,1]=4 4987 B11R1.218 CCOC[C@H]1C[C@@H]1C(=O)OC 6596fd83b996594c40e13637dbf9de4e [1,0,0,1,0,0|1,0,1]=4 4988 B11R1.222 CCC(=O)N1CCCCC1C 9f8997a43a0135743998f58647508ffc [1,0,0,1,0,0|2,0,0]=4 4989 B11R1.222 CCC(=O)N1CCCC[C@@H]1C b83df98c72b4c39c4638f2400442f81a [1,0,0,1,0,0|2,0,0]=4 4990 B11R1.222 CCC(=O)N1CCCC[C@H]1C ea345c17f894328087f191f4cea87dc5 [1,0,0,1,0,0|2,0,0]=4 4991 B11R1.223 COC(=O)CN[C@@H]1CC[C@H]1C 8cc1099987a14755bb326b9cf2f92721 [1,0,0,1,0,0|1,0,1]=4 4992 B11R1.223 COC(=O)CN[C@H]1CC[C@H]1C 1fa625a5e83c05d76a7f8e7f14f61158 [1,0,0,1,0,0|1,0,1]=4 4993 B11R1.228 COC(=O)CN1CCCC1C a42739d97a82c5ae3be363bbad65c1e8 [1,0,0,1,0,0|1,0,1]=4 4994 B11R1.228 COC(=O)CN1CCC[C@@H]1C 1192220f15b69db24025cd75b8c5c11e [1,0,0,1,0,0|1,0,1]=4 4995 B11R1.228 COC(=O)CN1CCC[C@H]1C bf37025eab3cd6aff9a0e0a086a3cf6c [1,0,0,1,0,0|1,0,1]=4 4996 B11R1.235 COC(=O)CCNC1CC1C 7e2d7925952763426c1fdcb3332cd11c [1,0,0,1,0,0|1,0,1]=4 4997 B11R1.235 COC(=O)COCC1CC1C 642422785b13dfbc2a58fed7d26da21a [1,0,0,1,0,0|1,0,1]=4 4998 B11R1.235 COC(=O)COC[C@@H]1C[C@@H]1C ac81e2d9e5c9300b8a4f5b0a0b55d590 [1,0,0,1,0,0|1,0,1]=4 4999 B11R1.235 COC(=O)COC[C@@H]1C[C@H]1C 0e57680fa8952696ce0012ec8117c7ed [1,0,0,1,0,0|1,0,1]=4 5000 B11R1.235 COC(=O)COC[C@H]1C[C@@H]1C f7f3e3103956f375d92f46e823eb60c6 [1,0,0,1,0,0|1,0,1]=4 5001 B11R1.235 COC(=O)OCNC1CC1C 2ad71e09a667bf38156f653e8a8bfb31 [1,0,0,1,0,0|2,0,0]=4 5002 B11R1.236 CCC(=O)NCCC1CCC1 424ecc43df8cb195dcf80d34a2290143 [1,0,0,1,0,0|2,0,0]=4 5003 B11R1.236 COC(=O)/C=C/CN1CCC1 fdf769d6953d84152876c5b19bfd7cdd [1,0,0,1,0,0|1,0,0]=3 5004 B11R1.236 COC(=O)/C=C\CN1CCC1 28644bf173cd3e0d1b1fe2c6b528c0f8 [1,0,0,1,0,0|1,0,0]=3 5005 B11R1.236 COC(=O)C=CCN1CCC1 83466418865fb8383c7ef2efb622b0e7 [1,0,0,1,0,0|1,0,0]=3 5006 B11R1.236 COC(=O)CCCN1CCC1 74402e37f99601995584ee802ee8d703 [1,0,0,1,0,0|1,0,1]=4 5007 B11R1.236 COC(=O)CCNC1CCC1 c703a29c0eed4e72bf5cc8eeec312367 [1,0,0,1,0,0|1,0,1]=4 5008 B11R1.236 COC(=O)CCOC1CCC1 a7f60890365a15910d6ce48e4d80abc2 [1,0,0,1,0,0|1,0,1]=4 5009 B11R1.236 COC(=O)CNCC1CCC1 09171f32f7240e23e29fdd51fc4c3059 [1,0,0,1,0,0|1,0,1]=4 5010 B11R1.236 COC(=O)COCC1CCC1 4ff67b75b106ed4edba88ae986d451f1 [1,0,0,1,0,0|1,0,1]=4 5011 B11R1.236 COC(=O)OCNC1CCC1 aff8c84d820034a3388284a9ef90a527 [1,0,0,1,0,0|2,0,0]=4 5012 B11R1.236 COC(=O)OCOC1CCC1 2dc207e9753dd047a880f8af9f9fc760 [1,0,0,1,0,0|2,0,0]=4 5013 B11R1.237 COC(=O)/C=C/CNC1CC1 fb39fc65e5c9af4e9a1abcb7740f2c17 [1,0,0,1,0,0|1,0,0]=3 5014 B11R1.237 COC(=O)/C=C/COC1CC1 58a401c2970cee1259998a85a76029e7 [1,0,0,1,0,0|1,0,0]=3 5015 B11R1.237 COC(=O)/C=C\CNC1CC1 62d521d5cbc7e6e3c47e5602fd64ea5c [1,0,0,1,0,0|1,0,0]=3 5016 B11R1.237 COC(=O)/C=C\COC1CC1 6f0b84e407a503acf1c2d225743621b5 [1,0,0,1,0,0|1,0,0]=3 5017 B11R1.237 COC(=O)C=CCNC1CC1 6f7eb8fc8510a7d29c3c06ba63803afd [1,0,0,1,0,0|1,0,0]=3 5018 B11R1.237 COC(=O)C=CCOC1CC1 818a57deec09a53a2628fea6d8db8755 [1,0,0,1,0,0|1,0,0]=3 5019 B11R1.237 COC(=O)CCCNC1CC1 91f122205aef264300272f7c71644f72 [1,0,0,1,0,0|1,0,1]=4 5020 B11R1.237 COC(=O)CCCOC1CC1 ce0aa01a0a22e22e273fc191e24962c2 [1,0,0,1,0,0|1,0,1]=4 5021 B11R1.237 COC(=O)CCNCC1CC1 5637813e47e4a9a39fb2139d614ec349 [1,0,0,1,0,0|1,0,1]=4 5022 B11R1.237 COC(=O)CCOCC1CC1 06fb4c15cedba387b690c0fd3c66e5c6 [1,0,0,1,0,0|1,0,1]=4 5023 B11R1.237 COC(=O)CNCCC1CC1 ad9b2757e698349a4cc88ccd892e85c6 [1,0,0,1,0,0|1,0,1]=4 5024 B11R1.237 COC(=O)COCCC1CC1 3f5d9037052dd112f065415a5e13b31e [1,0,0,1,0,0|1,0,1]=4 5025 B11R1.237 COC(=O)OCCOC1CC1 dcfcb2cf70b06d0935ce2516c06ad540 [1,0,0,1,0,0|2,0,0]=4 5026 B11R1.237 COC(=O)OCNCC1CC1 0774278246b758d31975d94dc3fac553 [1,0,0,1,0,0|2,0,0]=4 5027 B11R1.237 COC(=O)OCOCC1CC1 6f650c75d4f1bdbe126e93a1dfc77e0a [1,0,0,1,0,0|2,0,0]=4 5028 B11R1.272 CCC1CCN1CC(=O)OC 5734891ca1bd5022570b4186c00e22c2 [1,0,0,1,0,0|1,0,1]=4 5029 B11R1.852 CCC(=O)N1CCCCCC1 ad10cabe38a2ba06b9fbc202cc4d0017 [1,0,0,1,0,0|2,0,0]=4 5030 B13R1.6 CCCCCCN1CCOC(=O)C1 cd0966c31e6bdf74c976738e13f992c9 [0,1,0,1,0,0|1,0,1]=4 5031 B13R1.6 CCCCCOC1=CC(=O)CCC1 9cc40e8a9c314872c6e6f7594414cf08 [0,1,0,1,0,0|2,0,0]=4 5032 B13R1.42 CCOC(=O)CNC1CCCCC1 16f54310e993370e2e1d3a832339ce63 [0,1,0,1,0,0|1,0,1]=4 5033 B13R1.42 CCOC(=O)COC1CCCCC1 05ac9ffc5ce4489fae0e01beb476e9fc [0,1,0,1,0,0|1,0,1]=4 5034 B13R1.42 COCC(=O)COC1CCCCC1 9f16844a443a9c1d37a607df6669585d [0,1,0,1,0,0|1,0,1]=4 5035 B13R1.42 COCC(=O)NCC1CCCCC1 ad6e42bc2ef1d6829ace656e5c21cef6 [0,1,0,1,0,0|1,0,1]=4 5036 B13R1.42 N#CNC(=O)/C=C/C1CCCCC1 5083177c2802b8acd7a0c9502d8de7dc [0,1,0,1,0,0|1,0,1]=4 5037 B13R1.42 N#CNC(=O)C=CC1CCCCC1 0c368892dd2c27d9d661d8763a742c96 [0,1,0,1,0,0|1,0,1]=4 5038 B13R1.190 CCCCCNc1cc(=O)[nH]n1C d02e009edfe4961619cb0ac3dcd2ea27 [0,1,0,1,0,0|2,0,0]=4 5039 B13R1.190 CCCCNCc1cc(oc1C)C 16bad6af924474795ae500742ab8232d [0,1,0,1,0,0|2,0,0]=4 5040 B13R1.190 CCCCNCc1oc(=O)oc1C 3d5f5dd8b8842c00521575b20c74fb96 [0,1,0,1,0,0|2,0,0]=4 5041 B13R1.190 CCCCOCc1cc(oc1C)C a6559da3cd141bb1790b97afe3753c90 [0,1,0,1,0,0|2,0,0]=4 5042 B13R1.190 CCCCOCc1oc(=O)oc1C 156659b1b719749c33b68fcf2eeddc29 [0,1,0,1,0,0|2,0,0]=4 5043 B13R1.404 CCOC(=O)/C=C/CN1CCSC1 656fd45f76a3939149bc146a28b3a439 [0,1,0,1,0,0|2,0,0]=4 5044 B13R1.404 CCOC(=O)C=CCN1CCSC1 02c2e00d9a08900202ae34993cbbe9c9 [0,1,0,1,0,0|2,0,0]=4 5045 B13R1.404 CCOC(=O)CNCC1CCCC1 a270958ce7b4843a1cbd708614b75fa3 [0,1,0,1,0,0|1,0,1]=4 5046 B13R1.404 CCOC(=O)COCC1CCCC1 fa8fee2a54372431a12f70717e92b180 [0,1,0,1,0,0|1,0,1]=4 5047 B13R1.404 COCC(=O)CNCC1CCCC1 8ec0033329e311b091b657ae71e74d73 [0,1,0,1,0,0|1,0,1]=4 5048 B13R1.404 COCC(=O)COCC1CCCC1 91e9cf4ecc330c1b034bfbae6b838514 [0,1,0,1,0,0|1,0,1]=4 5049 B13R1.404 COCC(=O)NCCC1CCCC1 4c28779956abb195d5cb8692b4ba7d11 [0,1,0,1,0,0|1,0,1]=4 5050 B13R1.443 CCC1CCCN1CC(=O)COC 0b75b22ea3e00a0db789e8c2ac89baba [0,1,0,1,0,0|1,0,1]=4 5051 B13R1.443 CCOC(=O)CN1CCCC1CC 9e8b1738f8d1071d2c5a108dc9a71de6 [0,1,0,1,0,0|1,0,1]=4 5052 B13R1.443 CCOC(=O)CN1CCC[C@H]1CC 5ac92083e2b15d98df94af32b7053bf2 [0,1,0,1,0,0|1,0,1]=4 5053 B13R1.443 CC[C@@H]1CCCN1CC(=O)COC 7d63fbb9cb00871e39d038682ede70a5 [0,1,0,1,0,0|1,0,1]=4 5054 B13R1.443 CC[C@@H]1CCC[C@H]1NC(=O)COC 058c431a3f8d473411ce41ab1121c162 [0,1,0,1,0,0|1,0,1]=4 5055 B13R1.444 CCOC(=O)COC1CCCC1C 10ac12519c183fc31267280723db4fbd [0,1,0,1,0,0|1,0,1]=4 5056 B13R1.444 CCOC(=O)CO[C@@H]1CCC[C@@H]1C d04871114d543adc7edebb5c647d898d [0,1,0,1,0,0|1,0,1]=4 5057 B13R1.444 CCOC(=O)CO[C@@H]1CCC[C@H]1C 00a0e2195820fdc39410eef05ecc9045 [0,1,0,1,0,0|1,0,1]=4 5058 B13R1.444 CCOC(=O)CO[C@H]1CCC[C@@H]1C f3671fbdc653e45ab502c0657a46cd27 [0,1,0,1,0,0|1,0,1]=4 5059 B13R1.444 CCOC(=O)CO[C@H]1CCC[C@H]1C 08ae4a12af296edbbf3e18c14587266b [0,1,0,1,0,0|1,0,1]=4 5060 B13R1.444 COCC(=O)COC1CCCC1C d8bf2d645e96b39b64317ea12d129c76 [0,1,0,1,0,0|1,0,1]=4 5061 B13R1.444 COCC(=O)CO[C@@H]1CCC[C@@H]1C 316f70c36d513686d3ed3bf400bd6d2d [0,1,0,1,0,0|1,0,1]=4 5062 B13R1.444 COCC(=O)CO[C@@H]1CCC[C@H]1C e55523e965a85dcecdbdb43ecad1c5d8 [0,1,0,1,0,0|1,0,1]=4 5063 B13R1.444 COCC(=O)CO[C@H]1CCC[C@@H]1C 658751177fe8ed8b33400cdc573adddf [0,1,0,1,0,0|1,0,1]=4 5064 B13R1.444 COCC(=O)CO[C@H]1CCC[C@H]1C 8b2168b7ad6a94ffa7757537902695f9 [0,1,0,1,0,0|1,0,1]=4 5065 B13R1.447 CCOC(=O)/C=C/CNC1CC1C 7daa851da3be4efabd44ed2957a561e4 [0,1,0,1,0,0|1,0,0]=3 5066 B13R1.447 CCOC(=O)/C=C/CN[C@@H]1C[C@H]1F 1ebc2683f2db48b4792fbd2a5bcc1907 [0,1,0,1,0,0|2,0,0]=4 5067 B13R1.447 CCOC(=O)/C=C/CN[C@H]1C[C@@H]1F 2b0cabda36d5d9a83bebdb441220d460 [0,1,0,1,0,0|2,0,0]=4 5068 B13R1.447 CCOC(=O)/C=C/CN[C@H]1C[C@H]1F 76dabaf29787f068d7f504e6f98b20be [0,1,0,1,0,0|2,0,0]=4 5069 B13R1.447 CCOC(=O)C=CCNC1CC1C 6757c879f031ab1ac6939e6a594d2fce [0,1,0,1,0,0|1,0,0]=3 5070 B13R1.447 CCOC(=O)C=CCN[C@@H]1C[C@H]1F d82b8477c758d87d4787907e7ee17135 [0,1,0,1,0,0|2,0,0]=4 5071 B13R1.447 CCOC(=O)C=CCN[C@H]1C[C@@H]1F 9d2c69a82f4bee0135c99438ef16b9c1 [0,1,0,1,0,0|2,0,0]=4 5072 B13R1.447 CCOC(=O)C=CCN[C@H]1C[C@H]1F 9914178ba11409c7567599abef991c55 [0,1,0,1,0,0|2,0,0]=4 5073 B13R1.448 CCOC(=O)/C=C/CNC1CCC1 e6894abac870b9f50fe660d84620981f [0,1,0,1,0,0|1,0,0]=3 5074 B13R1.448 CCOC(=O)/C=C/CNC1COC1 41efd943283fa343d95ba9c97ec04feb [0,1,0,1,0,0|2,0,0]=4 5075 B13R1.448 CCOC(=O)/C=C/COC1CCC1 3948f37917ae186ac8ab946c79980ad1 [0,1,0,1,0,0|1,0,0]=3 5076 B13R1.448 CCOC(=O)/C=C/COC1COC1 9d1d565fd51556367a5b704e2f095492 [0,1,0,1,0,0|2,0,0]=4 5077 B13R1.448 CCOC(=O)/C=C/COC1CSC1 edf4eb26dad23d5d726699394fa8b148 [0,1,0,1,0,0|2,0,0]=4 5078 B13R1.448 CCOC(=O)C=CCCN1CCC1 c80bc22146e1ce3734f4892d64f8fbfd [0,1,0,1,0,0|1,0,0]=3 5079 B13R1.448 CCOC(=O)C=CCNC1CCC1 625c38f38c45513023407b1254ea31a2 [0,1,0,1,0,0|1,0,0]=3 5080 B13R1.448 CCOC(=O)C=CCNC1COC1 b9577cfc6dde5716a4b64d21b83b2d86 [0,1,0,1,0,0|2,0,0]=4 5081 B13R1.448 CCOC(=O)C=CCOC1CCC1 4fac05631889556de1d4f0a6f733b970 [0,1,0,1,0,0|1,0,0]=3 5082 B13R1.448 CCOC(=O)C=CCOC1COC1 33e6f6ac75e11d71b5de71f572653245 [0,1,0,1,0,0|2,0,0]=4 5083 B13R1.448 CCOC(=O)C=CCOC1CSC1 5b00edb0f3eb9be763462c1e8fbd2a93 [0,1,0,1,0,0|2,0,0]=4 5084 B13R1.448 CCOC(=O)CNCCC1CCC1 ac88be3c9375bc029f275ccc0afd2247 [0,1,0,1,0,0|1,0,1]=4 5085 B13R1.448 CCOC(=O)COCCC1CCC1 caf2d355d3ad89cdae9f167cb232519a [0,1,0,1,0,0|1,0,1]=4 5086 B13R1.448 COCC(=O)CNCCC1CCC1 b57e7562756e5dbf74537a9153ad6a9a [0,1,0,1,0,0|1,0,1]=4 5087 B13R1.448 COCC(=O)COCCC1CCC1 6f36546a5d0ba30504595faf526a9b19 [0,1,0,1,0,0|1,0,1]=4 5088 B13R1.453 CCOC(=O)/C=C/CCOC1CC1 1b2755d2a69100721c7a536a10649269 [0,1,0,1,0,0|1,0,0]=3 5089 B13R1.453 CCOC(=O)/C=C/CNCC1CC1 7ace004132d9eab6be649706fabe4a1f [0,1,0,1,0,0|1,0,0]=3 5090 B13R1.453 CCOC(=O)/C=C/COCC1CC1 6f76d6abe8d2574192afc745c982cf4f [0,1,0,1,0,0|1,0,0]=3 5091 B13R1.453 CCOC(=O)C=CCCNC1CC1 29833f1bc8b06a05b3872ec37f798384 [0,1,0,1,0,0|1,0,0]=3 5092 B13R1.453 CCOC(=O)C=CCCOC1CC1 aac8d136089875158266c9e542a772f9 [0,1,0,1,0,0|1,0,0]=3 5093 B13R1.453 CCOC(=O)C=CCNCC1CC1 03a7d06b25236f775e4f6add5a594624 [0,1,0,1,0,0|1,0,0]=3 5094 B13R1.453 CCOC(=O)C=CCOCC1CC1 73db623e80928ced64a7c7f693843d75 [0,1,0,1,0,0|1,0,0]=3 5095 B13R1.453 CCOC(=O)COCCCC1CC1 af93b06c427590c4df1835b26893e6aa [0,1,0,1,0,0|1,0,1]=4 5096 B13R1.453 COCC(=O)COCCCC1CC1 85815fd1f342968ed14ff1f43028195f [0,1,0,1,0,0|1,0,1]=4 5097 B13R1.463 COCC(=O)N1CCCCCC1C a48a8bfacefa810c330218b82fc06d91 [0,1,0,1,0,0|1,0,1]=4 5098 B13R1.464 CCC1CCCCN1C(=O)COC e0126eb77124f30d8e8a677af2f2c811 [0,1,0,1,0,0|1,0,1]=4 5099 B13R1.464 CC[C@@H]1CCCCN1C(=O)COC 2a1d2534f48ec68d8a04288a0e85d2ed [0,1,0,1,0,0|1,0,1]=4 5100 B13R1.464 CC[C@H]1CCCCN1C(=O)COC 4110ccfd01856759b3a8c89e5bacf7b3 [0,1,0,1,0,0|1,0,1]=4 5101 B13R1.470 CCOC(=O)CN1CCCCC1C 535378c9a650a897fb5b24f9be86001d [0,1,0,1,0,0|1,0,1]=4 5102 B13R1.470 CCOC(=O)CN1CCCC[C@@H]1C 794146e07a985f98a6ecbb558c59bd06 [0,1,0,1,0,0|1,0,1]=4 5103 B13R1.470 CCOC(=O)CN1CCCC[C@H]1C f59669138b1c36292c0b545ca7447685 [0,1,0,1,0,0|1,0,1]=4 5104 B13R1.470 COCC(=O)NC1CCCCC1C 867eb86430ccbcb6b70f742f9fa9f2fc [0,1,0,1,0,0|1,0,1]=4 5105 B13R1.470 COCC(=O)N[C@@H]1CCCC[C@@H]1C 0b212432f9fac7873f94375f61e80f50 [0,1,0,1,0,0|1,0,1]=4 5106 B13R1.470 COCC(=O)N[C@@H]1CCCC[C@H]1C f35f71b2dbfeee215603a953b9ffb07c [0,1,0,1,0,0|1,0,1]=4 5107 B13R1.470 COCC(=O)N[C@H]1CCCC[C@@H]1C 6f75fd1c35ddd502065c761d2911104d [0,1,0,1,0,0|1,0,1]=4 5108 B13R1.470 COCC(=O)N[C@H]1CCCC[C@H]1C 1e2d96580c0cf7b4f4b9de34de1c372b [0,1,0,1,0,0|1,0,1]=4 5109 B13R1.654 CCCCCCNC1CONC1=O a411303d9caa2dffff7d34a0afac119a [0,1,0,1,0,0|1,0,1]=4 5110 B13R1.654 CCCCCCN[C@@H]1CCOC1=O 9a949eebaeaa55ab73d8dd7129aa98d4 [0,1,0,1,0,0|1,0,1]=4 5111 B13R1.654 CCCCCCN[C@@H]1CONC1=O fade032940d0e0974fbb330760353de2 [0,1,0,1,0,0|1,0,1]=4 5112 B13R1.654 CCCCCCN[C@H]1CCOC1=O 601339c92ed17b576b2ee00fa96d9f99 [0,1,0,1,0,0|1,0,1]=4 5113 B13R1.654 CCCCCCN[C@H]1CONC1=O e85424abd566b42f44ffb8afd629358e [0,1,0,1,0,0|1,0,1]=4 5114 B13R1.654 CCCCCCNc1no[nH]c1=O 0cd13fa0647375f365df916277e710df [0,1,0,1,0,0|2,0,0]=4 5115 B13R1.654 CCCCCCOC1=CCCC1=O aa443f56592ff50e5e7ea5912440f240 [0,1,0,1,0,0|2,0,0]=4 5116 B13R1.1464 COCC(=O)N1CCCCCCC1 04c788917c5fcbee8d90b6e1678a9fb7 [0,1,0,1,0,0|1,0,1]=4 5117 B13R1.1575 CCOC(=O)CN1CCCCCC1 b66a5de06402119d233a4472db419f7c [0,1,0,1,0,0|1,0,1]=4 5118 B13R1.1575 COCC(=O)NC1CCCCCC1 71ad0e73b8a4ce53c03e5b2220822219 [0,1,0,1,0,0|1,0,1]=4 5119 B13R1.1575 N#CNC(=O)C=C1CCCCCC1 364abfa90fb1bc3daf584bf99abfd3f3 [0,1,0,1,0,0|1,0,1]=4 5120 B13R1.102 CCC(=O)C(=O)N1CCCC1CC 730406053f833632d691e8d4c6372a34 [0,1,0,1,0,0|2,0,0]=4 5121 B13R1.102 CCC(=O)C(=O)N1CCC[C@H]1CC f2347b80b2af98c2d4ea5145358de91e [0,1,0,1,0,0|2,0,0]=4 5122 B13R1.102 CCC1CCCN1C(=O)C(=O)NC 85fb56886ab065047f30b5479ff3cffa [0,1,0,1,0,0|2,0,0]=4 5123 B13R1.102 CCC1CCCN1C(=O)C(=O)OC 22d866580e7a8200b776726ea3e6fa0a [0,1,0,1,0,0|1,0,0]=3 5124 B13R1.102 CCC1CCCN1C(C)C(=O)OC b0d4bd4a14c1fc831ef27c1d8cd333cf [0,1,0,1,0,0|1,0,1]=4 5125 B13R1.102 CCC1CCCN1[C@@H](C)C(=O)OC 7ed06b32ee2eb232720314329d915a83 [0,1,0,1,0,0|1,0,1]=4 5126 B13R1.102 CCC1CCCN1[C@H](C)C(=O)OC 0e1d21e610cc788200bcee382dc03f59 [0,1,0,1,0,0|1,0,1]=4 5127 B13R1.102 CC[C@@H]1CCCN1C(=O)C(=O)NC 64baaf995e92b82f82dac7956b59c087 [0,1,0,1,0,0|2,0,0]=4 5128 B13R1.102 CC[C@@H]1CCCN1C(=O)C(=O)OC 4b0c367c7b1b6cb371e9ad37a749ba20 [0,1,0,1,0,0|1,0,0]=3 5129 B13R1.102 CC[C@@H]1CCCN1C(C)C(=O)OC 8e7ea46626b6e6e759e3365cfe075fd1 [0,1,0,1,0,0|1,0,1]=4 5130 B13R1.102 CC[C@@H]1CCCN1[C@@H](C)C(=O)OC e66ff013e4adbcb33362919bcc73d39d [0,1,0,1,0,0|1,0,1]=4 5131 B13R1.102 CC[C@@H]1CCCN1[C@H](C)C(=O)OC 0a38342eabf9f967cf8bef8c6ac29a29 [0,1,0,1,0,0|1,0,1]=4 5132 B13R1.102 COC(=O)C(=O)N1CCCC1CO b1565eff4e206769f2e63f65616e7cba [0,1,0,1,0,0|2,0,0]=4 5133 B13R1.102 COC(=O)C(=O)N1CCCC1OC 4707a325957ad463fa8747812cc994f7 [0,1,0,1,0,0|2,0,0]=4 5134 B13R1.102 COC(=O)C(=O)N1CCC[C@@H]1CF 6c18c64e51af779d97561b86d9192dba [0,1,0,1,0,0|2,0,0]=4 5135 B13R1.102 COC(=O)C(=O)N1CCC[C@@H]1CO a088842d86f50f48d4017f44c9306ba6 [0,1,0,1,0,0|2,0,0]=4 5136 B13R1.102 COC(=O)C(=O)N1CCC[C@H]1CF 6cc29380596112ede4b3dd2810b36985 [0,1,0,1,0,0|2,0,0]=4 5137 B13R1.102 COC(=O)C(=O)N1CCC[C@H]1CO dc946483d7788314ba946b606ff3e58c [0,1,0,1,0,0|2,0,0]=4 5138 B13R1.135 COC(=O)C(=O)NC1CCCOC1 11bcfe8a37196e1ab0f505899a7d4feb [0,1,0,1,0,0|2,0,0]=4 5139 B13R1.135 COC(=O)C(=O)NC1CCOCC1 cb85f9c672a366a3b2823637f7d64a82 [0,1,0,1,0,0|2,0,0]=4 5140 B13R1.135 COC(=O)C(=O)N[C@@H]1CCCOC1 52cb5ebd344f31f6bc355551e97efb92 [0,1,0,1,0,0|2,0,0]=4 5141 B13R1.135 COC(=O)C(=O)N[C@H]1CCCOC1 7049217a5a7df44252c9e5dea049ceac [0,1,0,1,0,0|2,0,0]=4 5142 B13R1.135 COC(=O)C(C)OC1CCCCC1 1e90fd508e2358c19d8969d36684f5a8 [0,1,0,1,0,0|1,0,1]=4 5143 B13R1.135 COC(=O)[C@@H](C)OC1CCCCC1 fe22f8573de46b19817d0255510c7b16 [0,1,0,1,0,0|1,0,1]=4 5144 B13R1.135 COC(=O)[C@H](C)OC1CCCCC1 e5085aa643a68b53ef00092d2d008b66 [0,1,0,1,0,0|1,0,1]=4 5145 B13R1.212 COC[C@@H]1C[C@@H]1NC(=O)C(=O)OC 2af50f78530b24d5d39d52a170bbb4e6 [0,1,0,1,0,0|2,0,0]=4 5146 B13R1.212 COC[C@H]1C[C@@H]1NC(=O)C(=O)OC f86c7bd3d59eab39b7ca46afa06bae04 [0,1,0,1,0,0|2,0,0]=4 5147 B13R1.217 COC(=O)C(=O)N1CCC1CCO 190be3fd29d368e2ac1d067c0ba13050 [0,1,0,1,0,0|2,0,0]=4 5148 B13R1.217 COCC1CCN1C(=O)C(=O)OC 15963de7352fad6d094810a63cbf5a92 [0,1,0,1,0,0|2,0,0]=4 5149 B13R1.217 COC[C@@H]1CCN1C(=O)C(=O)OC 982f67be5a3f4868037148849f0229b4 [0,1,0,1,0,0|2,0,0]=4 5150 B13R1.217 COC[C@H]1CCN1C(=O)C(=O)OC ec1b2bd14d37ec411645cd3f3ce21ec6 [0,1,0,1,0,0|2,0,0]=4 5151 B13R1.495 CCCNC1CC=C(C1)C(=O)OC f2d5a83ce79133680e352036bd496cf7 [0,1,0,1,0,0|1,0,0]=3 5152 B13R1.495 COC(=O)C1=CCC(C1)NCCF 8640429f358c359e1e019c30d23d1142 [0,1,0,1,0,0|2,0,0]=4 5153 B13R1.495 COC(=O)C1=CCC(C1)NCCO 05a981b301e59969583b91c57ad74a68 [0,1,0,1,0,0|2,0,0]=4 5154 B13R1.495 COC(=O)C1=CCC(C1)NCCS 90b3a0a5f2858de346d1d3c0347d84d6 [0,1,0,1,0,0|2,0,0]=4 5155 B13R1.495 COC(=O)C1=CCC(C1)NCSC dece9c7a74e97be4465762683943f83b [0,1,0,1,0,0|2,0,0]=4 5156 B13R1.495 COCNC1CC=C(C1)C(=O)OC 72964a923086b6c9bfb299f469a67c25 [0,1,0,1,0,0|2,0,0]=4 5157 B13R1.554 C=C(CNC1CCCC1)C(=O)OC 246cb474c8f3a7b6a5a7bf504aae16ba [0,1,0,1,0,0|1,0,1]=4 5158 B13R1.554 C=C(COC1CCCC1)C(=O)OC 374745021501d20a24e174d086e39bf8 [0,1,0,1,0,0|1,0,1]=4 5159 B13R1.554 CCC(=O)C(=O)NCC1CCCC1 3bbdeb814879c363ff7fcdec9eda5c2a [0,1,0,1,0,0|2,0,0]=4 5160 B13R1.554 CNC(=O)C(=O)NCC1CCCC1 748e958934766abe88ecc9edc1d1ff44 [0,1,0,1,0,0|2,0,0]=4 5161 B13R1.554 COC(=O)C(=COC1CCCC1)F d8e3e183b454935f0771c7ec3a261f7f [0,1,0,1,0,0|1,0,0]=3 5162 B13R1.554 COC(=O)C(=COC1CCOC1)F 883fda9d129c6c5452d4438435727fe6 [0,1,0,1,0,0|2,0,0]=4 5163 B13R1.554 COC(=O)C(=CO[C@@H]1CCOC1)F f9b579dc75d5a3b5445bbca1dc5bd587 [0,1,0,1,0,0|2,0,0]=4 5164 B13R1.554 COC(=O)C(=CO[C@H]1CCOC1)F ddbedfad3e62e2a3a0fd9c22f61b8918 [0,1,0,1,0,0|2,0,0]=4 5165 B13R1.554 COC(=O)C(=O)CNC1CCCC1 7a50531dc896372f8c9b0b4e76d42771 [0,1,0,1,0,0|1,0,1]=4 5166 B13R1.554 COC(=O)C(=O)COC1CCCC1 c524335fd1edd8db89c70d44c1bcd273 [0,1,0,1,0,0|1,0,1]=4 5167 B13R1.554 COC(=O)C(=O)NCC1CCCC1 bdd693656abb0ff8c31cd7f78c9e6085 [0,1,0,1,0,0|1,0,0]=3 5168 B13R1.554 COC(=O)C(=O)NCC1CCCO1 35a3650dfd56d41ceb3e023939e517c4 [0,1,0,1,0,0|2,0,0]=4 5169 B13R1.554 COC(=O)C(=O)NCC1CCOC1 0a7387e25a3fbdb66928d15762079fe6 [0,1,0,1,0,0|2,0,0]=4 5170 B13R1.554 COC(=O)C(=O)NC[C@@H]1CCCO1 945b21f3a4cb9282dc80a46cc672fea5 [0,1,0,1,0,0|2,0,0]=4 5171 B13R1.554 COC(=O)C(=O)NC[C@@H]1CCOC1 c88fd819ee845621f4c825a66b68c6c8 [0,1,0,1,0,0|2,0,0]=4 5172 B13R1.554 COC(=O)C(=O)NC[C@H]1CCCO1 0f05967ccbe7822e9fce71940fe011c0 [0,1,0,1,0,0|2,0,0]=4 5173 B13R1.554 COC(=O)C(=O)NC[C@H]1CCOC1 ed8a4c06c5c475a02df4377f4971500b [0,1,0,1,0,0|2,0,0]=4 5174 B13R1.554 COC(=O)C(C)NCC1CCCC1 e87100a3fb6664507d890aba74bd15d0 [0,1,0,1,0,0|1,0,1]=4 5175 B13R1.554 COC(=O)C(C)OCC1CCCC1 821146585c2c8a487ff308b445c19033 [0,1,0,1,0,0|1,0,1]=4 5176 B13R1.554 COC(=O)[C@@H](C)NCC1CCCC1 f0febadffa310ba7b48118f21590c616 [0,1,0,1,0,0|1,0,1]=4 5177 B13R1.554 COC(=O)[C@@H](C)OCC1CCCC1 3a2e737e8b0dbaaa39185ff7ea699d6f [0,1,0,1,0,0|1,0,1]=4 5178 B13R1.554 COC(=O)[C@H](C)NCC1CCCC1 de6e30a7e7d55ff157e3be644c92db1e [0,1,0,1,0,0|1,0,1]=4 5179 B13R1.554 COC(=O)[C@H](C)OCC1CCCC1 97f8b4cc6c902fc09abf2f322a586224 [0,1,0,1,0,0|1,0,1]=4 5180 B13R1.607 C=C(CN1CCC1CC)C(=O)OC b595d8bffa20abb9d0341ef88115b850 [0,1,0,1,0,0|1,0,1]=4 5181 B13R1.607 CCC1CCN1CC(=O)C(=O)OC 62b8bfcac3e7ebd5f56cfb212809a94a [0,1,0,1,0,0|1,0,1]=4 5182 B13R1.607 COC(=O)C(=O)NC1CCC1OC 7ad1e2196f88cc14313d884467af30ee [0,1,0,1,0,0|2,0,0]=4 5183 B13R1.607 COC(=O)C(=O)N[C@@H]1CC[C@@H]1OC af252451f3c459165335f385577b5234 [0,1,0,1,0,0|2,0,0]=4 5184 B13R1.607 COC(=O)C(=O)N[C@@H]1CC[C@H]1OC 2c1b50067bec7ddc6a7c05c5c7b66783 [0,1,0,1,0,0|2,0,0]=4 5185 B13R1.607 COC(=O)C(=O)N[C@H]1CC[C@@H]1OC b7d4ae18ea7840c3f06e799757c63810 [0,1,0,1,0,0|2,0,0]=4 5186 B13R1.607 COC(=O)C(=O)N[C@H]1CC[C@H]1OC 003bf251586d84b8b08c906cffaeb18c [0,1,0,1,0,0|2,0,0]=4 5187 B13R1.627 COC(=O)C(=O)NCC1CC1CO 85d0fce4d7a1a41ef00e4b11fc56cb70 [0,1,0,1,0,0|2,0,0]=4 5188 B13R1.696 CCC(=O)C(=O)N1CCCCC1C 3888e204a2b373aeb9f4a7671a7a466a [0,1,0,1,0,0|2,0,0]=4 5189 B13R1.696 CCC(=O)C(=O)N1CCCC[C@@H]1C 3729dd4350fed49feb41cdd26893f075 [0,1,0,1,0,0|2,0,0]=4 5190 B13R1.696 CCC(=O)C(=O)N1CCCC[C@H]1C 0e179d2558b625e45e9281a1c8a54c27 [0,1,0,1,0,0|2,0,0]=4 5191 B13R1.696 CNC(=O)C(=O)N1CCCCC1C 35dc68139e1e73d0827266def79ab2bf [0,1,0,1,0,0|2,0,0]=4 5192 B13R1.696 CNC(=O)C(=O)N1CCCC[C@@H]1C 29c8d1a1fc3f37da134defbc90204fc1 [0,1,0,1,0,0|2,0,0]=4 5193 B13R1.696 CNC(=O)C(=O)N1CCCC[C@H]1C b717bf96661854c24b36a4ee8102ae19 [0,1,0,1,0,0|2,0,0]=4 5194 B13R1.696 COC(=O)C(=O)N1CCCCC1C 23e5602bbcb862ba08a4be0287a6c419 [0,1,0,1,0,0|1,0,0]=3 5195 B13R1.696 COC(=O)C(=O)N1CCCC[C@@H]1C 824fb7223ca2695b7631b1dcd02be36e [0,1,0,1,0,0|1,0,0]=3 5196 B13R1.696 COC(=O)C(=O)N1CCCC[C@H]1C ba4325488ee35741a184c169e19a3aec [0,1,0,1,0,0|1,0,0]=3 5197 B13R1.696 COC(=O)C(=O)N1CCOCC1C 19b013fa22b383392f3cc9b1be168a00 [0,1,0,1,0,0|2,0,0]=4 5198 B13R1.696 COC(=O)C(=O)N1CCOC[C@@H]1C 7c1747f856401c3bd0dc2a7e32ce8a19 [0,1,0,1,0,0|2,0,0]=4 5199 B13R1.696 COC(=O)C(=O)N1CCOC[C@H]1C 7c9a3ce33b1bea921464cda5499f59ed [0,1,0,1,0,0|2,0,0]=4 5200 B13R1.696 COC(=O)C(C)N1CCCCC1C 349337438c827688c53b19ca8065a7c8 [0,1,0,1,0,0|1,0,1]=4 5201 B13R1.696 COC(=O)C(C)N1CCCC[C@@H]1C d1b44533159cb329fe0f662313bf1645 [0,1,0,1,0,0|1,0,1]=4 5202 B13R1.696 COC(=O)C(C)N1CCCC[C@H]1C 85dc88deb70e5662f977e7dfe862fb2f [0,1,0,1,0,0|1,0,1]=4 5203 B13R1.696 COC(=O)[C@@H](C)N1CCCCC1C 2d688e00b5e5c7f53b5664664acbc944 [0,1,0,1,0,0|1,0,1]=4 5204 B13R1.696 COC(=O)[C@@H](C)N1CCCC[C@@H]1C 71a545bc7dce5c23938718659ec3a070 [0,1,0,1,0,0|1,0,1]=4 5205 B13R1.696 COC(=O)[C@@H](C)N1CCCC[C@H]1C f5c7c314385302c7b3b2bed7c33ec159 [0,1,0,1,0,0|1,0,1]=4 5206 B13R1.696 COC(=O)[C@H](C)N1CCCCC1C 45d984dab42b66636849080ffc9c297c [0,1,0,1,0,0|1,0,1]=4 5207 B13R1.696 COC(=O)[C@H](C)N1CCCC[C@@H]1C 9c348bb5de94c4d99dd188344730ee00 [0,1,0,1,0,0|1,0,1]=4 5208 B13R1.696 COC(=O)[C@H](C)N1CCCC[C@H]1C 97ade9837f20a9a95ef4a9affc4cb47d [0,1,0,1,0,0|1,0,1]=4 5209 B13R1.697 C=C(CNCCC1CC1)C(=O)OC cce64ff02e0bf9bc75b7d8c8a27b9fc9 [0,1,0,1,0,0|1,0,1]=4 5210 B13R1.697 C=C(COCCC1CC1)C(=O)OC fdd29fca7f950f22516084b326a7208f [0,1,0,1,0,0|1,0,1]=4 5211 B13R1.697 COC(=O)C(=COCCC1CC1)F f01c8707fa00b0e65fd1500f5d4de9fd [0,1,0,1,0,0|1,0,0]=3 5212 B13R1.697 COC(=O)C(=O)CCCNC1CC1 44eac8452fc12d60e68aca13467e9a81 [0,1,0,1,0,0|1,0,1]=4 5213 B13R1.697 COC(=O)C(=O)CCCOC1CC1 97b4596e54a7166fa780d72a31e296fb [0,1,0,1,0,0|1,0,1]=4 5214 B13R1.697 COC(=O)C(=O)CNCCC1CC1 c63e9adfce6be3f8cb67625a2965a331 [0,1,0,1,0,0|1,0,1]=4 5215 B13R1.697 COC(=O)C(=O)COCCC1CC1 13593136286aa036e9a20629620d6172 [0,1,0,1,0,0|1,0,1]=4 5216 B13R1.697 COC(=O)C(=O)NCCOC1CC1 6d42ef03b4623a197b05dfec06f3020e [0,1,0,1,0,0|2,0,0]=4 5217 B13R1.698 C=C(CN[C@@H]1CC[C@H]1C)C(=O)OC ac0fe5ea335750ab8cc347feb3a0dc9f [0,1,0,1,0,0|1,0,1]=4 5218 B13R1.698 C=C(CN[C@H]1CC[C@H]1C)C(=O)OC 6d6efb9b64a0d077bd247459ba244e5c [0,1,0,1,0,0|1,0,1]=4 5219 B13R1.698 COC(=O)C(=O)CN[C@@H]1CC[C@H]1C 0d5b1ea2e0a7d1b320f6b966943d3087 [0,1,0,1,0,0|1,0,1]=4 5220 B13R1.698 COC(=O)C(=O)CN[C@H]1CC[C@H]1C 8d69692cf33a2bc32252bd77562e0229 [0,1,0,1,0,0|1,0,1]=4 5221 B13R1.698 COC(=O)C(=O)NCC1CCN1C 90e78e23d01d4c3deaab89b931f51094 [0,1,0,1,0,0|2,0,0]=4 5222 B13R1.702 C=C(CNCC1CCC1)C(=O)OC 0bcf1c00eb938897dd0ffb5568dcd400 [0,1,0,1,0,0|1,0,1]=4 5223 B13R1.702 C=C(COCC1CCC1)C(=O)OC 9872eb5748665c80f92fb1812094427a [0,1,0,1,0,0|1,0,1]=4 5224 B13R1.702 CCC(=O)C(=O)NCCC1CCC1 7a3f80610e08d2a1e882f645987f0978 [0,1,0,1,0,0|2,0,0]=4 5225 B13R1.702 CNC(=O)C(=O)NCCC1CCC1 64edad519014f755b3a8715e3af8fcc7 [0,1,0,1,0,0|2,0,0]=4 5226 B13R1.702 COC(=O)C(=COCC1CCC1)F 3eb4cdfbf108f107c90b37228190a4d0 [0,1,0,1,0,0|1,0,0]=3 5227 B13R1.702 COC(=O)C(=COCC1CCO1)F d544bd156af86b41642add5c0bbf8b19 [0,1,0,1,0,0|2,0,0]=4 5228 B13R1.702 COC(=O)C(=COCC1COC1)F 7334d99c7546a96edf1988ed8baf8766 [0,1,0,1,0,0|2,0,0]=4 5229 B13R1.702 COC(=O)C(=COC[C@@H]1CCO1)F 6970cd59c81a5a92751f1c451186934a [0,1,0,1,0,0|2,0,0]=4 5230 B13R1.702 COC(=O)C(=COC[C@H]1CCO1)F 79e63dd299ac009084a519b9a39e1cee [0,1,0,1,0,0|2,0,0]=4 5231 B13R1.702 COC(=O)C(=O)CCCN1CCC1 6dec72ac59fae5eb0fe51ae7689d2fcb [0,1,0,1,0,0|1,0,1]=4 5232 B13R1.702 COC(=O)C(=O)CNCC1CCC1 a864479b2066fdb1400b1bbd51d0b46c [0,1,0,1,0,0|1,0,1]=4 5233 B13R1.702 COC(=O)C(=O)COCC1CCC1 b05100be49d08a939cd6750484a80324 [0,1,0,1,0,0|1,0,1]=4 5234 B13R1.702 COC(=O)C(=O)NCCC1CCC1 46f39bfb32796c864ccbe93906c9bb38 [0,1,0,1,0,0|1,0,0]=3 5235 B13R1.702 COC(=O)C(=O)NCCC1CCO1 9c693609ea98019119c0d2826f9a5393 [0,1,0,1,0,0|2,0,0]=4 5236 B13R1.702 COC(=O)C(=O)NCCC1COC1 585bc9628b07d3049d7e99156b5956b9 [0,1,0,1,0,0|2,0,0]=4 5237 B13R1.702 COC(=O)C(=O)NCCN1CCC1 daeb7a0f3518effdb6e5ae052cf08a0b [0,1,0,1,0,0|2,0,0]=4 5238 B13R1.702 COC(=O)C(=O)NCC[C@@H]1CCO1 4580a009821073530c5c92065e726fbd [0,1,0,1,0,0|2,0,0]=4 5239 B13R1.702 COC(=O)C(C)NCCC1CCC1 ee80f3cbca8135490621b59fc7dd18bc [0,1,0,1,0,0|1,0,1]=4 5240 B13R1.702 COC(=O)C(C)OCCC1CCC1 4586f2cd33f5505cd9ca6a02bbeb471c [0,1,0,1,0,0|1,0,1]=4 5241 B13R1.702 COC(=O)[C@@H](C)NCCC1CCC1 69ff313b812fda3c9226e6360489ef11 [0,1,0,1,0,0|1,0,1]=4 5242 B13R1.702 COC(=O)[C@@H](C)OCCC1CCC1 63d4af31a1fa5cddb30647b25ae3f0f0 [0,1,0,1,0,0|1,0,1]=4 5243 B13R1.702 COC(=O)[C@H](C)NCCC1CCC1 4f78d6cf22bca297c29fd7dd1aefabd3 [0,1,0,1,0,0|1,0,1]=4 5244 B13R1.702 COC(=O)[C@H](C)OCCC1CCC1 656e4b213c781406b48fb336f6c48ed8 [0,1,0,1,0,0|1,0,1]=4 5245 B13R1.704 C=C(CN1CCCC1C)C(=O)OC 2afeba48ed45fbe2abcc48366742383b [0,1,0,1,0,0|1,0,1]=4 5246 B13R1.704 C=C(CN1CCC[C@@H]1C)C(=O)OC 21d285a02796176d4444957707303daa [0,1,0,1,0,0|1,0,1]=4 5247 B13R1.704 C=C(CN1CCC[C@H]1C)C(=O)OC 0114606e863109a0ad0a9540833f017c [0,1,0,1,0,0|1,0,1]=4 5248 B13R1.704 COC(=O)C(=O)CN1CCCC1C 8a07a1d64716b553c4119f1fc4e938ca [0,1,0,1,0,0|1,0,1]=4 5249 B13R1.704 COC(=O)C(=O)CN1CCC[C@@H]1C 7cb309c960cfb56af546a6e983b3c2bb [0,1,0,1,0,0|1,0,1]=4 5250 B13R1.704 COC(=O)C(=O)CN1CCC[C@H]1C 6da9766ba81bfbfa00c8fec442ec6365 [0,1,0,1,0,0|1,0,1]=4 5251 B13R1.704 COC(=O)C(=O)NC1CCCC1O 826335878e5996ac71e599ec3b2a475b [0,1,0,1,0,0|2,0,0]=4 5252 B13R1.704 COC(=O)C(=O)N[C@@H]1CCC[C@@H]1O b7c97f5ac44654879496aac0e3f697f2 [0,1,0,1,0,0|2,0,0]=4 5253 B13R1.704 COC(=O)C(=O)N[C@@H]1CCC[C@H]1O a57c05c8c6726884f5d59f88fac786a3 [0,1,0,1,0,0|2,0,0]=4 5254 B13R1.704 COC(=O)C(=O)N[C@H]1CCC[C@@H]1O 9f18c5510f29f368b11815fcfaa74482 [0,1,0,1,0,0|2,0,0]=4 5255 B13R1.704 COC(=O)C(=O)N[C@H]1CCC[C@H]1O 5b427eeba6f88647b177e1642d4b6ba3 [0,1,0,1,0,0|2,0,0]=4 5256 B13R1.704 COC(=O)C(C)OC1CCCC1C 0f056db9fd34f278de3b2f208a978ebf [0,1,0,1,0,0|1,0,1]=4 5257 B13R1.704 COC(=O)C(C)O[C@@H]1CCC[C@@H]1C e06f8c432ff697cf9cad9b53c4f57062 [0,1,0,1,0,0|1,0,1]=4 5258 B13R1.704 COC(=O)C(C)O[C@@H]1CCC[C@H]1C f0f1a4fda84b6ac9b4c48959d80bf413 [0,1,0,1,0,0|1,0,1]=4 5259 B13R1.704 COC(=O)C(C)O[C@H]1CCC[C@@H]1C ed1818fa51d5bcc1a0c741be2b034290 [0,1,0,1,0,0|1,0,1]=4 5260 B13R1.704 COC(=O)C(C)O[C@H]1CCC[C@H]1C 7715feef16187c957cbac2c9917d7ad8 [0,1,0,1,0,0|1,0,1]=4 5261 B13R1.704 COC(=O)[C@@H](C)OC1CCCC1C 1632f0f6bea0ed23553dde0d423c2295 [0,1,0,1,0,0|1,0,1]=4 5262 B13R1.704 COC(=O)[C@@H](C)O[C@@H]1CCC[C@@H]1C 95b6c22d691429eacf09d441e6309ccf [0,1,0,1,0,0|1,0,1]=4 5263 B13R1.704 COC(=O)[C@@H](C)O[C@@H]1CCC[C@H]1C 17e484ee32ec7f1cb2e759792fb1b73c [0,1,0,1,0,0|1,0,1]=4 5264 B13R1.704 COC(=O)[C@@H](C)O[C@H]1CCC[C@@H]1C 693185c6518cfec3d0f40f73a5a749ef [0,1,0,1,0,0|1,0,1]=4 5265 B13R1.704 COC(=O)[C@@H](C)O[C@H]1CCC[C@H]1C 0513ef453b30cf26e09e06a2f2466170 [0,1,0,1,0,0|1,0,1]=4 5266 B13R1.704 COC(=O)[C@H](C)OC1CCCC1C 0008b181655198dc9749bc2ea6a9d3e5 [0,1,0,1,0,0|1,0,1]=4 5267 B13R1.704 COC(=O)[C@H](C)O[C@@H]1CCC[C@@H]1C 44bddd13a8dc0a8258956998ebcd0b55 [0,1,0,1,0,0|1,0,1]=4 5268 B13R1.704 COC(=O)[C@H](C)O[C@@H]1CCC[C@H]1C b6d1d0a770af47ecc2eef95ce96f646f [0,1,0,1,0,0|1,0,1]=4 5269 B13R1.704 COC(=O)[C@H](C)O[C@H]1CCC[C@@H]1C 0f3bb7eb098f805c032a1823af5ada0f [0,1,0,1,0,0|1,0,1]=4 5270 B13R1.704 COC(=O)[C@H](C)O[C@H]1CCC[C@H]1C 16d49d6764aac8239734aff289718913 [0,1,0,1,0,0|1,0,1]=4 5271 B13R1.1878 C=C(COCC1CC1C)C(=O)OC cb5d4f7ff5bb68bb18bba783df96a13d [0,1,0,1,0,0|1,0,1]=4 5272 B13R1.1878 C=C(COC[C@@H]1C[C@@H]1C)C(=O)OC e5527da090a9f376be0990cf40c0fc6d [0,1,0,1,0,0|1,0,1]=4 5273 B13R1.1878 C=C(COC[C@@H]1C[C@H]1C)C(=O)OC 02950bb90b098a27e9c3175c28ae451f [0,1,0,1,0,0|1,0,1]=4 5274 B13R1.1878 C=C(COC[C@H]1C[C@@H]1C)C(=O)OC 2bad739ad0c1245d33c429f959e3a9ab [0,1,0,1,0,0|1,0,1]=4 5275 B13R1.1878 COC(=O)C(=O)COCC1CC1C 8f3cc939f908afa895ec68cfa008cf54 [0,1,0,1,0,0|1,0,1]=4 5276 B13R1.1878 COC(=O)C(=O)COC[C@@H]1C[C@@H]1C 271086042e773eaafd6a97ad624d3026 [0,1,0,1,0,0|1,0,1]=4 5277 B13R1.1878 COC(=O)C(=O)COC[C@@H]1C[C@H]1C 75926bbcf76c0deea4c024129d5a73ae [0,1,0,1,0,0|1,0,1]=4 5278 B13R1.1878 COC(=O)C(=O)COC[C@H]1C[C@@H]1C 5f7d3f2d205faf1fc38281cdb3046f83 [0,1,0,1,0,0|1,0,1]=4 5279 B13R1.1885 CCCCCCN1CC1C(=O)OC b9b6b61fb1e749e413739587dd81ef80 [0,1,0,1,0,0|0,0,2]=4 5280 B13R1.1885 CCCCCCN1C[C@H]1C(=O)OC 873c0326390cf4b4588d2040e143bc06 [0,1,0,1,0,0|0,0,2]=4 5281 B13R1.1885 CCCCCNC1CC1C(=O)OC 3acf6ca6e2f920ecb7ba6203e51474ec [0,1,0,1,0,0|0,0,2]=4 5282 B13R1.1885 CCCCCOC1CC1C(=O)OC d86f53f16c4195ec9529a5e0f35d7c61 [0,1,0,1,0,0|0,0,2]=4 5283 B13R1.1885 CCCCNC[C@@H]1C[C@H]1C(=O)OC 1002cd25782b8d1efc29bbcc7c4bfd4a [0,1,0,1,0,0|0,0,2]=4 5284 B13R1.1885 CCCCOCC1CC1C(=O)OC 915f197432d9f1784fbf7b3623b09b25 [0,1,0,1,0,0|0,0,2]=4 5285 B13R1.1885 CCCCOC[C@@H]1C[C@@H]1C(=O)OC 5f117687d689a9d9e642bcd9d2648b04 [0,1,0,1,0,0|0,0,2]=4 5286 B13R1.1885 CCCCOC[C@@H]1C[C@H]1C(=O)OC e39f60d3a27d7d2f07ca83e34b145263 [0,1,0,1,0,0|0,0,2]=4 5287 B13R1.1885 CCCCOC[C@H]1C[C@@H]1C(=O)OC 57ef2cbbbfc8b5f7f81b188203451a36 [0,1,0,1,0,0|0,0,2]=4 5288 B13R1.1885 CCCOCC[C@H]1C[C@@H]1C(=O)OC fdbda7009f844c26b7e1b6f2231ad1d6 [0,1,0,1,0,0|0,0,2]=4 5289 B13R1.2620 CCC(=O)C(=O)N1CCCCCC1 64fba9945f9ddaf389ae94f8b814919e [0,1,0,1,0,0|2,0,0]=4 5290 B13R1.2620 CNC(=O)C(=O)N1CCCCCC1 4454d19018d06a4910c99076a5597a98 [0,1,0,1,0,0|2,0,0]=4 5291 B13R1.2620 COC(=O)C(=O)N1CCCCCC1 5a599d276839f9c49dca60ec648bee2c [0,1,0,1,0,0|1,0,0]=3 5292 B13R1.2620 COC(=O)C(=O)N1CCCOCC1 6ca0ff285a4aca48465fa2a39d7d6ef0 [0,1,0,1,0,0|2,0,0]=4 5293 B13R1.2620 COC(=O)C(C)N1CCCCCC1 6d6f49628a56202d6a07169808d45dea [0,1,0,1,0,0|1,0,1]=4 5294 B13R1.2620 COC(=O)[C@@H](C)N1CCCCCC1 f3a2af520503959263be2a64f2adea8b [0,1,0,1,0,0|1,0,1]=4 5295 B13R1.2620 COC(=O)[C@H](C)N1CCCCCC1 5dc33399d9a102ff7cfc668c9fdc6b10 [0,1,0,1,0,0|1,0,1]=4 5296 B13R1.3440 CC1=C(COC1=O)OCCCCF 8b0d370c714b7e0f8c622a82b05245e7 [0,1,0,1,0,0|2,0,0]=4 5297 B13R1.3440 CCCCCOC1=C(C(=O)OC1)Br 52d70bbb52151bc7a825860d312a97cb [0,1,0,1,0,0|1,0,0]=3 5298 B13R1.3440 CCCCCOC1=C(C(=O)OC1)C 335be309d9f4be769592384456b68212 [0,1,0,1,0,0|1,0,0]=3 5299 B13R1.3440 CCOCCOC1=C(C(=O)OC1)Br b62d8798b909b567f5b71fd39ae1bd41 [0,1,0,1,0,0|2,0,0]=4 5300 B13R1.3440 CCOCCOC1=C(C(=O)OC1)C 3acdc1effbff5eccef3007ca45f84386 [0,1,0,1,0,0|2,0,0]=4 5301 B13R1.3440 CCSCCOC1=C(C(=O)OC1)Br ab6a1e87c880fd50ab8b2a71de3b6caa [0,1,0,1,0,0|2,0,0]=4 5302 B13R1.3440 CCSCCOC1=C(C(=O)OC1)C 055f15d1fa53142cdb460e51e660ea77 [0,1,0,1,0,0|2,0,0]=4 5303 B13R1.3440 COCCCOC1=C(C(=O)OC1)Br 86d5d07d8d11f0422d2af9ac88e74730 [0,1,0,1,0,0|2,0,0]=4 5304 B13R1.3440 COCCCOC1=C(C(=O)OC1)C 46be5d7b1181dccafac3cddbb93f122c [0,1,0,1,0,0|2,0,0]=4 5305 B13R1.3440 CSCCCOC1=C(C(=O)OC1)Br 869c4974b34c92ea2f7b528a7e527941 [0,1,0,1,0,0|2,0,0]=4 5306 B13R1.3440 CSCCCOC1=C(C(=O)OC1)C 8935331d57d9491b8e8fcdf6c9123885 [0,1,0,1,0,0|2,0,0]=4 5307 B13R1.3440 O=C1OCC(=C1Br)OCCCCF 9db0d65acfbc83eeedb5b8bc3a015103 [0,1,0,1,0,0|2,0,0]=4 5308 B13R1.189 CCCCCNc1cc([nH]n1)OC 622ccc6739dc3346b42dd4e734808366 [0,1,0,1,0,0|2,0,0]=4 5309 B13R1.189 CCCCCNc1cc(no1)OC 6553274dc0bf1d9e2e797069c3a56b4f [0,1,0,1,0,0|1,0,1]=4 5310 B13R1.189 CCCCCNc1cc(on1)C=O 07b0f0f24a8f0f45fdfaad1f755181ce [0,1,0,1,0,0|2,0,0]=4 5311 B13R1.189 CCCCCNc1cc(on1)OC e68f830b53eeaced0c703bda6af65374 [0,1,0,1,0,0|1,0,1]=4 5312 B13R1.189 CCCCCNc1ccc(s1)OC e0837795d314821a29772102e5672e4f [0,1,0,1,0,0|0,1,1]=4 5313 B13R1.189 CCCCCNc1cnc(s1)OC 535b0bcd03a099d53445aba3285286ab [0,1,0,1,0,0|1,1,0]=4 5314 B13R1.189 CCCCCNc1coc(c1)C=O 2b9b2c6e67aa37f9f2899596b938c410 [0,1,0,1,0,0|1,0,1]=4 5315 B13R1.189 CCCCCNc1csc(n1)OC ecc1f0cd555e8d4dc0ac2ef5d423894f [0,1,0,1,0,0|2,0,0]=4 5316 B13R1.189 CCCCCNc1nc(cs1)OC 52c3de3d3e741f7ed8a04d5a58b48165 [0,1,0,1,0,0|2,0,0]=4 5317 B13R1.189 CCCCCNc1ncc(s1)OC 4f912e327fed16a253b4e47e1b91a271 [0,1,0,1,0,0|1,1,0]=4 5318 B13R1.189 CCCCOCc1cc(no1)OC cd3df14e48f31d3e5bc474d62d7e07a9 [0,1,0,1,0,0|1,0,1]=4 5319 B13R1.189 CCCCOCc1cnc(o1)OC 24aab6f9651ec2830a300b49df53b054 [0,1,0,1,0,0|1,0,1]=4 5320 B13R1.189 CCCCOCc1cnc(s1)OC ac343ab85ca5813cf20df5d5569708c8 [0,1,0,1,0,0|1,1,0]=4 5321 B13R1.189 CCCCOCc1coc(c1)C=O ea17adc644c7100dbfe14e85282f5aeb [0,1,0,1,0,0|1,0,1]=4 5322 B13R1.189 CCCCOCc1coc(n1)OC a0675b616f7c31f2c719a13445697b92 [0,1,0,1,0,0|2,0,0]=4 5323 B13R1.189 CCCOCCc1cc(no1)OC b3f0895032fe2c3d78035035b1f36944 [0,1,0,1,0,0|1,0,1]=4 5324 B13R1.667 CCCCCCNCC1COC1=O 79235c75eb011c1660debd214209c865 [0,1,0,1,0,0|0,0,2]=4 5325 B13R1.667 CCCCCCOCC1COC1=O 032322bdfe049220b7567d334742118f [0,1,0,1,0,0|0,0,2]=4 5326 B13R1.43 CCCCC(C)OC1=CC(=O)NC1 a03cd3d2d088c43ec475464ec82b68af [0,1,0,1,0,0|2,0,0]=4 5327 B13R1.43 CCCCN(C)CC1=CC(=O)OC1 abd62ecdd7fd08c5457b9aa3429399f4 [0,1,0,1,0,0|1,0,0]=3 5328 B13R1.43 CN(CCCO)CC1=CC(=O)OC1 72707f2134377812e7fa29de377b3825 [0,1,0,1,0,0|2,0,0]=4 5329 B13R1.43 COCCN(C)CC1=CC(=O)OC1 d5ed933984e89302633c69057342d18d [0,1,0,1,0,0|2,0,0]=4 5330 B13R1.43 CSCCN(C)CC1=CC(=O)OC1 8f9cf38e2cbaf87b9d1fe90609608178 [0,1,0,1,0,0|2,0,0]=4 5331 B13R1.528 COC(=O)CCN1CCCCC1C ef8c98f2f34f940a739ee3de8f03b8cf [0,1,0,1,0,0|0,0,2]=4 5332 B13R1.528 COC(=O)CCN1CCCC[C@@H]1C c488d3543a40e6300a50858ebd6e1dc2 [0,1,0,1,0,0|0,0,2]=4 5333 B13R1.528 COC(=O)CCN1CCCC[C@H]1C 58a42fb055e141f7db8424589aab1652 [0,1,0,1,0,0|0,0,2]=4 5334 B13R1.528 COC(=O)CNC1CCCCC1C 35a184b111497c6de6452d16ee326255 [0,1,0,1,0,0|0,0,2]=4 5335 B13R1.528 COC(=O)CNC1CCCCC1F 75b78784db9a9315213cf71afea87339 [0,1,0,1,0,0|1,0,1]=4 5336 B13R1.528 COC(=O)CNC1CCCCC1O b50a4ff1d08e36ad73b39c80cc9f40d8 [0,1,0,1,0,0|1,0,1]=4 5337 B13R1.528 COC(=O)CNC1CCOCC1C bbe8ca04d06208267f810c8523726944 [0,1,0,1,0,0|1,0,1]=4 5338 B13R1.528 COC(=O)CN[C@@H]1CCCC[C@@H]1C 0a7ce6f2abd603141199bba264a9e621 [0,1,0,1,0,0|0,0,2]=4 5339 B13R1.528 COC(=O)CN[C@@H]1CCCC[C@H]1C 644767dc0ca5abaae7e2159873358be7 [0,1,0,1,0,0|0,0,2]=4 5340 B13R1.528 COC(=O)CN[C@@H]1CCCC[C@H]1O b56b20e2a515a6ca4bd229acf08e592e [0,1,0,1,0,0|1,0,1]=4 5341 B13R1.528 COC(=O)CN[C@@H]1CCOC[C@@H]1C 9803f4c21b7fbdb60156f5abc1f55e1f [0,1,0,1,0,0|1,0,1]=4 5342 B13R1.528 COC(=O)CN[C@H]1CCCC[C@@H]1C 729b9c55193cef1ba96c140e08e164fc [0,1,0,1,0,0|0,0,2]=4 5343 B13R1.528 COC(=O)CN[C@H]1CCCC[C@@H]1O 321b7a5012c00985256995e0c854605a [0,1,0,1,0,0|1,0,1]=4 5344 B13R1.528 COC(=O)CN[C@H]1CCCC[C@H]1C e3890e74e6d11e455205c25a189e97aa [0,1,0,1,0,0|0,0,2]=4 5345 B13R1.528 COC(=O)CN[C@H]1CCCC[C@H]1O 648f1866a78451f91430fb180ae39e35 [0,1,0,1,0,0|1,0,1]=4 5346 B13R1.528 COC(=O)CN[C@H]1CCOC[C@H]1C 7a145b4c936885313d99dfc12f7c4392 [0,1,0,1,0,0|1,0,1]=4 5347 B13R1.528 COC(=O)COC1CCCCC1C b74de9510a00a985e674edd292923b4f [0,1,0,1,0,0|0,0,2]=4 5348 B13R1.528 COC(=O)COC1CCCCC1F 020e4e75821d7fe65ef19dff721e2953 [0,1,0,1,0,0|1,0,1]=4 5349 B13R1.528 COC(=O)COC1CCOCC1C f31145225f89d95cd86ad4297ac41c41 [0,1,0,1,0,0|1,0,1]=4 5350 B13R1.528 COC(=O)CO[C@@H]1CCCC[C@@H]1C e67e19786db9771ad0a8cf07b41d6b3e [0,1,0,1,0,0|0,0,2]=4 5351 B13R1.528 COC(=O)CO[C@@H]1CCCC[C@H]1F 5e925eee87a60e3cdc1621ec17aa1921 [0,1,0,1,0,0|1,0,1]=4 5352 B13R1.528 COC(=O)CO[C@H]1CCCC[C@@H]1C 06c191f546ddb7e0ac5a03f84a4e57ea [0,1,0,1,0,0|0,0,2]=4 5353 B13R1.528 COC(=O)CO[C@H]1CCCC[C@H]1C 00bb601598a60bdb0cfce4a3b75d221e [0,1,0,1,0,0|0,0,2]=4 5354 B13R1.528 COC(=O)OCN1CCCCC1C 17d16b29865ff1db54f7e1345182fc7d [0,1,0,1,0,0|1,0,1]=4 5355 B13R1.528 COC(=O)OCN1CCCC[C@@H]1C a2371ec80aa38e01b37c6ad9f788c0db [0,1,0,1,0,0|1,0,1]=4 5356 B13R1.528 COC(=O)OCN1CCCC[C@H]1C 712a9feba74b66c53a277d22ab301d05 [0,1,0,1,0,0|1,0,1]=4 5357 B13R1.717 CC(CO)CNCC1=CC(=O)OC1 e2aecf456047b25314dabd62566dc818 [0,1,0,1,0,0|2,0,0]=4 5358 B13R1.717 CCC(=O)COCC1=CC(=O)OC1 077ea0404f3aa99494ccd2c2d15693d2 [0,1,0,1,0,0|1,0,1]=4 5359 B13R1.717 CCC(C)CCOC1=CC(=O)NC1 55104faee4e2cc43c82ec1376c1328e5 [0,1,0,1,0,0|2,0,0]=4 5360 B13R1.717 CCC(C)CNCC1=CC(=O)OC1 d952d658f13bd2b822b45e3d82a8175c [0,1,0,1,0,0|1,0,0]=3 5361 B13R1.717 CCC(O)CNCC1=CC(=O)OC1 070f198ad3661e13f4d3621dc2fd4159 [0,1,0,1,0,0|1,0,0]=3 5362 B13R1.717 CC[C@@H](O)CNCC1=CC(=O)OC1 c1f032595685eca05ad0602b6e5121e1 [0,1,0,1,0,0|1,0,0]=3 5363 B13R1.717 CC[C@H](C)CNCC1=CC(=O)OC1 9ea5a3bee0f5d4c2b1918f9b73f75e65 [0,1,0,1,0,0|1,0,0]=3 5364 B13R1.717 COC(=O)/C=C/CN1CCC(C1)C 014bc53dbdd047b678d7afd861383aae [0,1,0,1,0,0|1,0,0]=3 5365 B13R1.717 COC(=O)/C=C/CN1CCC(C1)F f632af5bc71b8d2519d79d0caac70b6d [0,1,0,1,0,0|1,0,0]=3 5366 B13R1.717 COC(=O)/C=C/CN1CCC(C1)O 1c2fae82a31b6ae1bbfd1a62d7d013b4 [0,1,0,1,0,0|1,0,0]=3 5367 B13R1.717 COC(=O)/C=C/CN1CCN(C1)C b3816923a676318a9833b00b5b27584f [0,1,0,1,0,0|2,0,0]=4 5368 B13R1.717 COC(=O)/C=C/CN1CC[C@@H](C1)F fc202ecd8954b773f937e99961b900ec [0,1,0,1,0,0|1,0,0]=3 5369 B13R1.717 COC(=O)/C=C/CN1CC[C@@H](C1)O 0244678a8d379a0cc9a9b5ade5d35a14 [0,1,0,1,0,0|1,0,0]=3 5370 B13R1.717 COC(=O)/C=C/CN1CC[C@H](C1)F bd3e4c966264dec2b139dba261cd2b98 [0,1,0,1,0,0|1,0,0]=3 5371 B13R1.717 COC(=O)/C=C/CN1CC[C@H](C1)O 16df5172b3e2407a72ae6553b73d1f8c [0,1,0,1,0,0|1,0,0]=3 5372 B13R1.717 COC(=O)/C=C\CN1CCC(C1)C 76b8f21a9637df1981a7a6ce7c80aa96 [0,1,0,1,0,0|1,0,0]=3 5373 B13R1.717 COC(=O)/C=C\CN1CCC(C1)F 975c2810f7c30a61a0a186773388f3ec [0,1,0,1,0,0|1,0,0]=3 5374 B13R1.717 COC(=O)/C=C\CN1CCC(C1)O 68946003e4c1f1589def9f6b8f8351bf [0,1,0,1,0,0|1,0,0]=3 5375 B13R1.717 COC(=O)/C=C\CN1CCN(C1)C 74e7185114096a480748509036eba0d7 [0,1,0,1,0,0|2,0,0]=4 5376 B13R1.717 COC(=O)/C=C\CN1CC[C@@H](C1)F 2b3c435d45e16d175fd60f442e064730 [0,1,0,1,0,0|1,0,0]=3 5377 B13R1.717 COC(=O)/C=C\CN1CC[C@@H](C1)O 466d06ca5049c0dbe9f153e73149d3b0 [0,1,0,1,0,0|1,0,0]=3 5378 B13R1.717 COC(=O)/C=C\CN1CC[C@H](C1)F 4c077068588050bf4b7982c578600f3f [0,1,0,1,0,0|1,0,0]=3 5379 B13R1.717 COC(=O)/C=C\CN1CC[C@H](C1)O 30a22e1b24b1c14954e635f0e8fdfe00 [0,1,0,1,0,0|1,0,0]=3 5380 B13R1.717 COC(=O)C=CCN1CCC(C1)C 904e275ebc0f987dbd307149d09acbb7 [0,1,0,1,0,0|1,0,0]=3 5381 B13R1.717 COC(=O)C=CCN1CCC(C1)F a733c74280a35482bdb71a2f4e335cd8 [0,1,0,1,0,0|1,0,0]=3 5382 B13R1.717 COC(=O)C=CCN1CCC(C1)O 859b4dd083bf6fee476a96501399847c [0,1,0,1,0,0|1,0,0]=3 5383 B13R1.717 COC(=O)C=CCN1CCN(C1)C 683ff07257d1b74f8646736a97035974 [0,1,0,1,0,0|2,0,0]=4 5384 B13R1.717 COC(=O)C=CCN1CC[C@@H](C1)F a8509d517696ed93a98892b3d515c1f6 [0,1,0,1,0,0|1,0,0]=3 5385 B13R1.717 COC(=O)C=CCN1CC[C@@H](C1)O d9aeafdf3bfae9f9f00006a0aed39098 [0,1,0,1,0,0|1,0,0]=3 5386 B13R1.717 COC(=O)C=CCN1CC[C@H](C1)F 3c38f025bd843ecae5e494c5816a2cd7 [0,1,0,1,0,0|1,0,0]=3 5387 B13R1.717 COC(=O)C=CCN1CC[C@H](C1)O 3cad623844418420a2ad70b20e0beb2f [0,1,0,1,0,0|1,0,0]=3 5388 B13R1.717 COC(=O)CNCC1CCC(C1)O dd5d3cafbe7c6b20031c1d1731d1a330 [0,1,0,1,0,0|1,0,1]=4 5389 B13R1.717 COC(=O)COCC1CCC(C1)C 9c25a1225e4fee79d336bbade2a44563 [0,1,0,1,0,0|1,0,1]=4 5390 B13R1.717 COC(=O)COCC1CCC(C1)F 8b4bb0cbb9a113203180110ca52ef720 [0,1,0,1,0,0|1,0,1]=4 5391 B13R1.717 COC(=O)COCC1CCC(O1)C 5d591cef212e4de0cc3884674be8a6d8 [0,1,0,1,0,0|1,0,1]=4 5392 B13R1.717 COC(=O)COC[C@@H]1CC[C@@H](O1)C acd5804634667fab03f179813489d3c1 [0,1,0,1,0,0|1,0,1]=4 5393 B13R1.717 COC(=O)COC[C@@H]1CC[C@H](C1)F cfcb707769ad588b715496b85ac3a150 [0,1,0,1,0,0|1,0,1]=4 5394 B13R1.717 COC(=O)COC[C@H]1CC[C@H](C1)F 488648b6ac3c15a5f88169dc374c2581 [0,1,0,1,0,0|1,0,1]=4 5395 B13R1.717 CO[C@@H](C)CNCC1=CC(=O)OC1 83bf8467b65c5b6c5d76616c46df69fc [0,1,0,1,0,0|2,0,0]=4 5396 B13R1.717 CO[C@H](C)CNCC1=CC(=O)OC1 aab5fff3a02057a03a4a395b20497436 [0,1,0,1,0,0|2,0,0]=4 5397 B13R1.717 C[C@H](CO)CNCC1=CC(=O)OC1 391970cbd12cf107defbd8a4a3b1e20f [0,1,0,1,0,0|2,0,0]=4 5398 B13R1.717 O=C1C=C(CO1)CNCC(Br)CBr d244bb2a26a17c2090ef75def94c87e1 [0,1,0,1,0,0|2,0,0]=4 5399 B13R1.717 O=C1C=C(CO1)CNCC(F)CO 8643cbd0c3a3f7ac0aec1d58529f5d76 [0,1,0,1,0,0|2,0,0]=4 5400 B13R1.717 O=C1C=C(CO1)CNCC(O)CO 761fcd5b670eedd9d1dd39283b99b66a [0,1,0,1,0,0|2,0,0]=4 5401 B13R1.717 O=C1C=C(CO1)CNC[C@@H](F)CO 996f4a82b7fa0e760ff8476c60383820 [0,1,0,1,0,0|2,0,0]=4 5402 B13R1.717 O=C1C=C(CO1)CNC[C@@H](O)CO c5737a5e7df9d9615c65303768dc4be4 [0,1,0,1,0,0|2,0,0]=4 5403 B13R1.717 O=C1C=C(CO1)CNC[C@H](F)CO 86399c3d739e7c2e1d1d8efa0018144e [0,1,0,1,0,0|2,0,0]=4 5404 B13R1.717 O=C1C=C(CO1)CNC[C@H](O)CO 21b93daac4b6d7b2f8fc030376fb13bd [0,1,0,1,0,0|2,0,0]=4 5405 B13R1.717 O=C1C=C(CO1)COCC(Cl)CCl 12154bdbf585e6051ef64471d9476f3b [0,1,0,1,0,0|2,0,0]=4 5406 B13R1.718 COC(=O)/C=C/CN1CC=CCC1 faddbdfffeb098d230665b6efa778734 [0,1,0,1,0,0|0,0,2]=4 5407 B13R1.718 COC(=O)/C=C/CN1CCCOC1 27df7524f322b6e322dbded4e32f88e1 [0,1,0,1,0,0|1,0,0]=3 5408 B13R1.718 COC(=O)/C=C/CN1CCCSC1 591f72a90f2105bf98efbfd040805e33 [0,1,0,1,0,0|1,0,0]=3 5409 B13R1.718 COC(=O)/C=C/CN1CCOCC1 2eed00f2fcbab616faf03f8bf256a1b0 [0,1,0,1,0,0|1,0,0]=3 5410 B13R1.718 COC(=O)/C=C/CN1CCSCC1 4719aecb2d73238911f99c0e5d4aa969 [0,1,0,1,0,0|1,0,0]=3 5411 B13R1.718 COC(=O)/C=C\CN1CC=CCC1 9cca8ccc6b8ec19d094e2f1be504c956 [0,1,0,1,0,0|0,0,2]=4 5412 B13R1.718 COC(=O)/C=C\CN1CCCOC1 129a97768640c22b62e6d877bc962be5 [0,1,0,1,0,0|1,0,0]=3 5413 B13R1.718 COC(=O)/C=C\CN1CCCSC1 b9f03c35e8d819480518484d0c258ad8 [0,1,0,1,0,0|1,0,0]=3 5414 B13R1.718 COC(=O)/C=C\CN1CCOCC1 0439add4b0439bc7a4fe8753c00c4ec4 [0,1,0,1,0,0|1,0,0]=3 5415 B13R1.718 COC(=O)/C=C\CN1CCSCC1 73eeb92cda5df6dc6c6c74e8e3e043b1 [0,1,0,1,0,0|1,0,0]=3 5416 B13R1.718 COC(=O)C=CCN1CC=CCC1 a7c692067f9fe8213394415ae836a511 [0,1,0,1,0,0|0,0,2]=4 5417 B13R1.718 COC(=O)C=CCN1CCCOC1 96719a4dda911a78845cbb09892868d3 [0,1,0,1,0,0|1,0,0]=3 5418 B13R1.718 COC(=O)C=CCN1CCCSC1 8e5b7c4830af37115011a3ffea836e32 [0,1,0,1,0,0|1,0,0]=3 5419 B13R1.718 COC(=O)C=CCN1CCOCC1 f5c2e957f543c91b649582309dac81ec [0,1,0,1,0,0|1,0,0]=3 5420 B13R1.718 COC(=O)C=CCN1CCSCC1 f129e26846243fd6794cea9352af812c [0,1,0,1,0,0|1,0,0]=3 5421 B13R1.718 COC(=O)CCNC1CCCCC1 6c834d69f457e3814fdbd355ce9a1cd4 [0,1,0,1,0,0|0,0,2]=4 5422 B13R1.718 COC(=O)CCOC1CCCCC1 e2a70e07c7489fc3c073c1ca57528dcf [0,1,0,1,0,0|0,0,2]=4 5423 B13R1.718 COC(=O)CNCC1CCCCC1 edbcfef674468e02b1702e0ecd4a528a [0,1,0,1,0,0|0,0,2]=4 5424 B13R1.718 COC(=O)CNCC1CCCCO1 0836cc05df886c59e04195bc8a7ec2bb [0,1,0,1,0,0|1,0,1]=4 5425 B13R1.718 COC(=O)CNCC1CCCOC1 a25859a130f9312b264f6595bd8d4bb4 [0,1,0,1,0,0|1,0,1]=4 5426 B13R1.718 COC(=O)CNCC1CCOCC1 d9cc78f40518dfc5cec148b7452096b6 [0,1,0,1,0,0|1,0,1]=4 5427 B13R1.718 COC(=O)CNCC1CCSCC1 97be5f3bc8f7710f33ea223082c3313b [0,1,0,1,0,0|1,0,1]=4 5428 B13R1.718 COC(=O)CNC[C@@H]1CCCOC1 86a88fc1607bc5d09ee5ea6ca41363f8 [0,1,0,1,0,0|1,0,1]=4 5429 B13R1.718 COC(=O)CNC[C@H]1CCCOC1 62e8604daacdf187d2974b3f7b81f4ce [0,1,0,1,0,0|1,0,1]=4 5430 B13R1.718 COC(=O)COCC1CCCCC1 0312531890271d63d212b0994c889dd8 [0,1,0,1,0,0|0,0,2]=4 5431 B13R1.718 COC(=O)COCC1CCCCO1 e83c2357ac433291042ec4565e5d75c9 [0,1,0,1,0,0|1,0,1]=4 5432 B13R1.718 COC(=O)COCC1CCCOC1 683e88a39be75da3ec7c93c84e1d5537 [0,1,0,1,0,0|1,0,1]=4 5433 B13R1.718 COC(=O)COCC1CCOCC1 fd375afb204be8e7c542e11b1af9eb87 [0,1,0,1,0,0|1,0,1]=4 5434 B13R1.718 COC(=O)COCC1CCSCC1 0a35e1e447c0eef8a22f86cbda42bb51 [0,1,0,1,0,0|1,0,1]=4 5435 B13R1.718 COC(=O)COC[C@@H]1CCCCO1 757b2c0e4ea1f7d04b9991c41cbf4847 [0,1,0,1,0,0|1,0,1]=4 5436 B13R1.718 COC(=O)COC[C@@H]1CCCOC1 e890919af9885169d4cc08441f9283e0 [0,1,0,1,0,0|1,0,1]=4 5437 B13R1.718 COC(=O)COC[C@H]1CCCCO1 a1e6ffaf53e14b9dc387ddff04ebbb15 [0,1,0,1,0,0|1,0,1]=4 5438 B13R1.718 COC(=O)COC[C@H]1CCCOC1 07b4ff3881bbe3cd1ae49c73e0c58a48 [0,1,0,1,0,0|1,0,1]=4 5439 B13R1.718 COC(=O)OCOC1CCCCC1 1a602a54bb58177feaba28ae34d27642 [0,1,0,1,0,0|1,0,1]=4 5440 B13R1.1737 COC(=O)/C=C/CN(C)C1CCC1 48c2b169e1dfeeac707c3777e224cfd4 [0,1,0,1,0,0|1,0,0]=3 5441 B13R1.1737 COC(=O)/C=C/CN(C)C1COC1 bdd4a1791cc6671c46dee6663156af15 [0,1,0,1,0,0|2,0,0]=4 5442 B13R1.1737 COC(=O)/C=C\CN(C)C1CCC1 f1b5c7d0067ef72fb40bf21bb3832843 [0,1,0,1,0,0|1,0,0]=3 5443 B13R1.1737 COC(=O)/C=C\CN(C)C1COC1 c45039ff991457479568af908b1aec84 [0,1,0,1,0,0|2,0,0]=4 5444 B13R1.1737 COC(=O)C=CCN(C)C1CCC1 45c627c9440ca81801afa939e855546b [0,1,0,1,0,0|1,0,0]=3 5445 B13R1.1737 COC(=O)C=CCN(C)C1COC1 100a38eea00e6ecfdcabdd3c22eca5af [0,1,0,1,0,0|2,0,0]=4 5446 B13R1.1739 COC(=O)/C=C/CN(C)CC1CC1 5d2b45e4fcccdf749ca8c2e5a3ec2125 [0,1,0,1,0,0|1,0,0]=3 5447 B13R1.1739 COC(=O)/C=C\CN(C)CC1CC1 2d06e445a3ff06281a4b31f3438b42bc [0,1,0,1,0,0|1,0,0]=3 5448 B13R1.1739 COC(=O)C=CCN(C)CC1CC1 ec6effeec702dfe19ce08c60d19edcfd [0,1,0,1,0,0|1,0,0]=3 5449 B13R1.1868 COC(=O)CN1CCCCC(C1)O c0b78e69ffe3a05139a5bdc986413c11 [0,1,0,1,0,0|1,0,1]=4 5450 B13R1.1868 COC(=O)CN1CCCC[C@H](C1)O 1740843bb8fd7dfd9c9de1a971425223 [0,1,0,1,0,0|1,0,1]=4 5451 B13R1.2062 COC(=O)CNCC1(CCCC1)C 41d1d6598bdbce40ac2b137b2b16df6c [0,1,0,1,0,0|1,0,1]=4 5452 B13R1.2062 COC(=O)CNCC1(CCCC1)F 2d83f77e41d2ca4cd327624c7fd76b03 [0,1,0,1,0,0|1,0,1]=4 5453 B13R1.2062 COC(=O)CNCC1(CCCC1)O 61629f1cd4a8ae0ff576cd6f3199eb39 [0,1,0,1,0,0|1,0,1]=4 5454 B13R1.2062 COC(=O)COCC1(CCCC1)C 3092e3e9c128f5855175d9f0b2298b6a [0,1,0,1,0,0|1,0,1]=4 5455 B13R1.2062 COC(=O)COCC1(CCCC1)F 2283c1bc942145bd187d0d089df02f76 [0,1,0,1,0,0|1,0,1]=4 5456 B13R1.2329 CCC1CN(C1)C/C=C/C(=O)OC 421b27d9c287c73d84ef801dfff3a4c2 [0,1,0,1,0,0|1,0,0]=3 5457 B13R1.2329 CCC1CN(C1)C/C=C\C(=O)OC 69d36d08a47a59b61940e58fc6c71ff0 [0,1,0,1,0,0|1,0,0]=3 5458 B13R1.2329 CCC1CN(C1)CC=CC(=O)OC 2745afe918f14fd5c2ffb078936b95ed [0,1,0,1,0,0|1,0,0]=3 5459 B13R1.2329 COC(=O)/C=C/CN1CC(C1)CF 7dc14084d3b0b21df0bce6387796c568 [0,1,0,1,0,0|2,0,0]=4 5460 B13R1.2329 COC(=O)/C=C/CN1CC(C1)CO 7b6b1f5f56f52fca1390136e66a404ef [0,1,0,1,0,0|2,0,0]=4 5461 B13R1.2329 COC(=O)/C=C/CN1CC(C1)OC 9a2214031d42ab7afd76e08738837683 [0,1,0,1,0,0|2,0,0]=4 5462 B13R1.2329 COC(=O)/C=C/CN1CC(C1)SC d36218aeaff3063f52cb2651e04c3baf [0,1,0,1,0,0|2,0,0]=4 5463 B13R1.2329 COC(=O)/C=C\CN1CC(C1)CF 10b14993b677e751b225d0021f7df4e6 [0,1,0,1,0,0|2,0,0]=4 5464 B13R1.2329 COC(=O)/C=C\CN1CC(C1)CO 4cd9b1f1c229859fa7b8357a27d7f278 [0,1,0,1,0,0|2,0,0]=4 5465 B13R1.2329 COC(=O)/C=C\CN1CC(C1)OC 66f149edebd86c04a8325dca8d0855e1 [0,1,0,1,0,0|2,0,0]=4 5466 B13R1.2329 COC(=O)/C=C\CN1CC(C1)SC 615021a85f3b1efe22b332a726b5259e [0,1,0,1,0,0|2,0,0]=4 5467 B13R1.2329 COC(=O)C=CCN1CC(C1)CF 8f5c8e84868d2ed1e336cd1dc3e5a28d [0,1,0,1,0,0|2,0,0]=4 5468 B13R1.2329 COC(=O)C=CCN1CC(C1)CO 62b98e5c565eb71e41573150c1546e5a [0,1,0,1,0,0|2,0,0]=4 5469 B13R1.2329 COC(=O)C=CCN1CC(C1)OC 48b49680c1183492afae3698eeb4d867 [0,1,0,1,0,0|2,0,0]=4 5470 B13R1.2329 COC(=O)C=CCN1CC(C1)SC 77aa4d0d96760ab8f87d2a2ab5817689 [0,1,0,1,0,0|2,0,0]=4 5471 B13R1.2872 COC(=O)CN1CC(CCC1C)O 7d6df28104517f078f199afbde7bfc44 [0,1,0,1,0,0|1,0,1]=4 5472 B13R1.2872 COC(=O)CN1C[C@@H](CC[C@H]1C)O bea98fe63a7e8c25fd979b966f270f53 [0,1,0,1,0,0|1,0,1]=4 5473 B13R1.11 COC(=O)CN(C)C1CCCCC1 e9ce3da146f6254be1aea528a029152c [0,1,0,1,0,0|1,0,1]=4 5474 B13R1.81 CCC1CCCN(C1)CC(=O)OC b3f8c476bd146e9333cedb295a189516 [0,1,0,1,0,0|1,0,1]=4 5475 B13R1.191 CCCCCNc1cc(=O)n([nH]1)C 53af574e30cd1c434255359db94703e8 [0,1,0,1,0,0|2,0,0]=4 5476 B13R1.191 CCCCCNc1cc(=O)n(s1)C 4d0db7a4c25a4dfce67df2af3bf339ce [0,1,0,1,0,0|2,0,0]=4 5477 B13R1.360 CCCC1CCN(C1)CC(=O)OC 2de75b35da086de2f37044feb73ca116 [0,1,0,1,0,0|1,0,1]=4 5478 B13R1.439 COC(=O)CC(=O)N1CCCC1C bcfef45723b0bf719b5c9783ecc68175 [0,1,0,1,0,0|1,0,1]=4 5479 B13R1.439 COC(=O)CC(=O)N1CCC[C@@H]1C eb37652461f299e1e8c956a2442dbbe8 [0,1,0,1,0,0|1,0,1]=4 5480 B13R1.439 COC(=O)CC(=O)N1CCC[C@H]1C f2cbdc632b3b5ff5f7abdfc87ba82bb5 [0,1,0,1,0,0|1,0,1]=4 5481 B13R1.441 C=C(CNC1CCC1)CC(=O)OC eb0b6fb3c97ab67e7e78a9296ebb48be [0,1,0,1,0,0|1,0,1]=4 5482 B13R1.441 C=C(COC1CCC1)CC(=O)OC 8c187dc072f5b957d721771bc0a7df5e [0,1,0,1,0,0|1,0,1]=4 5483 B13R1.441 CCC(=O)/C=C(\C)/OCC1CCC1 f70a9bff86124c8cd91fe95d37f14781 [0,1,0,1,0,0|2,0,0]=4 5484 B13R1.441 COC(=O)CC(=O)CNC1CCC1 745e6019f764d615bce85207675bfc48 [0,1,0,1,0,0|1,0,1]=4 5485 B13R1.441 COC(=O)CC(=O)COC1CCC1 2b0cce8c27af69df810c9292565ea1ea [0,1,0,1,0,0|1,0,1]=4 5486 B13R1.441 COC(=O)CC(=O)NCC1CCC1 06985c282ff5f90387048416eb36c903 [0,1,0,1,0,0|1,0,1]=4 5487 B13R1.441 COC(=O)CN(C)CCC1CCC1 29b50cc79b08c9908ea269853fb149d7 [0,1,0,1,0,0|1,0,1]=4 5488 B13R1.442 C=C(CNCC1CC1)CC(=O)OC 46968388bb0eef7da05d510821711b12 [0,1,0,1,0,0|1,0,1]=4 5489 B13R1.442 C=C(COCC1CC1)CC(=O)OC 36fdb9337bf2d002b41f4c721879d7c2 [0,1,0,1,0,0|1,0,1]=4 5490 B13R1.442 CCC(=O)/C=C(\C)/OCCC1CC1 58f6a99ba2ccd06103068c70b3236be1 [0,1,0,1,0,0|2,0,0]=4 5491 B13R1.442 COC(=O)CC(=O)CCOC1CC1 1c8043095d12c5a6ca7acc28c400bb84 [0,1,0,1,0,0|1,0,1]=4 5492 B13R1.442 COC(=O)CC(=O)CNCC1CC1 3e504b56f7588f412b0508a4444eb96b [0,1,0,1,0,0|1,0,1]=4 5493 B13R1.442 COC(=O)CC(=O)COCC1CC1 f09fa0b1cd68b94420bc085da5b138d2 [0,1,0,1,0,0|1,0,1]=4 5494 B13R1.442 COC(=O)CC(=O)NCCC1CC1 f0524e8e8be1b5b06f012ee7741d664a [0,1,0,1,0,0|1,0,1]=4 5495 B13R1.545 CCC(=O)/C=C(\C)/OC1CCCC1 69eb2173597a711c1d2c89397e5bad60 [0,1,0,1,0,0|2,0,0]=4 5496 B13R1.545 COC(=O)CC(=O)NC1CCCC1 92780e22d031904885973ee907577e96 [0,1,0,1,0,0|1,0,1]=4 5497 B13R1.545 COC(=O)CN(C)CC1CCCC1 b7c3019951ee8b9ee662c51ba6713569 [0,1,0,1,0,0|1,0,1]=4 5498 B13R1.1787 C=C(CNC1CC1C)CC(=O)OC f159c04f5b1f8074219ec6dd889e818c [0,1,0,1,0,0|1,0,1]=4 5499 B13R1.1787 COC(=O)CC(=O)CNC1CC1C fc29b176888f591a6f51dae223757561 [0,1,0,1,0,0|1,0,1]=4 5500 B13R1.1788 COC(=O)CC(=O)N[C@@H]1CC[C@H]1C 3f1e15f8dd7f28d0bce37eec5935f743 [0,1,0,1,0,0|1,0,1]=4 5501 B13R1.1788 COC(=O)CC(=O)N[C@H]1CC[C@H]1C 0d2fad8b15c8dcf0bc82e76b618def2f [0,1,0,1,0,0|1,0,1]=4 5502 B13R1.1870 COC(=O)CN1CCCCCCC1 b0b76993eaa7b2258637ddd25e55d518 [0,1,0,1,0,0|0,0,2]=4 5503 B13R1.2359 CCC1CCN1C(=O)CC(=O)OC bf388e31d627c585d5b2d323d814aadf [0,1,0,1,0,0|1,0,1]=4 5504 B13R1.15 COC(=O)CNC1CCCC(C1)C 54a837339cde2c4194ed43622d8a025a [0,1,0,1,0,0|1,0,1]=4 5505 B13R1.15 COC(=O)CNC1CCCC(C1)O 0f5a201259c4ee7ac1b89c064fd7f9ec [0,1,0,1,0,0|1,0,1]=4 5506 B13R1.15 COC(=O)CN[C@@H]1CCC[C@@H](C1)O 2781c9dfb2a171dc08d1f303f64f5f00 [0,1,0,1,0,0|1,0,1]=4 5507 B13R1.15 COC(=O)CN[C@@H]1CCC[C@H](C1)C 7a6b51f9570fd932dced6a9b299a1753 [0,1,0,1,0,0|1,0,1]=4 5508 B13R1.15 COC(=O)CN[C@@H]1CCC[C@H](C1)O f53dd5bad91b5d8f50b5e6f9cb466cff [0,1,0,1,0,0|1,0,1]=4 5509 B13R1.15 COC(=O)CN[C@H]1CCC[C@@H](C1)O c1c68ee9adcf23fed1c5e107a7f43cd5 [0,1,0,1,0,0|1,0,1]=4 5510 B13R1.15 COC(=O)CN[C@H]1CCC[C@H](C1)O b9831d0709e4a4e77533180d6dac33b7 [0,1,0,1,0,0|1,0,1]=4 5511 B13R1.15 COC(=O)COC1CCCC(C1)C fef8ce66d7a437f935eda49232439eff [0,1,0,1,0,0|1,0,1]=4 5512 B13R1.15 COC(=O)CO[C@@H]1CCC[C@@H](C1)C 70dbe05963e49d100f61e0ffda772c6c [0,1,0,1,0,0|1,0,1]=4 5513 B13R1.15 COC(=O)CO[C@H]1CCC[C@@H](C1)C f66a1fcf38bca9f18682e7ab3afc3534 [0,1,0,1,0,0|1,0,1]=4 5514 B13R1.15 COC(=O)CO[C@H]1CCC[C@H](C1)C 3cd757dd574b84782f0822b2f1d2aa21 [0,1,0,1,0,0|1,0,1]=4 5515 B13R1.162 COC(=O)CNC(C)C1CCCC1 8465ab150a0877f2bc595aee39e94c97 [0,1,0,1,0,0|1,0,1]=4 5516 B13R1.162 COC(=O)COC(C)C1CCCC1 298b65474426fc6aaedfd84b1094fa78 [0,1,0,1,0,0|1,0,1]=4 5517 B13R1.527 COC(=O)CN1CCCCCC1C d64d1c75b896111b8b52ec537bb7628e [0,1,0,1,0,0|0,0,2]=4 5518 B13R1.527 COC(=O)CN1CCCOCC1C b71fe3249375c1ba37149911abf63893 [0,1,0,1,0,0|1,0,1]=4 5519 B13R1.527 COC(=O)CN1CCOCCC1C 88f40f60b878d5fb2c6aa3f22e684ab3 [0,1,0,1,0,0|1,0,1]=4 5520 B13R1.527 COC(=O)CN1CCSCCC1C 77b74f243a06ef2b059a409fff9eee55 [0,1,0,1,0,0|1,0,1]=4 5521 B13R1.1711 COC(=O)CCN1CCCCCC1 5e5071b691467f8c1399fd481d84eb22 [0,1,0,1,0,0|0,0,2]=4 5522 B13R1.1711 COC(=O)CNC1CCCCCC1 b16ba115e3dcdf69c544cb1eaaefa267 [0,1,0,1,0,0|0,0,2]=4 5523 B13R1.1711 COC(=O)CNC1CCCOCC1 b118ae404e97484d329c3db89ed52176 [0,1,0,1,0,0|1,0,1]=4 5524 B13R1.1711 COC(=O)COC1CCCCCC1 34b7b213576e112cb4be06d7516d609e [0,1,0,1,0,0|0,0,2]=4 5525 B13R1.1711 COC(=O)COC1CCCOCC1 901a2fb2220a96aa11cccb163e60e9e8 [0,1,0,1,0,0|1,0,1]=4 5526 B13R1.1711 COC(=O)OCN1CCCCCC1 0070e783c5623d6aa623d7b63b35ba56 [0,1,0,1,0,0|1,0,1]=4 5527 B13R1.2045 COC(=O)CNC1(CCCCC1)C e1a255fbdd6ba70bdfcde17b9d99dce3 [0,1,0,1,0,0|1,0,1]=4 5528 B13R1.3544 COC(=O)/C=C/C(=O)NC1CC1C 33c1bd26ff9bdf90c92044364e40e3d1 [0,1,0,1,0,0|1,0,1]=4 5529 B13R1.3544 COC(=O)/C=C\C(=O)NC1CC1C 026bb1bca2934c9d8ac15eb0a1425ea8 [0,1,0,1,0,0|1,0,1]=4 5530 B13R1.3544 COC(=O)C=CC(=O)NC1CC1C 248136d8d39ce7f74941c3f9f88bf35d [0,1,0,1,0,0|1,0,1]=4 5531 B13R1.3545 COC(=O)/C=C/C(=O)NC1CCC1 d6c3320367f29271ae58098afa0d29c7 [0,1,0,1,0,0|1,0,1]=4 5532 B13R1.3545 COC(=O)/C=C\C(=O)NC1CCC1 653ee92fa00a3ed0a01ab711f77fb489 [0,1,0,1,0,0|1,0,1]=4 5533 B13R1.3545 COC(=O)C=CC(=O)NC1CCC1 92984b8552f630647eaf0ec6e12951a3 [0,1,0,1,0,0|1,0,1]=4 5534 B13R1.3546 COC(=O)/C=C/C(=O)NCC1CC1 fd9f7e36a2abfcd010b92872c954c0d7 [0,1,0,1,0,0|1,0,1]=4 5535 B13R1.3546 COC(=O)/C=C\C(=O)NCC1CC1 1e8ebd301b20aa1be7a93c7958447f9f [0,1,0,1,0,0|1,0,1]=4 5536 B13R1.3546 COC(=O)C=CC(=O)NCC1CC1 513b7ca5c378163e46f69bde62e378c7 [0,1,0,1,0,0|1,0,1]=4 5537 B13R1.4928 COC(=O)CN1C(CCCC1C)C cb6989ff17faa26de9a359f77fc97dbc [0,1,0,1,0,0|1,0,1]=4 5538 B13R1.4928 COC(=O)CN1[C@@H](CCC[C@@H]1C)C ec55e538389a1e5f134a45c1d38714b2 [0,1,0,1,0,0|1,0,1]=4 5539 B13R1.4928 COC(=O)CN1[C@@H](CCC[C@H]1C)C 8842f58b60525e9281995807c2856988 [0,1,0,1,0,0|1,0,1]=4 5540 B13R1.4928 COC(=O)CN1[C@H](CCC[C@@H]1C)C 0b89339a4c842acfcd56f323cb1a26b5 [0,1,0,1,0,0|1,0,1]=4 5541 B13R1.14 COC(=O)CNC1CCC(CC1)C 37e4d97b039f9c54aa53be08fff33831 [0,1,0,1,0,0|1,0,1]=4 5542 B13R1.14 COC(=O)CNC1CCC(CC1)Cl 12e88baaad5a415abbb6bfa7b2d7c952 [0,1,0,1,0,0|1,0,1]=4 5543 B13R1.14 COC(=O)CNC1CCC(CC1)O 48d57d704e8420d189477013465a06d3 [0,1,0,1,0,0|1,0,1]=4 5544 B13R1.14 COC(=O)CN[C@H]1CC[C@@H](CC1)C ee331f0af35d7e9410adfd4c25b8db3b [0,1,0,1,0,0|1,0,1]=4 5545 B13R1.14 COC(=O)CN[C@H]1CC[C@@H](CC1)Cl 54c8507ba4278c9c624f8067bf5baaee [0,1,0,1,0,0|1,0,1]=4 5546 B13R1.14 COC(=O)CN[C@H]1CC[C@@H](CC1)O 70f4357754bb3c71dad798d04929ce8f [0,1,0,1,0,0|1,0,1]=4 5547 B13R1.14 COC(=O)CN[C@H]1CC[C@H](CC1)C 460b31f38e5069b08e1a92320cdadc61 [0,1,0,1,0,0|1,0,1]=4 5548 B13R1.14 COC(=O)CN[C@H]1CC[C@H](CC1)Cl de6052ca334f36b66d7956d081483c7d [0,1,0,1,0,0|1,0,1]=4 5549 B13R1.14 COC(=O)CN[C@H]1CC[C@H](CC1)O 142a71165e55302c80cc0d83e02aef04 [0,1,0,1,0,0|1,0,1]=4 5550 B13R1.14 COC(=O)COC1CCC(CC1)C 2af4f4f3baca3a945a2d34758b20e205 [0,1,0,1,0,0|1,0,1]=4 5551 B13R1.14 COC(=O)COC1CCC(CC1)F 7f69ddfb8748f2d2b1fd0dafe063509a [0,1,0,1,0,0|1,0,1]=4 5552 B13R1.14 COC(=O)CO[C@H]1CC[C@@H](CC1)C ce1a87c3d02e200ee0ebb62dcb03087f [0,1,0,1,0,0|1,0,1]=4 5553 B13R1.14 COC(=O)CO[C@H]1CC[C@H](CC1)C 7f45679bc14b2739a5c66dcc20d81719 [0,1,0,1,0,0|1,0,1]=4 5554 B13R1.40 COC(=O)CN1CCCC(C1C)O e6048c140a5f7858b75224bfa5aa62ac [0,1,0,1,0,0|1,0,1]=4 5555 B13R1.40 COC(=O)CN1CCC[C@@H]([C@H]1C)O e38af52ebb243f1b8fad8b1020cf08a1 [0,1,0,1,0,0|1,0,1]=4 5556 B13R1.40 COC(=O)CN1CCC[C@H]([C@@H]1C)O bbc47714b3e3685c43c458b78e7acff1 [0,1,0,1,0,0|1,0,1]=4 5557 B13R1.538 C=C1CC1COC/C=C/C(=O)OC 4157fee916311a0569567f005ed634bd [0,1,0,1,0,0|0,0,2]=4 5558 B13R1.538 C=C1CC1COC/C=C\C(=O)OC 63012194617b01ea217de174b36e5486 [0,1,0,1,0,0|0,0,2]=4 5559 B13R1.538 C=C1CC1COCC=CC(=O)OC e61598ff28f24e04550b1177e6b9e8b7 [0,1,0,1,0,0|0,0,2]=4 5560 B13R1.538 COC(=O)/C=C/COCC1CC1C c7d78f0e0c21b5cea4d0773ee98bc721 [0,1,0,1,0,0|0,0,0]=2 5561 B13R1.538 COC(=O)/C=C/COC[C@@H]1C[C@@H]1C cb52e6eb37f6d6d90e9517977a18a2bb [0,1,0,1,0,0|0,0,0]=2 5562 B13R1.538 COC(=O)/C=C/COC[C@@H]1C[C@@H]1F a690922008d5757e6fc902d04c81e649 [0,1,0,1,0,0|1,0,0]=3 5563 B13R1.538 COC(=O)/C=C/COC[C@@H]1C[C@H]1C a722bc8722773f7df584dbfebbcfb89f [0,1,0,1,0,0|0,0,0]=2 5564 B13R1.538 COC(=O)/C=C/COC[C@@H]1C[C@H]1F f0656dae5a57e82f23629531454c8524 [0,1,0,1,0,0|1,0,0]=3 5565 B13R1.538 COC(=O)/C=C/COC[C@H]1C[C@@H]1C 974b27363dcaf20a5b70766741c8e417 [0,1,0,1,0,0|0,0,0]=2 5566 B13R1.538 COC(=O)/C=C/COC[C@H]1C[C@@H]1F 57d92b3ea1d1cc384e9704f03e7a50c0 [0,1,0,1,0,0|1,0,0]=3 5567 B13R1.538 COC(=O)/C=C/COC[C@H]1C[C@H]1F 3b31487758645605360c55f6984b0438 [0,1,0,1,0,0|1,0,0]=3 5568 B13R1.538 COC(=O)/C=C\COCC1CC1C b90296a5cf9b940389dab19b37a38606 [0,1,0,1,0,0|0,0,0]=2 5569 B13R1.538 COC(=O)/C=C\COC[C@@H]1C[C@@H]1C 5336e12467a52820146f871312c2936f [0,1,0,1,0,0|0,0,0]=2 5570 B13R1.538 COC(=O)/C=C\COC[C@@H]1C[C@@H]1F 91dbf6c01d5f001cc1e807a149db3e3f [0,1,0,1,0,0|1,0,0]=3 5571 B13R1.538 COC(=O)/C=C\COC[C@@H]1C[C@H]1C cc366d1da0b67ed615b69ba85a51b81d [0,1,0,1,0,0|0,0,0]=2 5572 B13R1.538 COC(=O)/C=C\COC[C@@H]1C[C@H]1F 4de6d303fa1bc7a7413c0d251e2ed8c7 [0,1,0,1,0,0|1,0,0]=3 5573 B13R1.538 COC(=O)/C=C\COC[C@H]1C[C@@H]1C cd819c02bba5d565616cd4b2dea7f554 [0,1,0,1,0,0|0,0,0]=2 5574 B13R1.538 COC(=O)/C=C\COC[C@H]1C[C@@H]1F 1356e033237c4ca8cf4231eefef647bb [0,1,0,1,0,0|1,0,0]=3 5575 B13R1.538 COC(=O)/C=C\COC[C@H]1C[C@H]1F 3f3f10975b27b46d31bccd41eaf0fb8c [0,1,0,1,0,0|1,0,0]=3 5576 B13R1.538 COC(=O)C#CCOCC1CC1C 1e9be9c8d677f513f762214a0701569a [0,1,0,1,0,0|0,0,2]=4 5577 B13R1.538 COC(=O)C#CCOC[C@@H]1C[C@@H]1C 7b7c7223bb6b637159c7a5d6932338b8 [0,1,0,1,0,0|0,0,2]=4 5578 B13R1.538 COC(=O)C#CCOC[C@@H]1C[C@H]1C e35dbc3819a4803cced2ac5752b6cc4b [0,1,0,1,0,0|0,0,2]=4 5579 B13R1.538 COC(=O)C#CCOC[C@H]1C[C@@H]1C b7b9daa3fc92f408faeb20ffad8801b3 [0,1,0,1,0,0|0,0,2]=4 5580 B13R1.538 COC(=O)C=CCOCC1CC1C 0cd6386f11f910f4a8c7b254e03f570b [0,1,0,1,0,0|0,0,0]=2 5581 B13R1.538 COC(=O)C=CCOC[C@@H]1C[C@@H]1C fa894635ec851a96878cba9994cdab11 [0,1,0,1,0,0|0,0,0]=2 5582 B13R1.538 COC(=O)C=CCOC[C@@H]1C[C@@H]1F 907a6b5d9f1478cb0c758fb328cfcd2f [0,1,0,1,0,0|1,0,0]=3 5583 B13R1.538 COC(=O)C=CCOC[C@@H]1C[C@H]1C c0291c207d40e22c4afe179192699f29 [0,1,0,1,0,0|0,0,0]=2 5584 B13R1.538 COC(=O)C=CCOC[C@@H]1C[C@H]1F 50a1178b74eeae94ac7a764653be1cdb [0,1,0,1,0,0|1,0,0]=3 5585 B13R1.538 COC(=O)C=CCOC[C@H]1C[C@@H]1C ac2a534d6070c858f11b92aabfbf392b [0,1,0,1,0,0|0,0,0]=2 5586 B13R1.538 COC(=O)C=CCOC[C@H]1C[C@@H]1F b137b18f1e2c70944f6a5d334903e7ac [0,1,0,1,0,0|1,0,0]=3 5587 B13R1.538 COC(=O)C=CCOC[C@H]1C[C@H]1F 2199c1a15239547cc3cfd6de68404ecc [0,1,0,1,0,0|1,0,0]=3 5588 B13R1.538 COC(=O)CCCCNC1CC1C fff1ff0ced2c194c1f07ff18bc4c45a6 [0,1,0,1,0,0|0,0,2]=4 5589 B13R1.538 COC(=O)CCCOCC1CC1C 4fd9dbc215860a4c232bae6aa2014236 [0,1,0,1,0,0|0,0,2]=4 5590 B13R1.538 COC(=O)CCCOC[C@@H]1C[C@@H]1C 1d1bc1130ba7b0b4b60e16ffca8da145 [0,1,0,1,0,0|0,0,2]=4 5591 B13R1.538 COC(=O)CCCOC[C@@H]1C[C@H]1C 842061fbd7908c72de0914ea3429eb3e [0,1,0,1,0,0|0,0,2]=4 5592 B13R1.538 COC(=O)CCCOC[C@H]1C[C@@H]1C 87714f07777461d9a6e8760301145071 [0,1,0,1,0,0|0,0,2]=4 5593 B13R1.538 COC(=O)COCCNC1CC1C 7bcd2974d41d1b3dc8e681b0632aec03 [0,1,0,1,0,0|1,0,1]=4 5594 B13R1.539 COC(=O)/C=C/C=C/CN1CCC1 9f611a432214391fab6f8e73860d9eac [0,1,0,1,0,0|0,0,2]=4 5595 B13R1.539 COC(=O)/C=C/CNCC1CCC1 11b304581d11b87753e29ba5b7eb8660 [0,1,0,1,0,0|0,0,0]=2 5596 B13R1.539 COC(=O)/C=C/CNCC1CCO1 44332aa97a56857c12a57fe3b8ae62c8 [0,1,0,1,0,0|1,0,0]=3 5597 B13R1.539 COC(=O)/C=C/CNCC1COC1 a3021f6438fcbdb0d6495f4d4d400d5c [0,1,0,1,0,0|1,0,0]=3 5598 B13R1.539 COC(=O)/C=C/CNC[C@@H]1CCO1 95c8aece77619724b07a8d538c6e54b6 [0,1,0,1,0,0|1,0,0]=3 5599 B13R1.539 COC(=O)/C=C/CNC[C@H]1CCO1 26302a9ece165731c9b61cf48708205e [0,1,0,1,0,0|1,0,0]=3 5600 B13R1.539 COC(=O)/C=C/COCC1CCC1 679d12daa3df8ed9dedd23b378d377d7 [0,1,0,1,0,0|0,0,0]=2 5601 B13R1.539 COC(=O)/C=C/COCC1CCO1 5e9bea58c502251de18545dcedda6ea9 [0,1,0,1,0,0|1,0,0]=3 5602 B13R1.539 COC(=O)/C=C/COCC1COC1 a6db3116b5988a5b6d51debf99a71465 [0,1,0,1,0,0|1,0,0]=3 5603 B13R1.539 COC(=O)/C=C/COCC1CSC1 9f6d56ce8f863e66c15b05072c81968a [0,1,0,1,0,0|1,0,0]=3 5604 B13R1.539 COC(=O)/C=C/COC[C@@H]1CCO1 2e1c5029b18bf1c0e904e6af60753b20 [0,1,0,1,0,0|1,0,0]=3 5605 B13R1.539 COC(=O)/C=C/COC[C@H]1CCO1 d9752f51faa9fc6df02b781064a38d59 [0,1,0,1,0,0|1,0,0]=3 5606 B13R1.539 COC(=O)/C=C\CNCC1CCC1 2cf52fd8d13c6fc6695515f3b053ec55 [0,1,0,1,0,0|0,0,0]=2 5607 B13R1.539 COC(=O)/C=C\CNCC1CCO1 8028882bc2c6bdf889558be7ad33815c [0,1,0,1,0,0|1,0,0]=3 5608 B13R1.539 COC(=O)/C=C\CNCC1COC1 5e5ed51e5b11fbdb4f4a8ba4d4030807 [0,1,0,1,0,0|1,0,0]=3 5609 B13R1.539 COC(=O)/C=C\CNC[C@@H]1CCO1 a9bb118d771bc16a2a6724fdb376cd21 [0,1,0,1,0,0|1,0,0]=3 5610 B13R1.539 COC(=O)/C=C\CNC[C@H]1CCO1 0a9da14bab2b84ab646133ea2fd0708d [0,1,0,1,0,0|1,0,0]=3 5611 B13R1.539 COC(=O)/C=C\COCC1CCC1 3a8d95b0e7d942ea79978ba39a0ee48c [0,1,0,1,0,0|0,0,0]=2 5612 B13R1.539 COC(=O)/C=C\COCC1CCO1 94ee94b5d1748fb7ce186da0d2608f60 [0,1,0,1,0,0|1,0,0]=3 5613 B13R1.539 COC(=O)/C=C\COCC1COC1 9809f021cb075717a5ea5807cfd699a3 [0,1,0,1,0,0|1,0,0]=3 5614 B13R1.539 COC(=O)/C=C\COCC1CSC1 a824a9df718e5e6df889f43a7fa73959 [0,1,0,1,0,0|1,0,0]=3 5615 B13R1.539 COC(=O)/C=C\COC[C@@H]1CCO1 472ad51b6523da234ea144e9e6708cc7 [0,1,0,1,0,0|1,0,0]=3 5616 B13R1.539 COC(=O)/C=C\COC[C@H]1CCO1 e0d54bdbdd2f689efba53acfdc1c89db [0,1,0,1,0,0|1,0,0]=3 5617 B13R1.539 COC(=O)C#CCNCC1CCC1 bb575657fc1de04673b61db6025298fd [0,1,0,1,0,0|0,0,2]=4 5618 B13R1.539 COC(=O)C#CCOCC1CCC1 30a8be8a1f6b9347d817162a4b2fc227 [0,1,0,1,0,0|0,0,2]=4 5619 B13R1.539 COC(=O)C=CC=CCN1CCC1 432655382f51781c8f29c17c8832c048 [0,1,0,1,0,0|0,0,2]=4 5620 B13R1.539 COC(=O)C=CCNCC1CCC1 d8f16ee04b6303c3bdb83bbd35260f41 [0,1,0,1,0,0|0,0,0]=2 5621 B13R1.539 COC(=O)C=CCNCC1CCO1 fc16f7ebba781df2c78cf12022fe8a86 [0,1,0,1,0,0|1,0,0]=3 5622 B13R1.539 COC(=O)C=CCNCC1COC1 1a5ff289aed9e773e4c10d6c3a1389d8 [0,1,0,1,0,0|1,0,0]=3 5623 B13R1.539 COC(=O)C=CCNC[C@@H]1CCO1 7ff83d43579ee518ead55b7f9b066942 [0,1,0,1,0,0|1,0,0]=3 5624 B13R1.539 COC(=O)C=CCNC[C@H]1CCO1 7f4200cc1b7af96a5861d1afe46db488 [0,1,0,1,0,0|1,0,0]=3 5625 B13R1.539 COC(=O)C=CCOCC1CCC1 48da645f1ded9d65e3b2fd35735fba14 [0,1,0,1,0,0|0,0,0]=2 5626 B13R1.539 COC(=O)C=CCOCC1CCO1 e728b1ed0b6f1ad164ad4b98a9e11f37 [0,1,0,1,0,0|1,0,0]=3 5627 B13R1.539 COC(=O)C=CCOCC1COC1 a7343870634746b80003f4e7160dae62 [0,1,0,1,0,0|1,0,0]=3 5628 B13R1.539 COC(=O)C=CCOCC1CSC1 6e4a7ba55fb76e7b7539c1d1108167a9 [0,1,0,1,0,0|1,0,0]=3 5629 B13R1.539 COC(=O)C=CCOC[C@@H]1CCO1 c0ec727224b50889a0fd389d928375bc [0,1,0,1,0,0|1,0,0]=3 5630 B13R1.539 COC(=O)C=CCOC[C@H]1CCO1 8f103d8e5b75332ba18bde097f7af743 [0,1,0,1,0,0|1,0,0]=3 5631 B13R1.539 COC(=O)CCCCCN1CCC1 5b935425eb9bf7bb109dc60df8cb2b54 [0,1,0,1,0,0|0,0,2]=4 5632 B13R1.539 COC(=O)CCCCNC1CCC1 e589182e9d4fd70f1509d8934205f806 [0,1,0,1,0,0|0,0,2]=4 5633 B13R1.539 COC(=O)CCCCOC1CCC1 c848757f11634e65b1417a5f755cbd36 [0,1,0,1,0,0|0,0,2]=4 5634 B13R1.539 COC(=O)CCCNCC1CCC1 41512d18de8f66e0bb22982c6d90b87d [0,1,0,1,0,0|0,0,2]=4 5635 B13R1.539 COC(=O)CCCOCC1CCC1 a2e59722fad73455431d3d7a37150133 [0,1,0,1,0,0|0,0,2]=4 5636 B13R1.539 COC(=O)CCNCCC1CCC1 1497ace9fbaf1d43a8b83302755d9ec4 [0,1,0,1,0,0|0,0,2]=4 5637 B13R1.539 COC(=O)CCOCCC1CCC1 117ba06f9d41e95870c3b7b0f740b19f [0,1,0,1,0,0|0,0,2]=4 5638 B13R1.539 COC(=O)CNCCCN1CCC1 b4cce6230af0b955e2a0315ea78fc054 [0,1,0,1,0,0|1,0,1]=4 5639 B13R1.539 COC(=O)CNCCOC1CCC1 0bf9ac01f0229c8613a80a83afe44f37 [0,1,0,1,0,0|1,0,1]=4 5640 B13R1.539 COC(=O)COCCCC1CCC1 75117038e5a73364080284ac43118f95 [0,1,0,1,0,0|0,0,2]=4 5641 B13R1.539 COC(=O)COCCCC1COC1 8d2df1b03474e82f5435342cab777b71 [0,1,0,1,0,0|1,0,1]=4 5642 B13R1.539 COC(=O)COCCCN1CCC1 d8cdbbb15b1071fac59ccaa8821d543d [0,1,0,1,0,0|1,0,1]=4 5643 B13R1.539 COC(=O)COCCNC1CCC1 b6afd8946e421593f82e08b31a93072d [0,1,0,1,0,0|1,0,1]=4 5644 B13R1.539 COC(=O)COCCOC1CCC1 5fd6ed5c8f551d89b1de276d4f224626 [0,1,0,1,0,0|1,0,1]=4 5645 B13R1.539 COC(=O)CSCCCN1CCC1 9668f95dca55bb59f0f5f8f9ead71f12 [0,1,0,1,0,0|1,0,1]=4 5646 B13R1.539 COC(=O)OCCOCC1CCC1 bcc539fc53d46f811e1e9d801cf5ef82 [0,1,0,1,0,0|1,0,1]=4 5647 B13R1.539 COC(=O)OCNCCC1CCC1 f264102b3f35473d5ddc0e1e92c55670 [0,1,0,1,0,0|1,0,1]=4 5648 B13R1.539 COC(=O)OCOCCC1CCC1 fa602eef7923d8431b8b1e4448594049 [0,1,0,1,0,0|1,0,1]=4 5649 B13R1.595 COC(=O)/C=C/CNC1CCC1F 9307da5522e319af351a13c3f68b5a1c [0,1,0,1,0,0|1,0,0]=3 5650 B13R1.595 COC(=O)/C=C/CNC1CCC1O 6ca5bf49dbb6f2628cc65f00d0ac8008 [0,1,0,1,0,0|1,0,0]=3 5651 B13R1.595 COC(=O)/C=C/CNC1COC1C 50e1629bf31691e89f2ff2732e15b8ef [0,1,0,1,0,0|1,0,0]=3 5652 B13R1.595 COC(=O)/C=C/CN[C@@H]1CC[C@@H]1O 1ba5b7498f6fa0c0b3e7c48e9bdc4512 [0,1,0,1,0,0|1,0,0]=3 5653 B13R1.595 COC(=O)/C=C/CN[C@@H]1CC[C@H]1C 143c64274e6a51247a4ed0d792a6b11a [0,1,0,1,0,0|0,0,0]=2 5654 B13R1.595 COC(=O)/C=C/CN[C@@H]1CC[C@H]1O efcf12cecb1e82ded9f74153aac23038 [0,1,0,1,0,0|1,0,0]=3 5655 B13R1.595 COC(=O)/C=C/CN[C@H]1CC[C@@H]1O f36c1fa71d81a814e770b1854128bfa7 [0,1,0,1,0,0|1,0,0]=3 5656 B13R1.595 COC(=O)/C=C/CN[C@H]1CC[C@H]1C 2f33c8c863fd062ab12be850a727ccdc [0,1,0,1,0,0|0,0,0]=2 5657 B13R1.595 COC(=O)/C=C/CN[C@H]1CC[C@H]1O e491924d6cd43571400309379090b6e0 [0,1,0,1,0,0|1,0,0]=3 5658 B13R1.595 COC(=O)/C=C/COC1CCC1=O b2b4325300ffc2450b01b84e6f7294b7 [0,1,0,1,0,0|1,0,1]=4 5659 B13R1.595 COC(=O)/C=C/COC1COC1C 2e402c3e43eef1a81eab3923616485ee [0,1,0,1,0,0|1,0,0]=3 5660 B13R1.595 COC(=O)/C=C\CNC1CCC1F 320354c1047ac9dc2fdc989b6aa92a08 [0,1,0,1,0,0|1,0,0]=3 5661 B13R1.595 COC(=O)/C=C\CNC1CCC1O fda36dd0ed4e58bb8323bf5deb09cdec [0,1,0,1,0,0|1,0,0]=3 5662 B13R1.595 COC(=O)/C=C\CNC1COC1C 64f5a5aed1fd89e341524f13b10650d5 [0,1,0,1,0,0|1,0,0]=3 5663 B13R1.595 COC(=O)/C=C\CN[C@@H]1CC[C@@H]1O be300ca407a90ae06df765714b94b915 [0,1,0,1,0,0|1,0,0]=3 5664 B13R1.595 COC(=O)/C=C\CN[C@@H]1CC[C@H]1C 5ea344e8fbe791dc2230a3937408a206 [0,1,0,1,0,0|0,0,0]=2 5665 B13R1.595 COC(=O)/C=C\CN[C@@H]1CC[C@H]1O 0e7a1c23cadc69d332c906f2380fae7e [0,1,0,1,0,0|1,0,0]=3 5666 B13R1.595 COC(=O)/C=C\CN[C@H]1CC[C@@H]1O aee5332ccb5b2973f6e6fcc54a86ac9c [0,1,0,1,0,0|1,0,0]=3 5667 B13R1.595 COC(=O)/C=C\CN[C@H]1CC[C@H]1C a65ab9f973af797f85f1f73e1f52d79c [0,1,0,1,0,0|0,0,0]=2 5668 B13R1.595 COC(=O)/C=C\CN[C@H]1CC[C@H]1O 6bd7f2f425fcaccf7362467b216319c3 [0,1,0,1,0,0|1,0,0]=3 5669 B13R1.595 COC(=O)/C=C\COC1CCC1=O c57b8bc49645fcd8ff8b0e66626be87c [0,1,0,1,0,0|1,0,1]=4 5670 B13R1.595 COC(=O)/C=C\COC1COC1C 6dc266b37fd30197ecac1eff5b5d67c1 [0,1,0,1,0,0|1,0,0]=3 5671 B13R1.595 COC(=O)C#CCN[C@@H]1CC[C@H]1C 0eab25d43585185894ece6010e9b3534 [0,1,0,1,0,0|0,0,2]=4 5672 B13R1.595 COC(=O)C#CCN[C@H]1CC[C@H]1C d6316ae06f26cd5e7c6c67be5f1f9912 [0,1,0,1,0,0|0,0,2]=4 5673 B13R1.595 COC(=O)C=CCNC1CCC1F 5aabeac42971e7565f0b9bd0abb0b8ca [0,1,0,1,0,0|1,0,0]=3 5674 B13R1.595 COC(=O)C=CCNC1CCC1O 7f4da8062db7dfe38c74cc4abbbbc298 [0,1,0,1,0,0|1,0,0]=3 5675 B13R1.595 COC(=O)C=CCNC1COC1C 8353f9cc1f82d292d511ee8c04896fa2 [0,1,0,1,0,0|1,0,0]=3 5676 B13R1.595 COC(=O)C=CCN[C@@H]1CC[C@@H]1O c95a2df16c9153f0b7ddc01284221f35 [0,1,0,1,0,0|1,0,0]=3 5677 B13R1.595 COC(=O)C=CCN[C@@H]1CC[C@H]1C 36dd55becbd8ceedf30980b1c27e506b [0,1,0,1,0,0|0,0,0]=2 5678 B13R1.595 COC(=O)C=CCN[C@@H]1CC[C@H]1O f008caa62736985f13dbf0c672772217 [0,1,0,1,0,0|1,0,0]=3 5679 B13R1.595 COC(=O)C=CCN[C@H]1CC[C@@H]1O 72904db6cf305013e81a9557f97ba615 [0,1,0,1,0,0|1,0,0]=3 5680 B13R1.595 COC(=O)C=CCN[C@H]1CC[C@H]1C e969d7bb9e6b2b9b5aeaefed2959f65a [0,1,0,1,0,0|0,0,0]=2 5681 B13R1.595 COC(=O)C=CCN[C@H]1CC[C@H]1O 8152397bb508a493c2542908c258865a [0,1,0,1,0,0|1,0,0]=3 5682 B13R1.595 COC(=O)C=CCOC1CCC1=O 55e38685df70dbb6c85c2bb02b9c0dc7 [0,1,0,1,0,0|1,0,1]=4 5683 B13R1.595 COC(=O)C=CCOC1COC1C 27856e55f6019350cd60d3c498bb6b14 [0,1,0,1,0,0|1,0,0]=3 5684 B13R1.595 COC(=O)CCCN[C@@H]1CC[C@H]1C 6290219bfd8fd8e859ad6586e882ea36 [0,1,0,1,0,0|0,0,2]=4 5685 B13R1.595 COC(=O)CCCN[C@H]1CC[C@H]1C d405beb0a3a46b17cdaf4f4aceed10dc [0,1,0,1,0,0|0,0,2]=4 5686 B13R1.619 COC(=O)/C=C/CN[C@@H]1C[C@@H]1OC 5ea813d4079a083ca9bdb0a36b272000 [0,1,0,1,0,0|1,0,0]=3 5687 B13R1.619 COC(=O)/C=C/CN[C@@H]1C[C@H]1CO b9d31882d0b0a403f45d1dbcad53cd88 [0,1,0,1,0,0|1,0,0]=3 5688 B13R1.619 COC(=O)/C=C/CN[C@H]1C[C@@H]1CO 0745e8d7312b3866e876094f2abec4f5 [0,1,0,1,0,0|1,0,0]=3 5689 B13R1.619 COC(=O)/C=C/CN[C@H]1C[C@H]1CO 889f487563ea4af877ed2ae8ecee09ec [0,1,0,1,0,0|1,0,0]=3 5690 B13R1.619 COC(=O)/C=C/COC1CC1C=O fb91ae9c2c489765b600ed494d7953a4 [0,1,0,1,0,0|1,0,1]=4 5691 B13R1.619 COC(=O)/C=C\CN[C@@H]1C[C@@H]1OC 50e799a906aa5feb9abbf365a4915ce0 [0,1,0,1,0,0|1,0,0]=3 5692 B13R1.619 COC(=O)/C=C\CN[C@@H]1C[C@H]1CO bf71ed20ae97d7b06c05d2968983f511 [0,1,0,1,0,0|1,0,0]=3 5693 B13R1.619 COC(=O)/C=C\CN[C@H]1C[C@@H]1CO 46607c01345b6fe3902b087b3b00cdc6 [0,1,0,1,0,0|1,0,0]=3 5694 B13R1.619 COC(=O)/C=C\CN[C@H]1C[C@H]1CO cf0f5c308093062b4abdaeade5f72d76 [0,1,0,1,0,0|1,0,0]=3 5695 B13R1.619 COC(=O)C=CCN[C@@H]1C[C@@H]1OC 46aeae0942c8df208a1147d1d9229d9c [0,1,0,1,0,0|1,0,0]=3 5696 B13R1.619 COC(=O)C=CCN[C@@H]1C[C@H]1CO e36dd0e566efc35c8a6ce892c119338a [0,1,0,1,0,0|1,0,0]=3 5697 B13R1.619 COC(=O)C=CCN[C@H]1C[C@@H]1CO f2e39367962c4d7bc2d498fe2a94a19e [0,1,0,1,0,0|1,0,0]=3 5698 B13R1.619 COC(=O)C=CCN[C@H]1C[C@H]1CO 4b0d6c80b9864243269d781e235531f6 [0,1,0,1,0,0|1,0,0]=3 5699 B13R1.1741 COC(=O)/C=C/CNCC1(CC1)F 10fd2694f79e2f032dda0a27043992a1 [0,1,0,1,0,0|1,0,0]=3 5700 B13R1.1741 COC(=O)/C=C/CNCC1(CC1)O 0fcc88cd0a6a2191350181a82500d689 [0,1,0,1,0,0|1,0,0]=3 5701 B13R1.1741 COC(=O)/C=C/COCC1(CC1)Br cfd26d6d31367afd2836703fb5493f76 [0,1,0,1,0,0|1,0,0]=3 5702 B13R1.1741 COC(=O)/C=C/COCC1(CC1)C 40e49bda40d41b16d552efd439f1dd27 [0,1,0,1,0,0|1,0,0]=3 5703 B13R1.1741 COC(=O)/C=C/COCC1(CC1)Cl 97285e59533846f208546d68edc4ea37 [0,1,0,1,0,0|1,0,0]=3 5704 B13R1.1741 COC(=O)/C=C/COCC1(CC1)F 05d8c68d3d0616572135efe78ae6efa3 [0,1,0,1,0,0|1,0,0]=3 5705 B13R1.1741 COC(=O)/C=C\CNCC1(CC1)F 2b99fd17ed0c35c921f4fc09e9c499e8 [0,1,0,1,0,0|1,0,0]=3 5706 B13R1.1741 COC(=O)/C=C\CNCC1(CC1)O cb4997818b2bffd811a0429cd3fdf9c8 [0,1,0,1,0,0|1,0,0]=3 5707 B13R1.1741 COC(=O)/C=C\COCC1(CC1)Br cd9989aeff8ac58dadb43ae72d3fa877 [0,1,0,1,0,0|1,0,0]=3 5708 B13R1.1741 COC(=O)/C=C\COCC1(CC1)C 19022173a7c532fd9f4cc484071b61a7 [0,1,0,1,0,0|1,0,0]=3 5709 B13R1.1741 COC(=O)/C=C\COCC1(CC1)Cl 458497077b4922c798f8bf81d41a7173 [0,1,0,1,0,0|1,0,0]=3 5710 B13R1.1741 COC(=O)/C=C\COCC1(CC1)F 473a5dabb7bef98d635767f7a4b4bc9b [0,1,0,1,0,0|1,0,0]=3 5711 B13R1.1741 COC(=O)C=CCNCC1(CC1)F 2f6159258dde05da289ae8847e5b85c0 [0,1,0,1,0,0|1,0,0]=3 5712 B13R1.1741 COC(=O)C=CCNCC1(CC1)O d16a2e118997f199d023cb561bdc5a39 [0,1,0,1,0,0|1,0,0]=3 5713 B13R1.1741 COC(=O)C=CCOCC1(CC1)Br 706ce5f3471f0c345acc1d4c7d8162ad [0,1,0,1,0,0|1,0,0]=3 5714 B13R1.1741 COC(=O)C=CCOCC1(CC1)C 7d5340cce5b60fdffc20afdb35907b3a [0,1,0,1,0,0|1,0,0]=3 5715 B13R1.1741 COC(=O)C=CCOCC1(CC1)Cl 2449940c445de4970d5f2c945fc52bc0 [0,1,0,1,0,0|1,0,0]=3 5716 B13R1.1741 COC(=O)C=CCOCC1(CC1)F 7d1463b5212f741df301647b93fa7b08 [0,1,0,1,0,0|1,0,0]=3 5717 B13R1.1869 COC(=O)CN1CCCC(CC1)C eb87890254ea64bef278b979a9e0d13f [0,1,0,1,0,0|1,0,1]=4 5718 B13R1.1869 COC(=O)CN1CCCC(CC1)F 12ef7c57ac3a2b25e76eaa3157fbbe09 [0,1,0,1,0,0|1,0,1]=4 5719 B13R1.1869 COC(=O)CN1CCCC(CC1)O 06742f6550f24b10a47fe5a394618bd2 [0,1,0,1,0,0|1,0,1]=4 5720 B13R1.1869 COC(=O)CN1CCC[C@@H](CC1)O 0454fd2bd18a70ad9cbf47340cd16fc2 [0,1,0,1,0,0|1,0,1]=4 5721 B13R1.1869 COC(=O)CN1CCC[C@H](CC1)O 42579e44c4f9b76e181b8dfa024ef26d [0,1,0,1,0,0|1,0,1]=4 5722 B13R1.128 C=C(C)CCNCC1=CC(=O)OC1 8837d84078b8f6e30f3e44ce5a5e3b15 [0,1,0,1,0,0|1,0,1]=4 5723 B13R1.128 CC(=O)CCCOC1=CC(=O)OC1 0c62b5698022de8730a38bf6146cc85a [0,1,0,1,0,0|1,0,1]=4 5724 B13R1.128 CC(=O)CCOCC1=CC(=O)OC1 75f25fd48176fa291c92a5351e51f899 [0,1,0,1,0,0|1,0,1]=4 5725 B13R1.128 CC(C)CCCOC1=CC(=O)CC1 9c3b7a9f463f8acb8b3c14d0a84c0114 [0,1,0,1,0,0|2,0,0]=4 5726 B13R1.128 CC(C)CCCOC1=CC(=O)NC1 a6eebd2d333ec336592b614a7d96fb42 [0,1,0,1,0,0|2,0,0]=4 5727 B13R1.128 CC(C)CCCOC1=CC(=O)OC1 7c1f5f8a1c178aba3a53fbecb53a1c5c [0,1,0,1,0,0|1,0,0]=3 5728 B13R1.128 CC(C)CCNCC1=CC(=O)OC1 ec087bddc7979a46187b12839d2323dd [0,1,0,1,0,0|1,0,0]=3 5729 B13R1.128 CC(O)CCNCC1=CC(=O)OC1 7a6d17fe13ffe30b0a2616ca9a99a921 [0,1,0,1,0,0|1,0,0]=3 5730 B13R1.128 CN(C)CCCOC1=CC(=O)OC1 45b8927fbbed17da1c6d14a10c3739e9 [0,1,0,1,0,0|2,0,0]=4 5731 B13R1.128 CN(C)CCNCC1=CC(=O)OC1 b6b9e83853539e563a2245e4297c0a84 [0,1,0,1,0,0|2,0,0]=4 5732 B13R1.128 CN(C)CCOCC1=CC(=O)OC1 7f5571256944659fdcb31b2bac287a73 [0,1,0,1,0,0|2,0,0]=4 5733 B13R1.128 CS(=O)CCNCC1=CC(=O)OC1 a3162b7afd6db3cdb8e096bc8d740526 [0,1,0,1,0,0|2,0,0]=4 5734 B13R1.128 CS(=O)CCOCC1=CC(=O)OC1 e992e09c682deeb3f17f2805d19cd14f [0,1,0,1,0,0|2,0,0]=4 5735 B13R1.128 C[C@@H](O)CCNCC1=CC(=O)OC1 b836fb0803a2c479cb8e853ece89cf2c [0,1,0,1,0,0|1,0,0]=3 5736 B13R1.128 C[C@H](O)CCNCC1=CC(=O)OC1 dbdcda9d03521ad8c7eddbc73b45acb5 [0,1,0,1,0,0|1,0,0]=3 5737 B13R1.128 O=C1C=C(CO1)CNCCC(F)F b3ab364cd0d5350408ad7af8e90b659c [0,1,0,1,0,0|2,0,0]=4 5738 B13R1.128 O=C1C=C(CO1)COCCC(F)F 728b229959d2124294c6f46d569cde45 [0,1,0,1,0,0|2,0,0]=4 5739 B13R1.530 COC(=O)/C=C/CNC1CC(C1)F 478c784474c62aa8e4d35c8d3c9e46f4 [0,1,0,1,0,0|1,0,0]=3 5740 B13R1.530 COC(=O)/C=C/CNC1CC(C1)O 43a80cc1ace8ef8dd6b2d8fa7496dc18 [0,1,0,1,0,0|1,0,0]=3 5741 B13R1.530 COC(=O)/C=C/CNC1CN(C1)C edd7dda695788a4c5f66e574d2d8529b [0,1,0,1,0,0|2,0,0]=4 5742 B13R1.530 COC(=O)/C=C/CN[C@H]1C[C@@H](C1)F 208619fd473f790cdb3799005ebe6820 [0,1,0,1,0,0|1,0,0]=3 5743 B13R1.530 COC(=O)/C=C/CN[C@H]1C[C@@H](C1)O e056b144517e33b834c2c544dcfdfbef [0,1,0,1,0,0|1,0,0]=3 5744 B13R1.530 COC(=O)/C=C/CN[C@H]1C[C@H](C1)F 4f31d6d7816d37d10573cc32cee72cbf [0,1,0,1,0,0|1,0,0]=3 5745 B13R1.530 COC(=O)/C=C/CN[C@H]1C[C@H](C1)O 021e333cafd03e7366f457e69f24f2e5 [0,1,0,1,0,0|1,0,0]=3 5746 B13R1.530 COC(=O)/C=C/COC1CC(=O)C1 1daaf1f7920286eb33e43763403bfd40 [0,1,0,1,0,0|1,0,1]=4 5747 B13R1.530 COC(=O)/C=C/COC1CC(C1)C 7bc9fec175e705092c496da108fd00fb [0,1,0,1,0,0|1,0,0]=3 5748 B13R1.530 COC(=O)/C=C/COC1CC(C1)F 9e8bdedf4b80c32f9ce48aad281246ec [0,1,0,1,0,0|1,0,0]=3 5749 B13R1.530 COC(=O)/C=C/COC1CN(C1)C 0449a9643b13506c5f8acfe6e9ed7174 [0,1,0,1,0,0|2,0,0]=4 5750 B13R1.530 COC(=O)/C=C/CO[C@H]1C[C@@H](C1)F c321a57209b4af556a9a4b1bf68e8e83 [0,1,0,1,0,0|1,0,0]=3 5751 B13R1.530 COC(=O)/C=C/CO[C@H]1C[C@H](C1)F 5ecede2e25a61b98608dd7dcb399bfe3 [0,1,0,1,0,0|1,0,0]=3 5752 B13R1.530 COC(=O)/C=C\CNC1CC(C1)F 26de614c144ad02da3a72dacb85949f6 [0,1,0,1,0,0|1,0,0]=3 5753 B13R1.530 COC(=O)/C=C\CNC1CC(C1)O ff2289511c9340140c3f3471a4de0af3 [0,1,0,1,0,0|1,0,0]=3 5754 B13R1.530 COC(=O)/C=C\CNC1CN(C1)C a427bf9ac06c3a1892582e381cfd9286 [0,1,0,1,0,0|2,0,0]=4 5755 B13R1.530 COC(=O)/C=C\CN[C@H]1C[C@@H](C1)F 37c990f58fee611924f534e352b18591 [0,1,0,1,0,0|1,0,0]=3 5756 B13R1.530 COC(=O)/C=C\CN[C@H]1C[C@@H](C1)O b59f0e18e287bd84d06acb74b2f55e00 [0,1,0,1,0,0|1,0,0]=3 5757 B13R1.530 COC(=O)/C=C\CN[C@H]1C[C@H](C1)F bd177c87564e7b78dc06ca8af0025b63 [0,1,0,1,0,0|1,0,0]=3 5758 B13R1.530 COC(=O)/C=C\CN[C@H]1C[C@H](C1)O 76965e71497e4387821deb26ed7cb65a [0,1,0,1,0,0|1,0,0]=3 5759 B13R1.530 COC(=O)/C=C\COC1CC(=O)C1 cd89d29feda3fda5ba0bf370da6e846f [0,1,0,1,0,0|1,0,1]=4 5760 B13R1.530 COC(=O)/C=C\COC1CC(C1)C 2edbbd28f0e8ed8a7d5b2fe602c79849 [0,1,0,1,0,0|1,0,0]=3 5761 B13R1.530 COC(=O)/C=C\COC1CC(C1)F 6e8a72f3e49227bb175be2e4dd27a5f4 [0,1,0,1,0,0|1,0,0]=3 5762 B13R1.530 COC(=O)/C=C\COC1CN(C1)C 4b187129881c14b449e2b9d899d28da7 [0,1,0,1,0,0|2,0,0]=4 5763 B13R1.530 COC(=O)/C=C\CO[C@H]1C[C@@H](C1)F 8357d15c6204eddfbc6ad6706b8866ff [0,1,0,1,0,0|1,0,0]=3 5764 B13R1.530 COC(=O)/C=C\CO[C@H]1C[C@H](C1)F 7c6a6a8d0e8978f3a4fd89bb15b19269 [0,1,0,1,0,0|1,0,0]=3 5765 B13R1.530 COC(=O)C=CCNC1CC(C1)F 7748c36250b2c727b5e499f2a0d16d91 [0,1,0,1,0,0|1,0,0]=3 5766 B13R1.530 COC(=O)C=CCNC1CC(C1)O 6ae901065c0327b59adc0ac8995a23ed [0,1,0,1,0,0|1,0,0]=3 5767 B13R1.530 COC(=O)C=CCNC1CN(C1)C 0d0b049d886033aaca9dfa65e4f20ada [0,1,0,1,0,0|2,0,0]=4 5768 B13R1.530 COC(=O)C=CCN[C@H]1C[C@@H](C1)F 145ac819f7f7a52d35cb9fb2d7c92fdb [0,1,0,1,0,0|1,0,0]=3 5769 B13R1.530 COC(=O)C=CCN[C@H]1C[C@@H](C1)O 68eb7971089056a95a0c3731ea4a9bbc [0,1,0,1,0,0|1,0,0]=3 5770 B13R1.530 COC(=O)C=CCN[C@H]1C[C@H](C1)F b67646d7fbde839c78c5a51426b9fe9a [0,1,0,1,0,0|1,0,0]=3 5771 B13R1.530 COC(=O)C=CCN[C@H]1C[C@H](C1)O 33d97536ad9f21f4ee9a33bc27b79709 [0,1,0,1,0,0|1,0,0]=3 5772 B13R1.530 COC(=O)C=CCOC1CC(=O)C1 e3bd31926f6c5a380270c68752acf39b [0,1,0,1,0,0|1,0,1]=4 5773 B13R1.530 COC(=O)C=CCOC1CC(C1)C 642da02341c2e1d751433876062a6841 [0,1,0,1,0,0|1,0,0]=3 5774 B13R1.530 COC(=O)C=CCOC1CC(C1)F 812e16adbdabd1767ad57b739f11da24 [0,1,0,1,0,0|1,0,0]=3 5775 B13R1.530 COC(=O)C=CCOC1CN(C1)C 3c05771e68be16cdd70dc3a79b9e895c [0,1,0,1,0,0|2,0,0]=4 5776 B13R1.530 COC(=O)C=CCO[C@H]1C[C@@H](C1)F 2d0ef2c8655bc149778f3c352efc8c1a [0,1,0,1,0,0|1,0,0]=3 5777 B13R1.530 COC(=O)C=CCO[C@H]1C[C@H](C1)F f7da06f67aed84f1de3eb4192e1d1b7d [0,1,0,1,0,0|1,0,0]=3 5778 B13R1.594 COC(=O)/C=C/C=C/CNC1CC1 2232c31bd80da134f5066c90cc6e7a23 [0,1,0,1,0,0|0,0,2]=4 5779 B13R1.594 COC(=O)/C=C/C=C/COC1CC1 c6d656dfad1bf412842ad2bedebd5333 [0,1,0,1,0,0|0,0,2]=4 5780 B13R1.594 COC(=O)/C=C/CNCCC1CC1 9f141ac8deede43856681b0cf04b6962 [0,1,0,1,0,0|0,0,0]=2 5781 B13R1.594 COC(=O)/C=C/CNCCN1CC1 04dd69125804a764250b46aec462a39c [0,1,0,1,0,0|1,0,0]=3 5782 B13R1.594 COC(=O)/C=C/COCCC1CC1 a624ba1217a0dcac972ed7ea16d976b3 [0,1,0,1,0,0|0,0,0]=2 5783 B13R1.594 COC(=O)/C=C/COCCN1CC1 bd8aea852e71405bd029b6c2f2e34bd8 [0,1,0,1,0,0|1,0,0]=3 5784 B13R1.594 COC(=O)/C=C\CNCCC1CC1 39ae7cd37120ef738b3edcd3bb52ecb9 [0,1,0,1,0,0|0,0,0]=2 5785 B13R1.594 COC(=O)/C=C\CNCCN1CC1 4015528ae52ba43f216087807434b0a9 [0,1,0,1,0,0|1,0,0]=3 5786 B13R1.594 COC(=O)/C=C\COCCC1CC1 6a924ce259d15ec84e035617a027aca1 [0,1,0,1,0,0|0,0,0]=2 5787 B13R1.594 COC(=O)/C=C\COCCN1CC1 5764060b175f0626e83f9d9298a05545 [0,1,0,1,0,0|1,0,0]=3 5788 B13R1.594 COC(=O)C#CCNCCC1CC1 967c98ce29fce6d6443f5bc03d742db5 [0,1,0,1,0,0|0,0,2]=4 5789 B13R1.594 COC(=O)C#CCOCCC1CC1 8deda398254d05f2c82a17b456fc4962 [0,1,0,1,0,0|0,0,2]=4 5790 B13R1.594 COC(=O)C=CC=CCNC1CC1 508359d2f4cb118382a7e3b7f628f703 [0,1,0,1,0,0|0,0,2]=4 5791 B13R1.594 COC(=O)C=CC=CCOC1CC1 7c5b447407ff226fccbef00d24e0a1de [0,1,0,1,0,0|0,0,2]=4 5792 B13R1.594 COC(=O)C=CCNCCC1CC1 3e345648bb0864a7766ad8d539740bda [0,1,0,1,0,0|0,0,0]=2 5793 B13R1.594 COC(=O)C=CCNCCN1CC1 a2b7341c8d5ba26f9312c6789708badc [0,1,0,1,0,0|1,0,0]=3 5794 B13R1.594 COC(=O)C=CCOCCC1CC1 b5e37c3ea80fe4697dc9e76f1bb959ac [0,1,0,1,0,0|0,0,0]=2 5795 B13R1.594 COC(=O)C=CCOCCN1CC1 e7ece05f5200cae400685aeaa983edd2 [0,1,0,1,0,0|1,0,0]=3 5796 B13R1.594 COC(=O)CCCCCNC1CC1 b33f49a20f0ef12360cfe7dbffd87091 [0,1,0,1,0,0|0,0,2]=4 5797 B13R1.594 COC(=O)CCCCCOC1CC1 a19a1baec6240f46c65879fd3cd8464b [0,1,0,1,0,0|0,0,2]=4 5798 B13R1.594 COC(=O)CCCCNCC1CC1 987b8409f7092c59b1cd4b12fec4b603 [0,1,0,1,0,0|0,0,2]=4 5799 B13R1.594 COC(=O)CCCCOCC1CC1 58edd3984adeb49462c1f9196a7cf71c [0,1,0,1,0,0|0,0,2]=4 5800 B13R1.594 COC(=O)CCCNCCC1CC1 b008b9012101c3953dab5df30b435f8e [0,1,0,1,0,0|0,0,2]=4 5801 B13R1.594 COC(=O)CCCOCCC1CC1 2150b8d8abc929fe46cc09637dc4be59 [0,1,0,1,0,0|0,0,2]=4 5802 B13R1.594 COC(=O)CCOCCCC1CC1 c9e3a5a792d067b7a7c385058af869a1 [0,1,0,1,0,0|0,0,2]=4 5803 B13R1.594 COC(=O)CNCCSCC1CC1 510f93e01316f273b9b547283f4007a5 [0,1,0,1,0,0|1,0,1]=4 5804 B13R1.594 COC(=O)COCCCNC1CC1 337d23fa67f9f28c1d3eceabdf13981f [0,1,0,1,0,0|1,0,1]=4 5805 B13R1.594 COC(=O)COCCCOC1CC1 d6f8dc5f5a395e363692b23e3d7d2a45 [0,1,0,1,0,0|1,0,1]=4 5806 B13R1.594 COC(=O)COCCCSC1CC1 0bd042a840b999735cb56e912a668d63 [0,1,0,1,0,0|1,0,1]=4 5807 B13R1.594 COC(=O)COCCNCC1CC1 7deb5e5fb6a695b5cc9dac2d26753270 [0,1,0,1,0,0|1,0,1]=4 5808 B13R1.594 COC(=O)COCCOCC1CC1 dec176cce398b758bf7be1cf8e922053 [0,1,0,1,0,0|1,0,1]=4 5809 B13R1.594 COC(=O)CSCCCNC1CC1 86f40339e5a8814a6f62c5aa9d73bca2 [0,1,0,1,0,0|1,0,1]=4 5810 B13R1.594 COC(=O)CSCCCOC1CC1 fe3a338045b5e949cc92e3004b405508 [0,1,0,1,0,0|1,0,1]=4 5811 B13R1.594 COC(=O)OCCOCCC1CC1 3ee156467d4cfd38680bd5d1ed5bb110 [0,1,0,1,0,0|1,0,1]=4 5812 B13R1.594 COC(=O)OCOCCCC1CC1 862bfb2750ae0732ae7a79ef1a4ff0ff [0,1,0,1,0,0|1,0,1]=4 5813 B13R1.598 COC(=O)CNC1CCCC1(C)C d00051557e8968df00938e080362f130 [0,1,0,1,0,0|1,0,1]=4 5814 B13R1.598 COC(=O)CNC1CCCC1(C)O 57a1dad1711e670dedb661331c42671d [0,1,0,1,0,0|1,0,1]=4 5815 B13R1.598 COC(=O)CN[C@@H]1CCC[C@@]1(C)O 4c4938dfe4267db5afba4a9404021f88 [0,1,0,1,0,0|1,0,1]=4 5816 B13R1.598 COC(=O)CN[C@H]1CCC[C@]1(C)O 6eed76edc5bd3846e0548e5014c73dce [0,1,0,1,0,0|1,0,1]=4 5817 B13R1.598 COC(=O)COC1CCCC1(C)C eaa5e891a18c78196137cda659c61fe5 [0,1,0,1,0,0|1,0,1]=4 5818 B13R1.598 COC(=O)CO[C@@H]1CCCC1(C)C 5d2448ed14182ee35f808b12d5ea6f15 [0,1,0,1,0,0|1,0,1]=4 5819 B13R1.598 COC(=O)CO[C@H]1CCCC1(C)C 410e750a7b3fe6f38caa478bb9695d5c [0,1,0,1,0,0|1,0,1]=4 5820 B13R1.2030 COC(=O)/C=C/CNC1CC1(C)C e6188cc8a6d28abc1175317b37d07085 [0,1,0,1,0,0|1,0,0]=3 5821 B13R1.2030 COC(=O)/C=C/CNC1CC1(F)F 31114f0399ab3faf7426a1481893098d [0,1,0,1,0,0|2,0,0]=4 5822 B13R1.2030 COC(=O)/C=C/CN[C@@H]1CC1(C)C f4514975685bb0054f3e85e288e51c42 [0,1,0,1,0,0|1,0,0]=3 5823 B13R1.2030 COC(=O)/C=C/CN[C@H]1CC1(C)C ec888baa2e1be9fa6c64de32c9392a92 [0,1,0,1,0,0|1,0,0]=3 5824 B13R1.2030 COC(=O)/C=C/COC1CC1(C)C c99039d21f8a8ba6d67d0d99963febd7 [0,1,0,1,0,0|1,0,0]=3 5825 B13R1.2030 COC(=O)/C=C/COC1CC1(F)F 6a77c0573a1e1abdca7e396ba6de5c80 [0,1,0,1,0,0|2,0,0]=4 5826 B13R1.2030 COC(=O)/C=C\CNC1CC1(C)C 43ca10291f0eb052b8e3cea201c709b8 [0,1,0,1,0,0|1,0,0]=3 5827 B13R1.2030 COC(=O)/C=C\CNC1CC1(F)F 5d4718113506931a3c29fa393e9dbd8b [0,1,0,1,0,0|2,0,0]=4 5828 B13R1.2030 COC(=O)/C=C\CN[C@@H]1CC1(C)C b0d780e48949dda7b3fbca6d82870484 [0,1,0,1,0,0|1,0,0]=3 5829 B13R1.2030 COC(=O)/C=C\CN[C@H]1CC1(C)C 9ed6db7ca167e2e0bddc05b79bffc40f [0,1,0,1,0,0|1,0,0]=3 5830 B13R1.2030 COC(=O)/C=C\COC1CC1(F)F d9ac8e14cb99515fec35612cffe722ab [0,1,0,1,0,0|2,0,0]=4 5831 B13R1.2030 COC(=O)C=CCNC1CC1(C)C 954bcd52a07512474208c879572e09aa [0,1,0,1,0,0|1,0,0]=3 5832 B13R1.2030 COC(=O)C=CCNC1CC1(F)F 5a1b77d2fc0b852533aef665ee8e977b [0,1,0,1,0,0|2,0,0]=4 5833 B13R1.2030 COC(=O)C=CCN[C@@H]1CC1(C)C 5de2f772ebcaf55d116a639927790a7f [0,1,0,1,0,0|1,0,0]=3 5834 B13R1.2030 COC(=O)C=CCN[C@H]1CC1(C)C 867a5bde0edc61995f182e7a2f33089d [0,1,0,1,0,0|1,0,0]=3 5835 B13R1.2030 COC(=O)C=CCOC1CC1(F)F ee1e6d199cf17310d7c30accea3d672f [0,1,0,1,0,0|2,0,0]=4 5836 B13R1.2878 COC(=O)CN1CCCCC1(C)C f72dca2f1ac4a70b2d52dc1bc4da2b27 [0,1,0,1,0,0|1,0,1]=4 5837 B13R1.2880 COC(=O)CN1CCCC1C(C)C ffba85033b61ce0495cc87f50131be8f [0,1,0,1,0,0|1,0,1]=4 5838 B13R1.2880 COC(=O)CN1CCCC1C(C)O e1ebf604c556b1d527c6a425617d41ac [0,1,0,1,0,0|1,0,1]=4 5839 B13R1.2880 COC(=O)CN1CCC[C@@H]1C(C)O 1f3f68f2359594f753f553e461cb595c [0,1,0,1,0,0|1,0,1]=4 5840 B13R1.2880 COC(=O)CN1CCC[C@H]1C(C)C c8dec4c853158dc983ab518ff8a58099 [0,1,0,1,0,0|1,0,1]=4 5841 B13R1.2880 COC(=O)CN1CCC[C@H]1[C@H](C)O 376321d51fbc55b7c9e44e5bf2da72de [0,1,0,1,0,0|1,0,1]=4 5842 B13R1.9 CCCCCNc1ccc(=O)oc1 f21a24503753d556853d7949ad2707fa [0,1,0,1,0,0|0,0,2]=4 5843 B13R1.9 CCCCCOC1C=CC(=O)CO1 18d600dee2d9d1575200448fe0717ad3 [0,1,0,1,0,0|2,0,0]=4 5844 B13R1.9 CCCCCOC1CCC(=O)OC1 ab02a3b8886117a11c20363b388a403a [0,1,0,1,0,0|0,0,2]=4 5845 B13R1.27 C#CCCCNCC1=CC(=O)OC1 6055bbc79205126d13fbf88c7182bbd3 [0,1,0,1,0,0|0,0,2]=4 5846 B13R1.27 C#CCCCOCC1=CC(=O)OC1 fdf14a0ee123e2cb7e243c9db477b07d [0,1,0,1,0,0|0,0,2]=4 5847 B13R1.27 C/C=C/CCOCC1=CC(=O)OC1 b0ee2ea8ec7188252956fe37ced78313 [0,1,0,1,0,0|0,0,2]=4 5848 B13R1.27 C/C=C\CCCOC1=CC(=O)OC1 0df0318617a7a8100066b9afce843374 [0,1,0,1,0,0|0,0,2]=4 5849 B13R1.27 C=CCCCCOC1=CC(=O)OC1 2aadcc4f0c18e38c7b063f08d1965500 [0,1,0,1,0,0|0,0,2]=4 5850 B13R1.27 C=CCCCNCC1=CC(=O)OC1 b78845d4d53b10823f3812064b81f12b [0,1,0,1,0,0|0,0,2]=4 5851 B13R1.27 C=CCCCOCC1=CC(=O)OC1 6b780336efbb6e267e41186355e94822 [0,1,0,1,0,0|0,0,2]=4 5852 B13R1.27 CC#CCCOCC1=CC(=O)OC1 95a39fb9d3739579eb0617ca3bf386bc [0,1,0,1,0,0|0,0,2]=4 5853 B13R1.27 CC/C=C/COCC1=CC(=O)OC1 225e14faa2cd25913b2540ef7fd75fc7 [0,1,0,1,0,0|0,0,2]=4 5854 B13R1.27 CC/C=C\CCOC1=CC(=O)OC1 1271e0f3de84a00401c2e7ed558ae23f [0,1,0,1,0,0|0,0,2]=4 5855 B13R1.27 CC/C=C\COCC1=CC(=O)OC1 db320abf34dc37dd7d596a9be9ed13a3 [0,1,0,1,0,0|0,0,2]=4 5856 B13R1.27 CCC/C=C/COC1=CC(=O)OC1 5092c3e24e832705143951096bbef8ff [0,1,0,1,0,0|0,0,2]=4 5857 B13R1.27 CCC/C=C\COC1=CC(=O)OC1 c6f6e595dece457c9df2e42242c5ed8e [0,1,0,1,0,0|0,0,2]=4 5858 B13R1.27 CCCCCCNc1cc(=O)[nH]o1 6addd5f98d51f1b345075f7023083847 [0,1,0,1,0,0|2,0,0]=4 5859 B13R1.27 CCCCCCNc1cc(on1)C 8a56f68ce86d5b30aed03664030ee2b7 [0,1,0,1,0,0|2,0,0]=4 5860 B13R1.27 CCCCCCNc1noc(=O)[nH]1 8d8a30e767c5289fc951cc6b3a039aa3 [0,1,0,1,0,0|2,0,0]=4 5861 B13R1.27 CCCCCCOC1=CC(=O)NC1 75d6494d01e6c25f8c311c02d5aa7380 [0,1,0,1,0,0|1,0,0]=3 5862 B13R1.27 CCCCCCOC1=CC(=O)OC1 bb89993c5fab45264d69cf78343d59e5 [0,1,0,1,0,0|0,0,0]=2 5863 B13R1.27 CCCCCCOC1=COC(=O)C1 90214a016d0ecda88a0883210f13b662 [0,1,0,1,0,0|0,0,2]=4 5864 B13R1.27 CCCCCCOC1COC(=O)C1 28f001e17e026a8f26cb22776dca6850 [0,1,0,1,0,0|0,0,2]=4 5865 B13R1.27 CCCCCCO[C@@H]1COC(=O)C1 ef02ca3377c2ce6110235c6ba2ad32c2 [0,1,0,1,0,0|0,0,2]=4 5866 B13R1.27 CCCCCCO[C@H]1COC(=O)C1 67a4c35050b2f4e5b32ede0ab001b277 [0,1,0,1,0,0|0,0,2]=4 5867 B13R1.27 CCCCCNCC1=CC(=O)OC1 3f17f3693c1106339e0e2fe916b461b5 [0,1,0,1,0,0|0,0,0]=2 5868 B13R1.27 CCCCCNCc1cc(=O)[nH]o1 91e9b4cec7a0959f5a11bf2e0bfe3e34 [0,1,0,1,0,0|2,0,0]=4 5869 B13R1.27 CCCCCNCc1cc(on1)C 3054dc8de7aaa04fdffeb1eb1c6ab084 [0,1,0,1,0,0|2,0,0]=4 5870 B13R1.27 CCCCCNCc1coc(=O)o1 db150c690c65b33b8b16194b68cf6267 [0,1,0,1,0,0|1,0,1]=4 5871 B13R1.27 CCCCCOCC1=CC(=O)OC1 a2fd347d36c55d729a24252391551c86 [0,1,0,1,0,0|0,0,0]=2 5872 B13R1.27 CCCCCOCC1COC(=O)C1 aac64858da10e92c4edc85963383dca6 [0,1,0,1,0,0|0,0,2]=4 5873 B13R1.27 CCCCCOCc1cc(on1)C 4a595538406e1547abc01432dc043b8d [0,1,0,1,0,0|2,0,0]=4 5874 B13R1.27 CCCCCOCc1coc(=O)o1 f30bccd77247ee52811b01172a6e9ff5 [0,1,0,1,0,0|1,0,1]=4 5875 B13R1.27 CCCCCOCc1coc(c1)Br 35c86cc212ae45840032da9171acc111 [0,1,0,1,0,0|1,0,1]=4 5876 B13R1.27 CCCCOCOC1=CC(=O)NC1 6775b46a1bbbedc2de447817828ce2d8 [0,1,0,1,0,0|2,0,0]=4 5877 B13R1.27 CCCNCCOC1=CC(=O)CC1 784707ee0c6a0a70567c9a97d81aaa96 [0,1,0,1,0,0|2,0,0]=4 5878 B13R1.27 CCCOCCOC1=CC(=O)CC1 5a081ba32657b3b309bd05f66700d31b [0,1,0,1,0,0|2,0,0]=4 5879 B13R1.27 CCCOCCOC1=CC(=O)NC1 ddde1fbad62f6bb1a02b70189fb7c693 [0,1,0,1,0,0|2,0,0]=4 5880 B13R1.27 CCCOCCOC1=CC(=O)OC1 82306f50212c2df32b5aeb4cda7d0bae [0,1,0,1,0,0|1,0,0]=3 5881 B13R1.27 CCOCCCOC1=CC(=O)CC1 e2d377f7c619d774dd5c50cd4691d3f7 [0,1,0,1,0,0|2,0,0]=4 5882 B13R1.27 CCOCCCOC1=CC(=O)NC1 b7b5def0c967e5cd3564930bdafe0345 [0,1,0,1,0,0|2,0,0]=4 5883 B13R1.27 CCOCCCOC1=CC(=O)OC1 a7b728578ea70c619b6a6e3fb68af482 [0,1,0,1,0,0|1,0,0]=3 5884 B13R1.27 CCOCCNCC1=CC(=O)OC1 92820c8f4411a711a52fa74ac0c20ef3 [0,1,0,1,0,0|1,0,0]=3 5885 B13R1.27 CCOCCOCC1=CC(=O)OC1 d21dbfa7e86773cdb2982acd49f4d27b [0,1,0,1,0,0|1,0,0]=3 5886 B13R1.27 CCSCCCOC1=CC(=O)NC1 65243256a38801d292b149b7b1515065 [0,1,0,1,0,0|2,0,0]=4 5887 B13R1.27 CCSCCNCC1=CC(=O)OC1 845e1b8e5befc64d62d077f64b0999c0 [0,1,0,1,0,0|1,0,0]=3 5888 B13R1.27 CCSCCOCC1=CC(=O)OC1 662b1dd793919e9c3a2eae48f0d86c08 [0,1,0,1,0,0|1,0,0]=3 5889 B13R1.27 COCCCCOC1=CC(=O)CC1 f4425c3f88650584e3880c1b2a16ef3b [0,1,0,1,0,0|2,0,0]=4 5890 B13R1.27 COCCCCOC1=CC(=O)NC1 b4514a16f941a5b1e38cf5b0e1df43ea [0,1,0,1,0,0|2,0,0]=4 5891 B13R1.27 COCCCCOC1=CC(=O)OC1 c5130b0d62c57255bc37b30cb2184006 [0,1,0,1,0,0|1,0,0]=3 5892 B13R1.27 COCCCNCC1=CC(=O)OC1 1f36499339855c4ed0cc2ff2d6fe988c [0,1,0,1,0,0|1,0,0]=3 5893 B13R1.27 COCCCOCC1=CC(=O)OC1 3a0591023dff4d7805d9ba59e824c6d9 [0,1,0,1,0,0|1,0,0]=3 5894 B13R1.27 COCOCCOC1=CC(=O)OC1 886df411e8c271b1be8608ea0ce6fdc6 [0,1,0,1,0,0|2,0,0]=4 5895 B13R1.27 CSCCCNCC1=CC(=O)OC1 245a38bf8da524b1fc930392727412da [0,1,0,1,0,0|1,0,0]=3 5896 B13R1.27 CSCCCOCC1=CC(=O)OC1 87bdc22236be41698a3bd77f25a6447e [0,1,0,1,0,0|1,0,0]=3 5897 B13R1.27 N#CCCCNCC1=CC(=O)OC1 a69f9207e8a8df2680ea34d8353745cf [0,1,0,1,0,0|1,0,1]=4 5898 B13R1.27 N#CCCCOCC1=CC(=O)OC1 ad419d66ba695d3f495278eef1420d8b [0,1,0,1,0,0|1,0,1]=4 5899 B13R1.27 O=C1C=C(CN1)OCCCCCF fb33b7de24ce79e3b296d0ddc660064d [0,1,0,1,0,0|2,0,0]=4 5900 B13R1.27 O=C1C=C(CO1)CNCCCCCl 0ce51b289b6af7c960134eb98ab2d804 [0,1,0,1,0,0|1,0,0]=3 5901 B13R1.27 O=C1C=C(CO1)CNCCCCO 5a53e1bef293899fe7939378996e83f3 [0,1,0,1,0,0|1,0,0]=3 5902 B13R1.27 O=C1C=C(CO1)CNCCCCS f2279057582fd8f3f424c4627371a63e [0,1,0,1,0,0|1,0,0]=3 5903 B13R1.27 O=C1C=C(CO1)COCCCCF 74458af1002eb3a8ad8f30df5c70e5bc [0,1,0,1,0,0|1,0,0]=3 5904 B13R1.27 O=C1C=C(CO1)COCCCCS 8ce601a135023266b3a20161fd54ed19 [0,1,0,1,0,0|1,0,0]=3 5905 B13R1.27 O=CCCCCOC1=CC(=O)OC1 a1b55028d2225a9726e221ba3b89c882 [0,1,0,1,0,0|1,0,1]=4 5906 B13R1.27 O=CCCCOCC1=CC(=O)OC1 9fe292868f0058b1c73bc9e9ef38ee46 [0,1,0,1,0,0|1,0,1]=4 5907 B13R1.91 CCC1CCCCN1CC(=O)OC ae57dc92552ff99169616955f8e95c37 [0,1,0,1,0,0|0,0,2]=4 5908 B13R1.91 CCC1COCCN1CC(=O)OC 0430235f0a609c89420ac27b816db3e5 [0,1,0,1,0,0|1,0,1]=4 5909 B13R1.91 CC[C@@H]1CCCCN1CC(=O)OC 50295193b9e1a7467a9f409f4aa6e127 [0,1,0,1,0,0|0,0,2]=4 5910 B13R1.91 CC[C@@H]1COCCN1CC(=O)OC 7494ccbc623dc8404e71c4105d2d35f1 [0,1,0,1,0,0|1,0,1]=4 5911 B13R1.91 CC[C@H]1CCCCN1CC(=O)OC 86af25905e294271b35d9d8e318ef66e [0,1,0,1,0,0|0,0,2]=4 5912 B13R1.91 CC[C@H]1COCCN1CC(=O)OC 9d286a2ccc425df40725583d25c8eedc [0,1,0,1,0,0|1,0,1]=4 5913 B13R1.91 COC(=O)CN1CCCCC1CO 3f3bb7c54f0d1fb0d9d413ec3a7c86b7 [0,1,0,1,0,0|1,0,1]=4 5914 B13R1.91 COC(=O)CN1CCCC[C@@H]1CO b10393410a48d8b2d1bfc3348315272e [0,1,0,1,0,0|1,0,1]=4 5915 B13R1.91 COC(=O)CN1CCCC[C@H]1CO 69ea30c085d8968621c82514d2ded199 [0,1,0,1,0,0|1,0,1]=4 5916 B13R1.382 CCCN1CCCCC1C(=O)OC 57da4972a3c6bb5de03a167eb01093c2 [0,1,0,1,0,0|0,0,2]=4 5917 B13R1.382 CCCN1CCCC[C@@H]1C(=O)OC af1a7095de62bd38f315bfd4db0a3830 [0,1,0,1,0,0|0,0,2]=4 5918 B13R1.382 CCCN1CCCC[C@H]1C(=O)OC 5dc4ad3027270df3149b31972b670bae [0,1,0,1,0,0|0,0,2]=4 5919 B13R1.382 CCOC1CCCCC1C(=O)OC 8bab1cde308d1c58b828fe2a95f6874d [0,1,0,1,0,0|0,0,2]=4 5920 B13R1.382 CCO[C@@H]1CCCC[C@@H]1C(=O)OC 53802cfd617871f8476bdf431dfd8d1f [0,1,0,1,0,0|0,0,2]=4 5921 B13R1.382 CCO[C@H]1CCCC[C@H]1C(=O)OC fd26ef6f320a1df73a0891bc958df153 [0,1,0,1,0,0|0,0,2]=4 5922 B13R1.393 CCCC1SCCN1CC(=O)OC 4d90a5983834c40b6bd43205b9811396 [0,1,0,1,0,0|1,0,1]=4 5923 B13R1.393 COC(=O)CN1CCCC1CCO b3b2737dad886b558bed6066e5345274 [0,1,0,1,0,0|1,0,1]=4 5924 B13R1.393 COC(=O)CN1CCCC1CSC 6dc14a20d2b480e321ec9848fd1a2f1d [0,1,0,1,0,0|1,0,1]=4 5925 B13R1.393 COC(=O)CN1CCC[C@@H]1CCO 31097fb0e1c41ccb71301c6c66467f52 [0,1,0,1,0,0|1,0,1]=4 5926 B13R1.393 COCC1CCCN1CC(=O)OC 98ad8c75c5e9edec161014a77c13b637 [0,1,0,1,0,0|1,0,1]=4 5927 B13R1.393 COC[C@@H]1CCCN1CC(=O)OC e3d9e50655a8607a9586ec654e92d582 [0,1,0,1,0,0|1,0,1]=4 5928 B13R1.393 COC[C@H]1CCCN1CC(=O)OC 9ccd3a2e84f27ad465806c4bb8de75ad [0,1,0,1,0,0|1,0,1]=4 5929 B13R1.536 COC(=O)/C=C/CNC1CC=CC1 c36cf67736a46c7f2d52d66a02e0761c [0,1,0,1,0,0|0,0,2]=4 5930 B13R1.536 COC(=O)/C=C/CNC1CCCC1 0845a4efc7d0b424c8dcf16178e3ef0f [0,1,0,1,0,0|0,0,0]=2 5931 B13R1.536 COC(=O)/C=C/CNC1CCOC1 63a587fa3783a28699b7def18e3ecfee [0,1,0,1,0,0|1,0,0]=3 5932 B13R1.536 COC(=O)/C=C/CNC1CCSC1 24ea964e5f89492cd3219530afea273d [0,1,0,1,0,0|1,0,0]=3 5933 B13R1.536 COC(=O)/C=C/CN[C@@H]1CCOC1 bd9da64567c3db6a383dda8600c3e82e [0,1,0,1,0,0|1,0,0]=3 5934 B13R1.536 COC(=O)/C=C/CN[C@H]1CCOC1 b240b77d6ee5a7c43c1026f3d5538043 [0,1,0,1,0,0|1,0,0]=3 5935 B13R1.536 COC(=O)/C=C/COC1C=CCC1 1e68dd49d4cac0157713e00021ed7917 [0,1,0,1,0,0|0,0,2]=4 5936 B13R1.536 COC(=O)/C=C/COC1CC=CC1 5155f81553ccdc41e50cc146c0466f5b [0,1,0,1,0,0|0,0,2]=4 5937 B13R1.536 COC(=O)/C=C/COC1CCCC1 6c56ba3e21eeb4efedb35abe91899577 [0,1,0,1,0,0|0,0,0]=2 5938 B13R1.536 COC(=O)/C=C/COC1CCCO1 08b33fd8dbcb0e4869f5822f3b65dc59 [0,1,0,1,0,0|1,0,0]=3 5939 B13R1.536 COC(=O)/C=C/COC1CCOC1 cbb826429be498fdc1127dc8380133fb [0,1,0,1,0,0|1,0,0]=3 5940 B13R1.536 COC(=O)/C=C/COC1CCSC1 8713645e9ff225e971331110dffcc25e [0,1,0,1,0,0|1,0,0]=3 5941 B13R1.536 COC(=O)/C=C/CO[C@@H]1CCOC1 0d981391ae8960e3b4e13fefbcd43481 [0,1,0,1,0,0|1,0,0]=3 5942 B13R1.536 COC(=O)/C=C/CO[C@@H]1CCSC1 78e5869382a8292e66b2770bf6131988 [0,1,0,1,0,0|1,0,0]=3 5943 B13R1.536 COC(=O)/C=C/CO[C@H]1CCOC1 327cf024f583d6237f79736a2182ad69 [0,1,0,1,0,0|1,0,0]=3 5944 B13R1.536 COC(=O)/C=C/CO[C@H]1CCSC1 6ddb2e1209275cb5c9cbb981ad236845 [0,1,0,1,0,0|1,0,0]=3 5945 B13R1.536 COC(=O)/C=C\CNC1CC=CC1 c76dadd7062aa3e235d9d2130594841e [0,1,0,1,0,0|0,0,2]=4 5946 B13R1.536 COC(=O)/C=C\CNC1CCCC1 a71aa3e9c99adfdb1570ac041107816a [0,1,0,1,0,0|0,0,0]=2 5947 B13R1.536 COC(=O)/C=C\CNC1CCOC1 6fb5d5be86dbabecc9f5c3877a958b23 [0,1,0,1,0,0|1,0,0]=3 5948 B13R1.536 COC(=O)/C=C\CNC1CCSC1 f951182a6ef13ea508cbceed8b807ec9 [0,1,0,1,0,0|1,0,0]=3 5949 B13R1.536 COC(=O)/C=C\CN[C@@H]1CCOC1 92e53db3d65568a9f983e4ef53e30242 [0,1,0,1,0,0|1,0,0]=3 5950 B13R1.536 COC(=O)/C=C\CN[C@H]1CCOC1 6ae915446fbf3fb14614d911e8f96dc2 [0,1,0,1,0,0|1,0,0]=3 5951 B13R1.536 COC(=O)/C=C\COC1C=CCC1 f48f05cde0e553ad880ad0508c13d0e5 [0,1,0,1,0,0|0,0,2]=4 5952 B13R1.536 COC(=O)/C=C\COC1CC=CC1 1c8800f244f25f629b80611b03c456df [0,1,0,1,0,0|0,0,2]=4 5953 B13R1.536 COC(=O)/C=C\COC1CCCC1 0a91da623f8d3f7a16adc81ec17b38d3 [0,1,0,1,0,0|0,0,0]=2 5954 B13R1.536 COC(=O)/C=C\COC1CCCO1 64819bcc090cd21fc08f6c2a1959bca4 [0,1,0,1,0,0|1,0,0]=3 5955 B13R1.536 COC(=O)/C=C\COC1CCOC1 4b2a731e47e0b84d4334d3fe2acd183a [0,1,0,1,0,0|1,0,0]=3 5956 B13R1.536 COC(=O)/C=C\COC1CCSC1 1d75269d1b5ceec4f4317d27be5a5855 [0,1,0,1,0,0|1,0,0]=3 5957 B13R1.536 COC(=O)/C=C\CO[C@@H]1CCOC1 1aec4bae6db23913e0de1e43bc4e4add [0,1,0,1,0,0|1,0,0]=3 5958 B13R1.536 COC(=O)/C=C\CO[C@@H]1CCSC1 ecdbd90f8285039f9efc745aef60b7e0 [0,1,0,1,0,0|1,0,0]=3 5959 B13R1.536 COC(=O)/C=C\CO[C@H]1CCOC1 ccea73a2136ba378f7a0a303d00248e4 [0,1,0,1,0,0|1,0,0]=3 5960 B13R1.536 COC(=O)/C=C\CO[C@H]1CCSC1 d2add641f427c40c57f0b06f2077d98d [0,1,0,1,0,0|1,0,0]=3 5961 B13R1.536 COC(=O)C#CCNC1CCCC1 03c4c0cbb8210e1cd457a85c402ae3c4 [0,1,0,1,0,0|0,0,2]=4 5962 B13R1.536 COC(=O)C#CCOC1CCCC1 23beb2a5ccf26f9daff0a4eb46e2b60e [0,1,0,1,0,0|0,0,2]=4 5963 B13R1.536 COC(=O)C=CCNC1CC=CC1 b21a678640c2f5cc7b4b9d055c0b1264 [0,1,0,1,0,0|0,0,2]=4 5964 B13R1.536 COC(=O)C=CCNC1CCCC1 d5ea2bfe70d44c8bd0d35760d76c30d6 [0,1,0,1,0,0|0,0,0]=2 5965 B13R1.536 COC(=O)C=CCNC1CCOC1 a22dc29f15264a5f174aedaccdf32bc6 [0,1,0,1,0,0|1,0,0]=3 5966 B13R1.536 COC(=O)C=CCNC1CCSC1 0cd2b3f0fa71ac5d47f6f56668770f5c [0,1,0,1,0,0|1,0,0]=3 5967 B13R1.536 COC(=O)C=CCN[C@@H]1CCOC1 e7a5c0d9562b89b22b86e69cb10d80a6 [0,1,0,1,0,0|1,0,0]=3 5968 B13R1.536 COC(=O)C=CCN[C@H]1CCOC1 68a3ce42a34689d237f401db3f36feea [0,1,0,1,0,0|1,0,0]=3 5969 B13R1.536 COC(=O)C=CCOC1C=CCC1 3cd45b6b5d517e810e90a47b814115d5 [0,1,0,1,0,0|0,0,2]=4 5970 B13R1.536 COC(=O)C=CCOC1CC=CC1 47c3283072804ce1624269248b48a135 [0,1,0,1,0,0|0,0,2]=4 5971 B13R1.536 COC(=O)C=CCOC1CCCC1 c494c9c6f69c13ed25db71efe8b07351 [0,1,0,1,0,0|0,0,0]=2 5972 B13R1.536 COC(=O)C=CCOC1CCCO1 c9a7b42bc547083099018bb3867c5ed9 [0,1,0,1,0,0|1,0,0]=3 5973 B13R1.536 COC(=O)C=CCOC1CCOC1 ddf2a50bab45a823c0bcc2771546718c [0,1,0,1,0,0|1,0,0]=3 5974 B13R1.536 COC(=O)C=CCOC1CCSC1 67f1bd1c4a2c95e1e3f5dd41ef00dffb [0,1,0,1,0,0|1,0,0]=3 5975 B13R1.536 COC(=O)C=CCO[C@@H]1CCOC1 504f2c372849f6e82dc98dc128192cf7 [0,1,0,1,0,0|1,0,0]=3 5976 B13R1.536 COC(=O)C=CCO[C@@H]1CCSC1 15354c73815cc361b136940d94a1c262 [0,1,0,1,0,0|1,0,0]=3 5977 B13R1.536 COC(=O)C=CCO[C@H]1CCOC1 e137c3b12e9c9c228db6d49fd8eb5919 [0,1,0,1,0,0|1,0,0]=3 5978 B13R1.536 COC(=O)C=CCO[C@H]1CCSC1 bf6d9c3404aaed8f9cc790a26eaaf1a1 [0,1,0,1,0,0|1,0,0]=3 5979 B13R1.536 COC(=O)CCCNC1CCCC1 fb27b4f2cace7bcb75b18112e01b2f90 [0,1,0,1,0,0|0,0,2]=4 5980 B13R1.536 COC(=O)CCCOC1CCCC1 e281d07653fa6ff34a38dcfdd8729264 [0,1,0,1,0,0|0,0,2]=4 5981 B13R1.536 COC(=O)CCNCC1CCCC1 4ce0c551e9742886e1ddf2fb0ba881ec [0,1,0,1,0,0|0,0,2]=4 5982 B13R1.536 COC(=O)CCOCC1CCCC1 678ac4ada82616416b992d05fa3309a0 [0,1,0,1,0,0|0,0,2]=4 5983 B13R1.536 COC(=O)CNCCC1CCCC1 d704458319e121d6785c855931198dc9 [0,1,0,1,0,0|0,0,2]=4 5984 B13R1.536 COC(=O)CNCCC1CCCO1 daf775f62d5a9ce47c354d786303b617 [0,1,0,1,0,0|1,0,1]=4 5985 B13R1.536 COC(=O)CNCCC1CCOC1 66cee982110a605757a1f99173bb3782 [0,1,0,1,0,0|1,0,1]=4 5986 B13R1.536 COC(=O)CNCCN1CCCC1 07dc9545741bf8ce3b0bef3609dfc8cf [0,1,0,1,0,0|1,0,1]=4 5987 B13R1.536 COC(=O)COCCC1CCCC1 3d0325bdfaa6d6afbc7c793e9373cc4b [0,1,0,1,0,0|0,0,2]=4 5988 B13R1.536 COC(=O)COCCC1CCCO1 b47136842ef36247c1a34ebb89226889 [0,1,0,1,0,0|1,0,1]=4 5989 B13R1.536 COC(=O)COCCC1CCOC1 8b450fe2717102943c825abd6fe9421f [0,1,0,1,0,0|1,0,1]=4 5990 B13R1.536 COC(=O)COCCN1CCCC1 9ffef3789bd03a52b175d77d01eb053f [0,1,0,1,0,0|1,0,1]=4 5991 B13R1.536 COC(=O)OCCOC1CCCC1 8245b0eebfed04bf29305a216a53b9a5 [0,1,0,1,0,0|1,0,1]=4 5992 B13R1.536 COC(=O)OCNCC1CCCC1 d81bd9cc4820327f55216c82a8525d0f [0,1,0,1,0,0|1,0,1]=4 5993 B13R1.536 COC(=O)OCOCC1CCCC1 73e8bba55c9ac7ef8688d75d4f23f999 [0,1,0,1,0,0|1,0,1]=4 5994 B13R1.581 CCCCN1CCCC1C(=O)OC 41ad74a6b2ebd004cee9cb29c1fdbc55 [0,1,0,1,0,0|0,0,2]=4 5995 B13R1.581 CCCCN1CCC[C@H]1C(=O)OC 09845784ee32f48280d2f9f0c8ffd0c9 [0,1,0,1,0,0|0,0,2]=4 5996 B13R1.581 CCCOC1CCCC1C(=O)OC 96a9dd4470fbdaf225f929bf8c8135f3 [0,1,0,1,0,0|0,0,2]=4 5997 B13R1.581 CCCO[C@@H]1CCC[C@@H]1C(=O)OC aeb663282165300599b456f8517a5d88 [0,1,0,1,0,0|0,0,2]=4 5998 B13R1.581 CCCO[C@H]1CCC[C@H]1C(=O)OC f8ed28c2214ee3c191e071beaf3f2480 [0,1,0,1,0,0|0,0,2]=4 5999 B13R1.599 COC(=O)/C=C/CN1CCCC1C 27153468b1346b02c8c52ca72317043a [0,1,0,1,0,0|0,0,0]=2 6000 B13R1.599 COC(=O)/C=C/CN1CCCC1O fbe1def98da012ee90e590fdd32a2815 [0,1,0,1,0,0|1,0,0]=3 6001 B13R1.599 COC(=O)/C=C/CN1CCC[C@@H]1C a226ce292dedf9757fdf2cf119266b5d [0,1,0,1,0,0|0,0,0]=2 6002 B13R1.599 COC(=O)/C=C/CN1CCC[C@H]1C 267fd311c96a9140351986881c488346 [0,1,0,1,0,0|0,0,0]=2 6003 B13R1.599 COC(=O)/C=C/CN1CCSC1C 2b3ee0f1414581a0d4a076a0d56c1f63 [0,1,0,1,0,0|1,0,0]=3 6004 B13R1.599 COC(=O)/C=C\CN1CCCC1C 621d7fbf7bbe1513e8ab4b87afba24f7 [0,1,0,1,0,0|0,0,0]=2 6005 B13R1.599 COC(=O)/C=C\CN1CCCC1O f5d756c41305dbec46d7eaf8dbca5b57 [0,1,0,1,0,0|1,0,0]=3 6006 B13R1.599 COC(=O)/C=C\CN1CCC[C@@H]1C 5194d661764ed02dc2937dd01d17a776 [0,1,0,1,0,0|0,0,0]=2 6007 B13R1.599 COC(=O)/C=C\CN1CCC[C@H]1C 362727aebe56850ee637fdc48caf26e3 [0,1,0,1,0,0|0,0,0]=2 6008 B13R1.599 COC(=O)/C=C\CN1CCSC1C 86dfb52400f525fdc2716242f1933133 [0,1,0,1,0,0|1,0,0]=3 6009 B13R1.599 COC(=O)C#CCN1CCCC1C f92e4d2636b62e21e9efe89c0e3b8cab [0,1,0,1,0,0|0,0,2]=4 6010 B13R1.599 COC(=O)C#CCN1CCC[C@@H]1C 4302215e2252095b94eb2539c502cb29 [0,1,0,1,0,0|0,0,2]=4 6011 B13R1.599 COC(=O)C#CCN1CCC[C@H]1C 7830d02eddc20d0cdb2ef1fa63823e85 [0,1,0,1,0,0|0,0,2]=4 6012 B13R1.599 COC(=O)C=CCN1CCCC1C 609cb068503c2d40ab28500aee7bb9ed [0,1,0,1,0,0|0,0,0]=2 6013 B13R1.599 COC(=O)C=CCN1CCCC1O cb4c51de9823817c30fe578aa7ae5af3 [0,1,0,1,0,0|1,0,0]=3 6014 B13R1.599 COC(=O)C=CCN1CCC[C@@H]1C 77bb1ee41c4e40ece805a31a9b7af5a1 [0,1,0,1,0,0|0,0,0]=2 6015 B13R1.599 COC(=O)C=CCN1CCC[C@H]1C cc58bde4d5e436ac9c37b45728adda16 [0,1,0,1,0,0|0,0,0]=2 6016 B13R1.599 COC(=O)C=CCN1CCSC1C 9e54061e37c21e4c1d7317504fc817f4 [0,1,0,1,0,0|1,0,0]=3 6017 B13R1.599 COC(=O)CCCN1CCCC1C 8923dbbe6e6f4f83d40ba925f6d96f4a [0,1,0,1,0,0|0,0,2]=4 6018 B13R1.599 COC(=O)CCCN1CCC[C@@H]1C 9e6bb7cbff94612aaf0e4e7e1b878d8f [0,1,0,1,0,0|0,0,2]=4 6019 B13R1.599 COC(=O)CCCN1CCC[C@H]1C 97f711021ba6357113fec4bf95f9cc38 [0,1,0,1,0,0|0,0,2]=4 6020 B13R1.599 COC(=O)CCOC1CCCC1C ac0f6a82465a2f065e758dea74dace93 [0,1,0,1,0,0|0,0,2]=4 6021 B13R1.599 COC(=O)CCO[C@@H]1CCC[C@@H]1C 733d850ae6e6fd6f10785100917c64fb [0,1,0,1,0,0|0,0,2]=4 6022 B13R1.599 COC(=O)CCO[C@@H]1CCC[C@H]1C 3cd5b3692d1af1ec691c4280fdd446b2 [0,1,0,1,0,0|0,0,2]=4 6023 B13R1.599 COC(=O)CCO[C@H]1CCC[C@@H]1C 385fe32493dd548fa34e00c4b5b06e3c [0,1,0,1,0,0|0,0,2]=4 6024 B13R1.599 COC(=O)CCO[C@H]1CCC[C@H]1C 9e2de0df491cb29c84d9780c400e1eb3 [0,1,0,1,0,0|0,0,2]=4 6025 B13R1.599 COC(=O)CNCC1CCCC1O c9691389a00b65eb59ba883a1aa41dd0 [0,1,0,1,0,0|1,0,1]=4 6026 B13R1.599 COC(=O)CNCC1CCCN1C 4c63d0b2c8039df27cc973592438aabf [0,1,0,1,0,0|1,0,1]=4 6027 B13R1.599 COC(=O)CNCC1COCC1C da43e1d9e0e5ede6cdb3b58c71b9ac8d [0,1,0,1,0,0|1,0,1]=4 6028 B13R1.599 COC(=O)CNC[C@@H]1CCCN1C 5185add8a9168793b6d250b3566de5c6 [0,1,0,1,0,0|1,0,1]=4 6029 B13R1.599 COC(=O)CNC[C@H]1CCCN1C 2ce8ab6087ac88624b8d33da6a6b6378 [0,1,0,1,0,0|1,0,1]=4 6030 B13R1.599 COC(=O)COCC1CCCC1C 70ad2bbd60be6e36b77313f00ca53492 [0,1,0,1,0,0|0,0,2]=4 6031 B13R1.599 COC(=O)COCC1CCCN1C 268ed06859cdb37cfc04a8d38412d85c [0,1,0,1,0,0|1,0,1]=4 6032 B13R1.599 COC(=O)COCC1COCC1C 616f100debeb6ca597fb66126c841adf [0,1,0,1,0,0|1,0,1]=4 6033 B13R1.599 COC(=O)COCC1OCCC1C 9cc8e826968ea2ccc6d7a5d29a4d1973 [0,1,0,1,0,0|1,0,1]=4 6034 B13R1.599 COC(=O)COC[C@@H]1CCCN1C b67248b5747f703d48a64bbe0e2a1c79 [0,1,0,1,0,0|1,0,1]=4 6035 B13R1.599 COC(=O)COC[C@@H]1CCC[C@H]1F 0ded22be2fb5461b31f5fc02923a6f08 [0,1,0,1,0,0|1,0,1]=4 6036 B13R1.599 COC(=O)COC[C@@H]1CCO[C@@H]1C f7d98802846a11acf3a3ea499f243ce7 [0,1,0,1,0,0|1,0,1]=4 6037 B13R1.599 COC(=O)COC[C@H]1CCCN1C e3dfadaddf384a284a65237d0469fe39 [0,1,0,1,0,0|1,0,1]=4 6038 B13R1.599 COC(=O)OCOC1CCCC1C 84d04f96cb3b74efd61bf33e3b0533ba [0,1,0,1,0,0|1,0,1]=4 6039 B13R1.599 COC(=O)OCO[C@@H]1CCC[C@@H]1C c8a564e4de1396ec36d9af9175ce007a [0,1,0,1,0,0|1,0,1]=4 6040 B13R1.599 COC(=O)OCO[C@@H]1CCC[C@H]1C bbb356dd002ebf3f7a5cc248376918ca [0,1,0,1,0,0|1,0,1]=4 6041 B13R1.599 COC(=O)OCO[C@H]1CCC[C@@H]1C 66b29a320f82e438502d31879b43d84c [0,1,0,1,0,0|1,0,1]=4 6042 B13R1.599 COC(=O)OCO[C@H]1CCC[C@H]1C 7413da54c3620694cb4f388e9f1c1a37 [0,1,0,1,0,0|1,0,1]=4 6043 B13R1.613 CCC1CCCN1CCC(=O)OC 1f74c4aca5c637df90d0e9cb7b0a2dba [0,1,0,1,0,0|0,0,2]=4 6044 B13R1.613 CCC1CCCN1COC(=O)OC c37160bb396b7150868dd94128fe2c7f [0,1,0,1,0,0|1,0,1]=4 6045 B13R1.613 CC[C@@H]1CCCN1CCC(=O)OC e7e1abd0b66d4c02fae316c78f529997 [0,1,0,1,0,0|0,0,2]=4 6046 B13R1.613 CC[C@@H]1CCCN1COC(=O)OC 574f82b65ec1366e729cc04cd6a18bb4 [0,1,0,1,0,0|1,0,1]=4 6047 B13R1.613 CC[C@@H]1CCC[C@H]1NCC(=O)OC ad0530dd659de05ad088d83f1199789f [0,1,0,1,0,0|0,0,2]=4 6048 B13R1.613 COC(=O)CNC1CCCC1OC f794d19883b72b00f86a807feac0b31b [0,1,0,1,0,0|1,0,1]=4 6049 B13R1.613 COC(=O)CN[C@@H]1CCC[C@H]1OC f07c0216b00fe448c6e4fe299b50a374 [0,1,0,1,0,0|1,0,1]=4 6050 B13R1.613 COC(=O)CN[C@H]1CCC[C@@H]1OC 642ad4f1d88b5396a905c714c3501b30 [0,1,0,1,0,0|1,0,1]=4 6051 B13R1.613 COC(=O)CN[C@H]1CCC[C@H]1CO e9a8e3a4df2912077fbc1e4f98c0558c [0,1,0,1,0,0|1,0,1]=4 6052 B13R1.613 COC(=O)CN[C@H]1CCC[C@H]1OC ce7098292a7b6a1b85f00a1aa5692337 [0,1,0,1,0,0|1,0,1]=4 6053 B13R1.648 CCC1CCN1C/C=C/C(=O)OC ac4d72471c4b27748ec026f7aa775cf6 [0,1,0,1,0,0|0,0,0]=2 6054 B13R1.648 CCC1CCN1C/C=C\C(=O)OC 05d121382d8bad036c340c52df82b118 [0,1,0,1,0,0|0,0,0]=2 6055 B13R1.648 CCC1CCN1CC#CC(=O)OC 80e80b67e9dfbe097e27395b237952bd [0,1,0,1,0,0|0,0,2]=4 6056 B13R1.648 CCC1CCN1CC=CC(=O)OC 74415cef0145642f1123aa788b995d1b [0,1,0,1,0,0|0,0,0]=2 6057 B13R1.648 CCC1CCN1CCCC(=O)OC fadf8e1c70356f67fc82a4349682dfb5 [0,1,0,1,0,0|0,0,2]=4 6058 B13R1.648 COC(=O)/C=C/CN1CCC1CO c9507e68638b206cf0d64a0e63ac174f [0,1,0,1,0,0|1,0,0]=3 6059 B13R1.648 COC(=O)/C=C/CN1CC[C@@H]1CO a6b551964b6cd02ee19efe5670266124 [0,1,0,1,0,0|1,0,0]=3 6060 B13R1.648 COC(=O)/C=C/CN1CC[C@H]1CO 8c0f847d5c787694ca2df330486d4d2a [0,1,0,1,0,0|1,0,0]=3 6061 B13R1.648 COC(=O)/C=C\CN1CCC1CO e4cdba6eb18a35c3fd3db440ea0fb35e [0,1,0,1,0,0|1,0,0]=3 6062 B13R1.648 COC(=O)/C=C\CN1CC[C@@H]1CO b305a349950d0f69b78e073d86d03ac8 [0,1,0,1,0,0|1,0,0]=3 6063 B13R1.648 COC(=O)/C=C\CN1CC[C@H]1CO 4d61238551f29766978aac3d39e0befa [0,1,0,1,0,0|1,0,0]=3 6064 B13R1.648 COC(=O)C=CCN1CCC1CO af1f48fad6957f9bc59ae072f40c5932 [0,1,0,1,0,0|1,0,0]=3 6065 B13R1.648 COC(=O)C=CCN1CC[C@@H]1CO e9eb63b2260f64b76f77c93e8da9ceae [0,1,0,1,0,0|1,0,0]=3 6066 B13R1.648 COC(=O)C=CCN1CC[C@H]1CO 20582f64b335e9a5b2171d3e48fa7aa4 [0,1,0,1,0,0|1,0,0]=3 6067 B13R1.648 COC(=O)COCC1CCC1OC 67d664bcb3a2fb697dc3e41c974c2d7f [0,1,0,1,0,0|1,0,1]=4 6068 B13R1.648 COC(=O)COC[C@@H]1CC[C@H]1OC 0321ef66617b951a114ad16996fc6aa3 [0,1,0,1,0,0|1,0,1]=4 6069 B13R1.648 COC(=O)COC[C@H]1CC[C@H]1OC 6e42269f8a89af44511e1daf9231d896 [0,1,0,1,0,0|1,0,1]=4 6070 B13R1.2855 CCCCCN1CC[C@@H]1C(=O)OC 78612711283312da191f533457c2c1bb [0,1,0,1,0,0|0,0,2]=4 6071 B13R1.2855 CCCOCC1CCC1C(=O)OC a0fbda492c9209f23ec1c4b58a3cde45 [0,1,0,1,0,0|0,0,2]=4 6072 B13R1.200 CC1CC1NC/C=C/C(=O)N(C)C 501f301222d8fb67f369fd45ea6d0c53 [0,1,0,1,0,0|2,0,0]=4 6073 B13R1.2839 CN(C)C(=O)/C=C/CNC1CCC1 4f1bc40cdf0a8441994d24a1a4a18b5d [0,1,0,1,0,0|2,0,0]=4 6074 B13R1.2839 CN(C)C(=O)/C=C/COC1CCC1 0e4f843143c9e34d3f404d870163bbaa [0,1,0,1,0,0|2,0,0]=4 6075 B13R1.2840 CN(C)C(=O)/C=C/CNCC1CC1 477a2d81930e3dc742f8de88f479c8af [0,1,0,1,0,0|2,0,0]=4 6076 B13R1.2840 CN(C)C(=O)/C=C/COCC1CC1 efea072a64804a53de7c6d70a9341217 [0,1,0,1,0,0|2,0,0]=4 6077 B13R1.41 CC(CCO)NCC1=CC(=O)OC1 d6aaf4943d63a37796dc84936275f1e2 [0,1,0,1,0,0|2,0,0]=4 6078 B13R1.41 CCCC(=O)COC1=CC(=O)OC1 fbc36f8d60904b70f18b1966c9fdd512 [0,1,0,1,0,0|1,0,1]=4 6079 B13R1.41 CCCC(=S)OCC1=CC(=O)OC1 e1969eefd12b5734042b318a85b19e48 [0,1,0,1,0,0|1,0,1]=4 6080 B13R1.41 CCCC(C)COC1=CC(=O)CC1 378d7d9f48658594ead4ac7fc5ec7076 [0,1,0,1,0,0|2,0,0]=4 6081 B13R1.41 CCCC(C)COC1=CC(=O)NC1 4277a08d51cd5d16852156dcccc75161 [0,1,0,1,0,0|2,0,0]=4 6082 B13R1.41 CCCC(C)COC1=CC(=O)OC1 8da8450811ce1acd85fbec032711c2e7 [0,1,0,1,0,0|1,0,0]=3 6083 B13R1.41 CCCC(C)NCC1=CC(=O)OC1 791a476c7fac870ba362ce9432b9eb2c [0,1,0,1,0,0|1,0,0]=3 6084 B13R1.41 CCCC(C)OCC1=CC(=O)OC1 53e0ea28096925bf5111806bfd3d32fd [0,1,0,1,0,0|1,0,0]=3 6085 B13R1.41 CCC[C@@H](C)OCC1=CC(=O)OC1 b8e7e9b891087c18e69e461e65a0652a [0,1,0,1,0,0|1,0,0]=3 6086 B13R1.41 CCC[C@H](C)NCC1=CC(=O)OC1 8f445d24669e8816728b61ffcde7fb00 [0,1,0,1,0,0|1,0,0]=3 6087 B13R1.41 CCC[C@H](C)OCC1=CC(=O)OC1 b3d0cd0abadc1ab0ed7c54be43a4d676 [0,1,0,1,0,0|1,0,0]=3 6088 B13R1.41 COCC(C)NCC1=CC(=O)OC1 390ababc236124e0fe79952e2e330103 [0,1,0,1,0,0|2,0,0]=4 6089 B13R1.41 COCC(C)OCC1=CC(=O)OC1 263cddb14de97dacf17bdb9e31eb078f [0,1,0,1,0,0|2,0,0]=4 6090 B13R1.41 COC[C@@H](C)NCC1=CC(=O)OC1 cd3f435979f1b6fd7616d2d179f51503 [0,1,0,1,0,0|2,0,0]=4 6091 B13R1.41 COC[C@@H](C)OCC1=CC(=O)OC1 8fa9f02ab1a267fff15afdd976a896e9 [0,1,0,1,0,0|2,0,0]=4 6092 B13R1.41 COC[C@H](C)NCC1=CC(=O)OC1 2366a4e5b8811e68f98b3d211a0a13a0 [0,1,0,1,0,0|2,0,0]=4 6093 B13R1.41 COC[C@H](C)OCC1=CC(=O)OC1 6368782dab1230c7725ad1cd48e1bcfe [0,1,0,1,0,0|2,0,0]=4 6094 B13R1.41 CSCC(C)OCC1=CC(=O)OC1 4b050fe5186686a8010ece72c1675ba6 [0,1,0,1,0,0|2,0,0]=4 6095 B13R1.41 C[C@@H](CCO)NCC1=CC(=O)OC1 d5097f3447689783e9575df99b3849b6 [0,1,0,1,0,0|2,0,0]=4 6096 B13R1.41 C[C@H](CCO)NCC1=CC(=O)OC1 4d08032073705c0d603b3bcbaed6c983 [0,1,0,1,0,0|2,0,0]=4 6097 B13R1.1699 COC(=O)/C=C/CN1C(CC1C)C 0156389d2e6b3b27f3123fc312357d59 [0,1,0,1,0,0|1,0,0]=3 6098 B13R1.1699 COC(=O)/C=C/CN1[C@@H](C[C@@H]1C)C b1d0595339673f57ebc2c91440452f03 [0,1,0,1,0,0|1,0,0]=3 6099 B13R1.1699 COC(=O)/C=C/CN1[C@@H](C[C@H]1C)C e14c62237fcb6bba55f730434f161245 [0,1,0,1,0,0|1,0,0]=3 6100 B13R1.1699 COC(=O)/C=C/CN1[C@H](C[C@@H]1C)C 6a1b63dee679a39398e80bca702102f4 [0,1,0,1,0,0|1,0,0]=3 6101 B13R1.1699 COC(=O)/C=C\CN1C(CC1C)C b6142d3c42fcf90ca6e92cac8d6832c9 [0,1,0,1,0,0|1,0,0]=3 6102 B13R1.1699 COC(=O)/C=C\CN1[C@@H](C[C@@H]1C)C 4305ea8ec4892b93fed7b950f5692d4c [0,1,0,1,0,0|1,0,0]=3 6103 B13R1.1699 COC(=O)/C=C\CN1[C@@H](C[C@H]1C)C be5c338049c43dedbef18db87fa57c65 [0,1,0,1,0,0|1,0,0]=3 6104 B13R1.1699 COC(=O)/C=C\CN1[C@H](C[C@@H]1C)C cb00400c4590c1d03bdb7a9c14322c63 [0,1,0,1,0,0|1,0,0]=3 6105 B13R1.1699 COC(=O)C=CCN1C(CC1C)C 4f7a870ad3eb33026aad805778cdf88a [0,1,0,1,0,0|1,0,0]=3 6106 B13R1.1699 COC(=O)C=CCN1[C@@H](C[C@@H]1C)C 47bcd0b06df99d83d19a107f538a6637 [0,1,0,1,0,0|1,0,0]=3 6107 B13R1.1699 COC(=O)C=CCN1[C@@H](C[C@H]1C)C bf908da0cbb9b6be156ccc3c5d1c9621 [0,1,0,1,0,0|1,0,0]=3 6108 B13R1.1699 COC(=O)C=CCN1[C@H](C[C@@H]1C)C 4c714ed64afaf7176fe2b70130c8f7e5 [0,1,0,1,0,0|1,0,0]=3 6109 B13R1.1734 COC(=O)/C=C/CN[C@@H](C)C1CC1 a4d0d924b3c7619016d9c75940078f8c [0,1,0,1,0,0|1,0,0]=3 6110 B13R1.1734 COC(=O)/C=C/CN[C@H](C)C1CC1 7ffeead2152305cc98e96826c62fa7cb [0,1,0,1,0,0|1,0,0]=3 6111 B13R1.1734 COC(=O)/C=C/COC(C)C1CC1 fd737209c93c38f84895e4677e8d9a62 [0,1,0,1,0,0|1,0,0]=3 6112 B13R1.1734 COC(=O)/C=C/CO[C@@H](C)C1CC1 b602bd01f440e5a7454927f346739eaf [0,1,0,1,0,0|1,0,0]=3 6113 B13R1.1734 COC(=O)/C=C/CO[C@H](C)C1CC1 0bbdc9ce26d7ddbf71dbed6676a7d61b [0,1,0,1,0,0|1,0,0]=3 6114 B13R1.1734 COC(=O)/C=C\CN[C@@H](C)C1CC1 8979906a05377a1d8457c83f195ab63a [0,1,0,1,0,0|1,0,0]=3 6115 B13R1.1734 COC(=O)/C=C\CN[C@H](C)C1CC1 79bd42c44d95f38db85db4da5ed925d5 [0,1,0,1,0,0|1,0,0]=3 6116 B13R1.1734 COC(=O)/C=C\COC(C)C1CC1 51e81f8ff83ab5126bfcc2ef6ea00fce [0,1,0,1,0,0|1,0,0]=3 6117 B13R1.1734 COC(=O)/C=C\CO[C@@H](C)C1CC1 ebb08cb6b977ef6f6a37935fa2d7e366 [0,1,0,1,0,0|1,0,0]=3 6118 B13R1.1734 COC(=O)/C=C\CO[C@H](C)C1CC1 31c1a8110d81bd2e2e3e523d3b9d8d26 [0,1,0,1,0,0|1,0,0]=3 6119 B13R1.1734 COC(=O)C=CCN[C@@H](C)C1CC1 5cdf61d9d9a695d5750bf6ab6fe13508 [0,1,0,1,0,0|1,0,0]=3 6120 B13R1.1734 COC(=O)C=CCN[C@H](C)C1CC1 00ad695267b360016f5d2409e7fc0fa0 [0,1,0,1,0,0|1,0,0]=3 6121 B13R1.1734 COC(=O)C=CCOC(C)C1CC1 a1fb7bfc219845f7d6d3ff96161e8c4b [0,1,0,1,0,0|1,0,0]=3 6122 B13R1.1734 COC(=O)C=CCO[C@@H](C)C1CC1 55c63bc676d83b4729981621e82d0813 [0,1,0,1,0,0|1,0,0]=3 6123 B13R1.1734 COC(=O)C=CCO[C@H](C)C1CC1 9e21bb8056864d65f1d4288123ae8a3f [0,1,0,1,0,0|1,0,0]=3 6124 B13R1.2031 COC(=O)/C=C/CNC1(CCC1)C 3cacf602a3540211711258c3605fab06 [0,1,0,1,0,0|1,0,0]=3 6125 B13R1.2031 COC(=O)/C=C/CNC1(COC1)C 66de08cd1c3caf6ecdb66e19030bd44e [0,1,0,1,0,0|2,0,0]=4 6126 B13R1.2031 COC(=O)/C=C/CNC1(CSC1)C b6bf82fd1991d1ed74aea12271a1496a [0,1,0,1,0,0|2,0,0]=4 6127 B13R1.2031 COC(=O)/C=C\CNC1(CCC1)C d382856e4a3b2f454b32ee0ea8718444 [0,1,0,1,0,0|1,0,0]=3 6128 B13R1.2031 COC(=O)/C=C\CNC1(COC1)C 249cd0523c7fd02f78b2da86b39d03c7 [0,1,0,1,0,0|2,0,0]=4 6129 B13R1.2031 COC(=O)/C=C\CNC1(CSC1)C cad74bca084b36bb1eb7ce3bf07868a5 [0,1,0,1,0,0|2,0,0]=4 6130 B13R1.2031 COC(=O)C=CCNC1(CCC1)C a87e6a363f79a74a1071724bffe58f69 [0,1,0,1,0,0|1,0,0]=3 6131 B13R1.2031 COC(=O)C=CCNC1(COC1)C 2acd7301e38a42ae88fca9478b548d5b [0,1,0,1,0,0|2,0,0]=4 6132 B13R1.2031 COC(=O)C=CCNC1(CSC1)C 9c088939588a236531f6622a6df94411 [0,1,0,1,0,0|2,0,0]=4 6133 B13R1.2031 COC(=O)CNCCC1(CCC1)O 86346cfa09cd7a1030dec17b73dc8b4d [0,1,0,1,0,0|1,0,1]=4 6134 B13R1.2679 COC(=O)CN1CCC(CC1C)C 839b7b1164ac342ce6a6e9b5dc7a19c3 [0,1,0,1,0,0|1,0,1]=4 6135 B13R1.2679 COC(=O)CN1CCC(CC1C)O 945464f51bb23ef33e49d81249a7293a [0,1,0,1,0,0|1,0,1]=4 6136 B13R1.2679 COC(=O)CN1CC[C@@H](C[C@@H]1C)C 131b022a366f243968babf8908a51c43 [0,1,0,1,0,0|1,0,1]=4 6137 B13R1.2679 COC(=O)CN1CC[C@@H](C[C@H]1C)O 82cbfa7bb1419d4fa55e624886ee5b0c [0,1,0,1,0,0|1,0,1]=4 6138 B13R1.2679 COC(=O)CN1CC[C@H](C[C@H]1C)C 9f48177227dd75e2f038f7537397e7ec [0,1,0,1,0,0|1,0,1]=4 6139 B13R1.2679 COC(=O)CN1CC[C@H](C[C@H]1C)O 946b050d2e375666fd71f172eabd9245 [0,1,0,1,0,0|1,0,1]=4 6140 B13R2.142 O=C1C=C(CN1)OC2CCCC2 b6b06a60f41c90663924fb86597804c6 [0,0,0,2,0,0|2,0,0]=4 6141 B13R2.142 O=C1C=C(CO1)CN2CCSC2 5e25e7d0f5680615c627a9d544d91fc9 [0,0,0,2,0,0|2,0,0]=4 6142 B13R2.143 CC1CC1NCC2=CC(=O)OC2 698d9fe9266f36efaaed23871291bc53 [0,0,0,2,0,0|1,0,0]=3 6143 B13R2.143 O=C1C=C(CO1)CN[C@@H]2C[C@H]2F 93b22f7d9cfead1be6beab8024b64ba7 [0,0,0,2,0,0|2,0,0]=4 6144 B13R2.143 O=C1C=C(CO1)CN[C@H]2C[C@@H]2F 3d83101f390a0ce46d3190411303e164 [0,0,0,2,0,0|2,0,0]=4 6145 B13R2.143 O=C1C=C(CO1)CN[C@H]2C[C@H]2F 6d74cc2cdb497c3efef8f215cd665bd3 [0,0,0,2,0,0|2,0,0]=4 6146 B13R2.2973 O=C1C=C(CN1)OCCC2CC2 f369b784448cf0d3a9c8c84d8df0cacd [0,0,0,2,0,0|2,0,0]=4 6147 B13R2.2973 O=C1C=C(CO1)CNCC2CC2 82fdd3eaff1defd70344ebfd38b1b165 [0,0,0,2,0,0|1,0,0]=3 6148 B13R2.2973 O=C1C=C(CO1)COCC2CC2 08da566f45cafd7ebf2e3d770affff54 [0,0,0,2,0,0|1,0,0]=3 6149 B13R2.2974 O=C1C=C(CN1)OCC2CCC2 f6b66d4f7f16dfd07a41cb7749bfd814 [0,0,0,2,0,0|2,0,0]=4 6150 B13R2.2974 O=C1C=C(CO1)CNC2CCC2 6d80adfb19ef09ad406382b690299506 [0,0,0,2,0,0|1,0,0]=3 6151 B13R2.2974 O=C1C=C(CO1)CNC2COC2 661b45b8052c551f509d523a56d057f0 [0,0,0,2,0,0|2,0,0]=4 6152 B13R2.2974 O=C1C=C(CO1)COC2CCC2 3612efa9f80ff01f812f4e879023d0f6 [0,0,0,2,0,0|1,0,0]=3 6153 B13R2.2974 O=C1C=C(CO1)COC2COC2 2b4e2217a0837e55d03f5bdf90ad94c9 [0,0,0,2,0,0|2,0,0]=4 6154 B13R2.2974 O=C1C=C(CO1)COC2CSC2 d5fa8cf4debccca4bfac2324e79996df [0,0,0,2,0,0|2,0,0]=4 6155 B13R2.2974 O=C1C=C(CO1)OCC2COC2 7890f8c6a417645a4969b683d57a8335 [0,0,0,2,0,0|2,0,0]=4 6156 B13R2.1106 COC(=O)CN1C2CCC1CC2 76c6a28fea38efffe569ca33deb48f63 [0,0,0,2,0,0|1,0,1]=4 6157 B13R2.1106 COC(=O)CN1[C@H]2CC[C@@H]1CC2 b613cf32a0163905d10512a8156571ca [0,0,0,2,0,0|1,0,1]=4 6158 B13R2.1132 COC(=O)COC1CC2CC2C1 5cb84d9a086384b2b0b6813af0bc905d [0,0,0,2,0,0|1,0,1]=4 6159 B13R2.1132 COC(=O)COC1C[C@@H]2C[C@@H]2C1 842556fc9eb9feccb9a5a4da083e79e0 [0,0,0,2,0,0|1,0,1]=4 6160 B13R2.1132 COC(=O)CO[C@@H]1C[C@@H]2C[C@@H]2C1 3f734117f74e3dd76600a9f3f0b9472f [0,0,0,2,0,0|1,0,1]=4 6161 B13R2.1132 COC(=O)CO[C@H]1C[C@@H]2C[C@@H]2C1 2180c0c196f55841c1247939061ea10e [0,0,0,2,0,0|1,0,1]=4 6162 B13R2.1304 COC(=O)COC1CCC2C1C2 e47e52b1a07667f28ca92b14cf92cee9 [0,0,0,2,0,0|1,0,1]=4 6163 B13R2.1304 COC(=O)CO[C@@H]1CC[C@@H]2[C@H]1C2 39bd9154c69d0dfb26e0e8530cdc0614 [0,0,0,2,0,0|1,0,1]=4 6164 B13R2.15195 COC(=O)CN1C2C1CCCC2 cf1581cb83d5a0147f0f9eec08d17a54 [0,0,0,2,0,0|1,0,1]=4 6165 B13R2.6859 COC(=O)CN1CC2CCC1C2 0401a7a27f896ce098932ada8256bacb [0,0,0,2,0,0|1,0,1]=4 6166 B13R2.6859 COC(=O)CN1C[C@@H]2CC[C@H]1C2 2f69c7d6bfd5203630401a471d90cb11 [0,0,0,2,0,0|1,0,1]=4 6167 B13R2.6859 COC(=O)CN1C[C@H]2CC[C@@H]1C2 c155516376c6c19231e7e61dfe533693 [0,0,0,2,0,0|1,0,1]=4 6168 B13R2.15218 COC(=O)CNC1CC12CCC2 12643bac74228f153af54e815d6e816c [0,0,0,2,0,0|1,0,1]=4 6169 B13R2.15218 COC(=O)COC1CC12CCC2 c6fb4e6fa4f3350ac2ba050306d123a4 [0,0,0,2,0,0|1,0,1]=4 6170 B13R2.1197 COC(=O)CN1CC2C1CCC2 6dbc95dcc5e80c28cfd99c469234eb27 [0,0,0,2,0,0|1,0,1]=4 6171 B13R2.1197 COC(=O)CN1C[C@H]2[C@@H]1CCC2 ce6cebe5bc20118d0c59e15e3312674d [0,0,0,2,0,0|1,0,1]=4 6172 B13R2.1217 COC(=O)CN1CCC2CC2C1 763d04fdfe4fe204ba98923cde2dc81c [0,0,0,2,0,0|1,0,1]=4 6173 B13R2.1133 COC(=O)COC1CCC12CC2 605bd44ae63deff27113eb32ab3a7243 [0,0,0,2,0,0|1,0,1]=4 6174 B13R2.1311 COC(=O)CNCC1CC12CC2 164a56b62a37f95da149e7f28f632a25 [0,0,0,2,0,0|1,0,1]=4 6175 B13R2.1311 COC(=O)COCC1CC12CC2 6737d2ffab444d2b5f226a47100f9d49 [0,0,0,2,0,0|1,0,1]=4 6176 B13R2.1196 COC(=O)CN1CC2CCC2C1 104cfca8a19088f7beb8269a3718e16a [0,0,0,2,0,0|1,0,1]=4 6177 B13R2.1312 COC(=O)COCC12CCC1C2 e48e60361ecf56f164851937f06d130e [0,0,0,2,0,0|1,0,1]=4