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[0,0,0,0,0,0|2,0,1]=3 34 B12R0.206 CC/C=C\CCN[C@H](C)CCCO 49e4aea08439727660c6f37216b89cd8 [0,0,0,0,0,0|3,0,1]=4 35 B12R0.206 CC/C=C\CCOC(C)CCC#N 9d0cf840a8dfb10e1596eb84d5206688 [0,0,0,0,0,0|2,0,2]=4 36 B12R0.206 CC/C=C\CCOC(C)CCCC e75fb44695bcc9916114aa36898f33b4 [0,0,0,0,0,0|1,0,1]=2 37 B12R0.206 CC/C=C\CCOC(C)CCOC 6f47cf8d324fef3e097fc1ff6bf26ff0 [0,0,0,0,0,0|2,0,1]=3 38 B12R0.206 CC/C=C\CCOC(C)CCSC 0b1b5b7d508f01d4df3cd380efd042b8 [0,0,0,0,0,0|2,0,1]=3 39 B12R0.206 CC/C=C\CCOC(C)COCC 2bd4dab7707dfe31e8b0eef8cf9cb040 [0,0,0,0,0,0|2,0,1]=3 40 B12R0.206 CC/C=C\CCO[C@@H](C)CCCC 22e34ec79d10eb7a22946c6504044bcb [0,0,0,0,0,0|1,0,1]=2 41 B12R0.206 CC/C=C\CCO[C@H](C)CCCC 2a7cdc60f19cc632aa22bc7ba8b7c600 [0,0,0,0,0,0|1,0,1]=2 42 B12R0.206 CC/C=C\COCC(=O)CCSC 8f891d725baab0bf0e7d2ffa48c7c5a8 [0,0,0,0,0,0|3,0,0]=3 43 B12R0.206 CC/C=C\COCC(=O)NCCC 3e3952e3c631db51da9abfdfef94ecc3 [0,0,0,0,0,0|3,0,0]=3 44 B12R0.206 CC/C=C\COCC(=O)OCCC 44307ea44b3c248be23eb8777239ebea [0,0,0,0,0,0|3,0,0]=3 45 B12R0.206 CC=C=CCCOC(C)CCCC 4bbf0c578794de5ef400f57031135699 [0,0,0,0,0,0|1,0,3]=4 46 B12R0.206 CC=CC=CCOC(C)CCCC b9d218cbcd9795d0b2f8f225591f93b3 [0,0,0,0,0,0|1,0,3]=4 47 B12R0.206 CC=CCCCOC(C)CCCC f6e9bd41fb7884919a58244f1acd883b [0,0,0,0,0,0|1,0,3]=4 48 B12R0.206 CC=CCNCOC(=O)CCCC bb910e3b8eef0aa73be2872b396b0fcb [0,0,0,0,0,0|1,0,2]=3 49 B12R0.206 CC=CCNCOC(=O)OCCC df63a5b0f0e125bb5788e8aa1d9e9991 [0,0,0,0,0,0|2,0,2]=4 50 B12R0.206 CC=CCOCOC(=O)CCCC 2b9b4b0b4efb69d06c4587a4c54cfd46 [0,0,0,0,0,0|1,0,2]=3 51 B12R0.206 CC=CCOCOC(=O)OCCC 2865c6e6422b8db3097a0a67397799c2 [0,0,0,0,0,0|2,0,2]=4 52 B12R0.206 CCC#CC(C)OCC/C=C\CC 180279628b63313a9c5644c3be64576b [0,0,0,0,0,0|1,0,3]=4 53 B12R0.206 CCC#CCCOC(C)CCCC e59229d6556df816735b47bd1254abaa [0,0,0,0,0,0|1,0,3]=4 54 B12R0.206 CCC/C=C/CCC(=O)NCCC 17e3c7580280fb58ca270138a5bcee72 [0,0,0,0,0,0|2,0,2]=4 55 B12R0.206 CCC/C=C/COC(C)CCCC d611120afab74731c790815d8dcf4672 [0,0,0,0,0,0|1,0,3]=4 56 B12R0.206 CCC/C=C/CO[C@@H](C)CCCC 3508c7549c69d1d8885b6d4720d228fd [0,0,0,0,0,0|1,0,3]=4 57 B12R0.206 CCC/C=C/CO[C@H](C)CCCC 7d761481da3f22934837a54e9435d1c7 [0,0,0,0,0,0|1,0,3]=4 58 B12R0.206 CCC/C=C\CCC(=O)NCCC 57c13cab41f080ae0ca043de717f3601 [0,0,0,0,0,0|2,0,2]=4 59 B12R0.206 CCC/C=C\COC(C)CCCC ce7a08a9784925ce1ccdc9a11607ff93 [0,0,0,0,0,0|1,0,3]=4 60 B12R0.206 CCC/C=C\CO[C@@H](C)CCCC d5dfa1de952f1c76b714396319eebaf0 [0,0,0,0,0,0|1,0,3]=4 61 B12R0.206 CCC/C=C\CO[C@H](C)CCCC 638f50fcc5768f629dd90fb92440ac34 [0,0,0,0,0,0|1,0,3]=4 62 B12R0.206 CCCCC(=O)NCCCCCCl dcdbba3f08bf0589d9296e6e29d70622 [0,0,0,0,0,0|2,0,2]=4 63 B12R0.206 CCCCC(=O)NCCCCCO 708187ab56d55406ad6cd96937fc37bb [0,0,0,0,0,0|2,0,2]=4 64 B12R0.206 CCCCC(=O)NCCCCOC c4313a1c3e6c2aebdb57cb893af968e7 [0,0,0,0,0,0|2,0,2]=4 65 B12R0.206 CCCCC(=O)NCCCCSC 7eb15abe44572fb34f98eb85f223c298 [0,0,0,0,0,0|2,0,2]=4 66 B12R0.206 CCCCC(=O)NCCCOCC 1ab2a8b6d814674961e457a217ed670b [0,0,0,0,0,0|2,0,1]=3 67 B12R0.206 CCCCC(=O)NCCOCCC 6a024cb730827e4472b09220771d10fd [0,0,0,0,0,0|2,0,1]=3 68 B12R0.206 CCCCC(=O)NCCOCCO fb5a87d9004d14d46c082a30e17aa6a2 [0,0,0,0,0,0|3,0,1]=4 69 B12R0.206 CCCCC(=O)NCCOCCS 44cea7c89d0d6d6c982dd09890a5b8f2 [0,0,0,0,0,0|3,0,1]=4 70 B12R0.206 CCCCC(=O)NCCSCCO bd125690773aaf407ed0ae754e92a98a [0,0,0,0,0,0|3,0,1]=4 71 B12R0.206 CCCCC(=O)OCNCCCCl 2b82437783a22e441e7af4b857b75da5 [0,0,0,0,0,0|2,0,2]=4 72 B12R0.206 CCCCC(=O)OCNCCCO a21688c02faef6a46a4d0fd1a2d1a399 [0,0,0,0,0,0|2,0,2]=4 73 B12R0.206 CCCCC(=O)OCNCCOC a17bb70a03baa300c62dcd09166d8f5a [0,0,0,0,0,0|2,0,2]=4 74 B12R0.206 CCCCC(=O)OCNCCSC f6e1e41007aefec042962bbd8a2d8ae5 [0,0,0,0,0,0|2,0,2]=4 75 B12R0.206 CCCCC(=O)OCOC/C=C/Cl d0ed40f5e4af633d52ee0604363700a8 [0,0,0,0,0,0|2,0,2]=4 76 B12R0.206 CCCCC(=O)OCOCC=CCl ab8c4a3957910ca20247f76abf231ef3 [0,0,0,0,0,0|2,0,2]=4 77 B12R0.206 CCCCC(=O)OCOCCCF 310538ecf4f81a7112815e982f334f02 [0,0,0,0,0,0|2,0,2]=4 78 B12R0.206 CCCCC(=O)OCOCCCS bfb274ea145689aeed7fedbbe26273b5 [0,0,0,0,0,0|2,0,2]=4 79 B12R0.206 CCCCC(=O)OCOCCOC 67464e6bcd00b2f399726c08cf6df997 [0,0,0,0,0,0|2,0,2]=4 80 B12R0.206 CCCCC(=O)OCOCCSC c0956cf633ab54833b5339fa281db62d [0,0,0,0,0,0|2,0,2]=4 81 B12R0.206 CCCCC(C)OCCCOCC 1ab9408c03cf3f53e335e3510f64bc84 [0,0,0,0,0,0|2,0,2]=4 82 B12R0.206 CCCCC(C)OCCCSCC c6fe2fd5a302a2381441e131228d16ff [0,0,0,0,0,0|2,0,2]=4 83 B12R0.206 CCCCC(C)OCCOCCC 9d82b151ea3cb68e3b56c8b90601635d [0,0,0,0,0,0|2,0,2]=4 84 B12R0.206 CCCCC(C)OCCSCCC 7fb386462bc88f8ca1ab0ed7b2778edc [0,0,0,0,0,0|2,0,2]=4 85 B12R0.206 CCCCCCCC(=O)NCCC 803c3b5f65103b7f1c85f768d717c2f2 [0,0,0,0,0,0|2,0,2]=4 86 B12R0.206 CCCCCCNC(=O)CCCC 70acaae11b2c6b1fd45feafe6ffa5b78 [0,0,0,0,0,0|1,0,2]=3 87 B12R0.206 CCCCCCNC(=O)CCCF 0e993041ca52f0859a511df998766182 [0,0,0,0,0,0|2,0,2]=4 88 B12R0.206 CCCCCCNC(=O)CCCS d10e075b1852f7856eaccec0857dcaaa [0,0,0,0,0,0|2,0,2]=4 89 B12R0.206 CCCCCCNC(=O)CCOC b4c31b8a66eba6314d589b98dd099b43 [0,0,0,0,0,0|2,0,2]=4 90 B12R0.206 CCCCCCNC(=O)CCSC 59d90d84443cb158320da85f181ac89e [0,0,0,0,0,0|2,0,2]=4 91 B12R0.206 CCCCCCNC(=O)COCC 4c932b059f758f3b35b21b0624ff070a [0,0,0,0,0,0|2,0,2]=4 92 B12R0.206 CCCCCCNC(=O)CSCC 5c1f59ea001a51aa153486a70e0a9d7e [0,0,0,0,0,0|2,0,2]=4 93 B12R0.206 CCCCCCNC(=O)NCCC f36e2e39309d437e377f2067d3d3eff8 [0,0,0,0,0,0|2,0,2]=4 94 B12R0.206 CCCCCCOC(C)CCCC 04829ec059dfcfc9e75c6467e18f1e92 [0,0,0,0,0,0|1,0,3]=4 95 B12R0.206 CCCCCCO[C@@H](C)CCCC dab3ff5e215dce23cef3459580579ba3 [0,0,0,0,0,0|1,0,3]=4 96 B12R0.206 CCCCCCO[C@H](C)CCCC ef87ba988f98c72c2e57f873fe3da34a [0,0,0,0,0,0|1,0,3]=4 97 B12R0.206 CCCCNCOC(=O)CCCC 1bafb601242da8a8d946db52f1bbeaf0 [0,0,0,0,0,0|1,0,2]=3 98 B12R0.206 CCCCNCOC(=O)OCCC d83cefbdb3981c9e3c96c1cd40b4f56b [0,0,0,0,0,0|2,0,2]=4 99 B12R0.206 CCCCOCOC(=O)CCCC fba6deb132e6e7f7f7861343ba29d758 [0,0,0,0,0,0|1,0,2]=3 100 B12R0.206 CCCCOCOC(=O)OCCC 071c97a3bb68cd2ecd9925c15aaf1564 [0,0,0,0,0,0|2,0,2]=4 101 B12R0.206 CCCC[C@@H](C)OCCCOCC 807a0b97444c3ca0fdd065a16f707f87 [0,0,0,0,0,0|2,0,2]=4 102 B12R0.206 CCCC[C@@H](C)OCCCSCC a238d48b54cc8fc890a7795385ef2124 [0,0,0,0,0,0|2,0,2]=4 103 B12R0.206 CCCC[C@@H](C)OCCOCCC 4b8e3e134a51c8394d29a1b972ebd620 [0,0,0,0,0,0|2,0,2]=4 104 B12R0.206 CCCC[C@H](C)OCCCOCC ae8b6821fdbddd8029a1b702b194a82b [0,0,0,0,0,0|2,0,2]=4 105 B12R0.206 CCCC[C@H](C)OCCCSCC 5f37a63aaf1848d7ab2e17c2e6b4f2e6 [0,0,0,0,0,0|2,0,2]=4 106 B12R0.206 CCCC[C@H](C)OCCOCCC 36c73d37039a30979884cb009b8d5009 [0,0,0,0,0,0|2,0,2]=4 107 B12R0.206 CCCNC(=O)CCCCOCC b5b1837a84cecb8e93b60a73927b2d74 [0,0,0,0,0,0|3,0,1]=4 108 B12R0.206 CCCNC(=O)CCCOCCC 435e5a2e43d294bff9b948a4f65ab99d [0,0,0,0,0,0|3,0,1]=4 109 B12R0.206 CCCNC(=O)NCCCOCC d714c40e165f327a9a129525803ce408 [0,0,0,0,0,0|3,0,1]=4 110 B12R0.206 CCCNC(=O)NCCOCCC 270129a94826db6ababc00fc15112a7b [0,0,0,0,0,0|3,0,1]=4 111 B12R0.206 CCCNCCCC(=O)NCCC b3989e6e752d16b37af92ec59dbde35e [0,0,0,0,0,0|3,0,1]=4 112 B12R0.206 CCCOCCNC(=O)CCCF dc5a48f08ca6357a67b4ac99f8f2198d [0,0,0,0,0,0|3,0,1]=4 113 B12R0.206 CCCOCCNC(=O)CCCS b32d77f2830975559988ddb2e181f686 [0,0,0,0,0,0|3,0,1]=4 114 B12R0.206 CCCOCCNC(=O)CCOC 9ef45dfe14d53154c9b4ae5291ccc7cf [0,0,0,0,0,0|3,0,1]=4 115 B12R0.206 CCCOCCNC(=O)CCSC a1a72933c38d4fbf2bf13bd69a5128b5 [0,0,0,0,0,0|3,0,1]=4 116 B12R0.206 CCCOCCNC(=O)COCC 2aee6b126539cc9ff72436117d573816 [0,0,0,0,0,0|3,0,1]=4 117 B12R0.206 CCCOCCNC(=O)CSCC b56bde388ef4f750117394d9220222ce [0,0,0,0,0,0|3,0,1]=4 118 B12R0.206 CCOCCCNC(=O)CCCF b7c8891201c1e9b495a01de5d354e12d [0,0,0,0,0,0|3,0,1]=4 119 B12R0.206 CCOCCCNC(=O)CCCS ac183174555220d933ff57ff91e858a0 [0,0,0,0,0,0|3,0,1]=4 120 B12R0.206 CCOCCCNC(=O)CCOC 4c679ef267eccebcc7ff027fb681e972 [0,0,0,0,0,0|3,0,1]=4 121 B12R0.206 CCOCCCNC(=O)CCSC 9680e4c55e1adb37fcd81bf772481581 [0,0,0,0,0,0|3,0,1]=4 122 B12R0.206 CCOCCCNC(=O)COCC 11952c318e7c8d69a9517c642900d017 [0,0,0,0,0,0|3,0,1]=4 123 B12R0.206 CCOCCCNC(=O)CSCC 834ff0f7868123758683db4a0f7cba0a [0,0,0,0,0,0|3,0,1]=4 124 B11R0.3 C#CCCCOCC/C=C/CC 6bc38f56792f3234470150204fc3bfef [1,0,0,0,0,0|0,0,3]=4 125 B11R0.3 C#CCCCOCC/C=C\CC 9b65faf9da063b37e8c4f0e66f4e1b83 [1,0,0,0,0,0|0,0,3]=4 126 B11R0.3 C/C=C/C=C/COCCCCC 2667a603d2690530aadc1c08dc0a0108 [1,0,0,0,0,0|0,0,3]=4 127 B11R0.3 C/C=C/CCCOCCCCC 14c1074a961f91af4aaf5acad9119f1f [1,0,0,0,0,0|0,0,3]=4 128 B11R0.3 C/C=C/CCOCC/C=C\CC 130e75a457431060e807634c54ca368d [1,0,0,0,0,0|0,0,3]=4 129 B11R0.3 C/C=C\CCCOCCCCC 568202d36daaca9382cf0b6e7e3d1686 [1,0,0,0,0,0|0,0,3]=4 130 B11R0.3 C=CCCCOCC/C=C/CC 1f450e7ca7b65d300cb21122a428399c [1,0,0,0,0,0|0,0,3]=4 131 B11R0.3 C=CCCCOCC/C=C\CC e23031b9cc28cc8c778a8a97ebb1b9b8 [1,0,0,0,0,0|0,0,3]=4 132 B11R0.3 CC#CCCOCC/C=C\CC 8eb36de631309d07bf878f1b80e229f0 [1,0,0,0,0,0|0,0,3]=4 133 B11R0.3 CC/C=C/CC/C=C/COCC 2e81bfa7d1f636d0f5a124981a8ba07a [1,0,0,0,0,0|2,0,0]=3 134 B11R0.3 CC/C=C/CC/C=C/COCF 4ff4ddfba701a7eaf4043d4df621bdd9 [1,0,0,0,0,0|3,0,0]=4 135 B11R0.3 CC/C=C/CCOC/C=C/CC 16d2ece02d159638875ad094092b3559 [1,0,0,0,0,0|0,0,3]=4 136 B11R0.3 CC/C=C/CCOCCCC#N 0e70b981d7441d01ebb742447c5be12b [1,0,0,0,0,0|1,0,2]=4 137 B11R0.3 CC/C=C/CCOCCCC=O 79e09c746fec07f02c875cafd0d74dfe [1,0,0,0,0,0|1,0,2]=4 138 B11R0.3 CC/C=C/CCOCCCCC b53d7a6c46eb728d1471fa5f092df813 [1,0,0,0,0,0|0,0,1]=2 139 B11R0.3 CC/C=C/CCOCCCCF db27d0c9635d0c213d73aac13911a160 [1,0,0,0,0,0|1,0,1]=3 140 B11R0.3 CC/C=C/CCOCCCOC bb57789fef830566880a8c794032bf0d [1,0,0,0,0,0|1,0,1]=3 141 B11R0.3 CC/C=C/CCOCCCSC 39df8352e504f047e1955c139750b56a [1,0,0,0,0,0|1,0,1]=3 142 B11R0.3 CC/C=C/CCOCCOCC 43b47c9363e674f04921656e013e0f54 [1,0,0,0,0,0|1,0,1]=3 143 B11R0.3 CC/C=C/CCOCCSCC 5285bf5ad09cbcadaa8cb6988b0408aa [1,0,0,0,0,0|1,0,1]=3 144 B11R0.3 CC/C=C/CNCCCCCC 4ea6a89a67bd880060b4122692e295c2 [1,0,0,0,0,0|2,0,1]=4 145 B11R0.3 CC/C=C/COC/C=C/CCC 431c1240655b5db582c40d0d8df16b11 [1,0,0,0,0,0|2,0,1]=4 146 B11R0.3 CC/C=C/COC/C=C\CCC 0ae03e71a753812c17f82bfd4033f61d [1,0,0,0,0,0|2,0,1]=4 147 B11R0.3 CC/C=C/COCCCCCC eb90121bb3484ddc510c42f4817c7d41 [1,0,0,0,0,0|2,0,1]=4 148 B11R0.3 CC/C=C/COCOCCCC 0d636c9ea306623be56f563bf5b5ad56 [1,0,0,0,0,0|3,0,0]=4 149 B11R0.3 CC/C=C\CC/C=C/COCC c4775277c610e2a512b2810ad8f6e57c [1,0,0,0,0,0|2,0,0]=3 150 B11R0.3 CC/C=C\CC/C=C/COCF 1fa87ffc3658f764572a559409bf78c6 [1,0,0,0,0,0|3,0,0]=4 151 B11R0.3 CC/C=C\CCCCCOCC 3fcd157868f9d6a02a7d59a5bad0c445 [1,0,0,0,0,0|2,0,1]=4 152 B11R0.3 CC/C=C\CCCCOCCC b91b66aedbd8d3f44f429a8b1d860578 [1,0,0,0,0,0|2,0,1]=4 153 B11R0.3 CC/C=C\CCCOCCCC 4cdaf8803428e2d9f645148af5a0d0b2 [1,0,0,0,0,0|2,0,0]=3 154 B11R0.3 CC/C=C\CCCOCCCF 98835682c1129b1c7916d471184b4885 [1,0,0,0,0,0|3,0,0]=4 155 B11R0.3 CC/C=C\CCCOCCCS 665272f90257bf8bbc1f5634ba395f6f [1,0,0,0,0,0|3,0,0]=4 156 B11R0.3 CC/C=C\CCCOCCOC b1bbbe91f93c611f79d8b0fb289f6aad [1,0,0,0,0,0|3,0,0]=4 157 B11R0.3 CC/C=C\CCCOCCSC 0d602f7c41af76f66157c88769ec6ec6 [1,0,0,0,0,0|3,0,0]=4 158 B11R0.3 CC/C=C\CCCOCOCC 33dae2e12167b7eabf2c7ee083b312ad [1,0,0,0,0,0|3,0,0]=4 159 B11R0.3 CC/C=C\CCNCCCCC ca3a0d15ea7c79f615890d56cab14290 [1,0,0,0,0,0|1,0,1]=3 160 B11R0.3 CC/C=C\CCNCCCCCl dda2a530611fdbf5cddb0da844142b75 [1,0,0,0,0,0|2,0,1]=4 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[1,0,0,0,0,0|1,0,1]=3 173 B11R0.3 CC/C=C\CCOCCCCS 85bb847715880a394fd78eea2b3c923b [1,0,0,0,0,0|1,0,1]=3 174 B11R0.3 CC/C=C\CCOCCCOC d9dc9776c04f9dda2dfd8674e381212a [1,0,0,0,0,0|1,0,1]=3 175 B11R0.3 CC/C=C\CCOCCCSC 8f41472641c02a41ae5f67f4917f0af3 [1,0,0,0,0,0|1,0,1]=3 176 B11R0.3 CC/C=C\CCOCCOCC 04dac999673e037fe50cf5f521ee462d [1,0,0,0,0,0|1,0,1]=3 177 B11R0.3 CC/C=C\CCOCCSCC 67d16d9b6fc19034eb83a73318f27b0e [1,0,0,0,0,0|1,0,1]=3 178 B11R0.3 CC/C=C\COC/C=C/CCC 9f0304d675a3454ce4d3415b70d9a844 [1,0,0,0,0,0|2,0,1]=4 179 B11R0.3 CC/C=C\COC/C=C\CCC f28d8c97e11462919c333ccf3c8c08af [1,0,0,0,0,0|2,0,1]=4 180 B11R0.3 CC/C=C\COCCCCCC 9755557f3f5961e4b7217afb6d53fd2f [1,0,0,0,0,0|2,0,1]=4 181 B11R0.3 CC/C=C\COCOCCCC ecbff20520a997a442bc1e107ec28aeb [1,0,0,0,0,0|3,0,0]=4 182 B11R0.3 CC=C=CCCOCCCCC f479771863cbff291f815f4a85f0457b [1,0,0,0,0,0|0,0,3]=4 183 B11R0.3 CC=CC=CCOCCCCC 0a414855753f5c15a0899ce0a42b5368 [1,0,0,0,0,0|0,0,3]=4 184 B11R0.3 CC=CCCCOCCCCC 150b13ec9b2c10d3b11289990257ead7 [1,0,0,0,0,0|0,0,3]=4 185 B11R0.3 CCC#CCCOCCCCC ea61c9e9f51ccb19ef08c5d6ca6a7377 [1,0,0,0,0,0|0,0,3]=4 186 B11R0.3 CCC#CCOCC/C=C/CC 2bf7dec6d1acfb68134ee2c8ac97ce4a [1,0,0,0,0,0|0,0,3]=4 187 B11R0.3 CCC#CCOCC/C=C\CC 05026b7f910f127b0b3699727a003e4f [1,0,0,0,0,0|0,0,3]=4 188 B11R0.3 CCC/C=C/COCCCCC 376fd1605555eb7afa40e728bdf19f2d [1,0,0,0,0,0|0,0,3]=4 189 B11R0.3 CCC/C=C\COCCCCC d379d1a8be0c42f6be0ab331a41b2209 [1,0,0,0,0,0|0,0,3]=4 190 B11R0.3 CCC=CCCC=CCOCC 002eeb171ac1bc76c2fb1e09fb71288f [1,0,0,0,0,0|2,0,0]=3 191 B11R0.3 CCC=CCCC=CCOCF 737c3d25039b6df5eb6388ca5e71e0c4 [1,0,0,0,0,0|3,0,0]=4 192 B11R0.3 CCC=CCCCCCOCC acb4ebc5d4b9da3999d78f72f192ac9b [1,0,0,0,0,0|2,0,1]=4 193 B11R0.3 CCCC/C=C\CCOCCC 1a8844975936e052ac905af32c23beeb [1,0,0,0,0,0|2,0,1]=4 194 B11R0.3 CCCCCCOCCCCC b4a731a4f44998aaa50eb10174d909fa [1,0,0,0,0,0|0,0,3]=4 195 B11R0.3 CCCCCOCCCOCC 8f415b136edee3dd18226f52cdfec746 [1,0,0,0,0,0|1,0,2]=4 196 B11R0.3 CCCCCOCCCSCC d152f0f24c87dfe3226edda7a393a099 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e90aaa69baefd496d90e54eb86ac96d3 [1,0,0,0,0,0|2,0,1]=4 232 B11R0.4 CCCC(=O)OCCOCOC b7d59abffd1800995f07b9169f358dd9 [1,0,0,0,0,0|2,0,1]=4 233 B11R0.4 CCCC(=O)OCCOCSC 395a57442bac60125264ec8041b1e3ee [1,0,0,0,0,0|2,0,1]=4 234 B11R0.4 CCCC(=S)OCCCOCC a1d861d8402c7ac3a3a543a988eb9adc [1,0,0,0,0,0|1,1,1]=4 235 B11R0.4 CCCC(=S)OCCCSCC 243bff7ce32c0ac7d9dc257fef4d6a42 [1,0,0,0,0,0|1,1,1]=4 236 B11R0.4 CCCCCCNC(=O)CCC 86ff0f5e9c808359785c4d555716a0c6 [1,0,0,0,0,0|1,0,2]=4 237 B11R0.4 CCCCCCOC(=S)CCC ebc5344eafa6dd48024f5c5c5e052730 [1,0,0,0,0,0|0,1,2]=4 238 B11R0.4 CCCCNCOC(=O)CCC cc2e2e110e13b6e9f5212bb3d4681698 [1,0,0,0,0,0|1,0,2]=4 239 B11R0.4 CCCCOCOC(=O)CCC b2403cfdcf9e3272dd7d915ff636f487 [1,0,0,0,0,0|1,0,2]=4 240 B11R0.4 CCCOCCNC(=O)CCC 95c055b4347bfd7bfa9c570d9719ea75 [1,0,0,0,0,0|2,0,1]=4 241 B11R0.4 CCCOCCOC(=O)CCC 94efe85d85fae3af0976a73792f0222f [1,0,0,0,0,0|1,0,1]=3 242 B11R0.4 CCCOCCOC(=S)CCC 95a4dad7fc3b1d357922e071080ce62e [1,0,0,0,0,0|1,1,1]=4 243 B11R0.81 C/C=C/CCCC(=O)NCCBr 3d68366afaf50874cd1e42173ab1d64c [1,0,0,0,0,0|3,0,0]=4 244 B11R0.81 C/C=C/CCCC(=O)NCCC 320cd7ca372be81d7dd0b97c4069ce50 [1,0,0,0,0,0|2,0,0]=3 245 B11R0.81 C/C=C/CCCC(=O)NCCF 49616904daac32934a54b1d06249e20d [1,0,0,0,0,0|3,0,0]=4 246 B11R0.81 C/C=C/CCCC(=O)NCCI 0140a75d36510a68019392e5948384dd [1,0,0,0,0,0|3,0,0]=4 247 B11R0.81 C/C=C/CCCC(=O)NCCO ee0d5d0d30a7a14d1f37d68caccbf7f9 [1,0,0,0,0,0|3,0,0]=4 248 B11R0.81 C/C=C/CCCC(=O)NCCS 662dee10f1de41884d43a19ca1c0d001 [1,0,0,0,0,0|3,0,0]=4 249 B11R0.81 C/C=C/CCOC(C)CCCC fc755d5939ac545b621671d079cee386 [1,0,0,0,0,0|1,0,1]=3 250 B11R0.81 C/C=C/CNCC(=O)NCCC 750b2045302869c52b8c5167974632e0 [1,0,0,0,0,0|3,0,0]=4 251 B11R0.81 C/C=C/COCC(=O)CCSC 0260c17e2a01a02ca2415759cf2174f6 [1,0,0,0,0,0|3,0,0]=4 252 B11R0.81 C/C=C/COCC(=O)NCCC 56ef844870fd0d49a91ad24bb67c2ae0 [1,0,0,0,0,0|3,0,0]=4 253 B11R0.81 C/C=C/COCC(=O)OCCC fc9ddd92128015db65856ff7285f202d [1,0,0,0,0,0|3,0,0]=4 254 B11R0.81 C/C=C\CCCN(C)CCCC dab94aa0fa141d79a59319ed5832c43b [1,0,0,0,0,0|3,0,0]=4 255 B11R0.81 C/C=C\CNCC(=O)NCCC 5f30a8efa0db6abd9031888607c6eb08 [1,0,0,0,0,0|3,0,0]=4 256 B11R0.81 C/C=C\COCC(=O)CCSC de25132cc2587707c36140f398c96e71 [1,0,0,0,0,0|3,0,0]=4 257 B11R0.81 C/C=C\COCC(=O)NCCC 6a8f69bdada74004404a364a1bdf613b [1,0,0,0,0,0|3,0,0]=4 258 B11R0.81 C/C=C\COCC(=O)OCCC 663c40ab73f619bda2c225171df1ee74 [1,0,0,0,0,0|3,0,0]=4 259 B11R0.81 C=CCCCNC(=O)CCCC 8e95d6f6c8d2bd1d97d3691b7880b49e [1,0,0,0,0,0|1,0,2]=4 260 B11R0.81 C=COCCNC(=O)CCCC 445d168d19aad0e54f57c8e8ae58b34a [1,0,0,0,0,0|2,0,1]=4 261 B11R0.81 CC/C=C/CNC(C)CCCC 81e86a8b9f48b2cc1219d4de5d459744 [1,0,0,0,0,0|2,0,1]=4 262 B11R0.81 CC/C=C/CN[C@H](C)CCCC f79cdffbb693f716fcf5d93b69b0310b [1,0,0,0,0,0|2,0,1]=4 263 B11R0.81 CC/C=C/COC(C)CCCC 42b37d9860f90ae1395ebb1fa01f0a58 [1,0,0,0,0,0|1,0,1]=3 264 B11R0.81 CC/C=C/COC(C)CCOC 8f2c0fbfc08b3d95c2209ef615f281d4 [1,0,0,0,0,0|2,0,1]=4 265 B11R0.81 CC/C=C/COC(C)CCSC 15e3fb0d1bfb4d9fccfa3fb47909c1e5 [1,0,0,0,0,0|2,0,1]=4 266 B11R0.81 CC/C=C/COC(C)COCC c6059682e2445a3a9c5740a70cc0f737 [1,0,0,0,0,0|2,0,1]=4 267 B11R0.81 CC/C=C/CO[C@@H](C)CCCC e4d373f852c3e3656bf4fcd1d8dc87f5 [1,0,0,0,0,0|1,0,1]=3 268 B11R0.81 CC/C=C/CO[C@H](C)CCCC a61448b5c4d7007538aaf40b63254bb0 [1,0,0,0,0,0|1,0,1]=3 269 B11R0.81 CC/C=C\CCN(C)CCCC ec9dc44d647d04a82557832f950258f9 [1,0,0,0,0,0|2,0,0]=3 270 B11R0.81 CC/C=C\CCN(C)CCCO 967067046764fb4805a1de92d4437b27 [1,0,0,0,0,0|3,0,0]=4 271 B11R0.81 CC/C=C\CCN(C)CCOC 3d81a72c596598f31ce7868878a994aa [1,0,0,0,0,0|3,0,0]=4 272 B11R0.81 CC/C=C\CCN(C)CCSC 39b78a2888d51d612380c96257df4c5c [1,0,0,0,0,0|3,0,0]=4 273 B11R0.81 CC/C=C\COC(C)CCCC 2c34bb4d4c5cae98da461010746a1e1c [1,0,0,0,0,0|1,0,1]=3 274 B11R0.81 CC=CCNCC(=O)CCSC adb05690d5ca4fe9649cdf7a624ebbc9 [1,0,0,0,0,0|3,0,0]=4 275 B11R0.81 CC=CCNCC(=O)NCCC f1719c40e68e24bfd8ab298aa4a5bf70 [1,0,0,0,0,0|3,0,0]=4 276 B11R0.81 CC=CCNCC(=O)OCCC cc9a9946aaa7efdb3824fd87e94e11bc [1,0,0,0,0,0|3,0,0]=4 277 B11R0.81 CC=CCOCC(=O)CCSC 1a33a809474c634be9432885f386a972 [1,0,0,0,0,0|3,0,0]=4 278 B11R0.81 CC=CCOCC(=O)NCCC 75ddb8adabaf44b89d339eea6f9c3ae0 [1,0,0,0,0,0|3,0,0]=4 279 B11R0.81 CC=CCOCC(=O)OCCC 2d72f130f78b56101482ac4a54bfb905 [1,0,0,0,0,0|3,0,0]=4 280 B11R0.81 CCC/C=C/CC(=O)NCCC 40794eac8680af8f7b27b0cc3497eac7 [1,0,0,0,0,0|1,0,2]=4 281 B11R0.81 CCCCC(=O)NCCCCCl b9536b0c8f50ac92230f25eea98ed7d1 [1,0,0,0,0,0|2,0,1]=4 282 B11R0.81 CCCCC(=O)NCCCCO fa42fcd441c7069b7e8d15f43c375c64 [1,0,0,0,0,0|2,0,1]=4 283 B11R0.81 CCCCC(=O)NCCCCS ce90c047aecddf54e66da494b3c8c31b [1,0,0,0,0,0|2,0,1]=4 284 B11R0.81 CCCCC(=O)NCCCOC d86159687395af2cdbf73960d6c053a1 [1,0,0,0,0,0|2,0,1]=4 285 B11R0.81 CCCCC(=O)NCCCSC be82751f82a49c9ebe55528be38267ca [1,0,0,0,0,0|2,0,1]=4 286 B11R0.81 CCCCC(=O)NCCOCC bcdbd9d41426e95de40e68225afe50a3 [1,0,0,0,0,0|2,0,0]=3 287 B11R0.81 CCCCC(=O)NCCSCC 3dc1a80f6b8f71092a353e3e3c630639 [1,0,0,0,0,0|2,0,0]=3 288 B11R0.81 CCCCC(=O)OCNCCBr b35cf5afed991c05e50b5e7336955d2a [1,0,0,0,0,0|2,0,1]=4 289 B11R0.81 CCCCC(=O)OCNCCC 189a0251ea5eef3ed179b78ec37eca6d [1,0,0,0,0,0|1,0,1]=3 290 B11R0.81 CCCCC(=O)OCNCCF 92476339d76daf98486af68d9dd3ae23 [1,0,0,0,0,0|2,0,1]=4 291 B11R0.81 CCCCC(=O)OCNCCI ec98e23477297f49500e4903c8c00086 [1,0,0,0,0,0|2,0,1]=4 292 B11R0.81 CCCCC(=O)OCNCCO a2247b6664afd75a70edee19128d94db [1,0,0,0,0,0|2,0,1]=4 293 B11R0.81 CCCCC(=O)OCNCCS 031b8d3582f8442adf31521fd13d67be [1,0,0,0,0,0|2,0,1]=4 294 B11R0.81 CCCCC(=O)OCOCCC 0911490fac5c15eab77dc944203f025f [1,0,0,0,0,0|1,0,1]=3 295 B11R0.81 CCCCC(=O)OCOCCF fc55082c71c8f0e3cdddb51d90ead405 [1,0,0,0,0,0|2,0,1]=4 296 B11R0.81 CCCCC(=O)OCOCCS df7a84fef8a135f7e1b5bf5951308452 [1,0,0,0,0,0|2,0,1]=4 297 B11R0.81 CCCCC(=O)OCOCOC b548ff67261092eea409be64a3c75113 [1,0,0,0,0,0|2,0,1]=4 298 B11R0.81 CCCCC(C)OCCOCC dbba43750acd2575431f76bcf49c2b77 [1,0,0,0,0,0|2,0,1]=4 299 B11R0.81 CCCCC(C)OCCSCC 00fec32fbad71cf764d7828b6e17dc07 [1,0,0,0,0,0|2,0,1]=4 300 B11R0.81 CCCCCCC(=O)NCCC 87d8790730f902707f59eb54172a1efa [1,0,0,0,0,0|1,0,2]=4 301 B11R0.81 CCCCCNC(=O)CCCC a06834419102a1558a19fb3a1406cfb0 [1,0,0,0,0,0|1,0,1]=3 302 B11R0.81 CCCCCNC(=O)CCCF cb3b728da5cd7a0af32935f0696071b9 [1,0,0,0,0,0|2,0,1]=4 303 B11R0.81 CCCCCNC(=O)CCCS 2ce8fa8be7e233b98c683adc51803bf5 [1,0,0,0,0,0|2,0,1]=4 304 B11R0.81 CCCCCNC(=O)CCOC 99bac40aabd096dca01631fdf32d2a4b [1,0,0,0,0,0|2,0,1]=4 305 B11R0.81 CCCCCNC(=O)CCSC 307383e6c5c252e00e4647926ad02c1d [1,0,0,0,0,0|2,0,1]=4 306 B11R0.81 CCCCCNC(=O)COCC 11ebeee9fef7d60698beadcb88e4cda2 [1,0,0,0,0,0|2,0,1]=4 307 B11R0.81 CCCCCNC(=O)CSCC bf3d4e842c78e9ee2405e5f2f5ac3c0b [1,0,0,0,0,0|2,0,1]=4 308 B11R0.81 CCCCCNC(=O)NCCC 2fb53f51cf25e3deb1739f07400adf03 [1,0,0,0,0,0|2,0,1]=4 309 B11R0.81 CCCCCOC(C)CCCC c7acc1e25061124a677e93a98c4880c3 [1,0,0,0,0,0|1,0,2]=4 310 B11R0.81 CCCCCO[C@@H](C)CCCC a39e9f1d5c06f929dc091d3b55f09321 [1,0,0,0,0,0|1,0,2]=4 311 B11R0.81 CCCCCO[C@H](C)CCCC f537dfc938a1fd068dc349c4b7b77c37 [1,0,0,0,0,0|1,0,2]=4 312 B11R0.81 CCCC[C@@H](C)OCCOCC 9a42cd4b604e33cac23cd89ad4684f1d [1,0,0,0,0,0|2,0,1]=4 313 B11R0.81 CCCC[C@@H](C)OCCSCC 0c7bacedbf026662c629335f79703299 [1,0,0,0,0,0|2,0,1]=4 314 B11R0.81 CCCC[C@H](C)OCCOCC 9d1ae575c5f34c17b77ad89ca30fa091 [1,0,0,0,0,0|2,0,1]=4 315 B11R0.81 CCCC[C@H](C)OCCSCC 924d4d546c762bc8b477026685ab3bb0 [1,0,0,0,0,0|2,0,1]=4 316 B11R0.81 CCCNC(=O)CCOCCC 42553a8c8b926fca8611ff8d68aeae7a [1,0,0,0,0,0|2,0,1]=4 317 B11R0.81 CCCNC(=O)NCCOCC 80e1f0671ff882759d81829124c92ad6 [1,0,0,0,0,0|3,0,0]=4 318 B11R0.81 CCCNC(=O)NCCSCC c2a740fdab08c6ec989b5f9aea85bf6c [1,0,0,0,0,0|3,0,0]=4 319 B11R0.81 CCCNCOC(=O)OCCC 4d1a92bf22713f11d028be261523bf97 [1,0,0,0,0,0|2,0,1]=4 320 B11R0.81 CCCOCCC(=O)OCCC 6ee22521ff14ec2304cdca3071c00c79 [1,0,0,0,0,0|2,0,1]=4 321 B11R0.81 CCCOCOC(=O)OCCC 7cd19f7197089ff3a04837dd12236c27 [1,0,0,0,0,0|2,0,1]=4 322 B11R0.81 CCOCC(=O)NCCSCC dc2db358571e9ce17f4f7e3af62ea85f [1,0,0,0,0,0|3,0,0]=4 323 B11R0.81 CCOCCNC(=O)CCCF 143244bf937b80e80b1012bf493a68c2 [1,0,0,0,0,0|3,0,0]=4 324 B11R0.81 CCOCCNC(=O)CCCS 19665b86e7c7d0a3fb523bfbe3572199 [1,0,0,0,0,0|3,0,0]=4 325 B11R0.81 CCOCCNC(=O)CCOC ac2e4792b39278e1be00015aba1c14ba [1,0,0,0,0,0|3,0,0]=4 326 B11R0.81 CCOCCNC(=O)CCSC e921116d3831e309cf43a8831d286efa [1,0,0,0,0,0|3,0,0]=4 327 B11R0.81 CCOCCNC(=O)COCC ccff2589632a0830014f62e4f65641f2 [1,0,0,0,0,0|3,0,0]=4 328 B11R0.81 CCOCCNC(=O)CSCC ad5aa08f7211c115983356636b1745f4 [1,0,0,0,0,0|3,0,0]=4 329 B11R0.81 CCSCCNC(=O)CCCF 27a5d2edf7fbd02ff957d5e4ca1b276f [1,0,0,0,0,0|3,0,0]=4 330 B11R0.81 CCSCCNC(=O)CCCS d71a7511e56051353f5f76d32534489f [1,0,0,0,0,0|3,0,0]=4 331 B11R0.81 CCSCCNC(=O)CCOC 43174eb7b6b512a7d0afbe0b9f344a65 [1,0,0,0,0,0|3,0,0]=4 332 B11R0.81 CCSCCNC(=O)CCSC 4dce0d397f7e5f7bb9ff360e55b32e5e [1,0,0,0,0,0|3,0,0]=4 333 B11R0.81 CCSCCNC(=O)CSCC 618931eb3238ccd09997ba70bf359774 [1,0,0,0,0,0|3,0,0]=4 334 B13R0.66 C#CCCC(=O)CCOC/C=C/CC 4b4fc7ff65e92d8186ee96e919202bad [0,1,0,0,0,0|1,0,2]=4 335 B13R0.66 C#CCNC(=O)COCC/C=C/CC dce817e18c29552d8095e90ab4609f94 [0,1,0,0,0,0|1,0,2]=4 336 B13R0.66 C#CCNC(=O)COCC/C=C\CC 8c21023c78dd6904191a80e4b96c310e [0,1,0,0,0,0|1,0,2]=4 337 B13R0.66 C/C=C/C=C/COCC(=O)CCSC 7656d2d553a2abbd0043b0f318214d90 [0,1,0,0,0,0|1,0,2]=4 338 B13R0.66 C/C=C/C=C/COCC(=O)NCCC e950354cf343aa1a6b0dd0ff29246492 [0,1,0,0,0,0|1,0,2]=4 339 B13R0.66 C/C=C/C=C/COCC(=O)OCCC eecf7d2b0d0bc0315333de40c3df62e7 [0,1,0,0,0,0|1,0,2]=4 340 B13R0.66 C/C=C/CCCOCC(=O)CCSC d8a4728eaad514b0aa2637bce73d1463 [0,1,0,0,0,0|1,0,2]=4 341 B13R0.66 C/C=C/CCCOCC(=O)NCCC 889793c62833d70843e1f4cb33719758 [0,1,0,0,0,0|1,0,2]=4 342 B13R0.66 C/C=C/CCCOCC(=O)OCCC 3dea20fff8929cf7256195e93337115f [0,1,0,0,0,0|1,0,2]=4 343 B13R0.66 C/C=C/CCOCOC(=O)CCCC 89d968f107bcd8c55f7fa1c16a5b2813 [0,1,0,0,0,0|0,0,2]=3 344 B13R0.66 C/C=C/CCOCOC(=O)OCCC 57e5e35d4836f6900139967f382b3636 [0,1,0,0,0,0|1,0,2]=4 345 B13R0.66 C/C=C\CCCOCC(=O)CCSC e8bf11a8bf438e111eaebdb3927d2420 [0,1,0,0,0,0|1,0,2]=4 346 B13R0.66 C/C=C\CCCOCC(=O)NCCC 39a36c11bd70e99907336b28cb024664 [0,1,0,0,0,0|1,0,2]=4 347 B13R0.66 C/C=C\CCCOCC(=O)OCCC b41d931072de495637fb97ad27039403 [0,1,0,0,0,0|1,0,2]=4 348 B13R0.66 C=C(COCC/C=C/CC)OCOC 1a67d2a9f976cff385e9e2481e51865f [0,1,0,0,0,0|3,0,0]=4 349 B13R0.66 C=C(COCC/C=C\CC)OCOC 38d16771ebf8b6482be165dacf92bdca [0,1,0,0,0,0|3,0,0]=4 350 B13R0.66 C=C=CCCOCOC(=O)CCCC 73fc7617cf79dd6a0de9e3188fc830c6 [0,1,0,0,0,0|0,0,3]=4 351 B13R0.66 C=CCNC(=O)COCC/C=C/CC a8ab56425837846ad28f1da9cb47a700 [0,1,0,0,0,0|1,0,2]=4 352 B13R0.66 C=CCNC(=O)COCC/C=C\CC ef825f2d20288310c01a5e8e3d698071 [0,1,0,0,0,0|1,0,2]=4 353 B13R0.66 C=CCOC(=O)COCC/C=C/CC 2c48bad1fa06a4c7afb72c1a0d276d1f [0,1,0,0,0,0|1,0,2]=4 354 B13R0.66 C=CCOC(=O)COCC/C=C\CC b24d8ea74229c511a3067883b7c90404 [0,1,0,0,0,0|1,0,2]=4 355 B13R0.66 CC#CCCOCOC(=O)CCCC a3c4f52c97d2b10b2412cf1f93a07ddb [0,1,0,0,0,0|0,0,3]=4 356 B13R0.66 CC/C=C/CCOCC(=O)CCSC c57bc6abfece68acfca754f2d2e08a93 [0,1,0,0,0,0|1,0,0]=2 357 B13R0.66 CC/C=C/CCOCC(=O)NCC#N ff56a8815601b7f2566715a9715734fc [0,1,0,0,0,0|2,0,1]=4 358 B13R0.66 CC/C=C/CCOCC(=O)NCCC 2db8b27f54539e550be0e7b8e138db72 [0,1,0,0,0,0|1,0,0]=2 359 B13R0.66 CC/C=C/CCOCC(=O)OCCC 05e807d7fa637b47083c7e00f1eb459f [0,1,0,0,0,0|1,0,0]=2 360 B13R0.66 CC/C=C/CNCCN(C)CCCC ab1cae6f3e79a9992a4d19676b70d613 [0,1,0,0,0,0|3,0,0]=4 361 B13R0.66 CC/C=C/COCCC(=O)OCCC 338d970eaa353043b54fc67ce712bc41 [0,1,0,0,0,0|2,0,0]=3 362 B13R0.66 CC/C=C/COCCC(C)CCCC 5b6d30193a22ab061f137879a2e0f85d [0,1,0,0,0,0|2,0,1]=4 363 B13R0.66 CC/C=C/COCOC(=O)CCCC 02a168759682a628eadf3ca4b3ceef2c [0,1,0,0,0,0|0,0,0]=1 364 B13R0.66 CC/C=C/COCOC(=O)OCCC 1dde129a7857be3f8e5ffdecfeef937f [0,1,0,0,0,0|1,0,0]=2 365 B13R0.66 CC/C=C\CCCOC(C)CCCC a97bcd30d1eca581b92e6d4b04a91116 [0,1,0,0,0,0|1,0,1]=3 366 B13R0.66 CC/C=C\CCNCC(=O)NCCC 652a09c6d7e7e2052c8274500f5c0e0a [0,1,0,0,0,0|2,0,0]=3 367 B13R0.66 CC/C=C\CCNCC(=O)NCCO c479aa4da8686651c5dc67650294b305 [0,1,0,0,0,0|3,0,0]=4 368 B13R0.66 CC/C=C\CCNCC(O)CCCC d2ae8980f912deb1a180dc29e7790be6 [0,1,0,0,0,0|1,0,2]=4 369 B13R0.66 CC/C=C\CCOCC(=O)CCSC cd93ef425dea85b9d7362a6e64fb7b0e [0,1,0,0,0,0|1,0,0]=2 370 B13R0.66 CC/C=C\CCOCC(=O)NCC#N 372c9e2b85da4d762581d900466ae030 [0,1,0,0,0,0|2,0,1]=4 371 B13R0.66 CC/C=C\CCOCC(=O)NCCC 7aa446aa1c13e92b72336c2f1f301c0b [0,1,0,0,0,0|1,0,0]=2 372 B13R0.66 CC/C=C\CCOCC(=O)OCCC 60ccb19ee2df3bb2637c9b137906e7f3 [0,1,0,0,0,0|1,0,0]=2 373 B13R0.66 CC/C=C\CCOCC(C)CCCC 3d9df6a9cddf5c103b5420d99fe9bf25 [0,1,0,0,0,0|1,0,1]=3 374 B13R0.66 CC/C=C\CCOCC(C)COCC 674cf8b24d659baf08d6537292fd5077 [0,1,0,0,0,0|2,0,1]=4 375 B13R0.66 CC/C=C\COCOC(=O)CCCC b34fdcd4cdad8610c666da0554f64477 [0,1,0,0,0,0|0,0,0]=1 376 B13R0.66 CC/C=C\COCOC(=O)OCCC 3d979cebd744f991807819a02ecf0a1e [0,1,0,0,0,0|1,0,0]=2 377 B13R0.66 CC=C=CCCOCC(=O)CCSC 08a04e2e3ce297122449f9070e134746 [0,1,0,0,0,0|1,0,2]=4 378 B13R0.66 CC=C=CCCOCC(=O)NCCC dbc933299a01743064af306ebaab264d [0,1,0,0,0,0|1,0,2]=4 379 B13R0.66 CC=C=CCCOCC(=O)OCCC 47bce389a38c49ee14909a2bd757b0e0 [0,1,0,0,0,0|1,0,2]=4 380 B13R0.66 CC=CC=CCOCC(=O)CCSC e2fd86084b2e47af3d29c1be9af3567c [0,1,0,0,0,0|1,0,2]=4 381 B13R0.66 CC=CC=CCOCC(=O)NCCC 44f3c3b4c58ca75891a010a1febc32ba [0,1,0,0,0,0|1,0,2]=4 382 B13R0.66 CC=CC=CCOCC(=O)OCCC 2bd64ac3cc28bccd70b986838837610b [0,1,0,0,0,0|1,0,2]=4 383 B13R0.66 CC=CCCCOCC(=O)CCSC 948ec2827afe2a601890086c50f82dc4 [0,1,0,0,0,0|1,0,2]=4 384 B13R0.66 CC=CCCCOCC(=O)NCCC badf96832ab88a2d62d90d1f7a409171 [0,1,0,0,0,0|1,0,2]=4 385 B13R0.66 CC=CCCCOCC(=O)OCCC c637b6a19bc1939569d4933906fdd00f [0,1,0,0,0,0|1,0,2]=4 386 B13R0.66 CCC#CCCOCC(=O)CCSC 65daef02c58af34e1e512767ba7218d3 [0,1,0,0,0,0|1,0,2]=4 387 B13R0.66 CCC#CCCOCC(=O)NCCC 0321973fca82dac37bab74a6bdc96a55 [0,1,0,0,0,0|1,0,2]=4 388 B13R0.66 CCC#CCCOCC(=O)OCCC e0ff73bded91af664c17b39d16052446 [0,1,0,0,0,0|1,0,2]=4 389 B13R0.66 CCC#CCOCOC(=O)CCCC 6afc940b97571d00c6114a961717c3a9 [0,1,0,0,0,0|0,0,2]=3 390 B13R0.66 CCC#CCOCOC(=O)OCCC 560a7533b392c39d1f1872f11ee6a74e [0,1,0,0,0,0|1,0,2]=4 391 B13R0.66 CCC/C=C/CCCC(=O)NCCBr 459028e94b65bf0c553b515f84a9dd8c [0,1,0,0,0,0|3,0,0]=4 392 B13R0.66 CCC/C=C/CCCC(=O)NCCC fcc7b47c52ccec929be73b8366d385d9 [0,1,0,0,0,0|2,0,0]=3 393 B13R0.66 CCC/C=C/CCCC(=O)NCCF 8d9fda9efe38ebe5f8fcec4badecc3ce [0,1,0,0,0,0|3,0,0]=4 394 B13R0.66 CCC/C=C/CCCC(=O)NCCI 3cef943d590d86ac05c3c7f09d29dd95 [0,1,0,0,0,0|3,0,0]=4 395 B13R0.66 CCC/C=C/CCCC(=O)NCCO f06f73c26a57372aee80a97c69379625 [0,1,0,0,0,0|3,0,0]=4 396 B13R0.66 CCC/C=C/CCCC(=O)NCCS a86c6f673849ea2d255984ec4cb87657 [0,1,0,0,0,0|3,0,0]=4 397 B13R0.66 CCC/C=C/CNCC(=O)NCCC 82ffd0b2cfc18d126fff38d3e4d6f370 [0,1,0,0,0,0|3,0,0]=4 398 B13R0.66 CCC/C=C/COCC(=O)CCSC 88ebeac819cf75645c26ad2fe59a3d09 [0,1,0,0,0,0|1,0,2]=4 399 B13R0.66 CCC/C=C/COCC(=O)NCCC 076c6d7f3313051f6b8de3205b7ee749 [0,1,0,0,0,0|1,0,2]=4 400 B13R0.66 CCC/C=C/COCC(=O)OCCC e1f925b28e1e385c196a6790621973f8 [0,1,0,0,0,0|1,0,2]=4 401 B13R0.66 CCC/C=C\CCOC(C)CCCC 407540d9c88fe1df3a3a0156e60142ac [0,1,0,0,0,0|1,0,1]=3 402 B13R0.66 CCC/C=C\CNCC(=O)NCCC 2dbdc0d27fc8b02b14112d93d879cfa9 [0,1,0,0,0,0|3,0,0]=4 403 B13R0.66 CCC/C=C\COCC(=O)CCSC b6585a80c501bcf3aa1f72b345299ae0 [0,1,0,0,0,0|1,0,2]=4 404 B13R0.66 CCC/C=C\COCC(=O)NCCC 4081990479782a724b139f2e5b76a6ee [0,1,0,0,0,0|1,0,2]=4 405 B13R0.66 CCC/C=C\COCC(=O)OCCC 199fb6346a1dd6fa5f14c580c774e3ff [0,1,0,0,0,0|1,0,2]=4 406 B13R0.66 CCCCC(=O)NCCCCCCCl 08faec295c4d9ee42d05f2ae3c2cac00 [0,1,0,0,0,0|1,0,2]=4 407 B13R0.66 CCCCC(=O)NCCCCCCO fdf630f4ca5cd61f0e32727e5f79cc84 [0,1,0,0,0,0|1,0,2]=4 408 B13R0.66 CCCCC(=O)NCCCCCOC 0d8ad07c1400d6a43b5ddd6d5e06ccf5 [0,1,0,0,0,0|1,0,2]=4 409 B13R0.66 CCCCC(=O)NCCCCSCC 9cda10a1e9a8a6d90f33cbaea3322fe0 [0,1,0,0,0,0|1,0,2]=4 410 B13R0.66 CCCCC(=O)NCCCOCCC 18d71520a637448525dbd8156b1bbc99 [0,1,0,0,0,0|1,0,2]=4 411 B13R0.66 CCCCC(=O)NCCCOCCO 83836ccda33802f7ab55d2d86f6057bc [0,1,0,0,0,0|2,0,1]=4 412 B13R0.66 CCCCC(=O)NCCOCCCO 0bbf4b88d67f198025bff2b8a933f342 [0,1,0,0,0,0|2,0,1]=4 413 B13R0.66 CCCCC(=O)NCCOCCOC f4951fb5c0ac961cb5eb18c74b4316ab [0,1,0,0,0,0|2,0,1]=4 414 B13R0.66 CCCCC(=O)NCCSSCCO 42ffda2be8006a02552c21622ccaa255 [0,1,0,0,0,0|3,0,0]=4 415 B13R0.66 CCCCC(=O)OCNCC#CCO 4248802545d09550e46fbdd35d07ca55 [0,1,0,0,0,0|1,0,2]=4 416 B13R0.66 CCCCC(=O)OCNCCCCCl 3f01d7b6d839f4b52b5d2a2e2171e810 [0,1,0,0,0,0|1,0,2]=4 417 B13R0.66 CCCCC(=O)OCNCCCCO 1f033e31f041101f32e3d82a82e322ad [0,1,0,0,0,0|1,0,2]=4 418 B13R0.66 CCCCC(=O)OCNCCCCS 67b23a0daad2b89ac77bd77b706af316 [0,1,0,0,0,0|1,0,2]=4 419 B13R0.66 CCCCC(=O)OCNCCCOC 5925fd9d319c24d2c3e256a172f8e28a [0,1,0,0,0,0|1,0,2]=4 420 B13R0.66 CCCCC(=O)OCNCCCSC 4a267b0393307f7815432f3153afe75a [0,1,0,0,0,0|1,0,2]=4 421 B13R0.66 CCCCC(=O)OCNCCOCC 4f335f6ec138a6115f5c277f953158de [0,1,0,0,0,0|1,0,1]=3 422 B13R0.66 CCCCC(=O)OCNCCSCC 5d1a50e6041894b44e5e07f6da173c2e [0,1,0,0,0,0|1,0,1]=3 423 B13R0.66 CCCCC(=O)OCOC/C=C/C=O c0ed7f752d06da35b8b798d085eec83a [0,1,0,0,0,0|1,0,1]=3 424 B13R0.66 CCCCC(=O)OCOCCCCF cd3f2f6a6743661c183160a516a5b77d [0,1,0,0,0,0|1,0,2]=4 425 B13R0.66 CCCCC(=O)OCOCCCCS 9ffa59747bb9e9bebf9398b58784f952 [0,1,0,0,0,0|1,0,2]=4 426 B13R0.66 CCCCC(=O)OCOCCCOC a3eced9a17a8670a508cc922acabe651 [0,1,0,0,0,0|1,0,2]=4 427 B13R0.66 CCCCC(=O)OCOCCCSC 060bddfbbbc0eab91fcb7fc299cfef19 [0,1,0,0,0,0|1,0,2]=4 428 B13R0.66 CCCCC(=O)OCOCCOCC da1c30fb13ba845433dd9dc762496586 [0,1,0,0,0,0|1,0,1]=3 429 B13R0.66 CCCCC(=O)OCOCCSCC 1aa269d37591f683c7b9aef09b38f848 [0,1,0,0,0,0|1,0,1]=3 430 B13R0.66 CCCCCCCNC(=O)CCCC 684c2a616aaeb29d62d8f48ad97e712f [0,1,0,0,0,0|1,0,2]=4 431 B13R0.66 CCCCCCOCC(=O)CCSC 090eace8f41effd70d4270a8fcd07f74 [0,1,0,0,0,0|1,0,2]=4 432 B13R0.66 CCCCCCOCC(=O)NCCC 26b263992edbfa53df49a4b91b94e9ec [0,1,0,0,0,0|1,0,2]=4 433 B13R0.66 CCCCCCOCC(=O)OCCC d005979674755503a456ea7894191e9e [0,1,0,0,0,0|1,0,2]=4 434 B13R0.66 CCCCCNCOC(=O)CCCC d956c20abea1be619b02522e8f602b09 [0,1,0,0,0,0|0,0,2]=3 435 B13R0.66 CCCCCNCOC(=O)OCCC 4dd0cdfa02480877d468e904e316e0a7 [0,1,0,0,0,0|1,0,2]=4 436 B13R0.66 CCCCCOCOC(=O)CCCC 3f76bdaee6f01cc5d754e6c5cf40c35d [0,1,0,0,0,0|0,0,2]=3 437 B13R0.66 CCCCCOCOC(=O)OCCC 2b9c07fc63ba8f501ff6f882c30d4e2e [0,1,0,0,0,0|1,0,2]=4 438 B13R0.66 CCCCOCCNC(=O)CCCC af15decb52f44fe761806f4f3842c76a [0,1,0,0,0,0|1,0,2]=4 439 B13R0.66 CCCNC(=O)COCCCOCC 41f2195c6307c6cd3a62fbbdd5471ceb [0,1,0,0,0,0|2,0,1]=4 440 B13R0.66 CCCNC(=O)COCCCSCC 0a00924e7ec3692bcd68affb1691e511 [0,1,0,0,0,0|2,0,1]=4 441 B13R0.66 CCCNC(=O)COCCOCCC 2ebfcbb6600ca6271369d0e45facc650 [0,1,0,0,0,0|2,0,1]=4 442 B13R0.66 CCCNC(=O)COCCSCCC fac428660d7eae358c36177da8860e63 [0,1,0,0,0,0|2,0,1]=4 443 B13R0.66 CCCOC(=O)COCCCOCC d0b0560035f27e3c01dd496291fb2b25 [0,1,0,0,0,0|2,0,1]=4 444 B13R0.66 CCCOC(=O)COCCCSCC 954da4a6f104f3a7e52a22b2f6484837 [0,1,0,0,0,0|2,0,1]=4 445 B13R0.66 CCCOC(=O)COCCSCCC 01b24229302f2b6fb3767b943378e591 [0,1,0,0,0,0|2,0,1]=4 446 B13R0.66 CCCOC(=O)OCNCCOCC 75c0c7f74718e9527e14df81e859b0f0 [0,1,0,0,0,0|2,0,1]=4 447 B13R0.66 CCCOC(=O)OCNCCSCC 94d5365aa33f2c34310e437265a6aabe [0,1,0,0,0,0|2,0,1]=4 448 B13R0.66 CCCOC(=O)OCOC/C=C/C=O 9a6a5cbb01376953b5c1350b96eddde4 [0,1,0,0,0,0|2,0,1]=4 449 B13R0.66 CCCOC(=O)OCOCCOCC 4225d1e022f078e0f7cb63ba0b928397 [0,1,0,0,0,0|2,0,1]=4 450 B13R0.66 CCCOC(=O)OCOCCSCC 7bd70455514ffc71955c621e216e3ce7 [0,1,0,0,0,0|2,0,1]=4 451 B13R0.66 CCCOCCOCC(=O)CCSC b582a954908b556f0d98a0e8d7c1d287 [0,1,0,0,0,0|2,0,1]=4 452 B13R0.66 CCCOCCOCC(=O)OCCC 7ba8198de6093b9c50828d348eca7544 [0,1,0,0,0,0|2,0,1]=4 453 B13R0.66 CCCSCCOCC(=O)CCSC 12283a1af3a1cffe9d14cdc6cc99d1c7 [0,1,0,0,0,0|2,0,1]=4 454 B13R0.66 CCOCCCOCC(=O)CCSC 3fdc8e8851226009e62113ac821f4522 [0,1,0,0,0,0|2,0,1]=4 455 B13R0.66 CCSCCCOCC(=O)CCSC 456d2b875352874b1cdd6a0919e6028b [0,1,0,0,0,0|2,0,1]=4 456 B13R0.113 CCC(=O)NCCNC(=O)CCCF 9c31d88c63bbfdcd9090ae2254dde0b2 [0,1,0,0,0,0|3,0,0]=4 457 B13R0.113 CCC(=O)NCCNC(=O)CCCS eca0d4c8bb289781fc2ed1a2b3ea9472 [0,1,0,0,0,0|3,0,0]=4 458 B13R0.113 CCC(=O)NCCNC(=O)CCOC 30567d49cbf14c47ed27108bd4cc4276 [0,1,0,0,0,0|3,0,0]=4 459 B13R0.113 CCC(=O)NCCNC(=O)CCSC 2b022c19c302b5827cd47a4a3752bd39 [0,1,0,0,0,0|3,0,0]=4 460 B13R0.113 CCCCC(=O)NCCCC(=O)OC 10524d14ef5611c3fda04feef0cb8570 [0,1,0,0,0,0|2,0,1]=4 461 B13R0.113 CCCCC(=O)NCCCN(C)CC 7ee52500f691b9cc8a5bed5fcede3d81 [0,1,0,0,0,0|2,0,1]=4 462 B13R0.113 CCCCC(=O)NCCNC(=O)CC 2fb852cc3930574d479e91445154999e [0,1,0,0,0,0|2,0,0]=3 463 B13R0.113 CCCCC(=O)OCNCC(=O)NC 7eee21f0765c7d49a5455979e6333943 [0,1,0,0,0,0|2,0,1]=4 464 B13R0.113 CCCCC(=O)OCNCC(=O)OC 95a27c9470a225edc0cb59ffe6e7fa60 [0,1,0,0,0,0|2,0,1]=4 465 B13R0.113 CCCCC(=O)OCNCC(C)CC 6a0ccc04f87a227032229d9631a11e21 [0,1,0,0,0,0|1,0,2]=4 466 B13R0.113 CCCCC(=O)OCNCC(O)CC 7f3f9c3030b122a3bb1140405d993633 [0,1,0,0,0,0|1,0,2]=4 467 B13R0.113 CCCCC(=O)OCNC[C@@H](C)CC 72476407fc23c3c692d0e53c12211850 [0,1,0,0,0,0|1,0,2]=4 468 B13R0.113 CCCCC(=O)OCNC[C@H](O)CC 6ce0b681dc7bda0889e9f59e829aaf02 [0,1,0,0,0,0|1,0,2]=4 469 B13R0.113 CCCCC(=O)OCOCC(=O)CC 41a6c9b55779b02227072f5c29127bfd [0,1,0,0,0,0|1,0,1]=3 470 B13R0.113 CCCCC(=O)OCOCC(=O)NC dd35b9fcd6fab1f92d6fe671eb89efe1 [0,1,0,0,0,0|2,0,1]=4 471 B13R0.113 CCCCC(=O)OCOCC(=O)OC acfb5184d9d7639e3216afd062a0d655 [0,1,0,0,0,0|2,0,1]=4 472 B13R0.113 CCCCC(=O)OCOCC(C)CC dbf35db61e9048b37fdf113b437c2e1a [0,1,0,0,0,0|1,0,2]=4 473 B13R0.113 CCCCC(=O)OCOC[C@@H](C)CC 83a7611bb225b6e5b8bae50bd1f3f776 [0,1,0,0,0,0|1,0,2]=4 474 B13R0.113 CCCCC(=O)OCOC[C@H](C)CC 5576c5fb36457827312635eb8c33a39e [0,1,0,0,0,0|1,0,2]=4 475 B13R0.113 CCCCC(C)OCCNC(=O)CC c8185f8b60bd504ca4d5b4755bbadc52 [0,1,0,0,0,0|2,0,1]=4 476 B13R0.113 CCCCC(C)OCCOC(=O)CC 07482311186b8beb0c93c376fa0a1190 [0,1,0,0,0,0|2,0,1]=4 477 B13R0.113 CCCNC(=O)CCCNC(=O)CC 22c40dc44d26526792d67f9fc1744ce6 [0,1,0,0,0,0|3,0,0]=4 478 B13R0.113 CCCNC(=O)NCCNC(=O)CC a806b1fd591cfff48ad4c4268db13d1c [0,1,0,0,0,0|3,0,0]=4 479 B13R0.113 CCCOC(=O)OCOCC(=O)CC c3deccef1f91a2bae66a9311c5a43081 [0,1,0,0,0,0|2,0,1]=4 480 B13R0.113 CCOCC(=O)NCCNC(=O)CC 5d7caf8aa161b535dcfe9f35e60668fb [0,1,0,0,0,0|3,0,0]=4 481 B13R0.113 CCSCC(=O)NCCNC(=O)CC e768fe23aa2a3ce3c5c6c901ab9f7d66 [0,1,0,0,0,0|3,0,0]=4 482 B13R0.119 CCCCC(=O)NCCCOC(C)C cc0bb09402f85da3f40b1b8f4a1b64f2 [0,1,0,0,0,0|2,0,1]=4 483 B13R0.119 CCCCC(=O)NCCCSC(C)C 556a69d11cc575a971ed192f1bb4ca23 [0,1,0,0,0,0|2,0,1]=4 484 B13R0.119 CCCCC(=O)OCNCC=C(C)C bfae69b3d4f59938789b9d1bec1f537d [0,1,0,0,0,0|1,0,2]=4 485 B13R0.119 CCCCC(=O)OCNCCC(C)C a0b7c7562f864aff73f3451504a025f0 [0,1,0,0,0,0|1,0,2]=4 486 B13R0.119 CCCCC(=O)OCNCCC(C)O f97487f791e091b511bfc80fba15fbdb [0,1,0,0,0,0|1,0,2]=4 487 B13R0.119 CCCCC(=O)OCNCC[C@@H](C)O a96d79caf2c1470fe9eec82b5b7213ec [0,1,0,0,0,0|1,0,2]=4 488 B13R0.119 CCCCC(=O)OCNCC[C@H](C)O 9ccf9a03ec36dd85875187f4ca3fdbe7 [0,1,0,0,0,0|1,0,2]=4 489 B13R0.119 CCCCC(=O)OCOC/C=C(/C)\Cl 1857a7a6d7d9543ea486b69cc10cae87 [0,1,0,0,0,0|1,0,2]=4 490 B13R0.119 CCCCC(=O)OCOC/C=C(/C)\I 83db351ca54843be67552778e69ea006 [0,1,0,0,0,0|1,0,2]=4 491 B13R0.119 CCCCC(=O)OCOCC=C(C)C 4aaf2a67d9476d213ad897ce5e90080c [0,1,0,0,0,0|1,0,2]=4 492 B13R0.119 CCCCC(=O)OCOCC=C(C)I 3b432dbb9c14cc7f99d7ecd50b57b83f [0,1,0,0,0,0|1,0,2]=4 493 B13R0.119 CCCCC(=O)OCOCCC(C)C 25893ea2f9eb45162f6282610f17070d [0,1,0,0,0,0|1,0,2]=4 494 B13R0.119 CCCNC(=O)CNC/C=C/C(C)C ff78189189ab2b8b00b79d16ceda09ad [0,1,0,0,0,0|3,0,0]=4 495 B13R0.154 C=C/C=C/CCNC(=O)CCC(C)C f0f9bc9d3ca3e28a4eb3c6a438275fb8 [0,1,0,0,0,0|1,0,2]=4 496 B13R0.154 C=C/C=C/CCNC(=O)CCC(C)O 35b361d705ded9ff76e2bc74e9b59487 [0,1,0,0,0,0|1,0,2]=4 497 B13R0.154 C=C/C=C/CCNC(=O)CCC(C)S 518d5774140cc3f674e26c7e12fc175e [0,1,0,0,0,0|1,0,2]=4 498 B13R0.154 C=C/C=C/CCNC(=O)CC[C@H](C)S 129a290faf42e9443bf257d679573093 [0,1,0,0,0,0|1,0,2]=4 499 B13R0.154 CC/C=C/CCOC(C)CCC(C)C 7c9065f0f45a14b6640121142b3552ff [0,1,0,0,0,0|1,0,1]=3 500 B13R0.154 CC/C=C/COCC(=O)NCC(C)C 4bbbe4826dfd770c100fd27a03a0d527 [0,1,0,0,0,0|3,0,0]=4 501 B13R0.154 CC/C=C\CCNC(C)CCC(C)C 747f3a8f086d336e64228ca2b33faff8 [0,1,0,0,0,0|2,0,1]=4 502 B13R0.154 CC/C=C\CCOC(C)CCC(C)C 248a7aec7235ec7edb143683a41bfaf6 [0,1,0,0,0,0|1,0,1]=3 503 B13R0.154 CC/C=C\CCOC(C)CCN(C)C 577be7f1f169447792456740dc763d47 [0,1,0,0,0,0|2,0,1]=4 504 B13R0.154 CC/C=C\CCOC(C)COC(C)C 1109c6837940278586669f8a4cd29350 [0,1,0,0,0,0|2,0,1]=4 505 B13R0.154 CC/C=C\CCO[C@@H](C)COC(C)C dd75e3d7c9dfa7107d3c4278f7548f80 [0,1,0,0,0,0|2,0,1]=4 506 B13R0.154 CC/C=C\COCC(=O)NCC(C)C 238fc52559bec20b0d88e2bc1e2877bd [0,1,0,0,0,0|3,0,0]=4 507 B13R0.154 CCCCCCNC(=O)CCC(C)C 7f6d618c5aff4af5e3147258c5d62a2b [0,1,0,0,0,0|1,0,2]=4 508 B13R0.154 CCCCCCNC(=O)CCC(C)O 43fea56a6d1b59daba80a7faaa98236f [0,1,0,0,0,0|1,0,2]=4 509 B13R0.154 CCCCCCNC(=O)CCC(C)S 033b15bf7830ebe6370d0768c729357a [0,1,0,0,0,0|1,0,2]=4 510 B13R0.154 CCCCCCNC(=O)CC[C@H](C)S 6e4d08e7e0b05fd203eb77b6cf931e49 [0,1,0,0,0,0|1,0,2]=4 511 B13R0.154 CCCOCCNC(=O)CCC(C)C 75afbec44df5f4868ed0bb53116191ed [0,1,0,0,0,0|2,0,1]=4 512 B13R0.154 CCCOCCNC(=O)CCC(C)O 6730909d74bbb5fdebc909b0cccc7c13 [0,1,0,0,0,0|2,0,1]=4 513 B13R0.154 CCCOCCNC(=O)CCC(C)S 6d9068458bd974cd3e527251814917c5 [0,1,0,0,0,0|2,0,1]=4 514 B13R0.154 CCCOCCNC(=O)CC[C@H](C)S b0baa3d799910ef27f93284fb8d23e02 [0,1,0,0,0,0|2,0,1]=4 515 B13R0.154 CCOCCCNC(=O)CCC(C)C 0c7cdf44cbe562db76a554c63cd13169 [0,1,0,0,0,0|2,0,1]=4 516 B13R0.154 CCOCCCNC(=O)CCC(C)O 23f575848864804f5b30f3dd75dd69cc [0,1,0,0,0,0|2,0,1]=4 517 B13R0.154 CCOCCCNC(=O)CCC(C)S d661929b4add8ceb18524b486ec47bfd [0,1,0,0,0,0|2,0,1]=4 518 B13R0.154 CCOCCCNC(=O)CC[C@H](C)S 683945cc8279b5b3c1f691fdb47b5757 [0,1,0,0,0,0|2,0,1]=4 519 B13R0.175 C/C=C/C(C)OCOC(=O)CCCC d94d661875f9485ee3f03b65f211e678 [0,1,0,0,0,0|1,0,2]=4 520 B13R0.175 CC=CC(C)OCOC(=O)CCCC c861ba1aa164e0f4efe796dd546622b4 [0,1,0,0,0,0|1,0,2]=4 521 B13R0.175 CCCCC(=O)NCCC(=O)OCC 7206b85b4e19e03bf69fa7dc50b98951 [0,1,0,0,0,0|2,0,0]=3 522 B13R0.175 CCCCC(=O)OCNC(C)CCC 13825af48c1bf7f906c7cdd14c523b9d [0,1,0,0,0,0|1,0,2]=4 523 B13R0.175 CCCCC(=O)OCN[C@@H](C)CCC 5b1c1d21271472aab5d432b5d0790a48 [0,1,0,0,0,0|1,0,2]=4 524 B13R0.175 CCCCC(=O)OCOC(=S)CCC 86fcf33a14adbf81018ff2333c63bfc2 [0,1,0,0,0,0|1,0,1]=3 525 B13R0.175 CCCCC(=O)OCOC(C)CCC 9a06daa09398421d6a242a0dff7b0248 [0,1,0,0,0,0|1,0,2]=4 526 B13R0.175 CCCCC(=O)OCO[C@@H](C)CCC b5b6a5a3ce9300ae9652e851bb75369b [0,1,0,0,0,0|1,0,2]=4 527 B13R0.175 CCCCC(=O)OCO[C@H](C)CCC 9ce752bc87e7183e934728b96452c112 [0,1,0,0,0,0|1,0,2]=4 528 B13R0.175 CCCCC(C)OCCC(=O)NCC b7450fe55bdee880ab4d653dd40d544f [0,1,0,0,0,0|2,0,1]=4 529 B13R0.175 CCCCC(C)OCCC(=O)OCC 2867cb74ef09bee4afe3bbedf699a94b [0,1,0,0,0,0|2,0,1]=4 530 B13R0.175 CCCC[C@@H](C)OCCC(=O)NCC 8d1a6b10e844a9a5824f823e36eafc14 [0,1,0,0,0,0|2,0,1]=4 531 B13R0.175 CCCC[C@@H](C)OCCC(=O)OCC 94babc9227cd4dc5a0283fcb756a98b7 [0,1,0,0,0,0|2,0,1]=4 532 B13R0.175 CCCC[C@H](C)OCCC(=O)NCC 40589988f97beaf73c01b782d2c6c51e [0,1,0,0,0,0|2,0,1]=4 533 B13R0.175 CCCC[C@H](C)OCCC(=O)OCC ebeaadc6ad694501f67311e82928a6e0 [0,1,0,0,0,0|2,0,1]=4 534 B13R0.175 CCCNC(=O)CCCC(=O)CCC 2349949e0e25bade89806744e9f9262e [0,1,0,0,0,0|2,0,1]=4 535 B13R0.175 CCCNC(=O)CCCC(=O)NCC 45c894abbb5cd98af9583b2513c90cb9 [0,1,0,0,0,0|3,0,0]=4 536 B13R0.175 CCCNC(=O)CCCC(=O)OCC 20d32ebebcf98543e677445305591972 [0,1,0,0,0,0|3,0,0]=4 537 B13R0.175 CCCNC(=O)NCCC(=O)OCC 85dbfa15a5d7478654426fa6e5159ec9 [0,1,0,0,0,0|3,0,0]=4 538 B13R0.175 CCCOC(=O)OCOC(=S)CCC f53219768f24a8239fb9e1d0d7b18ac6 [0,1,0,0,0,0|2,0,1]=4 539 B13R0.175 CCOC(=O)CCNC(=O)CCCF 3a8da3efa58547d324d334adc083f90b [0,1,0,0,0,0|3,0,0]=4 540 B13R0.175 CCOC(=O)CCNC(=O)CCCS e273c4b92bbe06a401f1eb3b16dd1fde [0,1,0,0,0,0|3,0,0]=4 541 B13R0.175 CCOC(=O)CCNC(=O)CCOC 611e7a0cd7bbf142975e8c4254544a1e [0,1,0,0,0,0|3,0,0]=4 542 B13R0.175 CCOC(=O)CCNC(=O)CCSC e2801a2baad801097aeca4c525bffa97 [0,1,0,0,0,0|3,0,0]=4 543 B13R0.175 CCOC(=O)CCNC(=O)CSCC 5ab40b5e3b1f04fcecf48d472cef1884 [0,1,0,0,0,0|3,0,0]=4 544 B13R0.175 CCOCC(=O)NCCC(=O)OCC 1048a8d88dc2725fb234f0f9c3e60451 [0,1,0,0,0,0|3,0,0]=4 545 B13R0.176 CCCCC(=O)NCC(O)CCCC 56e8bf4d7e697993760e45505094912d [0,1,0,0,0,0|1,0,2]=4 546 B13R0.176 CCCCC(=O)NCC(O)COCC 0fa81bf0bf2ec4b796c3339471cdb3fb [0,1,0,0,0,0|2,0,1]=4 547 B13R0.176 CCCCC(=O)OCN(C)CCCC 8a987e2bfef31244e58c323d3c6fb9d0 [0,1,0,0,0,0|1,0,2]=4 548 B13R0.195 CC/C=C/CN(C)CC(=O)NCCC 077e02530d1a2eb2b867c5c4171cbef9 [0,1,0,0,0,0|3,0,0]=4 549 B13R0.195 CCCCCC(C)NC(=O)CCCC f038515c42e43f4329928e13d9a6a732 [0,1,0,0,0,0|1,0,2]=4 550 B13R0.195 CCCCC[C@H](C)NC(=O)CCCC d8bd7cd44de2c5c3870e5b55de48793c [0,1,0,0,0,0|1,0,2]=4 551 B13R0.272 C#CC(CCCC)OCC/C=C\CC 9ca336b539981ce5fa7c586e98781a25 [0,1,0,0,0,0|1,0,1]=3 552 B13R0.272 C=CC(CCCC)OCC/C=C\CC b1ff7aff6247ed5f6844244c201c0043 [0,1,0,0,0,0|1,0,1]=3 553 B13R0.272 CC/C=C/CCOC(CC)CCCC 57afa02ae6be7b8ff124746d3a43cfb8 [0,1,0,0,0,0|1,0,1]=3 554 B13R0.272 CC/C=C\CCNC(CO)CCCC 3c0b82b8431cd59f93f0eb6a67d28e95 [0,1,0,0,0,0|1,0,2]=4 555 B13R0.272 CC/C=C\CCN[C@@H](CO)CCCC 6eec2432c84591a3f406f778f96f5c93 [0,1,0,0,0,0|1,0,2]=4 556 B13R0.272 CC/C=C\CCN[C@H](CO)CCCC 3e9eaa66ed1bf02c4bea0ca432c01867 [0,1,0,0,0,0|1,0,2]=4 557 B13R0.272 CC/C=C\CCOC(CC)CCCC 83188b7450efaf240fdf2921acfc0073 [0,1,0,0,0,0|1,0,1]=3 558 B13R0.274 C=C/C=C/CCNC(=O)CC(C)CC 0a802d7a4d5ece64528d7bd4e480acc4 [0,1,0,0,0,0|1,0,2]=4 559 B13R0.274 C=C/C=C/CCNC(=O)CC(O)CC 4918a8130a70304d1c4b712374812d5d [0,1,0,0,0,0|1,0,2]=4 560 B13R0.274 C=C/C=C/CCNC(=O)C[C@@H](C)CC e8ebc15b561eed29e9549cf344b629fa [0,1,0,0,0,0|1,0,2]=4 561 B13R0.274 C=C/C=C/CCNC(=O)C[C@@H](O)CC 02b479ac4feb2ced5018c91a7edb5c39 [0,1,0,0,0,0|1,0,2]=4 562 B13R0.274 C=C/C=C/CCNC(=O)C[C@H](C)CC 5cd5f679d6c9939e7571a04a47e9ea60 [0,1,0,0,0,0|1,0,2]=4 563 B13R0.274 C=C/C=C/CCNC(=O)C[C@H](O)CC 0721f857721a5130a33ac7c64dbab0f5 [0,1,0,0,0,0|1,0,2]=4 564 B13R0.274 CC/C=C/COCC(=O)NC(C)CC a172ffc65f4328afa728a07261be3a47 [0,1,0,0,0,0|3,0,0]=4 565 B13R0.274 CC/C=C\CCNC(C)CC(C)CC 899213e42e58f4b9395095b1e55c544b [0,1,0,0,0,0|2,0,1]=4 566 B13R0.274 CC/C=C\CCO/C(=C/C(=O)CC)/C 59ff531e18a4d7823d9ab4373c6fee6e [0,1,0,0,0,0|1,0,2]=4 567 B13R0.274 CC/C=C\CCOC(C)CC(C)OC d695c2d9ff98c0fbb3cc25b7adc232fe [0,1,0,0,0,0|2,0,1]=4 568 B13R0.274 CC/C=C\COCC(=O)NC(C)CC 66235a360e5f263c8cf6f3083c9be03a [0,1,0,0,0,0|3,0,0]=4 569 B13R0.274 CCCCCCNC(=O)CC(C)CC 64d69a6d9a9b964ece0129fbca78b5d7 [0,1,0,0,0,0|1,0,2]=4 570 B13R0.274 CCCCCCNC(=O)CC(O)CC cb2115466282998f057b73bf82c8dffb [0,1,0,0,0,0|1,0,2]=4 571 B13R0.274 CCCCCCNC(=O)C[C@@H](C)CC 435b063d82ce93955958d5ba0cc54495 [0,1,0,0,0,0|1,0,2]=4 572 B13R0.274 CCCCCCNC(=O)C[C@@H](O)CC 8616f6d786b7010b17fb94c940b6854e [0,1,0,0,0,0|1,0,2]=4 573 B13R0.274 CCCCCCNC(=O)C[C@H](C)CC a0d31460756b83697d59611440bd7931 [0,1,0,0,0,0|1,0,2]=4 574 B13R0.274 CCCCCCNC(=O)C[C@H](O)CC 3bce6c42f7cd25a1b188dc70d5e2c7e8 [0,1,0,0,0,0|1,0,2]=4 575 B13R0.274 CCCOCCNC(=O)CC(C)CC 6f9580128115ce40026ec41fcb009cc6 [0,1,0,0,0,0|2,0,1]=4 576 B13R0.274 CCCOCCNC(=O)CC(O)CC 9d672c48732e2a4aa29f489a46a98aec [0,1,0,0,0,0|2,0,1]=4 577 B13R0.274 CCCOCCNC(=O)C[C@@H](C)CC 2a4bbf765f79b13a5b048a842e6bea0d [0,1,0,0,0,0|2,0,1]=4 578 B13R0.274 CCCOCCNC(=O)C[C@@H](O)CC 7bf9739e0432087729625b5e337f8a8c [0,1,0,0,0,0|2,0,1]=4 579 B13R0.274 CCCOCCNC(=O)C[C@H](C)CC 6bb2c12bc85c213cf901ae09d749a400 [0,1,0,0,0,0|2,0,1]=4 580 B13R0.274 CCCOCCNC(=O)C[C@H](O)CC 11c7199d5b980b1447359821367332c0 [0,1,0,0,0,0|2,0,1]=4 581 B13R0.274 CCOCCCNC(=O)CC(C)CC 6d50cde2aae937db495967d9901fc35c [0,1,0,0,0,0|2,0,1]=4 582 B13R0.274 CCOCCCNC(=O)CC(O)CC 452e39f112c5bfdbf83a969d694221ef [0,1,0,0,0,0|2,0,1]=4 583 B13R0.274 CCOCCCNC(=O)C[C@@H](C)CC 7433c0228ef826f615d0b67602922a4f [0,1,0,0,0,0|2,0,1]=4 584 B13R0.274 CCOCCCNC(=O)C[C@@H](O)CC 909ac58c4639874cf1e3ea0379d9c823 [0,1,0,0,0,0|2,0,1]=4 585 B13R0.274 CCOCCCNC(=O)C[C@H](C)CC df7ca1f60c473e95640c3aab22ecbf65 [0,1,0,0,0,0|2,0,1]=4 586 B13R0.274 CCOCCCNC(=O)C[C@H](O)CC 67d377d2ee0d0bcc37b15d2c4136c610 [0,1,0,0,0,0|2,0,1]=4 587 B13R0.275 C=C/C=C/CCNC(=O)C(O)CCC 14896732ab400d3ec0b418d1d0d5d3b4 [0,1,0,0,0,0|1,0,2]=4 588 B13R0.275 C=C/C=C/CCNC(=O)[C@@H](O)CCC 053638b265a6f054a2524172b0e65c95 [0,1,0,0,0,0|1,0,2]=4 589 B13R0.275 C=C/C=C/CCNC(=O)[C@H](O)CCC ce6de0284fa0e4415ae26e3917438891 [0,1,0,0,0,0|1,0,2]=4 590 B13R0.275 CC/C=C/CCOC(=O)C(C)OCC 7263f07c83ca3f60cf5fbd56d67d9e1c [0,1,0,0,0,0|1,0,0]=2 591 B13R0.275 CC/C=C/CCOC(=O)C(C)OCF 4af7123442fce881b23bfe1bc318845f [0,1,0,0,0,0|2,0,0]=3 592 B13R0.275 CC/C=C\CCOC(=O)C(C)OCC 100f433891a73fa9479a97609d211df6 [0,1,0,0,0,0|1,0,0]=2 593 B13R0.275 CC/C=C\CCOC(=O)C(C)OCF 4db27746878949a30f6567a99675824c [0,1,0,0,0,0|2,0,0]=3 594 B13R0.275 CCC=CCCOC(=O)C(C)OCC e31b25270fbd379359eb0beec463d80c [0,1,0,0,0,0|1,0,0]=2 595 B13R0.275 CCC=CCCOC(=O)C(C)OCF b4655968ad8fadbdbb31389222bbda27 [0,1,0,0,0,0|2,0,0]=3 596 B13R0.275 CCCC(O)C(=O)NCCCOCC 7c3c9f3ef2d1e71d9e4a78a097feab55 [0,1,0,0,0,0|2,0,1]=4 597 B13R0.275 CCCCCCNC(=O)C(O)CCC 63d90f243924b800f8a0f0bd7626a9e2 [0,1,0,0,0,0|1,0,2]=4 598 B13R0.275 CCCCCCNC(=O)[C@@H](O)CCC 68cb61a9152ea765aae1773a057b57bd [0,1,0,0,0,0|1,0,2]=4 599 B13R0.275 CCCCCCNC(=O)[C@H](O)CCC 069b3d21fe51164275e2a74e58997239 [0,1,0,0,0,0|1,0,2]=4 600 B13R0.275 CCCOCCNC(=O)C(O)CCC 2fd2e537d331144747894bafc88f46b3 [0,1,0,0,0,0|2,0,1]=4 601 B13R0.275 CCCOCCNC(=O)[C@@H](O)CCC 193558b8fddacfbbdab11fd09a3e2654 [0,1,0,0,0,0|2,0,1]=4 602 B13R0.275 CCCOCCNC(=O)[C@H](O)CCC 4716253b0d32a60ae12ccdd34b8fd937 [0,1,0,0,0,0|2,0,1]=4 603 B13R0.275 CCC[C@@H](O)C(=O)NCCCOCC 7ec08f27048fdef3456af4444932dfe8 [0,1,0,0,0,0|2,0,1]=4 604 B13R0.275 CCC[C@H](O)C(=O)NCCCOCC 6291b4c5bdb5c7c4bc5b1eaf672cf30f [0,1,0,0,0,0|2,0,1]=4 605 B13R0.338 C/C=C/COCOC(=O)CCCCC 79fcaee5d216a44a4417bb6afbb0bfaf [0,1,0,0,0,0|1,0,2]=4 606 B13R0.338 C/C=C/COCOC(=O)OCCCC 4994314428ac6e3a7ecd77d00ef05622 [0,1,0,0,0,0|1,0,2]=4 607 B13R0.338 C/C=C\COCOC(=O)CCCCC 91979ea950a9cf53764a1dd55ca0837d [0,1,0,0,0,0|1,0,2]=4 608 B13R0.338 C/C=C\COCOC(=O)OCCCC b9ccc97814f9b4aa847aee8f5ac7c57d [0,1,0,0,0,0|1,0,2]=4 609 B13R0.338 C=C/C=C/CCNC(=O)CCCCC fafd6a2ed3c5e1867530d6babe61ce55 [0,1,0,0,0,0|1,0,2]=4 610 B13R0.338 C=C/C=C/CCNC(=O)CCCCF 4a2a5e48ab6814d79bc64310dbafdba7 [0,1,0,0,0,0|1,0,2]=4 611 B13R0.338 C=C/C=C/CCNC(=O)CCCCO b903ee04bde272b3d9c8365f559e9259 [0,1,0,0,0,0|1,0,2]=4 612 B13R0.338 C=C/C=C/CCNC(=O)CCCCS 4c411c012cce19928fe68fa7fb49e833 [0,1,0,0,0,0|1,0,2]=4 613 B13R0.338 C=C/C=C/CCNC(=O)CCCOC 95e0ab88518d08d786949da31c3be33f [0,1,0,0,0,0|1,0,2]=4 614 B13R0.338 C=C/C=C/CCNC(=O)CCCSC 26abe695e3fa2bfcce11db7478d2dd7a [0,1,0,0,0,0|1,0,2]=4 615 B13R0.338 C=C/C=C/CCNC(=O)CCOCC 97a5e40dea043f30d3da8cbb6425a564 [0,1,0,0,0,0|1,0,2]=4 616 B13R0.338 C=C/C=C/CCNC(=O)CCSCC abcd9f17abac32b6b1e50cc318389a20 [0,1,0,0,0,0|1,0,2]=4 617 B13R0.338 C=C/C=C/CCNC(=O)COCCC 43dddec2b64db09dd98f2478727d315a [0,1,0,0,0,0|1,0,2]=4 618 B13R0.338 C=C/C=C/CCNC(=O)CSCCC 6a460456e35721915805fa4096c2f153 [0,1,0,0,0,0|1,0,2]=4 619 B13R0.338 C=C/C=C/CCNC(=O)NCCCC 2e59248c2519cd355644bbe8337a15b1 [0,1,0,0,0,0|1,0,2]=4 620 B13R0.338 C=CCCC[C@H](C)OCC/C=C\CC aca93cc150ecce5654fc2ee6bda5180c [0,1,0,0,0,0|1,0,2]=4 621 B13R0.338 CC/C=C/CCOC(C)CCCCC 1259b20c027c8ce10f28081731e65e30 [0,1,0,0,0,0|1,0,1]=3 622 B13R0.338 CC/C=C/CCO[C@@H](C)CCCCC 307ff3551427530ffdc3fe714cbe0dbc [0,1,0,0,0,0|1,0,1]=3 623 B13R0.338 CC/C=C/CNCC(=O)NCCCC c9e16211efb7bbfb7b6a37c59767bbc5 [0,1,0,0,0,0|2,0,0]=3 624 B13R0.338 CC/C=C/COCC(=O)CCCCC 13e110c1f0393c1279e72774b74814d2 [0,1,0,0,0,0|2,0,0]=3 625 B13R0.338 CC/C=C/COCC(=O)NCCCC 6d19213e15749b456d9f7d5af9691cfa [0,1,0,0,0,0|2,0,0]=3 626 B13R0.338 CC/C=C/COCC(=O)NCCOC 78c6d9c151c7bc86e36fe564b811f3ea [0,1,0,0,0,0|3,0,0]=4 627 B13R0.338 CC/C=C/COCC(=O)OCCCC d02a5ec73097a07f61ed826a87847b2f [0,1,0,0,0,0|2,0,0]=3 628 B13R0.338 CC/C=C/COCC(=O)OCCOC 2db35c196b2d39d10a16e99b0ece7681 [0,1,0,0,0,0|3,0,0]=4 629 B13R0.338 CC/C=C\CCNC(C)CCCCC a0402c91bd538f60677efd5abcaf056c [0,1,0,0,0,0|2,0,1]=4 630 B13R0.338 CC/C=C\CCN[C@@H](C)CCCCC 3a996b13205156ea678c7fdce6146af3 [0,1,0,0,0,0|2,0,1]=4 631 B13R0.338 CC/C=C\CCOC(C)CCCCC d3c7cde3ee37939c42a3769e8b04d69a [0,1,0,0,0,0|1,0,1]=3 632 B13R0.338 CC/C=C\CCOC(C)COCCC 935578fbe61bd23fcf8231659bb4772c [0,1,0,0,0,0|1,0,1]=3 633 B13R0.338 CC/C=C\CCO[C@@H](C)CCCCC 496f7e9d29b684a4b9469a5244e703e5 [0,1,0,0,0,0|1,0,1]=3 634 B13R0.338 CC/C=C\CCO[C@H](C)CCCCC be92706479168a156b716b8a6a98d7ef [0,1,0,0,0,0|1,0,1]=3 635 B13R0.338 CC/C=C\COCC(=O)CCCCC 46dd05ae10da4916705268cdee357b3e [0,1,0,0,0,0|2,0,0]=3 636 B13R0.338 CC/C=C\COCC(=O)NCCCC 24376e34c662a3ea9361ac0751e4b893 [0,1,0,0,0,0|2,0,0]=3 637 B13R0.338 CC/C=C\COCC(=O)NCCOC 94f195755f38b3285fcd602099341e05 [0,1,0,0,0,0|3,0,0]=4 638 B13R0.338 CC/C=C\COCC(=O)OCCCC 7f975803c596361cc214875bc95c1b43 [0,1,0,0,0,0|2,0,0]=3 639 B13R0.338 CC/C=C\COCC(=O)OCCOC 7d8efe04385cc9e1af74df953252fefb [0,1,0,0,0,0|3,0,0]=4 640 B13R0.338 CC=CCNCOC(=O)CCCCC 9c521da97e50049d30a6f1e122225640 [0,1,0,0,0,0|1,0,2]=4 641 B13R0.338 CC=CCNCOC(=O)OCCCC 7ad5402458dce4e1c430d7b7819d153b [0,1,0,0,0,0|1,0,2]=4 642 B13R0.338 CC=CCOCOC(=O)CCCCC b984c23181530eb3e5fa3c9784ee121c [0,1,0,0,0,0|1,0,2]=4 643 B13R0.338 CC=CCOCOC(=O)OCCCC a1d2e11fbfa290a18d6bedbad607c8b2 [0,1,0,0,0,0|1,0,2]=4 644 B13R0.338 CCC#CCC(C)OCC/C=C\CC 5c9f438b637812a326a123ecb1858c6a [0,1,0,0,0,0|1,0,2]=4 645 B13R0.338 CCC/C=C/CCC(=O)NCCCC 38e7a8ed104804158be9776c53cae6d0 [0,1,0,0,0,0|1,0,2]=4 646 B13R0.338 CCC/C=C\CCC(=O)NCCCC 3f029d1265bdd9f2c094c6b3d90ac3e9 [0,1,0,0,0,0|1,0,2]=4 647 B13R0.338 CCCCCC(=O)NCCCOCC f83be71da758af670df0d92c901f40a5 [0,1,0,0,0,0|2,0,1]=4 648 B13R0.338 CCCCCC(=O)NCCOCCC ff91a97b0fb0710b5e99d0d5dde99b25 [0,1,0,0,0,0|2,0,1]=4 649 B13R0.338 CCCCCC(=O)OCNCCCC 01a15f07e9f5b2a28de48b53b2fb369c [0,1,0,0,0,0|1,0,2]=4 650 B13R0.338 CCCCCC(=O)OCOCCCC 1edc14327cfa0c460ca900180909fe7c [0,1,0,0,0,0|1,0,2]=4 651 B13R0.338 CCCCCCCC(=O)NCCCC 73b4d428c178dea5bab8a2815c525daa [0,1,0,0,0,0|1,0,2]=4 652 B13R0.338 CCCCCCNC(=O)CCCCC 5fa03ed2f9632de5f1af4ca71b39bf4e [0,1,0,0,0,0|1,0,2]=4 653 B13R0.338 CCCCCCNC(=O)CCCCF b4d78d83dfb4798a1d3a6f9f073891f7 [0,1,0,0,0,0|1,0,2]=4 654 B13R0.338 CCCCCCNC(=O)CCCCO a45c2cbde590c7e808f3ad9b26d70eee [0,1,0,0,0,0|1,0,2]=4 655 B13R0.338 CCCCCCNC(=O)CCCCS 701dbc8a2f64be7aad9881b30a62c45f [0,1,0,0,0,0|1,0,2]=4 656 B13R0.338 CCCCCCNC(=O)CCCOC 75d5cc27f18348cfb2e3b85208dbc407 [0,1,0,0,0,0|1,0,2]=4 657 B13R0.338 CCCCCCNC(=O)CCCSC f382bc6e782c48b87d78d08ed45b3a5e [0,1,0,0,0,0|1,0,2]=4 658 B13R0.338 CCCCCCNC(=O)CCOCC c3d7e28fba3f18b045930ae098df194d [0,1,0,0,0,0|1,0,2]=4 659 B13R0.338 CCCCCCNC(=O)CCSCC be999e9d86652f26961f8fd81c6e33c0 [0,1,0,0,0,0|1,0,2]=4 660 B13R0.338 CCCCCCNC(=O)CNCCC de4c36650e96a7f511a3ced778d7020f [0,1,0,0,0,0|1,0,2]=4 661 B13R0.338 CCCCCCNC(=O)COCCC 40f273b76938fb28213e95d5f36dd623 [0,1,0,0,0,0|1,0,2]=4 662 B13R0.338 CCCCCCNC(=O)CSCCC bf5ebe807cf2464e07f16bb438086e97 [0,1,0,0,0,0|1,0,2]=4 663 B13R0.338 CCCCCCNC(=O)NCCCC 4ee07715c2490e40ba2f983b3b32b966 [0,1,0,0,0,0|1,0,2]=4 664 B13R0.338 CCCCNC(=O)CCCCOCC 0f7fe9c45c72b8494f6077d2f3a304c0 [0,1,0,0,0,0|2,0,1]=4 665 B13R0.338 CCCCNC(=O)NCCCOCC 0610da2cd8b540c5ab20986ab3240df3 [0,1,0,0,0,0|2,0,1]=4 666 B13R0.338 CCCCNC(=O)NCCOCCC 15e068bb6b2953d05fdbf818e9cb9223 [0,1,0,0,0,0|2,0,1]=4 667 B13R0.338 CCCCNCOC(=O)OCCCC 9d4aa96ffaeed01d2b9fb928750ef3a5 [0,1,0,0,0,0|1,0,2]=4 668 B13R0.338 CCCCOC(=O)CCCOCCC d1147301aadcbcd5d14c8ed41ec5d67d [0,1,0,0,0,0|2,0,1]=4 669 B13R0.338 CCCCOCOC(=O)OCCCC 5fbb89b47413239df4a656baa1948745 [0,1,0,0,0,0|1,0,2]=4 670 B13R0.338 CCCOCC(=O)NCCCOCC 46e856849a80330a91b8cff6698b4212 [0,1,0,0,0,0|2,0,1]=4 671 B13R0.338 CCCOCCNC(=O)CCCCF e01194a26499fe3493d73805d66ee8eb [0,1,0,0,0,0|2,0,1]=4 672 B13R0.338 CCCOCCNC(=O)CCCCO c078f260e803bfa1c44886c88af9e28f [0,1,0,0,0,0|2,0,1]=4 673 B13R0.338 CCCOCCNC(=O)CCCCS 76a695bd33f69452b739f2a24f584c9a [0,1,0,0,0,0|2,0,1]=4 674 B13R0.338 CCCOCCNC(=O)CCCOC 306a860a2314c9480c1d5f16134a26fd [0,1,0,0,0,0|2,0,1]=4 675 B13R0.338 CCCOCCNC(=O)CCCSC 8bae629514f5c7d2ac3175a9ec55abf7 [0,1,0,0,0,0|2,0,1]=4 676 B13R0.338 CCCOCCNC(=O)CCOCC 8dba4e2ed5fcf1dae77a35dc14191eea [0,1,0,0,0,0|2,0,1]=4 677 B13R0.338 CCCOCCNC(=O)CCSCC 98ea8fdacc74d4b5544e3b51e0142c58 [0,1,0,0,0,0|2,0,1]=4 678 B13R0.338 CCCOCCNC(=O)COCCC 1989bc03d47445b35114ff997269fc7e [0,1,0,0,0,0|2,0,1]=4 679 B13R0.338 CCCOCCNC(=O)CSCCC 25825fa8c247595685cb3dfc3cc32bb9 [0,1,0,0,0,0|2,0,1]=4 680 B13R0.338 CCCSCC(=O)NCCCOCC ff9c61a3a8d54287f6b84c208413bc55 [0,1,0,0,0,0|2,0,1]=4 681 B13R0.338 CCOCCCNC(=O)CCCCF 47e2968944b81ce47e69651b95a42ffb [0,1,0,0,0,0|2,0,1]=4 682 B13R0.338 CCOCCCNC(=O)CCCCO b22e0a4f42ccf474af67aa07ad7538f4 [0,1,0,0,0,0|2,0,1]=4 683 B13R0.338 CCOCCCNC(=O)CCCCS 787e7598b42fc6f0736d32e6d1ef14ed [0,1,0,0,0,0|2,0,1]=4 684 B13R0.338 CCOCCCNC(=O)CCCOC 4ed4b505a066477f422c14d56165e4b2 [0,1,0,0,0,0|2,0,1]=4 685 B13R0.338 CCOCCCNC(=O)CCCSC 28d8a7b059ed39a74bae9b0c655511a4 [0,1,0,0,0,0|2,0,1]=4 686 B13R0.338 CCOCCCNC(=O)CCOCC a0dceef2e51b09d9993b694e9c910d89 [0,1,0,0,0,0|2,0,1]=4 687 B13R0.338 CCOCCCNC(=O)CCSCC e1d2608ff7509daa96543b7e29ec52f2 [0,1,0,0,0,0|2,0,1]=4 688 B13R0.1171 CC/C=C/CNC(C)C(=O)NCCC 351546b7c631751d9c864c7223ef47bb [0,1,0,0,0,0|3,0,0]=4 689 B13R0.1171 CC/C=C/CNC(C)C(=O)OCCC 078c031bb1cad8ad383dd0ec1c4e7864 [0,1,0,0,0,0|3,0,0]=4 690 B13R0.1171 CC/C=C/CN[C@@H](C)C(=O)OCCC 7d323d3e9256dd18cf71ab39154d89f3 [0,1,0,0,0,0|3,0,0]=4 691 B13R0.1171 CC/C=C/COC(C)C(=O)NCCC dc4144058239889c1abad2bd904025e5 [0,1,0,0,0,0|3,0,0]=4 692 B13R0.1171 CC/C=C/COC(C)C(=O)OCCC d444c54f6f2aeb68d6860cc6f9c75f47 [0,1,0,0,0,0|3,0,0]=4 693 B13R0.1171 CC/C=C/CO[C@@H](C)C(=O)OCCC 842cb9bf4438ada6a89c8842df92c624 [0,1,0,0,0,0|3,0,0]=4 694 B13R0.1171 CC/C=C\COC(C)C(=O)NCCC f17085e001c47e853613c6502ae1c2bb [0,1,0,0,0,0|3,0,0]=4 695 B13R0.1171 CC/C=C\COC(C)C(=O)OCCC 95f9bdd97224db9fe6322ee83a2cce5d [0,1,0,0,0,0|3,0,0]=4 696 B13R0.1171 CCCCCCN(C)C(=O)CCCC ef67561b3ef0d5826dda73bda6d41cce [0,1,0,0,0,0|1,0,2]=4 697 B13R1.27 CC/C=C/CCOC1CCN(C1)C 7ee6b257aa8e33b2716c8b5d05697558 [0,0,0,1,0,0|2,0,1]=4 698 B13R1.27 CC/C=C/CCOC1COC(C1)C b4f80f563583071cf06add67e92b5c0f [0,0,0,1,0,0|2,0,1]=4 699 B13R1.27 CC/C=C/CCO[C@@H]1CCN(C1)C a4aed17f5babab48277584d3e180ee73 [0,0,0,1,0,0|2,0,1]=4 700 B13R1.27 CC/C=C/CCO[C@H]1CCN(C1)C 46b0252d701eb1de89cf8a68aa5f939d [0,0,0,1,0,0|2,0,1]=4 701 B13R1.27 CC/C=C\CCNC1CCC(C1)C b6897d19957892fa09e9941692419506 [0,0,0,1,0,0|2,0,1]=4 702 B13R1.27 CC/C=C\CCOC1=CC(=O)CC1 be4a5d4b951305ef144686facb6410e2 [0,0,0,1,0,0|2,0,1]=4 703 B13R1.27 CC/C=C\CCOC1CCC(C1)C d553909a12424bcf41914b4b58b17cfa [0,0,0,1,0,0|1,0,1]=3 704 B13R1.27 CC/C=C\CCOC1CCC(C1)F 480c6e2f3ed7f3225be9b62016660ecd [0,0,0,1,0,0|2,0,1]=4 705 B13R1.27 CC/C=C\CCOC1CCN(C1)C fba0a7e536c2587eb80f4dd90ccd86b9 [0,0,0,1,0,0|2,0,1]=4 706 B13R1.27 CC/C=C\CCOC1COC(C1)C a55e40700bf8ce5d83b6fa17bb850344 [0,0,0,1,0,0|2,0,1]=4 707 B13R1.27 CC/C=C\CCO[C@@H]1CCN(C1)C 30976afae917dbb822934e3624819542 [0,0,0,1,0,0|2,0,1]=4 708 B13R1.27 CC/C=C\CCO[C@H]1CCN(C1)C 1ba7080c36261e785706799dc8523c12 [0,0,0,1,0,0|2,0,1]=4 709 B13R1.28 CC/C=C/CCOC1C=CCCC1 abaf18c0e304349d409bb178f20442b2 [0,0,0,1,0,0|1,0,2]=4 710 B13R1.28 CC/C=C/CCOC1CCCCC1 9ca622c45283076ac83fd0d2dfe9b2dd [0,0,0,1,0,0|1,0,1]=3 711 B13R1.28 CC/C=C/CCOC1CCCCO1 0e848e76743fb3be9d3a37dab34a4b2e [0,0,0,1,0,0|0,0,2]=3 712 B13R1.28 CC/C=C/CCOC1CCCOC1 1fcab7c42c780871352fb28f85ac1f8a [0,0,0,1,0,0|2,0,1]=4 713 B13R1.28 CC/C=C/CCOC1CCOCC1 0518ab7832732d580f6cac7e6b716f08 [0,0,0,1,0,0|2,0,1]=4 714 B13R1.28 CC/C=C/CCOC1CCSCC1 9577d000fcd7605a9f2befea57bc1a18 [0,0,0,1,0,0|2,0,1]=4 715 B13R1.28 CC/C=C/CNCC1=CCCCC1 8d159e16d0ce317d2c124140f5a7f854 [0,0,0,1,0,0|3,0,0]=4 716 B13R1.28 CC/C=C/COCC1=CCCCC1 bd3af88c505a266802cda99dadb1acca [0,0,0,1,0,0|3,0,0]=4 717 B13R1.28 CC/C=C\CCOC1C=CCCC1 d8e0e38b7cd6353ca3bb570ce27b8545 [0,0,0,1,0,0|1,0,2]=4 718 B13R1.28 CC/C=C\CCOC1CCCCC1 1d54da448c1d69c18b60ff08d119517d [0,0,0,1,0,0|1,0,1]=3 719 B13R1.28 CC/C=C\CCOC1CCCCO1 cf6b4f2157e5b8b0c96521bf05251e98 [0,0,0,1,0,0|0,0,2]=3 720 B13R1.28 CC/C=C\CCOC1CCCOC1 d0075f04ed3a7677f879625296b3d1d3 [0,0,0,1,0,0|2,0,1]=4 721 B13R1.28 CC/C=C\CCOC1CCCSC1 44affacaf556dd6e835c272c27b28428 [0,0,0,1,0,0|2,0,1]=4 722 B13R1.28 CC/C=C\CCOC1CCOCC1 f0f4c9e3719627bc8d5055f635517068 [0,0,0,1,0,0|2,0,1]=4 723 B13R1.28 CC/C=C\CCOC1CCSCC1 a08b69b286a11227b3087a4badeaaee4 [0,0,0,1,0,0|2,0,1]=4 724 B13R1.28 CC/C=C\CCO[C@@H]1CCCOC1 39bcaa9f037b229ed3c0826d70831af7 [0,0,0,1,0,0|2,0,1]=4 725 B13R1.28 CC/C=C\CCO[C@H]1CCCOC1 a4e501cb034d6474b5a6f39823e52c37 [0,0,0,1,0,0|2,0,1]=4 726 B13R1.28 CC/C=C\COCC1=CCCCC1 cc501c7f0ff4e32dd437455c6cec44c8 [0,0,0,1,0,0|3,0,0]=4 727 B13R1.44 CCCCC(=O)NC1C=CCCC1 5364374328918d1d9fcc4965932f6acc [0,0,0,1,0,0|1,0,2]=4 728 B13R1.44 CCCCC(=O)NC1CCCOC1 99f08b6ee5f8e41579b3bed011f8ef2e [0,0,0,1,0,0|2,0,1]=4 729 B13R1.44 CCCCC(=O)NC1CCOCC1 7281afc20af41cd0832d691a52d57dfe [0,0,0,1,0,0|2,0,1]=4 730 B13R1.44 CCCCC(=O)NC1CCSCC1 6258fc827cb27fb282e69d28b8a5de99 [0,0,0,1,0,0|2,0,1]=4 731 B13R1.44 CCCCC(=O)N[C@@H]1CCCOC1 307209539214e79868c3ba4a2b69bdee [0,0,0,1,0,0|2,0,1]=4 732 B13R1.44 CCCCC(=O)N[C@H]1CCCOC1 ae47b8bcbaee33fc60d3b2fced32699e [0,0,0,1,0,0|2,0,1]=4 733 B13R1.44 CCCCC(C)OC1CC=CCC1 085ea3f3c58a11bcd98e21cf795309f5 [0,0,0,1,0,0|1,0,1]=3 734 B13R1.44 CCCCN(C)CC1CC=CCC1 d1b28e837d282281cc3d1eaa74aa136d [0,0,0,1,0,0|3,0,0]=4 735 B13R1.44 CCCNC(=O)CN1CC=CCC1 48e1913efef855e943f4271761358ce4 [0,0,0,1,0,0|3,0,0]=4 736 B13R1.44 CCCOC(=O)CN1CC=CCC1 2bd04eb53826bf21e1f2838a50ec9faf [0,0,0,1,0,0|3,0,0]=4 737 B13R1.44 CSCCC(=O)CN1CC=CCC1 1c8266870e47e866a5a6447fa2b7aa95 [0,0,0,1,0,0|3,0,0]=4 738 B13R1.153 CCCCC(=O)NCC1CC=CC1 cd0f6119a963531deb17151078c59a3f [0,0,0,1,0,0|1,0,2]=4 739 B13R1.153 CCCCC(=O)NCC1CCCC1 6f5543e1a0e768595d290b41fd10bbe0 [0,0,0,1,0,0|1,0,2]=4 740 B13R1.153 CCCCC(=O)NCC1CCCO1 b2ab1fb8249ac75bff3623f455562415 [0,0,0,1,0,0|2,0,1]=4 741 B13R1.153 CCCCC(=O)NCC1CCOC1 d178c24634f35144be890d638b0c7d7c [0,0,0,1,0,0|2,0,1]=4 742 B13R1.153 CCCCC(=O)NC[C@@H]1CCCO1 873f095f8567b60792f44bb11ded4207 [0,0,0,1,0,0|2,0,1]=4 743 B13R1.153 CCCCC(=O)NC[C@@H]1CCOC1 9557d9145b2126603b2e06bc59403bd5 [0,0,0,1,0,0|2,0,1]=4 744 B13R1.153 CCCCC(=O)NC[C@H]1CCCO1 291a3cfdcbdbee98251e31096f5a7b82 [0,0,0,1,0,0|2,0,1]=4 745 B13R1.153 CCCCC(=O)NC[C@H]1CCOC1 6c9f9195de27f5f6a8c570a703426568 [0,0,0,1,0,0|2,0,1]=4 746 B13R1.153 CCCCC(=O)OCN1CC=CC1 508ebecec5b2ed6cb9719e6f3fcd6c01 [0,0,0,1,0,0|1,0,2]=4 747 B13R1.153 CCCCC(=O)OCN1CCSC1 66c8608276ffa71261961628c5a36876 [0,0,0,1,0,0|2,0,1]=4 748 B13R1.153 CCCCC(C)OCC1C=CCC1 296066b07587bd1d860bf09d925fcb27 [0,0,0,1,0,0|1,0,1]=3 749 B13R1.153 CCCNC(=O)COC1C=CCC1 b9bee50ddf5eb8e27b9d7803c103f2e3 [0,0,0,1,0,0|3,0,0]=4 750 B13R1.153 CCCOC(=O)COC1C=CCC1 5ca67b1d71418b78c50874e637a76bdb [0,0,0,1,0,0|3,0,0]=4 751 B13R1.153 CSCCC(=O)COC1C=CCC1 91b44b127fdd0cb4892a2d8f1d26913e [0,0,0,1,0,0|3,0,0]=4 752 B13R1.555 CC/C=C/CNC1CCCNC1=O a748ddcd2995bd19e605b088acfab677 [0,0,0,1,0,0|3,0,0]=4 753 B13R1.555 CC/C=C/CN[C@@H]1CCCNC1=O 295aa79fb94d874e4a7b3a8e7e2ef9b4 [0,0,0,1,0,0|3,0,0]=4 754 B13R1.555 CC/C=C/CN[C@H]1CCCNC1=O 55ce56e6c841262678f20a4fd7081018 [0,0,0,1,0,0|3,0,0]=4 755 B13R1.555 CC/C=C/COC1CCCCC1=O f535ff55bb04cbcebf6af1d9dcd058d7 [0,0,0,1,0,0|2,0,0]=3 756 B13R1.555 CC/C=C/COC1CCCNC1=O c69812e56f1728f9971f3d8ebb8e6301 [0,0,0,1,0,0|3,0,0]=4 757 B13R1.555 CC/C=C/COC1CCCOC1=O 7a64c15b58f71e93ee4475e848203af2 [0,0,0,1,0,0|3,0,0]=4 758 B13R1.555 CC/C=C/COC1COCCC1=O 1850cf3a49c50a661aa3bd0b7ff3544b [0,0,0,1,0,0|3,0,0]=4 759 B13R1.555 CC/C=C/COC1SCCCC1=O d7ebe5fe2cf1c45282eb87d40c25ae61 [0,0,0,1,0,0|3,0,0]=4 760 B13R1.555 CC/C=C/CO[C@@H]1CCCNC1=O a9152ad80a5f2b06cfc40b50009ee9e0 [0,0,0,1,0,0|3,0,0]=4 761 B13R1.555 CC/C=C/CO[C@H]1CCCNC1=O 19bc3ffb326e640942993d0e95e90b16 [0,0,0,1,0,0|3,0,0]=4 762 B13R1.555 CC/C=C\CCN1CCCCC1C 35236e8eec6a9a50590baa932ae3dd35 [0,0,0,1,0,0|2,0,1]=4 763 B13R1.555 CC/C=C\CCN1CCCC[C@@H]1C f9273d954ce4df3add9efa1be663e875 [0,0,0,1,0,0|2,0,1]=4 764 B13R1.555 CC/C=C\CCN1CCCC[C@H]1C 8104f7435bd077b3ef49da6ecfd5d5ce [0,0,0,1,0,0|2,0,1]=4 765 B13R1.555 CC/C=C\COC1CCCCC1=O 26f0beb87eec4d333cb7abf1b68b1224 [0,0,0,1,0,0|2,0,0]=3 766 B13R1.555 CC/C=C\COC1CCCNC1=O c7eb69d23ab9ae43ea93f241f479761b [0,0,0,1,0,0|3,0,0]=4 767 B13R1.555 CC/C=C\COC1COCCC1=O 50bc4aa538e01eda312bb3c2f48bd73a [0,0,0,1,0,0|3,0,0]=4 768 B13R1.555 CC/C=C\COC1SCCCC1=O fb134414c0b643560b21bad1a29f81ad [0,0,0,1,0,0|3,0,0]=4 769 B13R1.555 CCCNCCN1CCCCC1=O ea3318a0d515c9984928bc96af0ab557 [0,0,0,1,0,0|2,0,1]=4 770 B13R1.555 CCNCCCN1CCCCC1=O 2fb8aea51a810d0379bc9df12a576f21 [0,0,0,1,0,0|2,0,1]=4 771 B13R1.656 CC/C=C/CN1CC(=O)NCC1C 36b851c2cafbd7e2ee7d492ac84a12f2 [0,0,0,1,0,0|3,0,0]=4 772 B13R1.656 CC/C=C/CN1CC(=O)NC[C@@H]1C aa7372389f3d5e1db1667e6f2bf4c609 [0,0,0,1,0,0|3,0,0]=4 773 B13R1.656 CC/C=C/CN1CC(=O)NC[C@H]1C a475ca689eb01de169114171c3120daf [0,0,0,1,0,0|3,0,0]=4 774 B13R1.674 CCCCC(=O)N1CCCCC1C a325176eebb256885907840b75a8659d [0,0,0,1,0,0|1,0,2]=4 775 B13R1.674 CCCCC(=O)N1CCCC[C@@H]1C 38d23c08f4304c33203524b1b610cfc7 [0,0,0,1,0,0|1,0,2]=4 776 B13R1.674 CCCCC(=O)N1CCCC[C@H]1C ad3efbe83b544196a4329fd247369986 [0,0,0,1,0,0|1,0,2]=4 777 B13R1.674 CCCCC(=O)N1CCOCC1C 19531087a4dc43d5a02ec9641657f7cd [0,0,0,1,0,0|2,0,1]=4 778 B13R1.674 CCCCC(=O)N1CCOC[C@@H]1C 051025f1dca601ab69df1bed483a5e80 [0,0,0,1,0,0|2,0,1]=4 779 B13R1.674 CCCCC(=O)N1CCOC[C@H]1C 2ee99122e6281047e67194f38adc1044 [0,0,0,1,0,0|2,0,1]=4 780 B13R1.676 CCCCC(=O)NCCOC1CC1 def7fc84b2cce5741be3a7cef4479046 [0,0,0,1,0,0|2,0,1]=4 781 B13R1.676 CCCCC(=O)OCNCC1CC1 43bbb0df18620380a0c85a7cdb57e115 [0,0,0,1,0,0|1,0,2]=4 782 B13R1.676 CCCCC(=O)OCOCC1CC1 6f0565b47e287bda8c7941ab96a1bb2d [0,0,0,1,0,0|1,0,2]=4 783 B13R1.676 CCCCN(C)CCCC=C1CC1 f8d0e0ccf8f842025cc76e430b089adf [0,0,0,1,0,0|3,0,0]=4 784 B13R1.683 CCCCC(=O)NCCC1CCC1 83c32e7a669a977f5504c44d71fe3c72 [0,0,0,1,0,0|1,0,2]=4 785 B13R1.683 CCCCC(=O)NCCC1CCO1 10dacab3bda4addc4cf14aee1fbde274 [0,0,0,1,0,0|2,0,1]=4 786 B13R1.683 CCCCC(=O)NCCN1CCC1 a4637cbdd4029d025ae6459144855b5c [0,0,0,1,0,0|2,0,1]=4 787 B13R1.683 CCCCC(=O)NCC[C@@H]1CCO1 83f341c0c7ce5c04e1e87d0509a37171 [0,0,0,1,0,0|2,0,1]=4 788 B13R1.683 CCCCC(=O)OCNC1CCC1 00360c4708ede70963b003d97b083240 [0,0,0,1,0,0|1,0,2]=4 789 B13R1.683 CCCCC(=O)OCOC1CCC1 0b7641b5a52a5ec2270c2b8c0189f44e [0,0,0,1,0,0|1,0,2]=4 790 B13R1.684 CCCCC(=O)N1CCCC1CC 0591513608380053c88edd963c13216a [0,0,0,1,0,0|1,0,2]=4 791 B13R1.684 CCCCC(=O)N1CCC[C@H]1CC 49ca43f651a02803315e6a90ab11247d [0,0,0,1,0,0|1,0,2]=4 792 B13R1.1133 CC/C=C/COC1=C(CCC1=O)C d4c653806ae7a13420375d2035aa866b [0,0,0,1,0,0|2,0,1]=4 793 B13R1.1133 CC/C=C\CCN1C(CCC1C)C 8ddc7a9418e10e5afb0dce6933999bf9 [0,0,0,1,0,0|2,0,1]=4 794 B13R1.1133 CC/C=C\CCN1[C@@H](CC[C@@H]1C)C ab51c892b4e35c8c0287387c82043e03 [0,0,0,1,0,0|2,0,1]=4 795 B13R1.1133 CC/C=C\CCN1[C@@H](CC[C@H]1C)C 0bdd3ab96e418525f9c52ade877fceeb [0,0,0,1,0,0|2,0,1]=4 796 B13R1.1133 CC/C=C\CCN1[C@H](CC[C@@H]1C)C 101a90a82eb61c1574a72a4a201b5e50 [0,0,0,1,0,0|2,0,1]=4 797 B13R1.1148 CC/C=C/CN1CCCNC(=O)C1 c5377d0fddf8ebdda93a4d1fb11cf823 [0,0,0,1,0,0|3,0,0]=4 798 B13R1.1148 CCCOCC1CCCCC(=O)N1 f4305fc4018b2f3f7d2d226dc370e87f [0,0,0,1,0,0|2,0,1]=4 799 B13R1.2436 CC/C=C\CCNC1(CCCC1)C 3d92a744d52a0cf6c2fac3bac2be8b4e [0,0,0,1,0,0|2,0,1]=4 800 B13R1.2439 CC/C=C/CCOC1CC(C1)OC ad8b9ac613ffae9958e9cefd423f8134 [0,0,0,1,0,0|2,0,1]=4 801 B13R1.2439 CC/C=C/CCO[C@H]1C[C@@H](C1)OC 990e79d4c68804b23ab43a90caba692a [0,0,0,1,0,0|2,0,1]=4 802 B13R1.2439 CC/C=C\CCOC1CC(C1)OC be917767c1e3dd78b997d84ce67b23f4 [0,0,0,1,0,0|2,0,1]=4 803 B13R1.2439 CC/C=C\CCOC1CN(C1)CC 25cc99de714c05465adf272dab3aa918 [0,0,0,1,0,0|2,0,1]=4 804 B13R1.2439 CC/C=C\CCO[C@H]1C[C@@H](C1)OC b80171923f6b1b31afb8ac022ea08e82 [0,0,0,1,0,0|2,0,1]=4 805 B13R1.2439 CC/C=C\CCO[C@H]1C[C@H](C1)CF f3310011f1e8a6f1c70bf21941345e20 [0,0,0,1,0,0|2,0,1]=4 806 B13R1.2439 CC/C=C\CCO[C@H]1C[C@H](C1)OC 7971efb5687cc2618db1350172c3e4b9 [0,0,0,1,0,0|2,0,1]=4 807 B13R1.2488 CCCCC(=O)N1CCCCCC1 b06f73644271bca508e353a95bb57c19 [0,0,0,1,0,0|1,0,2]=4 808 B13R1.2488 CCCCC(=O)N1CCCOCC1 2f80200ab5073a14d80b6dda0cbf83a0 [0,0,0,1,0,0|2,0,1]=4 809 B13R1.3572 CC/C=C/COCC(=O)C1CCC1 ec9c6dcbd556ac415fb7a164425d7c44 [0,0,0,1,0,0|2,0,0]=3 810 B13R1.3572 CC/C=C/COCC(=O)N1CCC1 795a935f58b26958a10e9d717a5782b6 [0,0,0,1,0,0|3,0,0]=4 811 B13R1.3572 CC/C=C\CCOC(C)C1CCC1 ff038fc91cbe9b4733c610d443192d49 [0,0,0,1,0,0|1,0,1]=3 812 B13R1.3572 CC/C=C\CCOC(C)C1COC1 4117858d5f227664dc153f13a9c84c36 [0,0,0,1,0,0|2,0,1]=4 813 B13R1.3572 CC/C=C\CCO[C@@H](C)C1CCC1 4ee7d808b3cb37c5bca09d6c95ef270c [0,0,0,1,0,0|1,0,1]=3 814 B13R1.3572 CC/C=C\CCO[C@@H](C)C1COC1 cab9505c6baec6307ecad9316d3854ce [0,0,0,1,0,0|2,0,1]=4 815 B13R1.3572 CC/C=C\CCO[C@H](C)C1COC1 f524823b6c98d26baa9d13e68ebc84a4 [0,0,0,1,0,0|2,0,1]=4 816 B13R1.3572 CC/C=C\COCC(=O)C1CCC1 6a16cc099898d37b60c4bc1b71f57a94 [0,0,0,1,0,0|2,0,0]=3 817 B13R1.3572 CC/C=C\COCC(=O)N1CCC1 312b56860629d9b6002c4e6934b45ae4 [0,0,0,1,0,0|3,0,0]=4 818 B13R1.3572 CCNCCCNC(=O)C1CCC1 66c3b6e49cb1b01482291e08a5ab7826 [0,0,0,1,0,0|2,0,1]=4 819 B13R1.3574 C=C/C=C/CCNC(=O)CC1CC1 d402f729b065df119e8eb6752baf2764 [0,0,0,1,0,0|1,0,2]=4 820 B13R1.3574 CC/C=C/CNCC(=O)NC1CC1 3a933154e3a237a16b8b0d163ad6ea3a [0,0,0,1,0,0|3,0,0]=4 821 B13R1.3574 CC/C=C/COCC(=O)NC1CC1 5e4576b54015e5ff2e3789e237dbb40d [0,0,0,1,0,0|3,0,0]=4 822 B13R1.3574 CC/C=C\CCOC(C)CC1CC1 3e893fc772a4873a116819130b1d4997 [0,0,0,1,0,0|1,0,1]=3 823 B13R1.3574 CC/C=C\COCC(=O)NC1CC1 00ef997a1fb7c8998b410b602fd08f67 [0,0,0,1,0,0|3,0,0]=4 824 B13R1.3574 CCCCCCNC(=O)CC1CC1 1e8a92da6b1b91be48128954588084c0 [0,0,0,1,0,0|1,0,2]=4 825 B13R1.3574 CCCOCCNC(=O)CC1CC1 b590d1b6b2961074865121320c03bded [0,0,0,1,0,0|2,0,1]=4 826 B13R1.3574 CCOCCCNC(=O)CC1CC1 51e183cb1890fb1cc233bf06d57fe137 [0,0,0,1,0,0|2,0,1]=4 827 B13R1.3580 CCCCC(=O)OCNC1CC1C 819202ad72437494f11b74acbdcee00e [0,0,0,1,0,0|1,0,2]=4 828 B10R0.71 C#CCCOCC/C=C/CC 74d74bf4d6c2d75460dfacf68a9a580b [2,0,0,0,0,0|0,0,2]=4 829 B10R0.71 C#CCCOCC/C=C\CC 535e73d5205901617bde8680afff5afa [2,0,0,0,0,0|0,0,2]=4 830 B10R0.71 C/C=C/C=C/COCCCC 5be7c2b1277a2751ff6b685b75a09aa7 [2,0,0,0,0,0|0,0,2]=4 831 B10R0.71 C/C=C/CCCOCCCC 80f6cb269c0f24c47f7493f0858d135b [2,0,0,0,0,0|0,0,2]=4 832 B10R0.71 C/C=C/CCOCCCCC b01a3aac6d31bf1181d3412f98b352d1 [2,0,0,0,0,0|0,0,1]=3 833 B10R0.71 C/C=C/CCOCCCCF 0926564ddf9384633163943d107dc266 [2,0,0,0,0,0|1,0,1]=4 834 B10R0.71 C/C=C/CCOCCCOC e143401afb4a42af7a2b5b3da7333c58 [2,0,0,0,0,0|1,0,1]=4 835 B10R0.71 C/C=C/CCOCCCSC 7168c1bf70af6e8509d8357b12ea7a20 [2,0,0,0,0,0|1,0,1]=4 836 B10R0.71 C/C=C/CCOCCOCC 2dc32af9d28d7709b9788abfcda74b3a [2,0,0,0,0,0|1,0,1]=4 837 B10R0.71 C/C=C/CCOCCSCC 5937bb27e6bb3ee7337ee58bf6558520 [2,0,0,0,0,0|1,0,1]=4 838 B10R0.71 C/C=C/COCC/C=C/CC b64b9773fa341b27d9d1567b3b462587 [2,0,0,0,0,0|0,0,2]=4 839 B10R0.71 C/C=C/COCC/C=C\CC 67fa2a7eeebb12d9123f78d838c34e53 [2,0,0,0,0,0|0,0,2]=4 840 B10R0.71 C/C=C\CCCNCCCC a73db25df80dfe021f7d70c1fcec0182 [2,0,0,0,0,0|2,0,0]=4 841 B10R0.71 C/C=C\CCCOCCCC fe2923e9d84b92616f7a73a5334d712d [2,0,0,0,0,0|0,0,2]=4 842 B10R0.71 C/C=C\COCC/C=C/CC 1d0dedc0b89be954edd17fb1cb04b1e7 [2,0,0,0,0,0|0,0,2]=4 843 B10R0.71 C/C=C\COCC/C=C\CC e69c55870a373fdf3f38e626544c4bc2 [2,0,0,0,0,0|0,0,2]=4 844 B10R0.71 C=CCCOCC/C=C/CC 34e932e8340213e918b96915d5caa9f2 [2,0,0,0,0,0|0,0,2]=4 845 B10R0.71 C=CCCOCC/C=C\CC 6c8897552831f137e84ed17b901023a1 [2,0,0,0,0,0|0,0,2]=4 846 B10R0.71 CC#CCOCC/C=C\CC 808dd0f31617c96f61b90c4c3f9c935f [2,0,0,0,0,0|0,0,2]=4 847 B10R0.71 CC/C=C/CCOCCC#N f73f0b4079b08a2f55b9f71bc1349fc5 [2,0,0,0,0,0|1,0,1]=4 848 B10R0.71 CC/C=C/CCOCCC=O 6872b8e489d755d1798fb75aec622df4 [2,0,0,0,0,0|1,0,1]=4 849 B10R0.71 CC/C=C/CCOCCCC c8bbe4a116e9837c5acb0bd130d88747 [2,0,0,0,0,0|0,0,0]=2 850 B10R0.71 CC/C=C/CCOCCCF 88ecb959ca18d6af5da622832f1b87e9 [2,0,0,0,0,0|1,0,0]=3 851 B10R0.71 CC/C=C/CCOCCCS 2d2a5e2c573307f1405dd0f398018841 [2,0,0,0,0,0|1,0,0]=3 852 B10R0.71 CC/C=C/CCOCCOC 357931dbf492ba690ab5ab15f3f25efc [2,0,0,0,0,0|1,0,0]=3 853 B10R0.71 CC/C=C/CCOCCSC 27ca4bac73680406675dffc3e2b09158 [2,0,0,0,0,0|1,0,0]=3 854 B10R0.71 CC/C=C/CCOCOCC 5bbf3b2e62d730268265b4908a34cbee [2,0,0,0,0,0|1,0,0]=3 855 B10R0.71 CC/C=C/CNCCCCC 396ae7fd2aad2d3062225091f1ed8121 [2,0,0,0,0,0|1,0,1]=4 856 B10R0.71 CC/C=C/COCCCCC 4244476ee625bb91d4c75005fa57b26a [2,0,0,0,0,0|0,0,1]=3 857 B10R0.71 CC/C=C/COCCCCF 1dc81d22ea6c57418304e0917a0631f2 [2,0,0,0,0,0|1,0,1]=4 858 B10R0.71 CC/C=C/COCCCCS 07e5800718cf1f4b5355166f60667667 [2,0,0,0,0,0|1,0,1]=4 859 B10R0.71 CC/C=C/COCCCOC da9a60c9a4f386a7d1a509a02b8e1091 [2,0,0,0,0,0|1,0,1]=4 860 B10R0.71 CC/C=C/COCCCSC 554c810278825b7f95800a92c8ae421b [2,0,0,0,0,0|1,0,1]=4 861 B10R0.71 CC/C=C/COCCOCC 9a5afd7f01e126d7e19bfb079674ce6a [2,0,0,0,0,0|1,0,1]=4 862 B10R0.71 CC/C=C/COCCSCC a16cb8768dc153c0d5da120184491196 [2,0,0,0,0,0|1,0,1]=4 863 B10R0.71 CC/C=C\CCCCOCC 6f672bd2ab358cb454803e83d5c0e284 [2,0,0,0,0,0|1,0,1]=4 864 B10R0.71 CC/C=C\CCCOCCC 7fa768d31f02c71335efb28537f1ed87 [2,0,0,0,0,0|1,0,1]=4 865 B10R0.71 CC/C=C\CCNCCCC c4f059f6ebacdc59905230714b6eff68 [2,0,0,0,0,0|1,0,0]=3 866 B10R0.71 CC/C=C\CCNCCCCl 51cddba674b0299a3a928cf64999c244 [2,0,0,0,0,0|2,0,0]=4 867 B10R0.71 CC/C=C\CCNCCCO 289e512a3da0d8201ff3b6a7f6c8a4e6 [2,0,0,0,0,0|2,0,0]=4 868 B10R0.71 CC/C=C\CCNCCOC 898274d4166e713a95b39d4ba4ddea68 [2,0,0,0,0,0|2,0,0]=4 869 B10R0.71 CC/C=C\CCNCCSC 15772fe2a7784e8cbd0582b1e3089109 [2,0,0,0,0,0|2,0,0]=4 870 B10R0.71 CC/C=C\CCOCCC#N c2387d7b7248947432ca79d467ca0131 [2,0,0,0,0,0|1,0,1]=4 871 B10R0.71 CC/C=C\CCOCCC=O d85d7dfe4e2e6e8d032a753a156249ad [2,0,0,0,0,0|1,0,1]=4 872 B10R0.71 CC/C=C\CCOCCCC 8e83903dc8b2dc055f80be84ab4a3d9c [2,0,0,0,0,0|0,0,0]=2 873 B10R0.71 CC/C=C\CCOCCCF 4430bc766f9eb0d9c26980dd0840755d [2,0,0,0,0,0|1,0,0]=3 874 B10R0.71 CC/C=C\CCOCCCS a1e1396ab724ae1f920f1f57a0489d4e [2,0,0,0,0,0|1,0,0]=3 875 B10R0.71 CC/C=C\CCOCCOC 1a6120bf2aea14ad94a33580626ee6c2 [2,0,0,0,0,0|1,0,0]=3 876 B10R0.71 CC/C=C\CCOCCSC 035739549145efd9748ebd13a7349bf7 [2,0,0,0,0,0|1,0,0]=3 877 B10R0.71 CC/C=C\CCOCOCC 0feba21b91979670cd9ecf6b8a0bbf3f [2,0,0,0,0,0|1,0,0]=3 878 B10R0.71 CC/C=C\COCCCCC 273210e5829d96509e829e222979bc8b [2,0,0,0,0,0|0,0,1]=3 879 B10R0.71 CC/C=C\COCCCCF cceb6301c3fc703ee59d20a210d8e3fb [2,0,0,0,0,0|1,0,1]=4 880 B10R0.71 CC/C=C\COCCCOC 2778db8b130f5c046c26bb8e26950712 [2,0,0,0,0,0|1,0,1]=4 881 B10R0.71 CC/C=C\COCCCSC ffcfb2f3c5f9bdd080c465251703b682 [2,0,0,0,0,0|1,0,1]=4 882 B10R0.71 CC/C=C\COCCOCC 1548c7429369ffcb40b777378cae9d6b [2,0,0,0,0,0|1,0,1]=4 883 B10R0.71 CC/C=C\COCCSCC bf420840e62c6002d6099f83c76d210d [2,0,0,0,0,0|1,0,1]=4 884 B10R0.71 CC=C=CCCOCCCC 49a0b70400a78c3414989a3230bb7ded [2,0,0,0,0,0|0,0,2]=4 885 B10R0.71 CC=CC=CCOCCCC b2db690d4b1d749e1abe5e187adedbf9 [2,0,0,0,0,0|0,0,2]=4 886 B10R0.71 CC=CCCCOCCCC b937b4ad4c5d1a608e7129c714e871ac [2,0,0,0,0,0|0,0,2]=4 887 B10R0.71 CC=CCOCC/C=C\CC 75e1755252a27204ec39b2f227ebda40 [2,0,0,0,0,0|0,0,2]=4 888 B10R0.71 CCC#CCCOCCCC 164797f680cff0f6ad3f9b55f3918282 [2,0,0,0,0,0|0,0,2]=4 889 B10R0.71 CCC/C=C/COCCCC 5cb7fad967976b46414fd1e0981df754 [2,0,0,0,0,0|0,0,2]=4 890 B10R0.71 CCC/C=C\COCCCC 12552b98ae2ab17ee7aaf14497e6f771 [2,0,0,0,0,0|0,0,2]=4 891 B10R0.71 CCCC/C=C\CCOCC c0b86be5a318325f35923a807a0da0e5 [2,0,0,0,0,0|2,0,0]=4 892 B10R0.71 CCCCCCOCCCC 938d0ec0b6adc0f1b39dbfc036e22e02 [2,0,0,0,0,0|0,0,2]=4 893 B10R0.71 CCCCCOCCCCC 6be65cbda65609b70fc256077c9081b0 [2,0,0,0,0,0|0,0,2]=4 894 B10R0.71 CCCCCOCCOCC c8f98ba5fde1bc4c3459e40764f14618 [2,0,0,0,0,0|1,0,1]=4 895 B10R0.71 CCCCCOCCSCC 8e2ce49f0c9b939f61ef427ccb831b7d [2,0,0,0,0,0|1,0,1]=4 896 B10R0.71 CCCCOCCCNCC 010734c4fdc877ac094389f744441162 [2,0,0,0,0,0|1,0,1]=4 897 B10R0.71 CCCCOCCCOCC 1158a02552cfd2177bf76faa90c6df77 [2,0,0,0,0,0|1,0,1]=4 898 B10R0.71 CCCCOCCCSCC e04cab22dc6501876d38fc7fb5563829 [2,0,0,0,0,0|1,0,1]=4 899 B10R0.71 CCCCOCCNCCC c10c126aa77fae6dee2817c49229712d [2,0,0,0,0,0|1,0,1]=4 900 B10R0.71 CCCCOCCOCCC 62aa1933f9f6285673b3ff78d496fc74 [2,0,0,0,0,0|1,0,1]=4 901 B10R0.71 CCCCOCCSCCC dd7dd42c58efb56d123dfdb4ec52bdfa [2,0,0,0,0,0|1,0,1]=4 902 B10R0.1 C/C=C/CCOC(C)CCC 294fae16eede2a954b42064381e4ae97 [2,0,0,0,0,0|1,0,1]=4 903 B10R0.1 C/C=C/COCC(=O)CCC e705dd41e10e42b7866df48e1ca92157 [2,0,0,0,0,0|2,0,0]=4 904 B10R0.1 C/C=C\COCC(=O)CCC 8bf6bfccd0bb73cc8d5f50cefcee622b [2,0,0,0,0,0|2,0,0]=4 905 B10R0.1 CC/C=C/COC(=S)CCC 70ec4c0977dbca2d1155ab6d62691382 [2,0,0,0,0,0|0,1,0]=3 906 B10R0.1 CC/C=C/COC(C)CCC 19690a47d49baee7bb1487f172789f12 [2,0,0,0,0,0|1,0,1]=4 907 B10R0.1 CC/C=C/CO[C@@H](C)CCC dce6e8e95e54b6a2e50952d6c8d1337c [2,0,0,0,0,0|1,0,1]=4 908 B10R0.1 CC/C=C/CO[C@H](C)CCC 379a4b7cbe36b8805d03e2a84d75416d [2,0,0,0,0,0|1,0,1]=4 909 B10R0.1 CC/C=C\CCN(C)CCC 7274204e740762d854b5b58a93bd1eab [2,0,0,0,0,0|2,0,0]=4 910 B10R0.1 CC/C=C\COC(C)CCC 1b6a3cfa3da8e4e04cdead2fa0778ebd [2,0,0,0,0,0|1,0,1]=4 911 B10R0.1 CC=CCNCC(=O)CCC 82640ac2c5fa5f7a65f6439c940d2283 [2,0,0,0,0,0|2,0,0]=4 912 B10R0.1 CC=CCOCC(=O)CCC 8f6ba979a3d95982df241a72b750c80a [2,0,0,0,0,0|2,0,0]=4 913 B10R0.1 CCCC(=O)NCCOCC 79d9b92616c769d2cdcd747927c60328 [2,0,0,0,0,0|2,0,0]=4 914 B10R0.1 CCCC(=O)NCCSCC 80b0e19972a11cccc458980ea52b2299 [2,0,0,0,0,0|2,0,0]=4 915 B10R0.1 CCCC(=O)OCCOCC 9a285a2c378d3b3e5e911c97d35a22b7 [2,0,0,0,0,0|1,0,0]=3 916 B10R0.1 CCCC(=O)OCCOCF 3c9e2aeba7aac381e328973102e6b518 [2,0,0,0,0,0|2,0,0]=4 917 B10R0.1 CCCC(=S)OCCOCC a1bd1ecdf3a74bbe1c29303e11aeb9ee [2,0,0,0,0,0|1,1,0]=4 918 B10R0.1 CCCC(=S)OCCSCC 57566a2b28663af6eed39d2cf1b8b53f [2,0,0,0,0,0|1,1,0]=4 919 B10R0.1 CCCCCNC(=O)CCC cd3617b761f054cae655d3c214537a01 [2,0,0,0,0,0|1,0,1]=4 920 B10R0.1 CCCCCOC(=S)CCC e70fcd071a998201c96ff7af83897208 [2,0,0,0,0,0|0,1,1]=4 921 B10R0.1 CCCNCOC(=O)CCC 38cbf3506e155a3e433f65aa13f4e89b [2,0,0,0,0,0|1,0,1]=4 922 B10R0.1 CCCOCOC(=O)CCC ae34f309fddde79fb1b78768c738001e [2,0,0,0,0,0|1,0,1]=4 923 B10R0.74 CC/C=C/CCOC(C)CC a24e2ee69d8f4fe32a082cd13a1d9a10 [2,0,0,0,0,0|1,0,1]=4 924 B10R0.74 CC/C=C/COCC(=O)CC a01b136a5ca1f88d863986a7bbd53488 [2,0,0,0,0,0|2,0,0]=4 925 B10R0.74 CC/C=C\CCOC(C)CC 4eecc7e194e72e1bc2cd62bfc96fdd14 [2,0,0,0,0,0|1,0,1]=4 926 B10R0.74 CC/C=C\CCO[C@@H](C)CC 8b1d7dd677614d681cb02a4070cd720b [2,0,0,0,0,0|1,0,1]=4 927 B10R0.74 CC/C=C\CCO[C@H](C)CC e9f8dbd89e92c5ca6cff920ebeeb360f [2,0,0,0,0,0|1,0,1]=4 928 B10R0.74 CC/C=C\COCC(=O)CC 1dc130138fd1a08506cef35fcfe2aa39 [2,0,0,0,0,0|2,0,0]=4 929 B10R0.74 CCCOCCOC(=O)CC 0266b80a03c10e2cb61b113dd4b9130c [2,0,0,0,0,0|1,0,1]=4 930 B10R0.91 C/C=C/COC(C)CCCC 7805197790e1cd20e24e2590772b13ff [2,0,0,0,0,0|1,0,1]=4 931 B10R0.91 C/C=C/CO[C@@H](C)CCCC 9a554e267dffbe67e601644b9c99c569 [2,0,0,0,0,0|1,0,1]=4 932 B10R0.91 C/C=C/CO[C@H](C)CCCC e64769a5195eae2a7dd7850d6a7e6ad7 [2,0,0,0,0,0|1,0,1]=4 933 B10R0.91 C/C=C\COC(C)CCCC 0e0fc461c4d5efc29c2851a81d8d701f [2,0,0,0,0,0|1,0,1]=4 934 B10R0.91 C/C=C\CO[C@@H](C)CCCC 64c1e64c78ef97ae710aa96e8b9ba587 [2,0,0,0,0,0|1,0,1]=4 935 B10R0.91 C/C=C\CO[C@H](C)CCCC 5bcdb3d12b2edc99cd74d01d2dd8cf1c [2,0,0,0,0,0|1,0,1]=4 936 B10R0.91 C=CCCCC(=O)NCCC 711c26831a61ec4c93ba9b4bcdfa02df [2,0,0,0,0,0|2,0,0]=4 937 B10R0.91 C=CCCNC(=O)CCCC 69c4edbb5c60d786a453503b63dbd91a [2,0,0,0,0,0|1,0,0]=3 938 B10R0.91 C=CCCNC(=O)CCCF c801b98028089419834beb4483dd322d [2,0,0,0,0,0|2,0,0]=4 939 B10R0.91 C=CCCNC(=O)CCCS 3610749a3a57ed9de898834dbd362d16 [2,0,0,0,0,0|2,0,0]=4 940 B10R0.91 C=CCCNC(=O)CCOC b6a47d36cb407eff20f2ec91d626a0e2 [2,0,0,0,0,0|2,0,0]=4 941 B10R0.91 C=CCCNC(=O)CCSC 629570157734472777748b5e72c80992 [2,0,0,0,0,0|2,0,0]=4 942 B10R0.91 C=CCCNC(=O)COCC 7beedb04c099b02f8e0c25cceefd9cfa [2,0,0,0,0,0|2,0,0]=4 943 B10R0.91 C=CCCNC(=O)CSCC 4447f2c27f7345cd7a62595a0197c2ea [2,0,0,0,0,0|2,0,0]=4 944 B10R0.91 C=CCCNC(=O)NCCC 24529862e5cb083f4bec92859e0314d5 [2,0,0,0,0,0|2,0,0]=4 945 B10R0.91 C=CCCOC(C)CCCC a8ffb06f7884ec4652ba038ab7a86333 [2,0,0,0,0,0|1,0,1]=4 946 B10R0.91 C=CCCO[C@@H](C)CCCC 747e3d8a47aa140b373edf9c462ba99a [2,0,0,0,0,0|1,0,1]=4 947 B10R0.91 C=CCCO[C@H](C)CCCC a475446fa0e4e38dbc246d8faf0aaff6 [2,0,0,0,0,0|1,0,1]=4 948 B10R0.91 CC/C=C/CC(=O)NCCBr f37bb003bd92ac4d0e7cc45c4e88a7eb [2,0,0,0,0,0|2,0,0]=4 949 B10R0.91 CC/C=C/CC(=O)NCCC b0c6d67b89af1fa4f0f3663914f15094 [2,0,0,0,0,0|1,0,0]=3 950 B10R0.91 CC/C=C/CC(=O)NCCF 6ccce12a3a16451ecc358edbc609a87d [2,0,0,0,0,0|2,0,0]=4 951 B10R0.91 CC/C=C/CC(=O)NCCI 877695eb6ccb7bae8126ea0e3f7d2a09 [2,0,0,0,0,0|2,0,0]=4 952 B10R0.91 CC/C=C/CC(=O)NCCO 1493eb8bad76a81488488c5bdbf69ab1 [2,0,0,0,0,0|2,0,0]=4 953 B10R0.91 CC/C=C/CC(=O)NCCS 367058fa9e112455fe65bda7cc17162c [2,0,0,0,0,0|2,0,0]=4 954 B10R0.91 CC/C=C/CN(C)CCCC 2fc762324afa6bea41fb0cbf544fa6de [2,0,0,0,0,0|2,0,0]=4 955 B10R0.91 CC/C=C\CC(=O)NCCBr c0101c05d2438d6ed71558e7cde4095f [2,0,0,0,0,0|2,0,0]=4 956 B10R0.91 CC/C=C\CC(=O)NCCC 9766dbc28eb370933ff877484a58deff [2,0,0,0,0,0|1,0,0]=3 957 B10R0.91 CC/C=C\CC(=O)NCCF e65bb59268044b1f7314ea58bb5f6e07 [2,0,0,0,0,0|2,0,0]=4 958 B10R0.91 CC/C=C\CC(=O)NCCI d89e075bdc8a92a3e8bd3b05823c36a0 [2,0,0,0,0,0|2,0,0]=4 959 B10R0.91 CC/C=C\CC(=O)NCCO df1f53ca458cf9749adbc2c1d5e2ca50 [2,0,0,0,0,0|2,0,0]=4 960 B10R0.91 CC/C=C\CC(=O)NCCS 27c10c71c15987e41baa09236f98e5b5 [2,0,0,0,0,0|2,0,0]=4 961 B10R0.91 CC=CCCC(=O)NCCBr 6c4d019b5685c6db3a6467179c26d402 [2,0,0,0,0,0|2,0,0]=4 962 B10R0.91 CC=CCCC(=O)NCCC df5f18c0a3dc2e8e1c690fac3e9556f8 [2,0,0,0,0,0|1,0,0]=3 963 B10R0.91 CC=CCCC(=O)NCCF f6d521b73e99faafc1e6f299f6d731f2 [2,0,0,0,0,0|2,0,0]=4 964 B10R0.91 CC=CCCC(=O)NCCI 3bed3ab473dfc6e1a4a9cdd6a9beac36 [2,0,0,0,0,0|2,0,0]=4 965 B10R0.91 CC=CCCC(=O)NCCO 7cef69a4c86bf6dff344085c46317eee [2,0,0,0,0,0|2,0,0]=4 966 B10R0.91 CC=CCCC(=O)NCCS a7941efaa5a0e3a28cf1ead94f3582fa [2,0,0,0,0,0|2,0,0]=4 967 B10R0.91 CC=CCNC(=O)CCCC 4d197d152214c72ad748c812327bf472 [2,0,0,0,0,0|1,0,0]=3 968 B10R0.91 CC=CCNC(=O)CCCF 9672b87feb13f101fca3ad504e7fc364 [2,0,0,0,0,0|2,0,0]=4 969 B10R0.91 CC=CCNC(=O)CCCS cfee60122479c15aa06b7da273e43b27 [2,0,0,0,0,0|2,0,0]=4 970 B10R0.91 CC=CCNC(=O)CCOC 8100567a8365bdab7f72f7f16a79c1b4 [2,0,0,0,0,0|2,0,0]=4 971 B10R0.91 CC=CCNC(=O)CCSC 34418afd58ba61b8397323ce3936bd82 [2,0,0,0,0,0|2,0,0]=4 972 B10R0.91 CC=CCNC(=O)COCC 83b10426c0b4f1637e2428a67b152c22 [2,0,0,0,0,0|2,0,0]=4 973 B10R0.91 CC=CCNC(=O)CSCC 9b30b2266efbd26ad475a0abfb6a0551 [2,0,0,0,0,0|2,0,0]=4 974 B10R0.91 CC=CCNC(=O)NCCC e946524fbac89a871414fdd4f189d293 [2,0,0,0,0,0|2,0,0]=4 975 B10R0.91 CC=CCOC(C)CCCC 7921c31dab6b7d7442432f4b9b30ae0d [2,0,0,0,0,0|1,0,1]=4 976 B10R0.91 CCC=CCC(=O)NCCBr 607d96fa4830625c95836bf1f67186f9 [2,0,0,0,0,0|2,0,0]=4 977 B10R0.91 CCC=CCC(=O)NCCC b4918c368f0d79faa2e9aca1f273b1d5 [2,0,0,0,0,0|1,0,0]=3 978 B10R0.91 CCC=CCC(=O)NCCF 941cf05b6dbb56480ad7c05509d9b82b [2,0,0,0,0,0|2,0,0]=4 979 B10R0.91 CCC=CCC(=O)NCCI af10a6f29d14c73cfd4c037a1e9897fd [2,0,0,0,0,0|2,0,0]=4 980 B10R0.91 CCC=CCC(=O)NCCO 99327469f7c996e817d65b2988d32523 [2,0,0,0,0,0|2,0,0]=4 981 B10R0.91 CCC=CCC(=O)NCCS 5e1838a202a426d3ced347a4547ed136 [2,0,0,0,0,0|2,0,0]=4 982 B10R0.91 CCCCC(=O)NCCCCl 33a4b5638fdb717aefdcf6539c550173 [2,0,0,0,0,0|2,0,0]=4 983 B10R0.91 CCCCC(=O)NCCCO a506e03803236b22b3ae12611eccbe7c [2,0,0,0,0,0|2,0,0]=4 984 B10R0.91 CCCCC(=O)NCCOC 5ea5ee64f6f2aa6ec9332a0ab051832d [2,0,0,0,0,0|2,0,0]=4 985 B10R0.91 CCCCC(=O)NCCSC 8fb8629ea12736b986b6b7c52fdb4519 [2,0,0,0,0,0|2,0,0]=4 986 B10R0.91 CCCCCC(=O)NCCC 476273c2f4455ec9a0886335ed7ef341 [2,0,0,0,0,0|1,0,1]=4 987 B10R0.91 CCCCNC(=O)CCCC 5b6c1a774ebc9cf6b3cca95003cc944e [2,0,0,0,0,0|1,0,0]=3 988 B10R0.91 CCCCNC(=O)CCCF 2018023c6b79f86bf88e0ae98d70f56e [2,0,0,0,0,0|2,0,0]=4 989 B10R0.91 CCCCNC(=O)CCCS 1acf0f095503723b4d5b3e9341583954 [2,0,0,0,0,0|2,0,0]=4 990 B10R0.91 CCCCNC(=O)CCOC 6f0c7655b0241fead5cc4be83519576f [2,0,0,0,0,0|2,0,0]=4 991 B10R0.91 CCCCNC(=O)CCSC 6faaa951076ffc1f5066685857593ae9 [2,0,0,0,0,0|2,0,0]=4 992 B10R0.91 CCCCNC(=O)CNCC c8a7f81d189a0f129789cdd44548f084 [2,0,0,0,0,0|2,0,0]=4 993 B10R0.91 CCCCNC(=O)COCC cfe07acc4d092a3a207ae22828e3982e [2,0,0,0,0,0|2,0,0]=4 994 B10R0.91 CCCCNC(=O)CSCC 833d758cb45613aad283ee5c135a2097 [2,0,0,0,0,0|2,0,0]=4 995 B10R0.91 CCCCNC(=O)NCCC 3b1fa47b4b47d4900a6dc31a059123bf [2,0,0,0,0,0|2,0,0]=4 996 B10R0.91 CCCCOC(=O)COCC d484bc8a8e1cb9f1bc7a12a52a402449 [2,0,0,0,0,0|1,0,0]=3 997 B10R0.91 CCCCOC(=O)COCF 977c18c762e99407307de342070f2942 [2,0,0,0,0,0|2,0,0]=4 998 B10R0.91 CCCCOC(C)CCCC 7752635d00cac0640dd2ec5dbf9e52a3 [2,0,0,0,0,0|1,0,1]=4 999 B10R0.91 CCCCO[C@@H](C)CCCC c6c923102de856d0f10b7d64a1c257c9 [2,0,0,0,0,0|1,0,1]=4 1000 B10R0.91 CCCCO[C@H](C)CCCC 281397569e3850d5ee5ca2dbdbe8e8e7 [2,0,0,0,0,0|1,0,1]=4 1001 B10R0.91 CCCNC(=O)CCOCC 346f5ddb484887d61ec41ac0a6570f48 [2,0,0,0,0,0|2,0,0]=4 1002 B10R0.91 CCCNC(=O)CCSCC 6fe01c91f2feda5344fc25c7a6443960 [2,0,0,0,0,0|2,0,0]=4 1003 B10R0.91 CCCOC(=O)CCOCC eb2288e0eb1e17d54ff3e8eb454761b3 [2,0,0,0,0,0|2,0,0]=4 1004 B12R0.1 CC/C=C/CCOCC(=O)CCC 41317b7200754cb3bcb4d021be103013 [1,1,0,0,0,0|0,0,2]=4 1005 B12R0.1 CC/C=C/CCOCC(C)CCC e77527eedeb493fdf856af5502965e55 [1,1,0,0,0,0|0,0,1]=3 1006 B12R0.1 CC/C=C/CCOC[C@@H](O)CCO 9948dd4478cc90b390862874d8bbd99e [1,1,0,0,0,0|1,0,1]=4 1007 B12R0.1 CC/C=C\CCCOC(C)CCC 5ef7e519bbdffd066a6111c99b3e12a5 [1,1,0,0,0,0|2,0,0]=4 1008 B12R0.1 CC/C=C\CCNCC(O)CCC 08eb8a2018875c6fddc17f6ac92fb263 [1,1,0,0,0,0|1,0,1]=4 1009 B12R0.1 CC/C=C\CCOCC(=O)CCC e77a99429b63562e524ba646f33af3e8 [1,1,0,0,0,0|0,0,2]=4 1010 B12R0.1 CC/C=C\CCOCC(C)CCC 10f5057994ff4002418b173c9a8ffaba [1,1,0,0,0,0|0,0,1]=3 1011 B12R0.1 CC/C=C\CCOCC(C)COC 1a3dc3f44a4b0438a18896bb02c14606 [1,1,0,0,0,0|1,0,1]=4 1012 B12R0.1 CC/C=C\CCOCC(C)OCC 22abfcd68d8a7f4a1d66fc883c919d14 [1,1,0,0,0,0|1,0,1]=4 1013 B12R0.1 CC/C=C\CCOC[C@@H](C)COC 8f49f7a7ab314e7de1187a8feda277b1 [1,1,0,0,0,0|1,0,1]=4 1014 B12R0.1 CC/C=C\CCOC[C@@H](O)CCO b169ccbc48e91cfeed7bb53c821dc592 [1,1,0,0,0,0|1,0,1]=4 1015 B12R0.1 CCCCCOCCC(=O)NCC 8d86d4085f1914474d4def8476302536 [1,1,0,0,0,0|1,0,1]=4 1016 B12R0.1 CCCCCOCCC(=O)OCC 0e8d283a882f47cc8cf67da5cc42052f [1,1,0,0,0,0|1,0,1]=4 1017 B12R0.5 C#CCCCCOCC/C=C/CC c383c25d19ec73e4380b5d69abb69453 [1,1,0,0,0,0|0,0,2]=4 1018 B12R0.5 C#CCCCCOCC/C=C\CC fcbdf598fb174ea504deeac24f7502de [1,1,0,0,0,0|0,0,2]=4 1019 B12R0.5 C/C=C/CCCOCC/C=C\CC 7522599b4b16d657cbbe2088b07fbaac [1,1,0,0,0,0|0,0,2]=4 1020 B12R0.5 C/C=C\CCCOCC/C=C/CC f21e9b5cca4c249eee520d63ce7984f7 [1,1,0,0,0,0|0,0,2]=4 1021 B12R0.5 C/C=C\CCCOCC/C=C\CC 4edba88869144acf5b9faa6cdd35d1af [1,1,0,0,0,0|0,0,2]=4 1022 B12R0.5 C=CCCCCOCC/C=C/CC 551d42c532d05f6fd57a1aba63d7d4a0 [1,1,0,0,0,0|0,0,2]=4 1023 B12R0.5 C=CCCCCOCC/C=C\CC 654e1c6f4cc22e97f3f2131134874fc7 [1,1,0,0,0,0|0,0,2]=4 1024 B12R0.5 CC#CCCCOCC/C=C/CC 073331a9515ffb9e4296c0c7c1e6b7cd [1,1,0,0,0,0|0,0,2]=4 1025 B12R0.5 CC#CCCCOCC/C=C\CC c79d7c7bb78776299b7a1e8e4c44a5d8 [1,1,0,0,0,0|0,0,2]=4 1026 B12R0.5 CC/C=C/CC/C=C/COCCC 4a5d983a603d86734c380c9c200d4d19 [1,1,0,0,0,0|1,0,0]=3 1027 B12R0.5 CC/C=C/CC/C=C/COCCF e1f73afa8cc8dcbb98674f14124d8cf6 [1,1,0,0,0,0|2,0,0]=4 1028 B12R0.5 CC/C=C/CC/C=C/COCCS 77cf786d6fca09734141beee4f74eb24 [1,1,0,0,0,0|2,0,0]=4 1029 B12R0.5 CC/C=C/CC/C=C/COCOC 67184a9551a7a74c6f1101add700a7c7 [1,1,0,0,0,0|2,0,0]=4 1030 B12R0.5 CC/C=C/CC/C=C/COCSC 16d0025c56c5a937cf430810363b9ac1 [1,1,0,0,0,0|2,0,0]=4 1031 B12R0.5 CC/C=C/CCOC/C=C/CCC d67c7f3b87407fd36e977a318d389688 [1,1,0,0,0,0|0,0,1]=3 1032 B12R0.5 CC/C=C/CCOC/C=C\CCC a61c1e38d81896dacbcd317dba7630a9 [1,1,0,0,0,0|0,0,1]=3 1033 B12R0.5 CC/C=C/CCOCCCCC#N 705eafe11f5645564edf1fe0642c3c30 [1,1,0,0,0,0|0,0,2]=4 1034 B12R0.5 CC/C=C/CCOCCCCC=O 6d55b6e6a4837cfb96478f243218bd95 [1,1,0,0,0,0|0,0,2]=4 1035 B12R0.5 CC/C=C/CCOCCCCCC 767871e5a0d73feb9eb5a7defcfb49c5 [1,1,0,0,0,0|0,0,1]=3 1036 B12R0.5 CC/C=C/CCOCCCCCF 2b55f02c10e3ccdd6df31b1e0ba6a449 [1,1,0,0,0,0|0,0,1]=3 1037 B12R0.5 CC/C=C/CCOCCCCOC e2b39f528317979cb9d1de9d5265ad73 [1,1,0,0,0,0|0,0,1]=3 1038 B12R0.5 CC/C=C/CCOCCCOCC f88549108281ede7d294c020241ed805 [1,1,0,0,0,0|0,0,1]=3 1039 B12R0.5 CC/C=C/CCOCCCSCC 9f663c630638119270f23bb956669f0a [1,1,0,0,0,0|0,0,1]=3 1040 B12R0.5 CC/C=C/CCOCCOCCC a81f621c6a03f8cc18201edd475fc6b6 [1,1,0,0,0,0|0,0,1]=3 1041 B12R0.5 CC/C=C/CCOCCOCOC 50110fbba6b3b1fd4ca474b0939bcbd6 [1,1,0,0,0,0|1,0,1]=4 1042 B12R0.5 CC/C=C/CCOCOCCCC 6b5b004f900b0398d730b899d2d1e560 [1,1,0,0,0,0|0,0,1]=3 1043 B12R0.5 CC/C=C/CCOCOCCOC f0129d7da362787e2bb4414a41d74f58 [1,1,0,0,0,0|1,0,1]=4 1044 B12R0.5 CC/C=C/CNCCCCCCC be4c202248a8fd68380accb39cdc09e3 [1,1,0,0,0,0|1,0,1]=4 1045 B12R0.5 CC/C=C/CNCCOCCCC 459e30c647913e87db7342aa54566942 [1,1,0,0,0,0|2,0,0]=4 1046 B12R0.5 CC/C=C/COC/C=C/CCCC a7acfb6006ebfc3023bfbb3c89eb8a68 [1,1,0,0,0,0|1,0,0]=3 1047 B12R0.5 CC/C=C/COC/C=C\CCCC c13bca40ea80af75a486721eb6a6d465 [1,1,0,0,0,0|1,0,0]=3 1048 B12R0.5 CC/C=C/COCC#CCCCC 5dc7e17f46758bb7ad22d2b6f92bd41d [1,1,0,0,0,0|1,0,1]=4 1049 B12R0.5 CC/C=C/COCC/C=C\CCC 4961bb78ba2ec0f2dfca6156530a80a7 [1,1,0,0,0,0|1,0,1]=4 1050 B12R0.5 CC/C=C/COCCCCCCC fac406ad60d77dca9871164b96925a1f [1,1,0,0,0,0|1,0,1]=4 1051 B12R0.5 CC/C=C/COCCOCCCC a30c8683d731f6932c452cd44e389592 [1,1,0,0,0,0|2,0,0]=4 1052 B12R0.5 CC/C=C/COCCSCCCC aec64f917c3429cbf1a193f1d5cc13aa [1,1,0,0,0,0|2,0,0]=4 1053 B12R0.5 CC/C=C\CC/C=C/COCCC a9c0fdb8965fb028f1b33f346fa6f630 [1,1,0,0,0,0|1,0,0]=3 1054 B12R0.5 CC/C=C\CC/C=C/COCCF 1bf3d9457b80b8c82981f39cadd0b8e3 [1,1,0,0,0,0|2,0,0]=4 1055 B12R0.5 CC/C=C\CC/C=C/COCCS 25e413cb46fdc5d5d58dac778f8ee120 [1,1,0,0,0,0|2,0,0]=4 1056 B12R0.5 CC/C=C\CC/C=C/COCOC f81ec7a513616cebc6da2a7d2c785bea [1,1,0,0,0,0|2,0,0]=4 1057 B12R0.5 CC/C=C\CC/C=C/COCSC 219b823691c316513a079a9e3d7cb8c9 [1,1,0,0,0,0|2,0,0]=4 1058 B12R0.5 CC/C=C\CCCCCNCCC 69886208ccc481e644ef483e2c35e2e7 [1,1,0,0,0,0|1,0,1]=4 1059 B12R0.5 CC/C=C\CCCCCOCCC c88ae5976e237754dce5795d50b5c6fe [1,1,0,0,0,0|1,0,1]=4 1060 B12R0.5 CC/C=C\CCCCOCCCC ae170e71a50bb653be2dba2606dad3f4 [1,1,0,0,0,0|1,0,1]=4 1061 B12R0.5 CC/C=C\CCCOCCCCC 01c9d8c10a56d308f7978a9ae4df2b5d [1,1,0,0,0,0|0,0,1]=3 1062 B12R0.5 CC/C=C\CCCOCCCCF 28106d9dd37e300748526607af9481f3 [1,1,0,0,0,0|1,0,1]=4 1063 B12R0.5 CC/C=C\CCCOCCCOC 3dfdd39afd911221cb1f661beb344af6 [1,1,0,0,0,0|1,0,1]=4 1064 B12R0.5 CC/C=C\CCCOCCCSC f3cbb40004a47fa1dba403280596ca24 [1,1,0,0,0,0|1,0,1]=4 1065 B12R0.5 CC/C=C\CCCOCCOCC 7e46d22f40d432ce293fce7dd3803f86 [1,1,0,0,0,0|1,0,1]=4 1066 B12R0.5 CC/C=C\CCCOCCSCC 1409eb88e96ebc6f36f4f586f2585649 [1,1,0,0,0,0|1,0,1]=4 1067 B12R0.5 CC/C=C\CCNCCCCCC 49ae72512f311144c2d980bdb59c6aba [1,1,0,0,0,0|1,0,1]=4 1068 B12R0.5 CC/C=C\CCNCCCCCCl 10a0887d17f4423b14b1246554deb482 [1,1,0,0,0,0|1,0,1]=4 1069 B12R0.5 CC/C=C\CCNCCCCCO 5731462f1999a95940d06a77bb9768d7 [1,1,0,0,0,0|1,0,1]=4 1070 B12R0.5 CC/C=C\CCNCCCCOC 77e7588b297370fdf6763b0e1f0b0a94 [1,1,0,0,0,0|1,0,1]=4 1071 B12R0.5 CC/C=C\CCNCCCCSC 1471075d3dd66e6e7d887af54b06ecd5 [1,1,0,0,0,0|1,0,1]=4 1072 B12R0.5 CC/C=C\CCNCCCOCC d4b3fd087d0b1976d28b3ba47caf56aa [1,1,0,0,0,0|1,0,1]=4 1073 B12R0.5 CC/C=C\CCNCCOCCC 6a862fc6d3da86fb243f88c383698c3e [1,1,0,0,0,0|1,0,1]=4 1074 B12R0.5 CC/C=C\CCOC/C=C/CCC f7a4639dad325c3eda76c3941e3ae7b8 [1,1,0,0,0,0|0,0,1]=3 1075 B12R0.5 CC/C=C\CCOC/C=C\CCC fa68dc1e81964ea2119607ae5e8fb79b [1,1,0,0,0,0|0,0,1]=3 1076 B12R0.5 CC/C=C\CCOCC#CCCC edd6ccba394c986cf815bb5b907b47b4 [1,1,0,0,0,0|0,0,2]=4 1077 B12R0.5 CC/C=C\CCOCC/C=C/CC 54389520b8c97ae61cc1fdffd37ad3ab [1,1,0,0,0,0|0,0,2]=4 1078 B12R0.5 CC/C=C\CCOCC/C=C\CC f39996f7261eda408b1814cb9b7c4754 [1,1,0,0,0,0|0,0,2]=4 1079 B12R0.5 CC/C=C\CCOCCCCC#N 3f837ec2be81ca026659778c5ae7f5f6 [1,1,0,0,0,0|0,0,2]=4 1080 B12R0.5 CC/C=C\CCOCCCCC=O 0f8dc160371f8f38e3ede5953a911f59 [1,1,0,0,0,0|0,0,2]=4 1081 B12R0.5 CC/C=C\CCOCCCCCC 117d4e26b4f19482ce885b8297aa45c2 [1,1,0,0,0,0|0,0,1]=3 1082 B12R0.5 CC/C=C\CCOCCCCCF 6fb45212300edcfa96669f4cc7373ec4 [1,1,0,0,0,0|0,0,1]=3 1083 B12R0.5 CC/C=C\CCOCCCCOC c0830f32361612f79a3ed408b3777eb6 [1,1,0,0,0,0|0,0,1]=3 1084 B12R0.5 CC/C=C\CCOCCCCSC a7f64699d7d5aa3195d03046c1e80d72 [1,1,0,0,0,0|0,0,1]=3 1085 B12R0.5 CC/C=C\CCOCCCOCC 4cb33ce7cc497b4d194188c410a4af4c [1,1,0,0,0,0|0,0,1]=3 1086 B12R0.5 CC/C=C\CCOCCCSCC d4fb26b0a1456cfe595b746c9209588c [1,1,0,0,0,0|0,0,1]=3 1087 B12R0.5 CC/C=C\CCOCCOCCC e53279d20d935c326473fc6d43f9d271 [1,1,0,0,0,0|0,0,1]=3 1088 B12R0.5 CC/C=C\CCOCCOCCF 869e78e6277ef47b06c045f872dcd00c [1,1,0,0,0,0|1,0,1]=4 1089 B12R0.5 CC/C=C\CCOCCOCCS 611be20d884f1a2a4b77b8b10628c8b1 [1,1,0,0,0,0|1,0,1]=4 1090 B12R0.5 CC/C=C\CCOCCOCOC 661959662d727d8eb0049dbc8295281d [1,1,0,0,0,0|1,0,1]=4 1091 B12R0.5 CC/C=C\CCOCCSCCC af7d2080691879c7475b87b6afa74a33 [1,1,0,0,0,0|0,0,1]=3 1092 B12R0.5 CC/C=C\CCOCOCCCC 3772ac33b56db56b03077b82a4b58248 [1,1,0,0,0,0|0,0,1]=3 1093 B12R0.5 CC/C=C\CCOCOCCOC c02b95e2ca5fdc8141ad8cef5fd34f55 [1,1,0,0,0,0|1,0,1]=4 1094 B12R0.5 CC/C=C\COC/C=C/CCCC 71dda5b683d0769383141267e6d165b0 [1,1,0,0,0,0|1,0,0]=3 1095 B12R0.5 CC/C=C\COC/C=C\CCCC e9eb74215b54f1b9d166de713ede0398 [1,1,0,0,0,0|1,0,0]=3 1096 B12R0.5 CC/C=C\COCCCCCCC 77fa88fde0cce04fe5442e2aa45989e5 [1,1,0,0,0,0|1,0,1]=4 1097 B12R0.5 CC/C=C\COCCOCCCC d9e6d565fa0e364a43a769ddb105b116 [1,1,0,0,0,0|2,0,0]=4 1098 B12R0.5 CC=CCCCOCC/C=C\CC 8a9ded81b3b0bb8697c200a61a20c1f5 [1,1,0,0,0,0|0,0,2]=4 1099 B12R0.5 CCC#CCCOCC/C=C\CC a2ac2f513364197068cfd2df4b0060d4 [1,1,0,0,0,0|0,0,2]=4 1100 B12R0.5 CCC/C=C/CCCOCCCC d05acb292bb84d287eb30879ca488d91 [1,1,0,0,0,0|2,0,0]=4 1101 B12R0.5 CCC/C=C\CCCOCCCC 2debf5442c9aa795cd474990e79e2484 [1,1,0,0,0,0|2,0,0]=4 1102 B12R0.5 CCC/C=C\CCOCCCCC 933ae5e18f4e71f5abe819a6a4dec18b [1,1,0,0,0,0|0,0,1]=3 1103 B12R0.5 CCC/C=C\CCOCCCCF 43f5b7fc813ef6c81dc3cd917a86c70b [1,1,0,0,0,0|1,0,1]=4 1104 B12R0.5 CCC/C=C\CCOCCCOC d1f8c6975b41bf781665a0bdd6c385bf [1,1,0,0,0,0|1,0,1]=4 1105 B12R0.5 CCC/C=C\CCOCCCSC 48ac0a216e14e604344a96a2a1e27945 [1,1,0,0,0,0|1,0,1]=4 1106 B12R0.5 CCC/C=C\CCOCCOCC 1ee6db777536b74abb1f01c1fbf79aab [1,1,0,0,0,0|1,0,1]=4 1107 B12R0.5 CCC/C=C\CCOCCSCC a0ace1aa7f1195a554d15f0cc252808f [1,1,0,0,0,0|1,0,1]=4 1108 B12R0.5 CCC=CCCC=CCOCCC 8d1ffaf9a3e3b4214165224cd57d1c0b [1,1,0,0,0,0|1,0,0]=3 1109 B12R0.5 CCC=CCCC=CCOCCF 03a4a2865c4fa1da15eed3cdeb28aad3 [1,1,0,0,0,0|2,0,0]=4 1110 B12R0.5 CCC=CCCC=CCOCCS b38700d34a7a386f255c75c6bd480c03 [1,1,0,0,0,0|2,0,0]=4 1111 B12R0.5 CCC=CCCC=CCOCOC bf0d336484a224fa099d68b54d02d516 [1,1,0,0,0,0|2,0,0]=4 1112 B12R0.5 CCC=CCCC=CCOCSC d80adc8b957f078d82ac03bfdeaec4b1 [1,1,0,0,0,0|2,0,0]=4 1113 B12R0.5 CCC=CCCCCCOCCC a1e5b51b658af73fa132b283edd1b582 [1,1,0,0,0,0|1,0,1]=4 1114 B12R0.47 CC/C=C\CCN(C)CCCCC f31c906c96576da517f084ef21cd0ac3 [1,1,0,0,0,0|1,0,1]=4 1115 B12R0.234 C=C(C)CCCOCC/C=C/CC adf71f1b8230b42ab1b442dbfbaab0c5 [1,1,0,0,0,0|0,0,2]=4 1116 B12R0.234 C=C(C)CCCOCC/C=C\CC bf76c732764b20800fbf7b753830ca20 [1,1,0,0,0,0|0,0,2]=4 1117 B12R0.234 CC/C=C/CC/C=C/COC(C)C 5fdc756329015bb7866ada427db3d5af [1,1,0,0,0,0|2,0,0]=4 1118 B12R0.234 CC/C=C/CCOCCCC(=O)C 5ff156b625ccad76578ef5eaf9b4618e [1,1,0,0,0,0|0,0,2]=4 1119 B12R0.234 CC/C=C/CCOCCCC(C)C 1eb99eb54c62da2dd92d4d02a30dd5d1 [1,1,0,0,0,0|0,0,1]=3 1120 B12R0.234 CC/C=C/CCOCCCN(C)C 72bc2463d78afbf908583c068ee16885 [1,1,0,0,0,0|1,0,1]=4 1121 B12R0.234 CC/C=C/CCOCCOC(C)C 219bd986ec826157109d5665af051d22 [1,1,0,0,0,0|1,0,1]=4 1122 B12R0.234 CC/C=C/CCOCCSC(C)C 6f2e7f664c3cb770ba0da7ff420c4480 [1,1,0,0,0,0|1,0,1]=4 1123 B12R0.234 CC/C=C\CC/C=C/COC(C)C 45ec0a4cfe07575074c2b78b993358fe [1,1,0,0,0,0|2,0,0]=4 1124 B12R0.234 CC/C=C\CCCOCCC(C)C 373c5697820a50598e1e95195de64550 [1,1,0,0,0,0|2,0,0]=4 1125 B12R0.234 CC/C=C\CCNCCCC(C)C a2357bcd98e5361c725cecd10de4c1a7 [1,1,0,0,0,0|1,0,1]=4 1126 B12R0.234 CC/C=C\CCOCCCC(=O)C 9a0ab707ba3df73a5a9fc9ca0eaba9d3 [1,1,0,0,0,0|0,0,2]=4 1127 B12R0.234 CC/C=C\CCOCCCC(C)C de3528522f32f7a55475bcc84ceecc46 [1,1,0,0,0,0|0,0,1]=3 1128 B12R0.234 CC/C=C\CCOCCCN(C)C db78c969be61129225a3194ee8e677eb [1,1,0,0,0,0|1,0,1]=4 1129 B12R0.234 CC/C=C\CCOCCOC(C)C ca708b4b216f8a40b56da48e29da2741 [1,1,0,0,0,0|1,0,1]=4 1130 B12R0.234 CC/C=C\CCOCCSC(C)C 0850e07c834667a036c57ea894b80df7 [1,1,0,0,0,0|1,0,1]=4 1131 B12R0.234 CCC=CCCC=CCOC(C)C 3185ea316aadde589d71f599bd55cf6f [1,1,0,0,0,0|2,0,0]=4 1132 B12R0.248 CC/C=C/CCOCCC(C)CC cd83d63bc2f7c80be1e05592fefaa7b8 [1,1,0,0,0,0|0,0,1]=3 1133 B12R0.248 CC/C=C/CCOCCS(=O)CC 7917f13f23802b015fb44e2641664f88 [1,1,0,0,0,0|1,0,1]=4 1134 B12R0.248 CC/C=C\CCCOCC(C)CC 771407146c1c689dc45f268549ae39b5 [1,1,0,0,0,0|2,0,0]=4 1135 B12R0.248 CC/C=C\CCCOC[C@@H](C)CC 48a06bb5b9df5533fce3f2b4bf3a7485 [1,1,0,0,0,0|2,0,0]=4 1136 B12R0.248 CC/C=C\CCCOC[C@H](C)CC 57314bf996e8c033e018c871727680be [1,1,0,0,0,0|2,0,0]=4 1137 B12R0.248 CC/C=C\CCNCCC(C)CC f52f2f89a6091f2873fbbb3ab753bb87 [1,1,0,0,0,0|1,0,1]=4 1138 B12R0.248 CC/C=C\CCOCCC(C)CC 5288cf916f9763485bf9bda2a944de05 [1,1,0,0,0,0|0,0,1]=3 1139 B12R0.248 CC/C=C\CCOCCC(C)OC 4f749b8e15c6b5d70d6ff1efb6df29e7 [1,1,0,0,0,0|1,0,1]=4 1140 B12R0.248 CC/C=C\CCOCCC(S)CC 717cf4257880930a6049ce1bb3c69c2b [1,1,0,0,0,0|0,0,1]=3 1141 B12R0.248 CC/C=C\CCOCCS(=O)CC 9e5521826189214b92bb6d2f1975a686 [1,1,0,0,0,0|1,0,1]=4 1142 B12R0.248 CC/C=C\CCOCC[C@@H](C)CC ed2399f5a157c404c570ce12ccca3dd1 [1,1,0,0,0,0|0,0,1]=3 1143 B12R0.248 CCCCCOCCNC(=O)CC dc63ddbc4f1369b6b1650cd52229a426 [1,1,0,0,0,0|1,0,1]=4 1144 B12R0.248 CCCCCOCCOC(=O)CC c5dcbbaf984711ca2355a0d7dcdc1660 [1,1,0,0,0,0|1,0,1]=4 1145 B12R0.4 CC/C=C/CCOC(C)CC(C)C 3022b59da2b1bc542c311e3f2679121f [1,1,0,0,0,0|1,0,1]=4 1146 B12R0.4 CC/C=C/COCC(=O)CC(C)C ea0d9305b3a45f1d1f0f4bf2f33a3be5 [1,1,0,0,0,0|2,0,0]=4 1147 B12R0.4 CC/C=C\CCOC(C)CC(C)C 6f57319143676b6db8616e2222a1c270 [1,1,0,0,0,0|1,0,1]=4 1148 B12R0.4 CC/C=C\CCO[C@@H](C)CC(C)C 7556695f0700b5319536d9c38bb3d3f7 [1,1,0,0,0,0|1,0,1]=4 1149 B12R0.4 CC/C=C\CCO[C@H](C)CC(C)C 9eb1724e32c16293c887d5c434b95bc6 [1,1,0,0,0,0|1,0,1]=4 1150 B12R0.4 CC/C=C\COCC(=O)CC(C)C c7a68c976505b0ee4502e0173c895200 [1,1,0,0,0,0|2,0,0]=4 1151 B12R0.49 CC/C=C/COCC(=O)C(C)CC 8c54d1f6fd0e669b4317afe0560e7a89 [1,1,0,0,0,0|2,0,0]=4 1152 B12R0.49 CC/C=C\CCOC(C)C(C)CC f98fb203244e837a33b89039158f6a4a [1,1,0,0,0,0|1,0,1]=4 1153 B12R0.49 CC/C=C\COCC(=O)C(C)CC 0d6005c9323435f280a912ffed36d843 [1,1,0,0,0,0|2,0,0]=4 1154 B12R0.121 C#CC(CCC)OCC/C=C\CC 6fb81431bbe18bb3a954e46c10bc3207 [1,1,0,0,0,0|1,0,1]=4 1155 B12R0.121 C=CC(CCC)OCC/C=C\CC 81a74bc5953d7b5aecbd48b4bf31c3a5 [1,1,0,0,0,0|1,0,1]=4 1156 B12R0.121 CC/C=C/CCOC(CC)CCC f09dee902ede92d129ddbdd0ae46da04 [1,1,0,0,0,0|1,0,1]=4 1157 B12R0.121 CC/C=C\CCOC(C#N)CCC 90a3736d6c86bcd925ab6c63febbf788 [1,1,0,0,0,0|1,0,1]=4 1158 B12R0.121 CC/C=C\CCOC(CC)CCC bfef214d76a461052dd4e43a4f1b7470 [1,1,0,0,0,0|1,0,1]=4 1159 B12R0.121 CC/C=C\CCO[C@H](CC)CCC 99b179ef0a3511a83c0a41c9ef8d9740 [1,1,0,0,0,0|1,0,1]=4 1160 B12R0.276 CCCC(=O)NCCNC(=O)CC b34acb0ac4f8f5b80c853213c5dd2688 [1,1,0,0,0,0|2,0,0]=4 1161 B12R0.276 CCCC(=O)OCCOC(C)CC a4a6a2589daf29b089c1916679f2ee47 [1,1,0,0,0,0|1,0,1]=4 1162 B12R0.276 CCCC(=O)OCOCC(=O)CC 1cc4b38efa7c501f34136db55a54cb2f [1,1,0,0,0,0|1,0,1]=4 1163 B12R0.277 CCCC(=O)OCCOCC(C)C 0d6c23e4e2c081651a9e8ed36175fa54 [1,1,0,0,0,0|1,0,1]=4 1164 B12R0.285 CCCC(=O)NCCC(=O)OCC 2a4c82757e413b6c1114d6f6ab2b9be3 [1,1,0,0,0,0|2,0,0]=4 1165 B12R0.285 CCCC(=O)OCOC(=S)CCC 0e6ee6171da93b78fad3e9d87d90c2b1 [1,1,0,0,0,0|1,0,1]=4 1166 B12R0.285 CCCC(=S)OCCC(=O)NCC 29b960f61b430bd7cf3234ded29a671e [1,1,0,0,0,0|1,1,0]=4 1167 B12R0.285 CCCC(=S)OCCC(=O)OCC 4f9217f816851d2da20ce05ae421a9b7 [1,1,0,0,0,0|1,1,0]=4 1168 B12R0.95 C=C(C)CNCOC(=O)CCCC 415cda3b3e26c7cc69b781ce5d4507c5 [1,1,0,0,0,0|1,0,1]=4 1169 B12R0.95 C=C(C)COCOC(=O)CCCC fb1a9bf240c0417ca05159952c7bdae9 [1,1,0,0,0,0|1,0,1]=4 1170 B12R0.95 CCCCC(=O)NCCCC(C)C 4cfbd8cd4787b68f67725c2f6395b859 [1,1,0,0,0,0|1,0,1]=4 1171 B12R0.95 CCCCC(=O)NCCNC(=O)C e8a38432063a6de73e4845c5ae983766 [1,1,0,0,0,0|2,0,0]=4 1172 B12R0.95 CCCCC(=O)NCCOC(C)C 6fdc7d7ca2aabe1a6cdd81d4c3e9f3e6 [1,1,0,0,0,0|2,0,0]=4 1173 B12R0.95 CCCCC(=O)OCNCC(=O)C cac5cc43bee8bcbb528738f26d00aba6 [1,1,0,0,0,0|1,0,1]=4 1174 B12R0.95 CCCCC(=O)OCNCC(C)C 398b5c2dd73854504a11d47800dfa85c [1,1,0,0,0,0|1,0,1]=4 1175 B12R0.95 CCCCC(=O)OCNCC(C)O 44153623ecf39cc3939ac933198b5245 [1,1,0,0,0,0|1,0,1]=4 1176 B12R0.95 CCCCC(=O)OCNC[C@@H](C)O 154d85b5e31ba6f85d6cd62d8271e631 [1,1,0,0,0,0|1,0,1]=4 1177 B12R0.95 CCCCC(=O)OCNC[C@H](C)O e3492d206ed25d7c1e0ea2b05bf1e2bd [1,1,0,0,0,0|1,0,1]=4 1178 B12R0.95 CCCCC(=O)OCOCC(=O)C b946cb4e564cb1d85364c86401444267 [1,1,0,0,0,0|1,0,1]=4 1179 B12R0.95 CCCCC(=O)OCOCC(C)C d415ef9bdea7f5aca14fd71c6f1d7e8e [1,1,0,0,0,0|1,0,1]=4 1180 B12R0.95 CCCCC(=O)OCOCC(C)F 40d933d076752a93a273432d476a671f [1,1,0,0,0,0|1,0,1]=4 1181 B12R0.95 CCCCC(=O)OCOCC(C)S cc9e25e72674342f1ff946950434f5e5 [1,1,0,0,0,0|1,0,1]=4 1182 B12R0.95 CCCCC(=O)OCOC[C@@H](C)F a391fe0f327a4a5711323c423e71c560 [1,1,0,0,0,0|1,0,1]=4 1183 B12R0.95 CCCCC(=O)OCOC[C@H](C)F da7ea854b57a8ef4e443cccb85659192 [1,1,0,0,0,0|1,0,1]=4 1184 B12R0.95 CCCCC(C)OC/C=C/C(C)C 2a404821dd5080c300e6f8cc4ba10a71 [1,1,0,0,0,0|1,0,1]=4 1185 B12R0.95 CCCCC(C)OCCC=C(C)C 3faff752f7207f1d29206420a7d991a0 [1,1,0,0,0,0|1,0,1]=4 1186 B12R0.95 CCCC[C@@H](C)OC/C=C/C(C)C b99adff4efb56acdd2b70ef06ffcc6c4 [1,1,0,0,0,0|1,0,1]=4 1187 B12R0.95 CCCC[C@@H](C)OCCC=C(C)C f1736f75cd619157d3e6db505cb904ef [1,1,0,0,0,0|1,0,1]=4 1188 B12R0.95 CCCC[C@H](C)OC/C=C/C(C)C cfb46c146a0bc65364f96122297a7653 [1,1,0,0,0,0|1,0,1]=4 1189 B12R0.95 CCCC[C@H](C)OCCC=C(C)C e9b3ecd84fe5e92af8484570b120d7b7 [1,1,0,0,0,0|1,0,1]=4 1190 B12R0.102 C=C(C=O)OCOC(=O)CCCC 034ba28ec7dfa7ed91b841c0fdcf8e1d [1,1,0,0,0,0|2,0,0]=4 1191 B12R0.102 CCCCC(=O)NCCC(=O)NC 7e9ab16e55bf7a31d773c0be37914f87 [1,1,0,0,0,0|2,0,0]=4 1192 B12R0.102 CCCCC(=O)NCCC(=O)OC b7c02a04cbcf424ab10080fa486feaaf [1,1,0,0,0,0|2,0,0]=4 1193 B12R0.102 CCCCC(=O)NCCC(C)CC 4f52569bb623d7f775801ee22b5dd215 [1,1,0,0,0,0|1,0,1]=4 1194 B12R0.102 CCCCC(=O)OCOC(C)CC 0457cc5379377c62c69654ef906d7882 [1,1,0,0,0,0|1,0,1]=4 1195 B12R0.102 CCCCC(=O)OCO[C@@H](C)CC 941a8a6f02825443379a92f0d33b4e68 [1,1,0,0,0,0|1,0,1]=4 1196 B12R0.102 CCCCC(=O)OCO[C@H](C)CC fa459134ab25a7d5a1e347714e81ffec [1,1,0,0,0,0|1,0,1]=4 1197 B12R0.102 CCCNC(=O)CCCC(=O)CC 1961ac9f040acfc591cd5015cf471778 [1,1,0,0,0,0|1,0,1]=4 1198 B12R0.102 CCCNC(=O)CCNC(=O)CC 47ea83769e1cd5760ccf18b3a6b57781 [1,1,0,0,0,0|2,0,0]=4 1199 B12R0.103 CCCCC(=O)NC(C)CCCC 53fcf1ea0760468784741571f64c5305 [1,1,0,0,0,0|1,0,1]=4 1200 B12R0.103 CCCCC(=O)N[C@H](C)CCCC 5c605c84e87a34425b647c9c1f530254 [1,1,0,0,0,0|1,0,1]=4 1201 B12R0.111 C#CC(CCCC)OC/C=C/CC d07edc734289b1604247138973205f65 [1,1,0,0,0,0|1,0,1]=4 1202 B12R0.111 C/C=C/CCOC(CC)CCCC 3fe05b068f4333a7583fd3dfbd36f72a [1,1,0,0,0,0|1,0,1]=4 1203 B12R0.111 C=CC(CCCC)OC/C=C/CC bc1eb305d8dce8cd68d3a6bd3c60a4f4 [1,1,0,0,0,0|1,0,1]=4 1204 B12R0.111 CC/C=C/COC(CC)CCCC 71aee288774e884d7d912ceef13ff87a [1,1,0,0,0,0|1,0,1]=4 1205 B12R0.111 CC/C=C\CCN(CC)CCCC aee019664ad984571732e639e0880f79 [1,1,0,0,0,0|2,0,0]=4 1206 B12R0.111 CC/C=C\COC(CC)CCCC c7a2fdd9b0245abb5ee77c31ce869f85 [1,1,0,0,0,0|1,0,1]=4 1207 B12R0.113 C/C=C/CCCC(=O)NC(C)CC d4661c95a92b756a7efea9ecf01b09f3 [1,1,0,0,0,0|2,0,0]=4 1208 B12R0.113 C/C=C/CCCC(=O)N[C@@H](C)CC b8dc4e37c9b930b51c0642b01ec5fddb [1,1,0,0,0,0|2,0,0]=4 1209 B12R0.113 C/C=C/CCCC(=O)N[C@H](C)CC 6b34abe7c9aac9ac8c533fe05f387af3 [1,1,0,0,0,0|2,0,0]=4 1210 B12R0.113 CC/C=C\CCN(C)CC(O)CC a353cd81a46783a2b998fc4beac40558 [1,1,0,0,0,0|2,0,0]=4 1211 B12R0.113 CCCCCNC(=O)CC(C)CC f7055e01481448307fbb56c6ba0a086b [1,1,0,0,0,0|1,0,1]=4 1212 B12R0.113 CCCCCNC(=O)CC(O)CC bec883dd847725cd1242dfce46146527 [1,1,0,0,0,0|1,0,1]=4 1213 B12R0.113 CCCCCNC(=O)C[C@@H](C)CC 6828e80832fb96a9cada9a521fe40da4 [1,1,0,0,0,0|1,0,1]=4 1214 B12R0.113 CCCCCNC(=O)C[C@@H](O)CC af78e84a1cad93172d8bf487f9ae9beb [1,1,0,0,0,0|1,0,1]=4 1215 B12R0.113 CCCCCNC(=O)C[C@H](C)CC 7e5866c799cf610387e8027c8b2d0ed1 [1,1,0,0,0,0|1,0,1]=4 1216 B12R0.113 CCCCCNC(=O)C[C@H](O)CC b1954248f57a23c226e64fa5f3efef57 [1,1,0,0,0,0|1,0,1]=4 1217 B12R0.113 CCOCCNC(=O)CC(C)CC 9d1251c204741441e0c3a765ca28a484 [1,1,0,0,0,0|2,0,0]=4 1218 B12R0.113 CCOCCNC(=O)CC(O)CC 77805c92c48843fa668da5c19057903e [1,1,0,0,0,0|2,0,0]=4 1219 B12R0.113 CCOCCNC(=O)C[C@@H](C)CC b716723c8d7a9c58b353ed4205931e7e [1,1,0,0,0,0|2,0,0]=4 1220 B12R0.113 CCOCCNC(=O)C[C@@H](O)CC b74835b805b9767097a29cf097c58301 [1,1,0,0,0,0|2,0,0]=4 1221 B12R0.113 CCOCCNC(=O)C[C@H](C)CC 73c5a1d1b0deaaf7c4fcbe702963f915 [1,1,0,0,0,0|2,0,0]=4 1222 B12R0.113 CCOCCNC(=O)C[C@H](O)CC c06f877f0d4e82c6e4a3c879474cdc43 [1,1,0,0,0,0|2,0,0]=4 1223 B12R0.113 CCOCCOC(=O)CN(C)CC 07d857c12bb1b18b4dabfcc02cfcf1d4 [1,1,0,0,0,0|2,0,0]=4 1224 B12R0.113 CCSCCNC(=O)CC(C)CC 34c9e25d6de3bfab3354eb23e4577594 [1,1,0,0,0,0|2,0,0]=4 1225 B12R0.113 CCSCCNC(=O)CC(O)CC 701deb0a31bdc68b225c52192e2a6471 [1,1,0,0,0,0|2,0,0]=4 1226 B12R0.113 CCSCCNC(=O)C[C@@H](C)CC ba9ef97d20b6a7d2788235abcd72e3e6 [1,1,0,0,0,0|2,0,0]=4 1227 B12R0.113 CCSCCNC(=O)C[C@@H](O)CC eb47750484af85b2819379ae48ac5499 [1,1,0,0,0,0|2,0,0]=4 1228 B12R0.113 CCSCCNC(=O)C[C@H](C)CC 8bb081bf0269ca39191e27698ff55b2a [1,1,0,0,0,0|2,0,0]=4 1229 B12R0.113 CCSCCNC(=O)C[C@H](O)CC 558f46725a751d78384837015f5d6c21 [1,1,0,0,0,0|2,0,0]=4 1230 B12R0.255 C/C=C/CCCC(=O)NCC(C)C 190f65aac34278a9f29ffa96c5b75eab [1,1,0,0,0,0|2,0,0]=4 1231 B12R0.255 C/C=C/CCCC(=O)NCC(C)O 1ecad7e0d2a75c52520578d6c4d8c33a [1,1,0,0,0,0|2,0,0]=4 1232 B12R0.255 C/C=C/CCCC(=O)NC[C@@H](C)O 7603032758acad2e734d7ef17acfa7ae [1,1,0,0,0,0|2,0,0]=4 1233 B12R0.255 C/C=C/CCCC(=O)NC[C@H](C)O 60135c203d002f9936a5e25a8cdbb87f [1,1,0,0,0,0|2,0,0]=4 1234 B12R0.255 C/C=C/CCOC(C)CCC(C)C 584ebfcefb6382bc775ded1eb48b46fa [1,1,0,0,0,0|1,0,1]=4 1235 B12R0.255 CC/C=C/COC(C)CCC(C)C 59b5aa462fb709eec995d161d948e362 [1,1,0,0,0,0|1,0,1]=4 1236 B12R0.255 CC/C=C\CCN(C)CCC(C)C 2c6dc563982252ae54201c44996e3276 [1,1,0,0,0,0|2,0,0]=4 1237 B12R0.255 CC/C=C\CCN(C)CCC(C)O b7c2210f1c408a015a067169e8b90b61 [1,1,0,0,0,0|2,0,0]=4 1238 B12R0.255 CC/C=C\COC(C)CCC(C)C ed54436a3dd76b8bccb75bf67357d0fc [1,1,0,0,0,0|1,0,1]=4 1239 B12R0.255 CCCCCNC(=O)CCC(C)C 4509dfaa9996ad412b21022ad1197a9e [1,1,0,0,0,0|1,0,1]=4 1240 B12R0.255 CCCCCNC(=O)CCC(C)O 9ae4d2e8fa18dd30b74dc56d421339a8 [1,1,0,0,0,0|1,0,1]=4 1241 B12R0.255 CCCCCNC(=O)CCC(C)S 8fcca9b47bf869f2b2b12ba6d6ba9a1a [1,1,0,0,0,0|1,0,1]=4 1242 B12R0.255 CCCCCNC(=O)CC[C@H](C)S 32f20faa1501cb075be47f0761d88337 [1,1,0,0,0,0|1,0,1]=4 1243 B12R0.255 CCOCCNC(=O)CCC(C)C 1b467f1e3de55b675df3751a1ce524ee [1,1,0,0,0,0|2,0,0]=4 1244 B12R0.255 CCOCCNC(=O)CCC(C)O 7a25dc3ee917c3693b505f95f6452db7 [1,1,0,0,0,0|2,0,0]=4 1245 B12R0.255 CCOCCNC(=O)CCC(C)S ca1e6e1a8a161da46fb784651bf23bd9 [1,1,0,0,0,0|2,0,0]=4 1246 B12R0.255 CCOCCNC(=O)CC[C@H](C)S fdc6bbfcb342f851f333391f1fbf4d7c [1,1,0,0,0,0|2,0,0]=4 1247 B12R0.255 CCOCCOC(=O)COC(C)C c3240d10e7a1edfa9ae26512c8fe6bd2 [1,1,0,0,0,0|2,0,0]=4 1248 B12R0.255 CCSCCNC(=O)CCC(C)C d8bc032baf473b196f6e889922c90bec [1,1,0,0,0,0|2,0,0]=4 1249 B12R0.255 CCSCCNC(=O)CCC(C)O de8ae67b27ff4b882ec4cdd27e2285df [1,1,0,0,0,0|2,0,0]=4 1250 B12R0.255 CCSCCNC(=O)CCC(C)S 18eed4ca1cf7c47507981583b87425dc [1,1,0,0,0,0|2,0,0]=4 1251 B12R0.255 CCSCCNC(=O)CC[C@H](C)S 71ce032c33c0e5c29af6a5fa3104f0a7 [1,1,0,0,0,0|2,0,0]=4 1252 B12R0.648 CC=CCNC(=O)C(=O)CCCC 6d5c7dd007020e2793c64814521e2634 [1,1,0,0,0,0|2,0,0]=4 1253 B12R0.648 CCCCC(=O)N(C)CCOCC ad81704c443b8ff8cc53d7e1cb504d41 [1,1,0,0,0,0|2,0,0]=4 1254 B12R0.648 CCCCCN(C)C(=O)CCCC b8e48fd07fbf020f91bdded241b261bc [1,1,0,0,0,0|1,0,1]=4 1255 B14R0.11 CCC#CC(C)OCOC(=O)CCCC f1668c0748357f28adeb019396d2f75a [0,2,0,0,0,0|0,0,2]=4 1256 B14R0.11 CCCCC(=O)CCCC(=O)NCCBr 124c3cebfc85184c7623b6545704574b [0,2,0,0,0,0|2,0,0]=4 1257 B14R0.11 CCCCC(=O)CCCC(=O)NCCC 1a3a7871c5e6810e81d86fac6fb292e1 [0,2,0,0,0,0|1,0,1]=4 1258 B14R0.11 CCCCC(=O)CCCC(=O)NCCF 789b6856817c22722fc84981f5f57e8b [0,2,0,0,0,0|2,0,0]=4 1259 B14R0.11 CCCCC(=O)CCCC(=O)NCCI 2d3d3142ad0235aad23b8a9b9c04ef90 [0,2,0,0,0,0|2,0,0]=4 1260 B14R0.11 CCCCC(=O)CCCC(=O)NCCO a2c396aefe86eef730b71fcee59b0e59 [0,2,0,0,0,0|2,0,0]=4 1261 B14R0.11 CCCCC(=O)CCCC(=O)NCCS f642441c5efd532343304ae7ebdb0fb0 [0,2,0,0,0,0|2,0,0]=4 1262 B14R0.11 CCCCC(=O)OCNC(C)CCCC 484c5a0d426ce697c3207c41aa8435f3 [0,2,0,0,0,0|0,0,2]=4 1263 B14R0.11 CCCCC(=O)OCN[C@H](C)CCCC 7fe2a4d2ada9dd163fc4703eb89de6e3 [0,2,0,0,0,0|0,0,2]=4 1264 B14R0.11 CCCCC(=O)OCOC(C)COCC 841a814057296f899c7677adf5cddeea [0,2,0,0,0,0|1,0,1]=4 1265 B14R0.80 CC/C=C/CCOCC(CC)CCCC 6b41dfd67eb6de70e0742c47d8bf9f89 [0,2,0,0,0,0|1,0,1]=4 1266 B14R0.80 CC/C=C/CCOC[C@H](CC)CCCC 96e607307eabe26644ab023420b26f8c [0,2,0,0,0,0|1,0,1]=4 1267 B14R0.80 CC/C=C\CCCOC(CC)CCCC bd83c77d1ef8a90a13459370c1f830c3 [0,2,0,0,0,0|1,0,1]=4 1268 B14R0.80 CC/C=C\CCOC/C(=C/CCC)/CC abcd8f2368493cbee58f5ff56a8e6ef9 [0,2,0,0,0,0|1,0,1]=4 1269 B14R0.80 CC/C=C\CCOCC(CC)CCCC 007c7de7744f92bcf5d29072ede929f8 [0,2,0,0,0,0|1,0,1]=4 1270 B14R0.80 CC/C=C\CCOC[C@H](CC)CCCC f16f41d4e41737c12e173de687af57c5 [0,2,0,0,0,0|1,0,1]=4 1271 B14R0.80 CCC/C=C\CCOC(CC)CCCC 5afef22b758dac134140c985ff254cca [0,2,0,0,0,0|1,0,1]=4 1272 B14R0.82 CC/C=C/CCOCC(=O)CC(=O)OC 6215554525d7973df7986da409d82adf [0,2,0,0,0,0|1,0,1]=4 1273 B14R0.82 CC/C=C/CCOCC(=O)NC(C)CC 98aa1f987f434ca5a056c6b822e63821 [0,2,0,0,0,0|1,0,0]=3 1274 B14R0.82 CC/C=C\CCOCC(=O)CC(=O)OC 0d5a15dd79dff53da47db16e57aa2763 [0,2,0,0,0,0|1,0,1]=4 1275 B14R0.82 CC/C=C\CCOCC(=O)NC(C)CC 09322ee300f5734ea6489071e2aee8e4 [0,2,0,0,0,0|1,0,0]=3 1276 B14R0.82 CCC/C=C/CCCC(=O)NC(C)CC e1e782f6b2baa4f4ef0e3cbe55e91647 [0,2,0,0,0,0|2,0,0]=4 1277 B14R0.82 CCC/C=C/CCCC(=O)N[C@@H](C)CC a59be959193edc8def78be80174ed438 [0,2,0,0,0,0|2,0,0]=4 1278 B14R0.82 CCC/C=C/CCCC(=O)N[C@H](C)CC 9415d46c7051350b8dba22c0ac1f7355 [0,2,0,0,0,0|2,0,0]=4 1279 B14R0.83 CC/C=C/CCOCC(=O)C(=O)OCC 69b069ba9ac7a327a5f15707b6ea9719 [0,2,0,0,0,0|1,0,1]=4 1280 B14R0.83 CC/C=C\CCOCC(=O)C(=O)OCC c7eb3b172ff14d8c35ddfc2221bef136 [0,2,0,0,0,0|1,0,1]=4 1281 B14R0.83 CCC/C=C/CCCC(=O)N(C)CCC 3c8c8183182f37d1ab378bef4a3d1818 [0,2,0,0,0,0|2,0,0]=4 1282 B14R0.152 C#C/C(=C/COCOC(=O)CCCC)/C 82e5f82a18da71ecba07c784b2d4ab9b [0,2,0,0,0,0|0,0,2]=4 1283 B14R0.152 C#C/C(=C\COCOC(=O)CCCC)/C bc9a04e057e6ff0da5a3b3b38db07f8a [0,2,0,0,0,0|0,0,2]=4 1284 B14R0.152 CCC(=O)NCCOCC(=O)CCSC 460d9e6796959cf5bbfdf4f741a51fac [0,2,0,0,0,0|2,0,0]=4 1285 B14R0.152 CCC(=O)OCCOCC(=O)CCSC 74387e653ff9d35f822a762f491cdfd8 [0,2,0,0,0,0|2,0,0]=4 1286 B14R0.152 CCCCC(=O)OCNCCC(=O)NC b4c2598de1f0ef27d22091338b766e8b [0,2,0,0,0,0|1,0,1]=4 1287 B14R0.152 CCCCC(=O)OCNCCC(=O)OC 9f380ddc7dc84fffc325c8023e9d5bdc [0,2,0,0,0,0|1,0,1]=4 1288 B14R0.152 CCCCC(=O)OCNCCC(C)CC 6614537e18f8262a9b236b7e3d06bc3b [0,2,0,0,0,0|0,0,2]=4 1289 B14R0.152 CCCCC(=O)OCOCCC(=O)NC f7fbaafcd31f74a020479e64a952feb0 [0,2,0,0,0,0|1,0,1]=4 1290 B14R0.152 CCCCC(=O)OCOCCC(=O)OC ad5b8efed2eb90fa40e917e3bbf7f984 [0,2,0,0,0,0|1,0,1]=4 1291 B14R0.152 CCCCC(=O)OCOCCC(C)CC 4ca4b26ea17e8cd8da49c50d66a9fae1 [0,2,0,0,0,0|0,0,2]=4 1292 B14R0.152 CCCCC(=O)OCOCCC(S)CC 88f361459c6fc856754f9a0647df2cd2 [0,2,0,0,0,0|0,0,2]=4 1293 B14R0.152 CCCCC(=O)OCOCC[C@@H](C)CC 40255f6d38381c338d0d5b3acc6ad931 [0,2,0,0,0,0|0,0,2]=4 1294 B14R0.152 CCCNC(=O)COCCNC(=O)CC e718c48e27b84b522b36cc041087b1e1 [0,2,0,0,0,0|2,0,0]=4 1295 B14R0.152 CCCNC(=O)COCCOC(=O)CC 7c1f2dc41f8a6df50a5d0bbeb63db957 [0,2,0,0,0,0|2,0,0]=4 1296 B14R0.152 CCCOC(=O)COCCNC(=O)CC b5bdc64bf68bb4e132f90aec504bdda2 [0,2,0,0,0,0|2,0,0]=4 1297 B14R0.152 CCCOC(=O)COCCOC(=O)CC fcf3bd54ab62b990ab0b6dba88704684 [0,2,0,0,0,0|2,0,0]=4 1298 B14R0.153 CCCCC(=O)OCNC/C=C/C(=O)O 8f96b65e1b5775fe97ef66a987691678 [0,2,0,0,0,0|1,0,1]=4 1299 B14R0.153 CCCCC(=O)OCNCC=CC(=O)O ec96bdcb7df04ecf871b971f70d3480b [0,2,0,0,0,0|1,0,1]=4 1300 B14R0.153 CCCCC(=O)OCNCCCC(C)C 6c8175ebd41fdf1553c816abc55dfa70 [0,2,0,0,0,0|0,0,2]=4 1301 B14R0.153 CCCCC(=O)OCNCCOC(C)C 926302a772c6dbb5fd34ab1524f1eff0 [0,2,0,0,0,0|1,0,1]=4 1302 B14R0.153 CCCCC(=O)OCOC/C=C/C(=O)O 9f6883f670f9546ba550221b0c59bedd [0,2,0,0,0,0|1,0,1]=4 1303 B14R0.153 CCCCC(=O)OCOCC=CC(=O)O a3bef7e10079dacb44f4fa8eb583d1da [0,2,0,0,0,0|1,0,1]=4 1304 B14R0.153 CCCCC(=O)OCOCCCC(C)C a157f87b62c58de3db04c65b08e21fff [0,2,0,0,0,0|0,0,2]=4 1305 B14R0.153 CCCCC(=O)OCOCCOC(C)C 9d9c57a3aa1b207c39982831c61527d5 [0,2,0,0,0,0|1,0,1]=4 1306 B14R0.153 CCCCC(=O)OCOCCSC(C)C adf7ba2e6b82e7e8e4232bc87a4ce8a8 [0,2,0,0,0,0|1,0,1]=4 1307 B14R0.153 CCCNC(=O)CCCC/C=C/C(C)C 475389cd8a7e26b048ef3d531644e35a [0,2,0,0,0,0|2,0,0]=4 1308 B14R0.153 CCCOC(=O)CCOC/C=C/C(C)C 7a9c59db6772c748b48395d42171ae14 [0,2,0,0,0,0|2,0,0]=4 1309 B14R0.163 CCCCC(=O)NCCCC(=O)OCC 7c53d51dec7dfe8e34765713b3ba0d16 [0,2,0,0,0,0|1,0,1]=4 1310 B14R0.163 CCCCC(=O)OCNCC(=O)NCC 57c1b826576f6c8ee75755e016f3d3cd [0,2,0,0,0,0|1,0,0]=3 1311 B14R0.163 CCCCC(=O)OCNCC(=O)OCC f3e52e9eb535e071cbcb1d72f303745f [0,2,0,0,0,0|1,0,0]=3 1312 B14R0.163 CCCCC(=O)OCNCC(C)OCC 4722decb4f79274f99708c430740ae38 [0,2,0,0,0,0|1,0,1]=4 1313 B14R0.163 CCCCC(=O)OCNCC(O)CCC be67276a454b1ad515a0c33562ba4ee1 [0,2,0,0,0,0|0,0,2]=4 1314 B14R0.163 CCCCC(=O)OCOCC(=O)NCC 9557f443279f8df3430c18ea7617e7c7 [0,2,0,0,0,0|1,0,0]=3 1315 B14R0.163 CCCCC(=O)OCOCC(=O)OCC 9fdeb43eb83ff90036f03264b95940aa [0,2,0,0,0,0|1,0,0]=3 1316 B14R0.163 CCCCC(=O)OCOCC(C)CCC f7ba68b8fad48dccc85163b81a57c8fd [0,2,0,0,0,0|0,0,2]=4 1317 B14R0.163 CCCCC(=O)OCOCC(C)OCC adf9f2ce516fe5f8c4f023aaa2bacf23 [0,2,0,0,0,0|1,0,1]=4 1318 B14R0.163 CCCNC(=O)COCCC(=O)OCC 8dacb65616be6c21e88d7de92f383e31 [0,2,0,0,0,0|2,0,0]=4 1319 B14R0.163 CCCOC(=O)COCCC(=O)OCC a76a321c3dfc85afbfb8f1208316ffa1 [0,2,0,0,0,0|2,0,0]=4 1320 B14R0.163 CCCOC(=O)OCNCC(=O)NCC bb230433699923e6c155b0a2ed9cbe8e [0,2,0,0,0,0|2,0,0]=4 1321 B14R0.163 CCCOC(=O)OCNCC(=O)OCC d68eac57c537b2e481ef545e99299d12 [0,2,0,0,0,0|2,0,0]=4 1322 B14R0.163 CCCOC(=O)OCOCC(=O)NCC b3e716d184ebf289424c25fcf2263cd5 [0,2,0,0,0,0|2,0,0]=4 1323 B14R0.163 CCCOC(=O)OCOCC(=O)OCC 9b156000fedecb3d643af5aceaf45492 [0,2,0,0,0,0|2,0,0]=4 1324 B14R0.163 CCOC(=O)CCOCC(=O)CCSC b0a7a12e15a8cd18c577f4beffb58303 [0,2,0,0,0,0|2,0,0]=4 1325 B14R0.179 C/C=C/C=C/COCC(=O)CCCCC f30960f8bb4c3628bf7fba4670d1be4a [0,2,0,0,0,0|0,0,2]=4 1326 B14R0.179 C/C=C/C=C/COCC(=O)NCCCC f613a7a39317b56a7f22480a32aa5a81 [0,2,0,0,0,0|0,0,2]=4 1327 B14R0.179 C/C=C/C=C/COCC(=O)OCCCC 38837a1df7d673b60c6768c133644500 [0,2,0,0,0,0|0,0,2]=4 1328 B14R0.179 C/C=C/CCCOCC(=O)CCCCC 574a58e1dd8c316d29bfa5edd9098524 [0,2,0,0,0,0|0,0,2]=4 1329 B14R0.179 C/C=C/CCCOCC(=O)NCCCC ce7440cd029ada33b8704eb0ab97bb6a [0,2,0,0,0,0|0,0,2]=4 1330 B14R0.179 C/C=C/CCCOCC(=O)OCCCC 30e92cb2d03aa2c46ef2de1663fcef79 [0,2,0,0,0,0|0,0,2]=4 1331 B14R0.179 C/C=C/CCOCOC(=O)CCCCC d913e724c8f92a1ac655d1caaf21cf51 [0,2,0,0,0,0|0,0,2]=4 1332 B14R0.179 C/C=C/CCOCOC(=O)OCCCC 0196e4382d908272c816109d11b73d97 [0,2,0,0,0,0|0,0,2]=4 1333 B14R0.179 C/C=C\CCCOCC(=O)CCCCC 50a32d393bb8e27f0563de44ba10f643 [0,2,0,0,0,0|0,0,2]=4 1334 B14R0.179 C/C=C\CCCOCC(=O)NCCCC a2410979743c487cf8bca04d1536b93d [0,2,0,0,0,0|0,0,2]=4 1335 B14R0.179 C/C=C\CCCOCC(=O)OCCCC 6f92aa2dbae34c792d0175021fdddfe6 [0,2,0,0,0,0|0,0,2]=4 1336 B14R0.179 CC/C=C/CCOCC(=O)CCCCC c00f29df046fbfc9f6e8fc242a988593 [0,2,0,0,0,0|0,0,0]=2 1337 B14R0.179 CC/C=C/CCOCC(=O)NCCC#N 08c39f6a1db541dfc8ae4c020d365650 [0,2,0,0,0,0|1,0,1]=4 1338 B14R0.179 CC/C=C/CCOCC(=O)NCCCC af9ae8fdd71edf269af4aca2c753b300 [0,2,0,0,0,0|0,0,0]=2 1339 B14R0.179 CC/C=C/CCOCC(=O)NCCOC 33c441361a44603e869d1e5fc3a79656 [0,2,0,0,0,0|1,0,0]=3 1340 B14R0.179 CC/C=C/CCOCC(=O)OCCCC f5671ace348e95ffc5527afcbb90ea3f [0,2,0,0,0,0|0,0,0]=2 1341 B14R0.179 CC/C=C/CCOCC(=O)OCCOC f39ead298600aa1ec70204c85253b63c [0,2,0,0,0,0|1,0,0]=3 1342 B14R0.179 CC/C=C/COCOC(=O)CCCCC b98fa65b698f5f9b514fb877424e4a6a [0,2,0,0,0,0|0,0,0]=2 1343 B14R0.179 CC/C=C/COCOC(=O)OCCCC 00b949a32f4de3e87baffe864cd5bd72 [0,2,0,0,0,0|0,0,0]=2 1344 B14R0.179 CC/C=C\CCCOC(C)CCCCC 6fd63614470d53c05efc9ac250ca93cf [0,2,0,0,0,0|1,0,1]=4 1345 B14R0.179 CC/C=C\CCCO[C@@H](C)CCCCC 5090e7e904211c3ffdb7f698027abffc [0,2,0,0,0,0|1,0,1]=4 1346 B14R0.179 CC/C=C\CCNCC(=O)NCCCC 53caa97dbab3d26380043e77aa4cdaf3 [0,2,0,0,0,0|1,0,0]=3 1347 B14R0.179 CC/C=C\CCOCC(=O)CCCCC f3645a02f982b67fe55981a7ae4c2ad2 [0,2,0,0,0,0|0,0,0]=2 1348 B14R0.179 CC/C=C\CCOCC(=O)NCCC#N 89eb6a973c474a0ea04ccf948cfaaa6b [0,2,0,0,0,0|1,0,1]=4 1349 B14R0.179 CC/C=C\CCOCC(=O)NCCCC 782cdcee79bfb1981ed4402deb4cdf6f [0,2,0,0,0,0|0,0,0]=2 1350 B14R0.179 CC/C=C\CCOCC(=O)NCCOC dd501a9016c3e25caccb53f677d137e4 [0,2,0,0,0,0|1,0,0]=3 1351 B14R0.179 CC/C=C\CCOCC(=O)OCCCC 61bba99d16ade871af5006d952a3ce3e [0,2,0,0,0,0|0,0,0]=2 1352 B14R0.179 CC/C=C\CCOCC(=O)OCCOC 6d1af1f0b83c94f09b55531945fa87ff [0,2,0,0,0,0|1,0,0]=3 1353 B14R0.179 CC/C=C\CCOCC(C)CCCCC eb02359e92c98d099acc637d7952f7fe [0,2,0,0,0,0|1,0,1]=4 1354 B14R0.179 CC/C=C\CCOCC(C)COCCC 68a120d2cdf3b409edb07920fa62d539 [0,2,0,0,0,0|1,0,1]=4 1355 B14R0.179 CC/C=C\COCOC(=O)CCCCC b347320020c51243a01e90fa1abef891 [0,2,0,0,0,0|0,0,0]=2 1356 B14R0.179 CC/C=C\COCOC(=O)OCCCC 9370c846cad34305bf25e531fbc2d21a [0,2,0,0,0,0|0,0,0]=2 1357 B14R0.179 CC=C=CCCOCC(=O)CCCCC 559bcf4b1068f080d185e674d25fc117 [0,2,0,0,0,0|0,0,2]=4 1358 B14R0.179 CC=C=CCCOCC(=O)NCCCC faf8c608d7f993de976eb2edf9d7e200 [0,2,0,0,0,0|0,0,2]=4 1359 B14R0.179 CC=C=CCCOCC(=O)OCCCC 7e49d5068569c43f8d6d15a1b06de0c9 [0,2,0,0,0,0|0,0,2]=4 1360 B14R0.179 CC=CC=CCOCC(=O)CCCCC 7a28143e6b2dec6c2514be27b37d5892 [0,2,0,0,0,0|0,0,2]=4 1361 B14R0.179 CC=CC=CCOCC(=O)NCCCC 9f2fa30aaad3eee600cc727672a596e8 [0,2,0,0,0,0|0,0,2]=4 1362 B14R0.179 CC=CC=CCOCC(=O)OCCCC e79481b903dd07944f1e64998ac7f60e [0,2,0,0,0,0|0,0,2]=4 1363 B14R0.179 CC=CCCCOCC(=O)CCCCC 04055d0bbdf684e254d9de1ab68dc806 [0,2,0,0,0,0|0,0,2]=4 1364 B14R0.179 CC=CCCCOCC(=O)NCCCC 3342a9ea335afa0ce73bf1328110e92d [0,2,0,0,0,0|0,0,2]=4 1365 B14R0.179 CC=CCCCOCC(=O)OCCCC b49ec4e14ef3eb0d2cfa341ea347895b [0,2,0,0,0,0|0,0,2]=4 1366 B14R0.179 CCC#CCCOCC(=O)CCCCC b6cf738d689422910444ba88f60ca590 [0,2,0,0,0,0|0,0,2]=4 1367 B14R0.179 CCC#CCCOCC(=O)NCCCC 03abfbd7eafdb5177cc081344eb3dc65 [0,2,0,0,0,0|0,0,2]=4 1368 B14R0.179 CCC#CCCOCC(=O)OCCCC ba2e68a6fac468d3c35654859a91680c [0,2,0,0,0,0|0,0,2]=4 1369 B14R0.179 CCC#CCOCOC(=O)CCCCC bd0736a044afb1f4186df4e0dd79a79e [0,2,0,0,0,0|0,0,2]=4 1370 B14R0.179 CCC#CCOCOC(=O)OCCCC b8bb834cdf2b54886b84a32b316aa3c6 [0,2,0,0,0,0|0,0,2]=4 1371 B14R0.179 CCC/C=C/CCCC(=O)NCCCC 19b4069bddb00cb86fe4aa6e752eef29 [0,2,0,0,0,0|1,0,0]=3 1372 B14R0.179 CCC/C=C/CCCC(=O)NCCCCl bfa1dd7b5103011831e78d470f9c3b64 [0,2,0,0,0,0|2,0,0]=4 1373 B14R0.179 CCC/C=C/CCCC(=O)NCCCO 1d6eca5ac0aae87bc53b42189e256287 [0,2,0,0,0,0|2,0,0]=4 1374 B14R0.179 CCC/C=C/CCCC(=O)NCCOC 2bc543dcaeb0f9fc88f802ad921f4ea0 [0,2,0,0,0,0|2,0,0]=4 1375 B14R0.179 CCC/C=C/CCCC(=O)NCCSC 7fe42dc131e1d3aab44112fca325a888 [0,2,0,0,0,0|2,0,0]=4 1376 B14R0.179 CCC/C=C/CNCC(=O)NCCCC 9fb726cf4047ef497a1096f36c72dee5 [0,2,0,0,0,0|2,0,0]=4 1377 B14R0.179 CCC/C=C/COCC(=O)CCCCC 2203ab642ec40d798c5a3e2deaebc197 [0,2,0,0,0,0|0,0,2]=4 1378 B14R0.179 CCC/C=C/COCC(=O)NCCCC 838ba9cd5feb7141b1a544c1d237b2f3 [0,2,0,0,0,0|0,0,2]=4 1379 B14R0.179 CCC/C=C/COCC(=O)OCCCC ea800daec42d713f03e10226ce03cfc0 [0,2,0,0,0,0|0,0,2]=4 1380 B14R0.179 CCC/C=C\CCOC(C)CCCCC 84f71c1459684c0f05913e890c76a769 [0,2,0,0,0,0|1,0,1]=4 1381 B14R0.179 CCC/C=C\CCO[C@@H](C)CCCCC b5d3a47545f9bdd33a62cd2094b19f81 [0,2,0,0,0,0|1,0,1]=4 1382 B14R0.179 CCC/C=C\CNCC(=O)NCCCC 3f81560289b278a5f08607e8883b502f [0,2,0,0,0,0|2,0,0]=4 1383 B14R0.179 CCC/C=C\COCC(=O)CCCCC 03b34a81289e46d1e898d106e50f3e5d [0,2,0,0,0,0|0,0,2]=4 1384 B14R0.179 CCC/C=C\COCC(=O)NCCCC 280bb5912431577a3522546121f6eb51 [0,2,0,0,0,0|0,0,2]=4 1385 B14R0.179 CCC/C=C\COCC(=O)OCCCC 32f713fb3c0cccb61be2344f662f310a [0,2,0,0,0,0|0,0,2]=4 1386 B14R0.179 CCCCCC(=O)COCCCOCC 3b388da0a0e95131d9166d4810422e65 [0,2,0,0,0,0|1,0,1]=4 1387 B14R0.179 CCCCCC(=O)COCCCSCC 3cb2d92514b6a5f9a0421515c11c7606 [0,2,0,0,0,0|1,0,1]=4 1388 B14R0.179 CCCCCC(=O)COCCOCCC 2dbe48e4e6ecc39a4ccd3ada2d206e93 [0,2,0,0,0,0|1,0,1]=4 1389 B14R0.179 CCCCCC(=O)COCCSCCC 2ed856ad2a1139a8c5c5acee9575736c [0,2,0,0,0,0|1,0,1]=4 1390 B14R0.179 CCCCCC(=O)OCNCCSCC 91449d697a7d60c3a332b37371c92df8 [0,2,0,0,0,0|1,0,1]=4 1391 B14R0.179 CCCCCC(=O)OCOC/C=C/C=O edef404d389e55d1fd2309c93969046f [0,2,0,0,0,0|1,0,1]=4 1392 B14R0.179 CCCCCC(=O)OCOCCOCC d5d355c377902e1c71414c9e6fce71a6 [0,2,0,0,0,0|1,0,1]=4 1393 B14R0.179 CCCCCC(=O)OCOCCSCC dcbc0795162736f4b147e4b89cd26281 [0,2,0,0,0,0|1,0,1]=4 1394 B14R0.179 CCCCCCOCC(=O)CCCCC 0118cf7fad884aeadae8be1046aa4452 [0,2,0,0,0,0|0,0,2]=4 1395 B14R0.179 CCCCCCOCC(=O)NCCCC f44caf2525a798c57d2f23db8939511b [0,2,0,0,0,0|0,0,2]=4 1396 B14R0.179 CCCCCCOCC(=O)OCCCC e9dc7b5c789cfe5c7586b9645d46f0d7 [0,2,0,0,0,0|0,0,2]=4 1397 B14R0.179 CCCCCNCOC(=O)CCCCC b8e200065ea833ec7034103de5979a0a [0,2,0,0,0,0|0,0,2]=4 1398 B14R0.179 CCCCCNCOC(=O)OCCCC 5dcfb4f176765bbe509a92c6b57ce00c [0,2,0,0,0,0|0,0,2]=4 1399 B14R0.179 CCCCCOCOC(=O)CCCCC 0312c5a2a741ec2260a24293190d14e7 [0,2,0,0,0,0|0,0,2]=4 1400 B14R0.179 CCCCCOCOC(=O)OCCCC 1ad3c72abb5ef3416e19394b6819fcfe [0,2,0,0,0,0|0,0,2]=4 1401 B14R0.179 CCCCNC(=O)COCCCOCC 77e4b2edfaed54e061d221ca7b3066ad [0,2,0,0,0,0|1,0,1]=4 1402 B14R0.179 CCCCNC(=O)COCCCSCC f2d32197e43b74c63ccbcc259df37ef8 [0,2,0,0,0,0|1,0,1]=4 1403 B14R0.179 CCCCNC(=O)COCCOCCC 91a4bac58aa383a984280af363065fda [0,2,0,0,0,0|1,0,1]=4 1404 B14R0.179 CCCCNC(=O)COCCSCCC 093bb31906fab1b7c463b4e0b95cf0a0 [0,2,0,0,0,0|1,0,1]=4 1405 B14R0.179 CCCCOC(=O)COCCCOCC a939cbba55f5e6f1a1d96a06cce9203d [0,2,0,0,0,0|1,0,1]=4 1406 B14R0.179 CCCCOC(=O)COCCCSCC e1d6769d5570a6096df84e46da7cdbe8 [0,2,0,0,0,0|1,0,1]=4 1407 B14R0.179 CCCCOC(=O)COCCOCCC 751d1cb31ec51dfc38058ac602b5af94 [0,2,0,0,0,0|1,0,1]=4 1408 B14R0.179 CCCCOC(=O)COCCSCCC 0edf6128a8e133a424333c9f152cc438 [0,2,0,0,0,0|1,0,1]=4 1409 B14R0.179 CCCCOC(=O)OCNCCOCC 5d061746d6e4119a629aef1f138b4a3c [0,2,0,0,0,0|1,0,1]=4 1410 B14R0.179 CCCCOC(=O)OCNCCSCC d26cc91a77416e1f190c6fa538f8dcdf [0,2,0,0,0,0|1,0,1]=4 1411 B14R0.179 CCCCOC(=O)OCOC/C=C/C=O 0638a5415d88af2a37a446bb18b5adfd [0,2,0,0,0,0|1,0,1]=4 1412 B14R0.179 CCCCOC(=O)OCOCCOCC 928ec91f7fe8a9416d3949956d11b465 [0,2,0,0,0,0|1,0,1]=4 1413 B14R0.179 CCCCOC(=O)OCOCCSCC a78d153ccd2366938f54686caab65828 [0,2,0,0,0,0|1,0,1]=4 1414 B14R0.203 CC/C=C\CCN(C)CC(=O)NCCC 7dae5121fa6ede88412a7a2650474c61 [0,2,0,0,0,0|2,0,0]=4 1415 B14R0.344 CC/C=C/CCOCC(=O)CCC(=O)O 76ea0f23bf7e2de6614fad56e2a183b3 [0,2,0,0,0,0|1,0,1]=4 1416 B14R0.344 CC/C=C/CCOCC(=O)COC(=O)C d2025683bd3c4b8c20b16e70d410da07 [0,2,0,0,0,0|1,0,1]=4 1417 B14R0.344 CC/C=C/CCOCC(=O)NCC(=O)C 07b33162446499debe87a80f19bda76d [0,2,0,0,0,0|1,0,1]=4 1418 B14R0.344 CC/C=C/CCOCC(=O)NCC(C)C 96c09a830ec21cd4670b6cc46d1f7fac [0,2,0,0,0,0|1,0,0]=3 1419 B14R0.344 CC/C=C/CCOCC(C)CCC(C)C f6e23dd41dad78a597ac573fa67b9e56 [0,2,0,0,0,0|1,0,1]=4 1420 B14R0.344 CC/C=C\CCCOC(C)CCC(C)C cf96357c3188fdcf8a1b37037059d758 [0,2,0,0,0,0|1,0,1]=4 1421 B14R0.344 CC/C=C\CCOCC(=O)CCC(=O)O f89fdc24db3db0b7ae3c440d2730a92f [0,2,0,0,0,0|1,0,1]=4 1422 B14R0.344 CC/C=C\CCOCC(=O)COC(=O)C e04d3fa2b4a9861de3606bd67c446bf5 [0,2,0,0,0,0|1,0,1]=4 1423 B14R0.344 CC/C=C\CCOCC(=O)NCC(=O)C 17d54d2fbcc25d5ba0af30b63529dd01 [0,2,0,0,0,0|1,0,1]=4 1424 B14R0.344 CC/C=C\CCOCC(=O)NCC(C)C e0ace294e0ae4327321a5369c47e5733 [0,2,0,0,0,0|1,0,0]=3 1425 B14R0.344 CC/C=C\CCOCC(C)CCC(C)C 239680378523be31e1086dae3d470391 [0,2,0,0,0,0|1,0,1]=4 1426 B14R0.344 CCC/C=C/CCCC(=O)NCC(C)C d0c76344638437a7f2391c600b782efe [0,2,0,0,0,0|2,0,0]=4 1427 B14R0.344 CCC/C=C/CCCC(=O)NCC(C)O af7ce4d71c3360981d44cc9f14bf8ef7 [0,2,0,0,0,0|2,0,0]=4 1428 B14R0.344 CCC/C=C/CCCC(=O)NC[C@@H](C)O 0700d5cc167cab46aed769e43eb42e26 [0,2,0,0,0,0|2,0,0]=4 1429 B14R0.344 CCC/C=C/CCCC(=O)NC[C@H](C)O 1bfcaa9ac2352d4aa24853d7ace223c0 [0,2,0,0,0,0|2,0,0]=4 1430 B14R0.344 CCC/C=C\CCOC(C)CCC(C)C 5722a4003c54192c5e183279844a905e [0,2,0,0,0,0|1,0,1]=4 1431 B14R0.493 C#CCCC(=O)CCOCC/C=C\CC 33d88a7767ec8709c5e9c303d449025b [0,2,0,0,0,0|0,0,2]=4 1432 B14R0.493 C/C=C/C=C/COCOC(=O)CCCC 1b70e6fe3ed1ff7a4deeddef4ff498c6 [0,2,0,0,0,0|0,0,1]=3 1433 B14R0.493 C/C=C/C=C/COCOC(=O)OCCC e4d28de0bba1ae3585811b0ba0607d59 [0,2,0,0,0,0|1,0,1]=4 1434 B14R0.493 C/C=C/CCCOCOC(=O)CCCC f2816722226ec75771456916622f9d71 [0,2,0,0,0,0|0,0,2]=4 1435 B14R0.493 C/C=C\CCCOCOC(=O)CCCC 2ac20f9fef11815796f00cf87d9af355 [0,2,0,0,0,0|0,0,2]=4 1436 B14R0.493 C=C/C=C/CCNCOC(=O)CCCC 86c02bb82844b17e2588a34561ac9b17 [0,2,0,0,0,0|0,0,2]=4 1437 B14R0.493 CC/C=C/CCOCOC(=O)CCCC 17652dd88b6807bb5f13bdba574e18c6 [0,2,0,0,0,0|0,0,0]=2 1438 B14R0.493 CC/C=C/CCOCOC(=O)OCCC a470bd45581d0e4693b8afd170700d29 [0,2,0,0,0,0|1,0,0]=3 1439 B14R0.493 CC/C=C/COCCCC(=O)NCCC c83732a61e342b4f01ebc431486bca1d [0,2,0,0,0,0|2,0,0]=4 1440 B14R0.493 CC/C=C\CCCCOC(C)CCCC 10737019114d93ee5d03dd66d9b3b087 [0,2,0,0,0,0|1,0,1]=4 1441 B14R0.493 CC/C=C\CCCOCC(=O)CCSC 1738612bcc950159cb2c881c6bb6be6a [0,2,0,0,0,0|1,0,0]=3 1442 B14R0.493 CC/C=C\CCCOCC(=O)NCCC 12b7b51f2786fa5222493b106f874c4b [0,2,0,0,0,0|1,0,0]=3 1443 B14R0.493 CC/C=C\CCCOCC(=O)OCCC 5419437ee502b2a2aace8acf5db6d490 [0,2,0,0,0,0|1,0,0]=3 1444 B14R0.493 CC/C=C\CCOCCC(=O)OCCC 26f7ee6593e2cac396595c9908876007 [0,2,0,0,0,0|1,0,0]=3 1445 B14R0.493 CC/C=C\CCOCCC(C)CCCC a678425e8bcc3104a996c797a77ac3b0 [0,2,0,0,0,0|1,0,1]=4 1446 B14R0.493 CC/C=C\CCOCOC(=O)CCCC ff8a63d3fe0179f60ddc0732ab5880df [0,2,0,0,0,0|0,0,0]=2 1447 B14R0.493 CC/C=C\CCOCOC(=O)OCCC 3158f823b7fddee81e2ce3816b00e0c0 [0,2,0,0,0,0|1,0,0]=3 1448 B14R0.493 CC/C=C\COCCCC(=O)NCCC 7ebfc9385d562e871d783e2a168a19df [0,2,0,0,0,0|2,0,0]=4 1449 B14R0.493 CC=C=CCCOCOC(=O)CCCC 041585b5f0ef0526403552c47baf114d [0,2,0,0,0,0|0,0,2]=4 1450 B14R0.493 CC=CC=CCOCOC(=O)CCCC e4255ba1b3b601441694e146faa59869 [0,2,0,0,0,0|0,0,1]=3 1451 B14R0.493 CC=CC=CCOCOC(=O)OCCC 9dd004cdff58328fde9ea030213228a9 [0,2,0,0,0,0|1,0,1]=4 1452 B14R0.493 CC=CCCCOCOC(=O)CCCC 7f9988220c72caa61f523622a6321525 [0,2,0,0,0,0|0,0,2]=4 1453 B14R0.493 CCC#CCCOCOC(=O)CCCC a70d21153f50609ea24049d319f020ea [0,2,0,0,0,0|0,0,2]=4 1454 B14R0.493 CCC/C=C/CCCOC(C)CCCC c8270425c02be6cfa323a5dc838a38b0 [0,2,0,0,0,0|1,0,1]=4 1455 B14R0.493 CCC/C=C/COCCC(=O)OCCC d9f77c006da4d9148aea6e48e05fcd43 [0,2,0,0,0,0|2,0,0]=4 1456 B14R0.493 CCC/C=C/COCOC(=O)CCCC 4681d1be1b8bd04e34e31b08e25439a8 [0,2,0,0,0,0|0,0,0]=2 1457 B14R0.493 CCC/C=C/COCOC(=O)OCCC 829a6563184d5729c745ae65878d0618 [0,2,0,0,0,0|1,0,0]=3 1458 B14R0.493 CCC/C=C\CCCOC(C)CCCC 9750c913a264fcc38c7f91cc69011556 [0,2,0,0,0,0|1,0,1]=4 1459 B14R0.493 CCC/C=C\CCOCC(=O)CCSC 042d89e9b105f6ae37d2ce3b72ec15d6 [0,2,0,0,0,0|1,0,0]=3 1460 B14R0.493 CCC/C=C\CCOCC(=O)NCCC 483558895bc849c15a9d88968b65c660 [0,2,0,0,0,0|1,0,0]=3 1461 B14R0.493 CCC/C=C\CCOCC(=O)OCCC 9f41886faeec9db1acda8cb50e0b8c2f [0,2,0,0,0,0|1,0,0]=3 1462 B14R0.493 CCC/C=C\COCCC(=O)OCCC 13e5d09867bf0e32c55e8264e889d961 [0,2,0,0,0,0|2,0,0]=4 1463 B14R0.493 CCC/C=C\COCOC(=O)CCCC 1adbb27ccd1f5f43d8aab72794a70de4 [0,2,0,0,0,0|0,0,0]=2 1464 B14R0.493 CCC/C=C\COCOC(=O)OCCC 6548e880009630b07a3a5cbc16fe70f4 [0,2,0,0,0,0|1,0,0]=3 1465 B14R0.493 CCCC#CCOCOC(=O)CCCC 640b861d85c1d6a983cd2008cb2a87df [0,2,0,0,0,0|0,0,2]=4 1466 B14R0.493 CCCC/C=C\CCOC(C)CCCC 82398f0da6af5066274f71c73e86e7dc [0,2,0,0,0,0|1,0,1]=4 1467 B14R0.493 CCCC=C=CCCOC(C)CCCC b551d4a31721916694e68dd163622bcf [0,2,0,0,0,0|1,0,1]=4 1468 B14R0.493 CCCCC(=O)OCNCCCCCCl 83b2736b83ed3172c4250bf6393f4f1a [0,2,0,0,0,0|0,0,2]=4 1469 B14R0.493 CCCCC(=O)OCNCCCCCO b60584104236fa035d45a784f13cfd31 [0,2,0,0,0,0|0,0,2]=4 1470 B14R0.493 CCCCC(=O)OCNCCCCOC 10922b1fb0e4a35903c3ebbb1376b55e [0,2,0,0,0,0|0,0,2]=4 1471 B14R0.493 CCCCC(=O)OCNCCCCSC be88c7a3e4221afe37e822fcd500c87e [0,2,0,0,0,0|0,0,2]=4 1472 B14R0.493 CCCCC(=O)OCNCCCOCC c4a5d6c296bd2920521755eb4f397537 [0,2,0,0,0,0|0,0,2]=4 1473 B14R0.493 CCCCC(=O)OCNCCOCCC ce511084fd17e9bf7ba7173973b41e24 [0,2,0,0,0,0|0,0,2]=4 1474 B14R0.493 CCCCC(=O)OCNCCOCCO e54a43d338051054865543b46060d927 [0,2,0,0,0,0|1,0,1]=4 1475 B14R0.493 CCCCC(=O)OCNCCOCCS 6462c52ef4d41d4d83a96bb2c1d853f0 [0,2,0,0,0,0|1,0,1]=4 1476 B14R0.493 CCCCC(=O)OCNCCSCCO 2d1bb2770ffdc37396cae596ecae25e3 [0,2,0,0,0,0|1,0,1]=4 1477 B14R0.493 CCCCC(=O)OCOCCCCOC 773854cb2b0a62b07dea8c2a76ee095a [0,2,0,0,0,0|0,0,2]=4 1478 B14R0.493 CCCCC(=O)OCOCCCCSC c51813584819bbf43b76c0ea4de8aabd [0,2,0,0,0,0|0,0,2]=4 1479 B14R0.493 CCCCC(=O)OCOCCCOCC 93323e52babd90bcdcabed5b422abd07 [0,2,0,0,0,0|0,0,2]=4 1480 B14R0.493 CCCCC(=O)OCOCCCSCC 3d455fd6e9a6c3f69ca7fc35ef312ede [0,2,0,0,0,0|0,0,2]=4 1481 B14R0.493 CCCCC(=O)OCOCCOCCC 28cf712694b84056dfead068fa0acf1f [0,2,0,0,0,0|0,0,2]=4 1482 B14R0.493 CCCCC(=O)OCOCCOCCF a97b96666bb2a3c61c15ab769ca36797 [0,2,0,0,0,0|1,0,1]=4 1483 B14R0.493 CCCCC(=O)OCOCCOCCS 5c1d0e975b79a2692793646ca528356f [0,2,0,0,0,0|1,0,1]=4 1484 B14R0.493 CCCCC(=O)OCOCCSCCC 45bfefd2b079ff43e772ee24d36b0ad6 [0,2,0,0,0,0|0,0,2]=4 1485 B14R0.493 CCCCCCNCOC(=O)CCCC 3c245901af015ed4550896848bcb2aeb [0,2,0,0,0,0|0,0,2]=4 1486 B14R0.493 CCCCCCOCOC(=O)CCCC a8465b59cdd186ce35d3d692e00f7582 [0,2,0,0,0,0|0,0,2]=4 1487 B14R0.529 CCCCC(=O)OCN(C)CCOCC 82289caab35c6304e554b83db35acc66 [0,2,0,0,0,0|1,0,1]=4 1488 B14R0.529 CCCCCN(C)COC(=O)CCCC a8e02e967f82afac861b6b9bafe1972d [0,2,0,0,0,0|0,0,2]=4 1489 B14R0.1095 C#CCOC(C)C(=O)OCC/C=C/CC cdd595e19b0995ebd69abb5ccbadcda8 [0,2,0,0,0,0|0,0,2]=4 1490 B14R0.1095 C#CCOC(C)C(=O)OCC/C=C\CC da163b2e692badc79360162fad4f7375 [0,2,0,0,0,0|0,0,2]=4 1491 B14R0.1095 C#CCOC(C)C(=O)OCCC=CCC 9d2f48342a938b8a1cce50101322f657 [0,2,0,0,0,0|0,0,2]=4 1492 B14R0.1095 C=CCOC(C)C(=O)OCC/C=C/CC 31fe42e79c1c899f886dc8944b5c6ce1 [0,2,0,0,0,0|0,0,2]=4 1493 B14R0.1095 C=CCOC(C)C(=O)OCC/C=C\CC 31bf269671c46bf91cc4ed7642825714 [0,2,0,0,0,0|0,0,2]=4 1494 B14R0.1095 C=CCOC(C)C(=O)OCCC=CCC b54cd1fbb7653f1c0a1dc886683e36a5 [0,2,0,0,0,0|0,0,2]=4 1495 B14R0.1095 CC/C=C/CCOC(=O)C(C)OCC#N a4c4aa98d78dd57b1bc0fc26237b0187 [0,2,0,0,0,0|1,0,1]=4 1496 B14R0.1095 CC/C=C/CCOC(=O)C(C)OCC=O 9dda5a9bacd7bb2d08d6e55a8cd00676 [0,2,0,0,0,0|1,0,1]=4 1497 B14R0.1095 CC/C=C/CCOC(=O)C(C)OCCC 71869ed1b3d273cce850d8d966e677b4 [0,2,0,0,0,0|0,0,0]=2 1498 B14R0.1095 CC/C=C/CCOC(=O)C(C)OCCF 9fa6a62b0de0660069d60962a87fc3c6 [0,2,0,0,0,0|1,0,0]=3 1499 B14R0.1095 CC/C=C/CCOC(=O)C(C)OCCS c18483aa0fb15caf1e34a04c319d2a23 [0,2,0,0,0,0|1,0,0]=3 1500 B14R0.1095 CC/C=C/CCOC(=O)C(C)OCOC 6f8ac4cd8b5a0b5c96da1c9d1bd54d8d [0,2,0,0,0,0|1,0,0]=3 1501 B14R0.1095 CC/C=C/CCOC(=O)C(C)OCSC 547182df4e90ba96ed2ab3c151280c38 [0,2,0,0,0,0|1,0,0]=3 1502 B14R0.1095 CC/C=C/CCOC(C)C(=O)NCCC fc2cd5cb7b3f64ded4809a435e9ed87c [0,2,0,0,0,0|1,0,0]=3 1503 B14R0.1095 CC/C=C/CCOC(C)C(=O)OCCC 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CCC=CCCOC(=O)C(C)OCOC 9249382300931056bcc7baf844ac2b99 [0,2,0,0,0,0|1,0,0]=3 1525 B14R0.1095 CCC=CCCOC(=O)C(C)OCSC 8e4123505be1788787f3366b65b2d9a9 [0,2,0,0,0,0|1,0,0]=3 1526 B14R0.195 CCC(=O)NCCNC(=O)CCC(C)C a2b054d6c0c23a3ff96b604db28063b9 [0,2,0,0,0,0|2,0,0]=4 1527 B14R0.195 CCC(=O)NCCNC(=O)CCC(C)O c3d5f9679d1d96803d9b7d05ad6c667f [0,2,0,0,0,0|2,0,0]=4 1528 B14R0.195 CCC(=O)NCCNC(=O)CCC(C)S de718a767628c34c892896eac9c2c84d [0,2,0,0,0,0|2,0,0]=4 1529 B14R0.195 CCC(=O)NCCNC(=O)CC[C@H](C)S 48c926d2144d95e616e825302ce1a9f2 [0,2,0,0,0,0|2,0,0]=4 1530 B14R0.218 CCCCC(=O)CCCC(=O)N(C)CC 914605e4c2c0abdcc2b6b255b68afa48 [0,2,0,0,0,0|2,0,0]=4 1531 B14R0.226 CCC(=O)NCCNC(=O)CCCCF 322c8fbcad124356a400ed3c75f6e1c7 [0,2,0,0,0,0|2,0,0]=4 1532 B14R0.226 CCC(=O)NCCNC(=O)CCCCO 67606ad6019184ca9b98ba3800aa93aa [0,2,0,0,0,0|2,0,0]=4 1533 B14R0.226 CCC(=O)NCCNC(=O)CCCCS 6963e1037dcac3f550a2ebae34ff043c [0,2,0,0,0,0|2,0,0]=4 1534 B14R0.226 CCC(=O)NCCNC(=O)CCCOC 9ba445f1708157f527ed4670f3a49117 [0,2,0,0,0,0|2,0,0]=4 1535 B14R0.226 CCC(=O)NCCNC(=O)CCCSC aa0fd0ba11c745d700351315ecbd14d8 [0,2,0,0,0,0|2,0,0]=4 1536 B14R0.226 CCCCCC(=O)NCCNC(=O)CC db6a1cd8d7fa538c36abaee561fde23d [0,2,0,0,0,0|2,0,0]=4 1537 B14R0.226 CCCCCC(=O)OCOCC(=O)CC 83383de065549b1b5871019d9513851d [0,2,0,0,0,0|1,0,1]=4 1538 B14R0.226 CCCCNC(=O)CCCNC(=O)CC 1c19973e231d615f8cef337a02be614f [0,2,0,0,0,0|2,0,0]=4 1539 B14R0.226 CCCCNC(=O)NCCNC(=O)CC dfb9896982005589a556649e01a4d18f [0,2,0,0,0,0|2,0,0]=4 1540 B14R0.226 CCCCOC(=O)OCOCC(=O)CC 5cd147af3cfdedc1bfb9d377a4e5ba7c [0,2,0,0,0,0|1,0,1]=4 1541 B14R0.226 CCCOCC(=O)NCCNC(=O)CC b1e4a61443e005f72bac26cb5ef12af8 [0,2,0,0,0,0|2,0,0]=4 1542 B14R0.226 CCCSCC(=O)NCCNC(=O)CC 533b47cb27f0625cf63f686a8a2311ef [0,2,0,0,0,0|2,0,0]=4 1543 B14R0.226 CCOCCC(=O)NCCNC(=O)CC ef36821d822164045229783f9ddfb048 [0,2,0,0,0,0|2,0,0]=4 1544 B14R0.226 CCSCCC(=O)NCCNC(=O)CC ad60939b4c9c80e7a073f22766f67163 [0,2,0,0,0,0|2,0,0]=4 1545 B14R0.310 CCCC(O)C(=O)NCCNC(=O)CC 44d816b5056b86f5a5500e18435483c5 [0,2,0,0,0,0|2,0,0]=4 1546 B14R0.310 CCC[C@@H](O)C(=O)NCCNC(=O)CC 0ba919f6cd8f93b40cfd324faaa0bdb1 [0,2,0,0,0,0|2,0,0]=4 1547 B14R0.310 CCC[C@H](O)C(=O)NCCNC(=O)CC 5274dd8a498613342dae582096833564 [0,2,0,0,0,0|2,0,0]=4 1548 B14R0.2341 CCC(=O)NCCNC(=O)CC(C)CC 1009798778f9ce79c262c4ab129e0c60 [0,2,0,0,0,0|2,0,0]=4 1549 B14R0.2341 CCC(=O)NCCNC(=O)CC(O)CC dfdab39cd5e3e70344901e3f956ac898 [0,2,0,0,0,0|2,0,0]=4 1550 B14R0.2341 CCC(=O)NCCNC(=O)C[C@@H](C)CC 133972ab1b67d9fce90a1cb144c651df [0,2,0,0,0,0|2,0,0]=4 1551 B14R0.2341 CCC(=O)NCCNC(=O)C[C@@H](O)CC 7e3794606a989df5017282f4152e249f [0,2,0,0,0,0|2,0,0]=4 1552 B14R0.2341 CCC(=O)NCCNC(=O)C[C@H](C)CC c2df48bed0f6fcc9178bbb42b9601652 [0,2,0,0,0,0|2,0,0]=4 1553 B14R0.2341 CCC(=O)NCCNC(=O)C[C@H](O)CC 56757d255b5ffc0f420a837e5e0e18e7 [0,2,0,0,0,0|2,0,0]=4 1554 B14R0.231 CCCCNC(=O)CNC/C=C/C(C)C a5605ca1169ccef5b4fab84d39721217 [0,2,0,0,0,0|2,0,0]=4 1555 B14R0.231 CCCCOC(=O)COC/C=C/C(C)C 051bdfc612468f940e90087a380880d9 [0,2,0,0,0,0|2,0,0]=4 1556 B14R0.39 CCOC(=O)CCNC(=O)CCC(C)C 628b34f984ec8dac41ca40775aa7c968 [0,2,0,0,0,0|2,0,0]=4 1557 B14R0.39 CCOC(=O)CCNC(=O)CCC(C)O 38e922509ae1efa0f71a1228dbeb2dbf [0,2,0,0,0,0|2,0,0]=4 1558 B14R0.39 CCOC(=O)CCNC(=O)CCC(C)S b8da813c3962571335be772c13ad3bdc [0,2,0,0,0,0|2,0,0]=4 1559 B14R0.39 CCOC(=O)CCNC(=O)CC[C@H](C)S f6ff68cd2e537a171aa34ccac3a6cf48 [0,2,0,0,0,0|2,0,0]=4 1560 B14R0.138 CC/C=C/CCOC(=O)C(C)OC(C)C 94865dbd56460dd74f778d88d337a81d [0,2,0,0,0,0|1,0,0]=3 1561 B14R0.138 CC/C=C\CCOC(=O)C(C)OC(C)C fc35e0bb7798f4e401f0b4564263675f [0,2,0,0,0,0|1,0,0]=3 1562 B14R0.138 CCC=CCCOC(=O)C(C)OC(C)C 040a822dcc05866b5654d3bd0f494a56 [0,2,0,0,0,0|1,0,0]=3 1563 B14R0.140 CC/C=C\CCOC(C)CCC(C)CC 7408e446d7c4d1feecfc8ff7882a1b4a [0,2,0,0,0,0|1,0,1]=4 1564 B14R0.154 CCCCC(=O)NC(C)CC(=O)OCC 0f3b01ac5923bcd12010f41ca8d163f7 [0,2,0,0,0,0|2,0,0]=4 1565 B14R0.207 CCCCC(=O)NCC(C)C(=O)OCC 7852ff6c56538e728949b8a2662bd94b [0,2,0,0,0,0|2,0,0]=4 1566 B14R0.409 CCOC(=O)CCNC(=O)CC(C)CC c9b97c238edba7b76b4baf79bb340ce6 [0,2,0,0,0,0|2,0,0]=4 1567 B14R0.409 CCOC(=O)CCNC(=O)CC(O)CC 2ae3feb20b131fa78aa7f74796c1e498 [0,2,0,0,0,0|2,0,0]=4 1568 B14R0.409 CCOC(=O)CCNC(=O)C[C@@H](C)CC 21be1d9afcc014ac7f08e3b078929a24 [0,2,0,0,0,0|2,0,0]=4 1569 B14R0.409 CCOC(=O)CCNC(=O)C[C@@H](O)CC 89a3bd6e279fa3db7db936c63c2ddcff [0,2,0,0,0,0|2,0,0]=4 1570 B14R0.409 CCOC(=O)CCNC(=O)C[C@H](C)CC 6c028e5ab2d2865816f417ba1765eb06 [0,2,0,0,0,0|2,0,0]=4 1571 B14R0.409 CCOC(=O)CCNC(=O)C[C@H](O)CC f8d1e645cda02538848ca683360e58ad [0,2,0,0,0,0|2,0,0]=4 1572 B14R0.410 CCCC(O)C(=O)NCCC(=O)OCC 6141ad9b24004e785fd01d845c86d71d [0,2,0,0,0,0|2,0,0]=4 1573 B14R0.410 CCC[C@@H](O)C(=O)NCCC(=O)OCC 9d11af39c6ef7ac598bfb9f3972b8127 [0,2,0,0,0,0|2,0,0]=4 1574 B14R0.410 CCC[C@H](O)C(=O)NCCC(=O)OCC 6ae31525b3193be166487cca8ceeca49 [0,2,0,0,0,0|2,0,0]=4 1575 B14R0.597 CCCCC(=O)N(C)CCC(=O)OCC f28accf682d9946495842552ebb89148 [0,2,0,0,0,0|2,0,0]=4 1576 B14R0.2432 CCCCCC(=O)NCCC(=O)OCC 3525954f2ab45fd50e38bab45743fd4e [0,2,0,0,0,0|2,0,0]=4 1577 B14R0.2432 CCCCCC(=O)OCOC(=S)CCC 3868902d0b1f4c8867cf0b42aa449b65 [0,2,0,0,0,0|1,0,1]=4 1578 B14R0.2432 CCCCNC(=O)CCCC(=O)CCC 19e44711f82bb43f0de8c7c4765a5b25 [0,2,0,0,0,0|1,0,1]=4 1579 B14R0.2432 CCCCNC(=O)CCCC(=O)NCC 6c6419ee2cb53f5a8dba98e13d60fd8d [0,2,0,0,0,0|2,0,0]=4 1580 B14R0.2432 CCCCNC(=O)CCCC(=O)OCC b3279c5f981c8e84073ca73a660f52c3 [0,2,0,0,0,0|2,0,0]=4 1581 B14R0.2432 CCCCNC(=O)NCCC(=O)OCC 59018e0dc40f3d6b952b7a18b04cbce7 [0,2,0,0,0,0|2,0,0]=4 1582 B14R0.2432 CCCCOC(=O)OCOC(=S)CCC b71205c34abdd56efd2af8e0cc3ab26a [0,2,0,0,0,0|1,0,1]=4 1583 B14R0.2432 CCCOCC(=O)NCCC(=O)OCC 0d1c948028ad135db680671b4d0ad021 [0,2,0,0,0,0|2,0,0]=4 1584 B14R0.2432 CCCSCC(=O)NCCC(=O)OCC e56e5284bd130b8f71638e2efc6eccdc [0,2,0,0,0,0|2,0,0]=4 1585 B14R0.2432 CCOC(=O)CCNC(=O)CCCCF 6c53c174a7a408438cdaaca2430487e8 [0,2,0,0,0,0|2,0,0]=4 1586 B14R0.2432 CCOC(=O)CCNC(=O)CCCCO 9e1c11513203acd095d5453b6aa9065c [0,2,0,0,0,0|2,0,0]=4 1587 B14R0.2432 CCOC(=O)CCNC(=O)CCCCS fefda8f537929d290ed597c76ff17e05 [0,2,0,0,0,0|2,0,0]=4 1588 B14R0.2432 CCOC(=O)CCNC(=O)CCCOC 9a355ccef2c039050b6e4723ec50fbcb [0,2,0,0,0,0|2,0,0]=4 1589 B14R0.2432 CCOC(=O)CCNC(=O)CCCSC c1dfc172ab3deb2530791bca074fc3f4 [0,2,0,0,0,0|2,0,0]=4 1590 B14R0.2432 CCOC(=O)CCNC(=O)CCSCC 41c75b2a4d139b362f8f7d7b841e868c [0,2,0,0,0,0|2,0,0]=4 1591 B14R0.2432 CCOCCC(=O)NCCC(=O)OCC b03f1498ec4db782e198bfebda06a4c3 [0,2,0,0,0,0|2,0,0]=4 1592 B14R0.1444 CC/C=C/CN(C)CC(=O)NCCCC c78c26cdff4bb829f55010ff5e7b84aa [0,2,0,0,0,0|2,0,0]=4 1593 B14R0.1444 CCCCCC(C)OC(=O)CNCCC af3f47d48a49ba072daa30da8fe27bb5 [0,2,0,0,0,0|0,0,2]=4 1594 B14R0.1444 CCCCCC(C)OC(=O)COCCC 788d305bfb388e9f58753d01db57be0f [0,2,0,0,0,0|0,0,2]=4 1595 B14R0.86 C#CC(CCCCC)OCC/C=C\CC ad9c430456b995647419fa39038f429c [0,2,0,0,0,0|1,0,1]=4 1596 B14R0.86 C#C[C@H](CCCCC)OCC/C=C\CC 7f82631bdffe8bcc7e4988df958356ba [0,2,0,0,0,0|1,0,1]=4 1597 B14R0.86 C=CC(CCCCC)OCC/C=C\CC 56c03ac7c01350f0423c062c4dbe75b1 [0,2,0,0,0,0|1,0,1]=4 1598 B14R0.86 C=C[C@H](CCCCC)OCC/C=C\CC c43d9a1ce09704f2b08b6c76c7279b22 [0,2,0,0,0,0|1,0,1]=4 1599 B14R0.86 CC/C=C\CCOC(CC)CCCCC c34350e32dbd711f24db03677eae3c9e [0,2,0,0,0,0|1,0,1]=4 1600 B14R0.86 CC/C=C\CCO[C@@H](CC)CCCCC a85a141c318d93c9f93a41cf2207ee49 [0,2,0,0,0,0|1,0,1]=4 1601 B14R0.87 C=CCC(CCCC)OCC/C=C\CC 7ea59d14e05d504ebe187b4f583159c9 [0,2,0,0,0,0|1,0,1]=4 1602 B14R0.87 CC/C=C\CCOC(CCC)CCCC 7b0ce4e72416039461929ceae1877ede [0,2,0,0,0,0|1,0,1]=4 1603 B14R0.95 CC/C=C\CCOC(CC)CC(C)CC 503501d2d669bd469c2f5f6f5d4eb41c [0,2,0,0,0,0|1,0,1]=4 1604 B14R0.333 CC/C=C\CCNC(CCCC)C(=O)N f1357b71e1efa44e6e62ccfce50ca7c0 [0,2,0,0,0,0|1,0,1]=4 1605 B14R0.333 CC/C=C\CCNC(CCCC)C(=O)O b9a4b34839e6847652f7d2d9561a6cfc [0,2,0,0,0,0|1,0,1]=4 1606 B14R0.333 CC/C=C\CCN[C@@H](CCCC)C(=O)O 12a5a5591fbbe5ed771995f70807298f [0,2,0,0,0,0|1,0,1]=4 1607 B14R0.333 CC/C=C\CCN[C@H](CCCC)C(=O)O ce2fd862ba0eea45fdb0cdd84debb047 [0,2,0,0,0,0|1,0,1]=4 1608 B14R0.333 CC/C=C\CCOC(CCCC)C(=O)O fcf7c24e3b5164cbdbad8c5725027ee2 [0,2,0,0,0,0|0,0,1]=3 1609 B14R0.333 CC/C=C\CCOC(CCSC)C(=O)N 8401caf6a87e1a555f93f25ddb0c0642 [0,2,0,0,0,0|1,0,1]=4 1610 B14R0.333 CC/C=C\CCOC(CCSC)C(=O)O 966208bb543f618b628b1bd6b3874ead [0,2,0,0,0,0|1,0,1]=4 1611 B14R0.333 CC/C=C\CCO[C@@H](CCCC)C(=O)O 43d89dd87625042694902adb248c6a7a [0,2,0,0,0,0|0,0,1]=3 1612 B14R0.333 CC/C=C\CCO[C@H](CCCC)C(=O)O 30e0eaf159fb3ea55d141035f16334b2 [0,2,0,0,0,0|0,0,1]=3 1613 B14R0.486 CC/C=C\CCOC(CC)C(C)CCC 220e0e5edf0c279257ffc06377723c7d [0,2,0,0,0,0|1,0,1]=4 1614 B14R0.73 CC/C=C\CCOC(C)CC(C)CCC 427c955173eadc9439f473c00e5a6d38 [0,2,0,0,0,0|1,0,1]=4 1615 B14R0.2 CC/C=C/COCC(=O)NCCC(C)C f1a755f6a1520193026fd80617b20a40 [0,2,0,0,0,0|2,0,0]=4 1616 B14R0.2 CC/C=C\CCOC(C)CCCC(C)C d3576220769541de524486649db1d277 [0,2,0,0,0,0|1,0,1]=4 1617 B14R0.2 CC/C=C\COCC(=O)NCCC(C)C e6721482a5a1107b979644c3f69a589b [0,2,0,0,0,0|2,0,0]=4 1618 B14R0.145 C=CCCCCC(C)OCC/C=C\CC 85b4f99007609cb55123c1360e19e058 [0,2,0,0,0,0|1,0,1]=4 1619 B14R0.145 C=CCCCC[C@@H](C)OCC/C=C\CC 09154c1fda725ab3ca5d8dc0f4276daf [0,2,0,0,0,0|1,0,1]=4 1620 B14R0.145 CC/C=C/CCOC(C)CCCCCC bae12f2695625be64ee33b622e6fc365 [0,2,0,0,0,0|1,0,1]=4 1621 B14R0.145 CC/C=C/COCC(=O)NCCCCC f3dbf8ad1105242b62c8d11bf1fe0888 [0,2,0,0,0,0|2,0,0]=4 1622 B14R0.145 CC/C=C/COCC(=O)NCCOCC 2de3c5508d0e194c619cbf08976465d9 [0,2,0,0,0,0|2,0,0]=4 1623 B14R0.145 CC/C=C/COCC(=O)OCCOCC 667744e5bb81e20e5765e257e1de4b50 [0,2,0,0,0,0|2,0,0]=4 1624 B14R0.145 CC/C=C\CCOC(C)CCCCCC 86a46dd76de764a15e096300f5771701 [0,2,0,0,0,0|1,0,1]=4 1625 B14R0.145 CC/C=C\CCOC(C)COCCCC 0f088b9e067b2adc65ca8260a262e36d [0,2,0,0,0,0|1,0,1]=4 1626 B14R0.145 CC/C=C\CCO[C@@H](C)CCCCCC b6cc3e207164dd1a9780047155547760 [0,2,0,0,0,0|1,0,1]=4 1627 B14R0.145 CC/C=C\CCO[C@H](C)CCCCCC 307c89f7a55dfcb1dca7dc5d2ac3dbcb [0,2,0,0,0,0|1,0,1]=4 1628 B14R0.145 CC/C=C\COCC(=O)NCCCCC 5b572bbe4a4ce7e9bdf30c892a126312 [0,2,0,0,0,0|2,0,0]=4 1629 B14R0.145 CC/C=C\COCC(=O)NCCOCC 507d236e4284e658e53cc07ed007deac [0,2,0,0,0,0|2,0,0]=4 1630 B14R0.145 CC/C=C\COCC(=O)OCCOCC e2ebb618f4066982d280a2ec5392b78a [0,2,0,0,0,0|2,0,0]=4 1631 B14R0.145 CCCCCCOC(=O)OCNCCC 278256989199621b61414e80b9a2073f [0,2,0,0,0,0|0,0,2]=4 1632 B14R0.145 CCCCCCOC(=O)OCOCCC 783cc82afda11721b1858a645ead8dfd [0,2,0,0,0,0|0,0,2]=4 1633 B14R0.2256 CC/C=C/CNC(C)C(=O)NCCCC fe75c88a33833d4dce08a1e57f4f0d41 [0,2,0,0,0,0|2,0,0]=4 1634 B14R0.2256 CC/C=C/CN[C@@H](C)C(=O)OCCCC 83eec2fc278b8cd3204a309e1f4db444 [0,2,0,0,0,0|2,0,0]=4 1635 B14R0.2256 CC/C=C/COC(C)C(=O)NCCCC 82ca5d06de7a35131a0ce3641239372a [0,2,0,0,0,0|2,0,0]=4 1636 B14R0.2256 CC/C=C/COC(C)C(=O)OCCCC d976046554c1152af76521bfeb21d540 [0,2,0,0,0,0|2,0,0]=4 1637 B14R0.2256 CC/C=C/CO[C@@H](C)C(=O)OCCCC 154b7caf0d3da0919ddc0aaea845592c [0,2,0,0,0,0|2,0,0]=4 1638 B14R0.2256 CC/C=C\COC(C)C(=O)NCCCC f2fdda88348420095ca1673430c204d2 [0,2,0,0,0,0|2,0,0]=4 1639 B14R0.2256 CC/C=C\COC(C)C(=O)OCCCC 25a80649a276e343180b1a05af483d06 [0,2,0,0,0,0|2,0,0]=4 1640 B12R1.8 CCCCCOC1CC=CCC1 98926859eebd82806784f0435b91a1e2 [1,0,0,1,0,0|0,0,1]=3 1641 B12R1.8 CCCCNCC1CC=CCC1 1378cb96c226671017080cc72fbe3fe5 [1,0,0,1,0,0|2,0,0]=4 1642 B12R1.8 CCCCOCC1CC=CCC1 8b42516e7a8d45b86de09b1ea298113b [1,0,0,1,0,0|2,0,0]=4 1643 B12R1.8 CCCCOC[C@@H]1CC=CCC1 bd9bd0c77657d1c69dd6a8d247fa4f59 [1,0,0,1,0,0|2,0,0]=4 1644 B12R1.8 CCCCOC[C@H]1CC=CCC1 902459b8d198eb52aa8be77fa2fd34d6 [1,0,0,1,0,0|2,0,0]=4 1645 B12R1.8 CCOCCOC1CC=CCC1 68e6970175f1427517178e2928b4bb66 [1,0,0,1,0,0|1,0,1]=4 1646 B12R1.8 CCSCCOC1CC=CCC1 7b023b783e94abda52b959e52acaa164 [1,0,0,1,0,0|1,0,1]=4 1647 B12R1.8 COCCCOC1CC=CCC1 348a69afb0dc71606c21fd2f5bc01459 [1,0,0,1,0,0|1,0,1]=4 1648 B12R1.8 CSCCCOC1CC=CCC1 735411b3c62c671e9e3f5f8621a284d0 [1,0,0,1,0,0|1,0,1]=4 1649 B12R1.8 FCCCCOC1CC=CCC1 2b62fbcb75fb6b628f70edba98f81373 [1,0,0,1,0,0|1,0,1]=4 1650 B12R1.37 CC/C=C/CCOC1CCCC1 ddcd652bd1d83f24d68ba31d077aa1e0 [1,0,0,1,0,0|0,0,1]=3 1651 B12R1.37 CC/C=C/CCOC1CCOC1 e71a62ce6e40c42916357f3beb14d861 [1,0,0,1,0,0|1,0,1]=4 1652 B12R1.37 CC/C=C/CCO[C@@H]1CCOC1 572c6c7203a5e9d8df98fa156d85dcda [1,0,0,1,0,0|1,0,1]=4 1653 B12R1.37 CC/C=C/CCO[C@H]1CCOC1 294ff299dbdaaa385d929647c0b694f0 [1,0,0,1,0,0|1,0,1]=4 1654 B12R1.37 CC/C=C\CCNC1CCCC1 43ec2659d1850e69fc9e66343408bde1 [1,0,0,1,0,0|1,0,1]=4 1655 B12R1.37 CC/C=C\CCOC1CCCC1 6697c31ca6f1d37dedfede98e97cbc54 [1,0,0,1,0,0|0,0,1]=3 1656 B12R1.37 CC/C=C\CCOC1CCCO1 6e8584a96797af38114b7c67b2bf9a63 [1,0,0,1,0,0|1,0,1]=4 1657 B12R1.37 CC/C=C\CCOC1CCOC1 84a0e980d618b007b8ec839d82c5571e [1,0,0,1,0,0|1,0,1]=4 1658 B12R1.37 CC/C=C\CCOC1CCSC1 6941d240f20eae382b9fbfbde93c7bf1 [1,0,0,1,0,0|1,0,1]=4 1659 B12R1.37 CC/C=C\CCO[C@@H]1CCOC1 792eebefd512a71ef8cd02555a7fd0ee [1,0,0,1,0,0|1,0,1]=4 1660 B12R1.37 CC/C=C\CCO[C@@H]1CCSC1 230561fc84e8d6ea170786957ca4325b [1,0,0,1,0,0|1,0,1]=4 1661 B12R1.37 CC/C=C\CCO[C@H]1CCOC1 19c2e2a799fdc63b30cd31f35256abef [1,0,0,1,0,0|1,0,1]=4 1662 B12R1.37 CC/C=C\CCO[C@H]1CCSC1 f7d8fe5f50778d50d647ea5f48c7165c [1,0,0,1,0,0|1,0,1]=4 1663 B12R1.37 CCCCCOCC1C=CCC1 c9dca47e92cd405ce08214550be345a6 [1,0,0,1,0,0|0,0,1]=3 1664 B12R1.37 CCOCCOCC1C=CCC1 38b3e2148a18fe0a671fd14062662064 [1,0,0,1,0,0|1,0,1]=4 1665 B12R1.37 CCSCCOCC1C=CCC1 7f7396339fccb0a475617f86cc572fb3 [1,0,0,1,0,0|1,0,1]=4 1666 B12R1.37 COCCCOCC1C=CCC1 fe286d7c09bf30a28fef900a90f18867 [1,0,0,1,0,0|1,0,1]=4 1667 B12R1.37 CSCCCOCC1C=CCC1 0c4c562dbc84e25ba063eba160e32e8b [1,0,0,1,0,0|1,0,1]=4 1668 B12R1.37 FCCCCOCC1C=CCC1 61a2417e5ca3fc21dd6b2ed7e2aa7f7d [1,0,0,1,0,0|1,0,1]=4 1669 B12R1.271 CC/C=C\CCOCC1CC1C e335a6508b1ad1959ae41e0d6b295cf8 [1,0,0,1,0,0|0,0,1]=3 1670 B12R1.271 CC/C=C\CCOC[C@@H]1C[C@@H]1C 6d4f9c0de2c74dba23e1533f9c62da65 [1,0,0,1,0,0|0,0,1]=3 1671 B12R1.271 CC/C=C\CCOC[C@@H]1C[C@@H]1F 7b7a5099298cec9878a911d8336335ba [1,0,0,1,0,0|1,0,1]=4 1672 B12R1.271 CC/C=C\CCOC[C@@H]1C[C@H]1C c7d9685b17f3ef06a5708bb0a56fe53c [1,0,0,1,0,0|0,0,1]=3 1673 B12R1.271 CC/C=C\CCOC[C@@H]1C[C@H]1F 8ccb808d8c3c70445f67f5d497eaffdc [1,0,0,1,0,0|1,0,1]=4 1674 B12R1.271 CC/C=C\CCOC[C@H]1C[C@@H]1C d7e359e0d32d40cdce54fb37dce53d07 [1,0,0,1,0,0|0,0,1]=3 1675 B12R1.271 CC/C=C\CCOC[C@H]1C[C@@H]1F 10c89492221bbf617d4dc5714d3d2f9c [1,0,0,1,0,0|1,0,1]=4 1676 B12R1.271 CC/C=C\CCOC[C@H]1C[C@H]1F 089b737c4a4a4e4872a2de3df282ce25 [1,0,0,1,0,0|1,0,1]=4 1677 B12R1.272 CC/C=C/CCOCC1CCC1 fdf8a4aa27d1e6c6521de234bbe3075f [1,0,0,1,0,0|0,0,1]=3 1678 B12R1.272 CC/C=C/CCOCC1CCO1 06f9c5c8f3b9b25de7cd8ecc6143241e [1,0,0,1,0,0|1,0,1]=4 1679 B12R1.272 CC/C=C/CCOCC1COC1 a920ae90e759ddb3cd53d45b21d27f97 [1,0,0,1,0,0|1,0,1]=4 1680 B12R1.272 CC/C=C/CCOC[C@@H]1CCO1 24f357144ee542e215f06be61418035e [1,0,0,1,0,0|1,0,1]=4 1681 B12R1.272 CC/C=C/CCOC[C@H]1CCO1 e82cf79bedcd052732107fc5dbd3e1ca [1,0,0,1,0,0|1,0,1]=4 1682 B12R1.272 CC/C=C\CCCOC1CCC1 04818645248df48aea14de639580243d [1,0,0,1,0,0|2,0,0]=4 1683 B12R1.272 CC/C=C\CCNCC1CCC1 d1f3e6237d4a55221d06075a1449b5da [1,0,0,1,0,0|1,0,1]=4 1684 B12R1.272 CC/C=C\CCOCC1CCC1 a255c129dfe819aec185d6bf0dadf4b2 [1,0,0,1,0,0|0,0,1]=3 1685 B12R1.272 CC/C=C\CCOCC1CCO1 d72edb3c02467c01b6c84f08945bc4fe [1,0,0,1,0,0|1,0,1]=4 1686 B12R1.272 CC/C=C\CCOCC1COC1 035065423d1d45a345b2e46db79f38b2 [1,0,0,1,0,0|1,0,1]=4 1687 B12R1.272 CC/C=C\CCOCC1CSC1 c1696b424801c57f2ec611c8dbe0ed8d [1,0,0,1,0,0|1,0,1]=4 1688 B12R1.272 CC/C=C\CCOC[C@@H]1CCO1 816b0b353805cac2b24465f6d6c80ffa [1,0,0,1,0,0|1,0,1]=4 1689 B12R1.272 CC/C=C\CCOC[C@H]1CCO1 a74b1357ea077f9723931124392672fb [1,0,0,1,0,0|1,0,1]=4 1690 B12R1.372 CC/C=C\CCN1CCCC1C c7f71f4338d6fb4c00fe43e6fecf909e [1,0,0,1,0,0|1,0,1]=4 1691 B12R1.372 CC/C=C\CCN1CCC[C@@H]1C d6f568d4a07abd58ef3be0dc16c1f24b [1,0,0,1,0,0|1,0,1]=4 1692 B12R1.372 CC/C=C\CCN1CCC[C@H]1C e453e34575c359471a87bf401da319fc [1,0,0,1,0,0|1,0,1]=4 1693 B12R1.373 CC/C=C\CCN1CCC1CC 75a63674204adb9294faacc2cf9b86f0 [1,0,0,1,0,0|1,0,1]=4 1694 B12R1.375 CC/C=C/CCOCCC1CC1 bbc732a8813ae5b13863d4692a40692b [1,0,0,1,0,0|0,0,1]=3 1695 B12R1.375 CC/C=C\CCCOCC1CC1 39d5d02c2f79e8a31cb42c8d30a22c63 [1,0,0,1,0,0|2,0,0]=4 1696 B12R1.375 CC/C=C\CCNCCC1CC1 b9cacdd0db747dbd38c27b9616b5b576 [1,0,0,1,0,0|1,0,1]=4 1697 B12R1.375 CC/C=C\CCOCCC1CC1 073e70c1da7f5298d8249e19c76d6cd1 [1,0,0,1,0,0|0,0,1]=3 1698 B12R1.375 CC/C=C\CCOCCN1CC1 d864fef7d793237f496a88be166663e3 [1,0,0,1,0,0|1,0,1]=4 1699 B12R1.375 CCCCNCCCC=C1CC1 db6610d5f1d5cb44da155d1248689d47 [1,0,0,1,0,0|2,0,0]=4 1700 B12R1.375 CCCCOCCCC=C1CC1 c9b22eb69b7d2c369d022dc387d49eee [1,0,0,1,0,0|2,0,0]=4 1701 B12R1.383 CC/C=C\CCN[C@@H]1CC[C@H]1C 57d51e9c047e41dbc3daf13a69a8887f [1,0,0,1,0,0|1,0,1]=4 1702 B12R1.383 CC/C=C\CCN[C@H]1CC[C@H]1C 8dd2dcbf62be9c74e8bd04d8fa3b715d [1,0,0,1,0,0|1,0,1]=4 1703 B12R1.383 CC/C=C\CCOC1COC1C 1db8293ad36bf186175702c77daa82ea [1,0,0,1,0,0|1,0,1]=4 1704 B12R1.1414 CCCCNC1CCC=CCC1 82ba0a96517acc657003bb802a373e14 [1,0,0,1,0,0|2,0,0]=4 1705 B12R1.28 CC/C=C/CN1CCCC(=O)C1 ab6ba7f27b9c1721bb8000d415d741bf [1,0,0,1,0,0|2,0,0]=4 1706 B12R1.32 CCCC(=O)CN1CC=CCC1 f32a8ba69cd95b1db8ab959ffa6ed515 [1,0,0,1,0,0|2,0,0]=4 1707 B12R1.32 CCCC(C)OC1CC=CCC1 f15094d2530c2ec1537f491b4684b9d4 [1,0,0,1,0,0|1,0,1]=4 1708 B12R1.51 CCCC(=O)COC1C=CCC1 e2d01f708d19cdc3147b14c6e250c5b8 [1,0,0,1,0,0|2,0,0]=4 1709 B12R1.51 CCCC(C)OCC1C=CCC1 43ab0838cf1a7854b1b87a2fb89ef3ad [1,0,0,1,0,0|1,0,1]=4 1710 B12R1.62 CC/C=C\CCOC1CC(C1)C ad1e1cde29ff2fd6660f867e517cf8e0 [1,0,0,1,0,0|1,0,1]=4 1711 B12R1.310 CCCC(=O)OCCOC1CC1 c6355cd2c488ee5c8251c82f789bd58c [1,0,0,1,0,0|1,0,1]=4 1712 B12R1.923 CC/C=C/CCOC(C)C1CC1 742a307a6f0235ed7ebca69a76feaa60 [1,0,0,1,0,0|1,0,1]=4 1713 B12R1.923 CC/C=C/COCC(=O)C1CC1 e09410851f4e6e3419534fa7138b53af [1,0,0,1,0,0|2,0,0]=4 1714 B12R1.923 CC/C=C\CCOC(C)C1CC1 3f2957118176c275e7af752aab7474a7 [1,0,0,1,0,0|1,0,1]=4 1715 B12R1.923 CC/C=C\CCO[C@@H](C)C1CC1 107b58c7a5130da3e531c28345e8701f [1,0,0,1,0,0|1,0,1]=4 1716 B12R1.923 CC/C=C\CCO[C@H](C)C1CC1 19f2717ceb3a082623d8b388d840d368 [1,0,0,1,0,0|1,0,1]=4 1717 B12R1.923 CC/C=C\COCC(=O)C1CC1 30eceba5ae319b400efc8bd3faaf6d26 [1,0,0,1,0,0|2,0,0]=4 1718 B12R1.7 CC/C=C/COC1CCC(C1)C 8e481785b4567dc3f7dd9b60b0272bd4 [1,0,0,1,0,0|1,0,1]=4 1719 B12R1.7 CC/C=C\CCN1CCC(C1)C bc265d5e22c56c48835403f8bd4eb10c [1,0,0,1,0,0|2,0,0]=4 1720 B12R1.30 CCCCC(=O)N1CC=CCC1 0661eeb363c70199bf33ad14fdd97871 [1,0,0,1,0,0|1,0,0]=3 1721 B12R1.30 CCCCC(=O)N1CCOCC1 d7c3947703a9973f25e7aaa74a3642c8 [1,0,0,1,0,0|2,0,0]=4 1722 B12R1.30 CCCCC(=O)N1CCSCC1 8749c8419fb5e70aad6376250fccc329 [1,0,0,1,0,0|2,0,0]=4 1723 B12R1.30 CCCNC(=O)C1CC=CCO1 7c84774ce20577ba203e6a8fe63bcd63 [1,0,0,1,0,0|2,0,0]=4 1724 B12R1.30 CCCNC(=O)N1CC=CCC1 39b3ca8a16a0c18ce36a176db27d91c8 [1,0,0,1,0,0|2,0,0]=4 1725 B12R1.30 CCOCC(=O)N1CC=CCC1 14e7458d15fd90d786bb596fc048da0d [1,0,0,1,0,0|2,0,0]=4 1726 B12R1.30 CCSCC(=O)N1CC=CCC1 c460aa0fe21209b82223213643556b75 [1,0,0,1,0,0|2,0,0]=4 1727 B12R1.30 COCCC(=O)N1CC=CCC1 87e9d4df0de067b12273119d9adc1c44 [1,0,0,1,0,0|2,0,0]=4 1728 B12R1.30 CSCCC(=O)N1CC=CCC1 f874b80f6c76e3c5927452b78d77dd36 [1,0,0,1,0,0|2,0,0]=4 1729 B12R1.30 O=C(CCCF)N1CC=CCC1 a2a2d489bb984ce633d21a724d0ff0bc [1,0,0,1,0,0|2,0,0]=4 1730 B12R1.30 O=C(CCCS)N1CC=CCC1 3207763701702c6a19208314e23a1ce1 [1,0,0,1,0,0|2,0,0]=4 1731 B12R1.53 CCCCC(=O)NC1CC=CC1 6c62bbe2c8f876e28946966fd7b4bd6b [1,0,0,1,0,0|1,0,0]=3 1732 B12R1.53 CCCCC(=O)NC1CCCC1 ffe0944aa7dffceb8b72efd3831dfd91 [1,0,0,1,0,0|1,0,1]=4 1733 B12R1.53 CCCCC(=O)NC1CCOC1 1e674d26de54780cb9628df6d4fb4e31 [1,0,0,1,0,0|2,0,0]=4 1734 B12R1.53 CCCCC(=O)NC1CCSC1 8d2892d72c79b4f9d447384de9033c10 [1,0,0,1,0,0|2,0,0]=4 1735 B12R1.53 CCCCC(=O)N[C@@H]1CCOC1 8c781642c4110288eee66bf3ddb78c79 [1,0,0,1,0,0|2,0,0]=4 1736 B12R1.53 CCCCC(=O)N[C@H]1CCOC1 aba5d341347845e888fc9699ad516b66 [1,0,0,1,0,0|2,0,0]=4 1737 B12R1.53 CCCCC(C)OC1C=CCC1 b16162fecfdc2fa2f33bbc2f938db5aa [1,0,0,1,0,0|1,0,1]=4 1738 B12R1.53 CCCCC(C)OC1CC=CC1 153449c44cabccf1800547d9b71cdf9b [1,0,0,1,0,0|1,0,1]=4 1739 B12R1.53 CCCNC(=O)CC1C=CCC1 729a8d23531ba68737f77f0040980056 [1,0,0,1,0,0|1,0,0]=3 1740 B12R1.53 CCCNC(=O)NC1CC=CC1 027f393bb14489995ae0a971ca8ace5d [1,0,0,1,0,0|2,0,0]=4 1741 B12R1.53 CCNCC(=O)OC1CCCC1 51ab5c2281a6d5777297a8ad97e1e293 [1,0,0,1,0,0|1,0,1]=4 1742 B12R1.53 CCOCC(=O)NC1CC=CC1 cdcaedb192d5dcd398f0073037046b6c [1,0,0,1,0,0|2,0,0]=4 1743 B12R1.53 CCSCC(=O)NC1CC=CC1 60724b72603ad1a920cd3d83ad33e109 [1,0,0,1,0,0|2,0,0]=4 1744 B12R1.53 COCCC(=O)NC1CC=CC1 0ad3e1394eeb6c8f47b95759dbd6e37a [1,0,0,1,0,0|2,0,0]=4 1745 B12R1.53 CSCCC(=O)NC1CC=CC1 0e1759cb9c2f0a2679902ae8c1d02349 [1,0,0,1,0,0|2,0,0]=4 1746 B12R1.53 O=C(CC1C=CCC1)NCCBr 5db1eb7da4d23a08e352e7b724d172ae [1,0,0,1,0,0|2,0,0]=4 1747 B12R1.53 O=C(CC1C=CCC1)NCCF 727c71a4833e7faff5bfba840966cda4 [1,0,0,1,0,0|2,0,0]=4 1748 B12R1.53 O=C(CC1C=CCC1)NCCI 0fee5ea56a08b064819b4d22397ad7af [1,0,0,1,0,0|2,0,0]=4 1749 B12R1.53 O=C(CC1C=CCC1)NCCO 8175c90757938308a2b990cd103d447f [1,0,0,1,0,0|2,0,0]=4 1750 B12R1.53 O=C(CC1C=CCC1)NCCS 66d5090c80176c254eaeb832b1d7ff69 [1,0,0,1,0,0|2,0,0]=4 1751 B12R1.53 O=C(CCCF)NC1CC=CC1 606beb05bac1304a98c034bc3809d6c2 [1,0,0,1,0,0|2,0,0]=4 1752 B12R1.53 O=C(CCCS)NC1CC=CC1 bd8851b30513cdc0bbfdd15957b806fd [1,0,0,1,0,0|2,0,0]=4 1753 B12R1.321 CCOCC1CCCCC(=O)N1 837f1b31b3c4f97e4560e55cd1cb9fa1 [1,0,0,1,0,0|2,0,0]=4 1754 B12R1.460 CCCCC(=O)N1CCCC1C 0e685beda1e3f942c1d396019f13eace [1,0,0,1,0,0|1,0,1]=4 1755 B12R1.460 CCCCC(=O)N1CCC[C@@H]1C ff6830781dd2398e65d557bbf6a92b09 [1,0,0,1,0,0|1,0,1]=4 1756 B12R1.460 CCCCC(=O)N1CCC[C@H]1C 7cd825f92b5fd2c2a80cf77f89d0bab0 [1,0,0,1,0,0|1,0,1]=4 1757 B12R1.460 CCCCC(=O)N1CCSC1C 1ae6f8361645ff8d730e43bba70e450c [1,0,0,1,0,0|2,0,0]=4 1758 B12R1.461 CCCCC(=O)N1CCC1CC e4dad2be972f5b43fc5990bed70296fa [1,0,0,1,0,0|1,0,1]=4 1759 B12R1.463 CCCCC(=O)NCC1CCC1 837d5edf6ff5895d223cac23d3f6a0b1 [1,0,0,1,0,0|1,0,1]=4 1760 B12R1.463 CCCCC(=O)NCC1CCO1 96b15e76e76b9d2796080949aec5b5f5 [1,0,0,1,0,0|2,0,0]=4 1761 B12R1.463 CCCCC(=O)NC[C@@H]1CCO1 64196eeddbabe38738c525466f4abdc7 [1,0,0,1,0,0|2,0,0]=4 1762 B12R1.463 CCCCC(=O)NC[C@H]1CCO1 f9383e72ece39bd8abbc96006bf26b2a [1,0,0,1,0,0|2,0,0]=4 1763 B12R1.463 CCCCC(=O)OCN1CCC1 7cd2f5991bec06bfe0baf55a37c781bb [1,0,0,1,0,0|1,0,1]=4 1764 B12R1.464 CCCCC(=O)NCCC1CC1 ad968fdec4d052e5613d4ba300f20332 [1,0,0,1,0,0|1,0,1]=4 1765 B12R1.464 CCCCC(=O)NCCN1CC1 6d3dd88b5beb6dbcfd5a75043af0dcc0 [1,0,0,1,0,0|2,0,0]=4 1766 B12R1.464 CCCCC(=O)OCNC1CC1 32936cde5d52dbf687757e2724987d2d [1,0,0,1,0,0|1,0,1]=4 1767 B12R1.464 CCCCC(=O)OCOC1CC1 62f57097065184062c6371adddfab550 [1,0,0,1,0,0|1,0,1]=4 1768 B12R1.561 C/C=C/CCCC(=O)N1CCC1 ad51d8a8ee4f61e0d0a6de5fb969f302 [1,0,0,1,0,0|2,0,0]=4 1769 B12R1.561 C/C=C/COCC(=O)C1CCC1 4aaf8458f9a43a87e6e20f2af6f173c2 [1,0,0,1,0,0|2,0,0]=4 1770 B12R1.561 C/C=C\COCC(=O)C1CCC1 a26092e700262364af896c8d5d12f60d [1,0,0,1,0,0|2,0,0]=4 1771 B12R1.561 CC/C=C/COC(C)C1CCC1 55d038e16b8945323fd99b7abe95aa16 [1,0,0,1,0,0|1,0,1]=4 1772 B12R1.561 CC/C=C/CO[C@@H](C)C1CCC1 cdc5f0b189975516df1c17a0ebfe9d4e [1,0,0,1,0,0|1,0,1]=4 1773 B12R1.561 CC/C=C\CCN(C)C1CCC1 076c106dffb00d4b2eee638119026151 [1,0,0,1,0,0|2,0,0]=4 1774 B12R1.561 CC=CCNCC(=O)C1CCC1 19f4adad475c119bdd774b1de6d9b705 [1,0,0,1,0,0|2,0,0]=4 1775 B12R1.561 CC=CCOCC(=O)C1CCC1 425ec84cd8d633d63e117de3cb26593a [1,0,0,1,0,0|2,0,0]=4 1776 B12R1.563 C/C=C/CCCC(=O)NC1CC1 3cb230e810c3724c8fe3c12b4cae0800 [1,0,0,1,0,0|2,0,0]=4 1777 B12R1.563 CC/C=C/COC(C)CC1CC1 d25e6e98fe038caf3a45271c4506c438 [1,0,0,1,0,0|1,0,1]=4 1778 B12R1.563 CC/C=C\CCN(C)CC1CC1 3fcca5d7ad9c6d43b18b8c4143383de7 [1,0,0,1,0,0|2,0,0]=4 1779 B12R1.563 CCCCCNC(=O)CC1CC1 f12e9579253eec36c1a8e6a252992cd3 [1,0,0,1,0,0|1,0,1]=4 1780 B12R1.563 CCOCCNC(=O)CC1CC1 f10cff23095d64ac1d190866b3573260 [1,0,0,1,0,0|2,0,0]=4 1781 B12R1.563 CCSCCNC(=O)CC1CC1 f5e6d1101c239ad906e3d373a656ee07 [1,0,0,1,0,0|2,0,0]=4 1782 B12R1.925 CCCCC(=O)NC1COC1C 38c31418dc94c0889dc0b931a257658b [1,0,0,1,0,0|2,0,0]=4 1783 B12R1.925 CCCCC(=O)N[C@@H]1CC[C@H]1C 9265218896b27d4a1d2eb6a938d8aef1 [1,0,0,1,0,0|1,0,1]=4 1784 B12R1.925 CCCCC(=O)N[C@H]1CC[C@H]1C 02dfba1d0b3b135d627a156f11593eb2 [1,0,0,1,0,0|1,0,1]=4 1785 B12R1.1761 CC/C=C\CCN1CC(C1)CC 609329322520d362f90b313ef0d848a3 [1,0,0,1,0,0|2,0,0]=4 1786 B14R1.122 CC/C=C\CCOCC1CCC(C1)C d2ca8f223c12336eeac951659ccbe9be [0,1,0,1,0,0|1,0,1]=4 1787 B14R1.122 CC/C=C\CCOCC1CCC(O1)C 9f89c32f23852337ff5ee6a027cf35ca [0,1,0,1,0,0|0,0,2]=4 1788 B14R1.122 CC/C=C\CCOC[C@@H]1CC[C@@H](O1)C c9f4c6e4bd9d15058ccf6c308e877177 [0,1,0,1,0,0|0,0,2]=4 1789 B14R1.123 CC/C=C/CCOCC1=CCCCC1 dfa45d37c8bf836ffb5d283c1a8f736a [0,1,0,1,0,0|1,0,0]=3 1790 B14R1.123 CC/C=C/CCOCC1=CCOCC1 67ddeffef7ea9e1203d54f78e31ab5d4 [0,1,0,1,0,0|2,0,0]=4 1791 B14R1.123 CC/C=C/CCOCC1CCCCC1 96424156d2ee3dca5e3509260c65a834 [0,1,0,1,0,0|1,0,1]=4 1792 B14R1.123 CC/C=C/CCOCC1CCCCO1 73fa2380bcd73a6ea354685b56c57da4 [0,1,0,1,0,0|0,0,2]=4 1793 B14R1.123 CC/C=C/CNCCC1=CCCCC1 6593f86a2d609ba694341311e9ce5e27 [0,1,0,1,0,0|2,0,0]=4 1794 B14R1.123 CC/C=C/COCC=C1CCCCC1 52e318766433c5227964d4834db8c5df [0,1,0,1,0,0|2,0,0]=4 1795 B14R1.123 CC/C=C/COCOC1CCCCC1 c19b9907de21326dec1f2cf48ad2ba79 [0,1,0,1,0,0|1,0,1]=4 1796 B14R1.123 CC/C=C\CCCOC1CCCCC1 25693c1e52a5aebcdc00dcbe8a4b1862 [0,1,0,1,0,0|1,0,1]=4 1797 B14R1.123 CC/C=C\CCCOC1CCCCO1 a874eb8dea3035593d8e5f5febdfe745 [0,1,0,1,0,0|0,0,2]=4 1798 B14R1.123 CC/C=C\CCNCC1=CCCCC1 dd07eca4e8303b4d9dda13c3a9278c7b [0,1,0,1,0,0|2,0,0]=4 1799 B14R1.123 CC/C=C\CCOCC1=CCCCC1 1a01d1cb8e19cfa38c5c3bb63cb9fc6f [0,1,0,1,0,0|1,0,0]=3 1800 B14R1.123 CC/C=C\CCOCC1=CCCCO1 eda13649124ece31b23815d8cd0069a5 [0,1,0,1,0,0|0,0,2]=4 1801 B14R1.123 CC/C=C\CCOCC1=CCOCC1 61f7c1622283d17d61ded6e42834e450 [0,1,0,1,0,0|2,0,0]=4 1802 B14R1.123 CC/C=C\CCOCC1CCCCC1 fe08eeaca7278c000aaf37cc895aeb64 [0,1,0,1,0,0|1,0,1]=4 1803 B14R1.123 CC/C=C\CCOCC1CCCCO1 6e13d769602bf66e1f389da63f26ecae [0,1,0,1,0,0|0,0,2]=4 1804 B14R1.123 CC/C=C\CCOC[C@@H]1CCCCO1 85f4a5c2300cc9a46ba4a206ddb38183 [0,1,0,1,0,0|0,0,2]=4 1805 B14R1.123 CC/C=C\CCOC[C@H]1CCCCO1 0c73dc8ab4e67d00539a6779ab61d903 [0,1,0,1,0,0|0,0,2]=4 1806 B14R1.123 CC/C=C\COCOC1CCCCC1 0b89adb17091397c1587feccdcae6a2e [0,1,0,1,0,0|1,0,1]=4 1807 B14R1.123 CCC/C=C\CCOC1CCCCC1 9689b1e1aaa03e831299f75098dc598f [0,1,0,1,0,0|1,0,1]=4 1808 B14R1.123 CCC/C=C\CCOC1CCCCO1 16050aa6986186ce2fd489b06dccf1e4 [0,1,0,1,0,0|0,0,2]=4 1809 B14R1.156 CCCCC(=O)NCC1CC=CCC1 2dc2f2c39195651a605d74e38922f7ea [0,1,0,1,0,0|1,0,0]=3 1810 B14R1.156 CCCCC(=O)OCN1CC=CCC1 6b8cc2f30bd359036d69bea7276aa9cb [0,1,0,1,0,0|0,0,0]=2 1811 B14R1.156 CCCCC(=O)OCN1CCCOC1 9e6af4e56e6130bdf6ce35afc4ebf6dc [0,1,0,1,0,0|1,0,1]=4 1812 B14R1.156 CCCCC(=O)OCN1CCCSC1 b5278b0d5e959a29885c46db191d2b06 [0,1,0,1,0,0|1,0,1]=4 1813 B14R1.156 CCCCC(=O)OCN1CCOCC1 cf8a304d7ad46cbf44492863cca9b330 [0,1,0,1,0,0|1,0,1]=4 1814 B14R1.156 CCCCC(=O)OCN1CCSCC1 15abca14686495da61caafb1e3ea8748 [0,1,0,1,0,0|1,0,1]=4 1815 B14R1.156 CCCCC(C)OCC1CC=CCC1 cf44795e653168755c05690dce50aed2 [0,1,0,1,0,0|1,0,1]=4 1816 B14R1.156 CCCCC(C)OCC1CCC=CO1 3eb63c5d1a3ce3b75b4e168763f16358 [0,1,0,1,0,0|1,0,1]=4 1817 B14R1.156 CCCCC(C)OC[C@@H]1CC=CCC1 7c2093045226aae5ebea8a04e050de11 [0,1,0,1,0,0|1,0,1]=4 1818 B14R1.156 CCCCC(C)OC[C@H]1CC=CCC1 2a3697dd49c25e094fcf093144e550b9 [0,1,0,1,0,0|1,0,1]=4 1819 B14R1.156 CCCC[C@@H](C)OCC1CC=CCC1 639de8e24ea413e8da0fd269e2d7f28a [0,1,0,1,0,0|1,0,1]=4 1820 B14R1.156 CCCC[C@H](C)OCC1CC=CCC1 feed8291b396848bd923ab322fdb5fcc [0,1,0,1,0,0|1,0,1]=4 1821 B14R1.156 CCCNC(=O)COC1CC=CCC1 a2138c299c725fa92263b4ce36ac9dbb [0,1,0,1,0,0|1,0,0]=3 1822 B14R1.156 CCCNC(=O)NCC1CC=CCC1 25f6d91bc5ea448f9538ddb53e69f390 [0,1,0,1,0,0|2,0,0]=4 1823 B14R1.156 CCCOC(=O)COC1CC=CCC1 0f16c7eb19ed76b7bbc410c917307a11 [0,1,0,1,0,0|1,0,0]=3 1824 B14R1.156 CCCOC(=O)OCN1CC=CCC1 2650bbfbf005d0f6e1dca49c54a09eee [0,1,0,1,0,0|1,0,0]=3 1825 B14R1.156 CCOCC(=O)NCC1CC=CCC1 b3952d72bdf2c5498a994eaff29a23e6 [0,1,0,1,0,0|2,0,0]=4 1826 B14R1.156 CCSCC(=O)NCC1CC=CCC1 a8ff9c6185782d7f552c102ccf3d379e [0,1,0,1,0,0|2,0,0]=4 1827 B14R1.156 COCCC(=O)NCC1CC=CCC1 976b7c6a489a2f692c9ca2b80cd71543 [0,1,0,1,0,0|2,0,0]=4 1828 B14R1.156 CSCCC(=O)COC1CC=CCC1 a1473bd1e56271f07902a8598f75679f [0,1,0,1,0,0|1,0,0]=3 1829 B14R1.156 CSCCC(=O)NCC1CC=CCC1 253b48e639b0074f2e9e95f899962bf7 [0,1,0,1,0,0|2,0,0]=4 1830 B14R1.156 O=C(CCCF)NCC1CC=CCC1 e09292ff3363347ff0a0347dfec699da [0,1,0,1,0,0|2,0,0]=4 1831 B14R1.156 O=C(CCCS)NCC1CC=CCC1 315a8eed0ba823b1ef53d302b543ce03 [0,1,0,1,0,0|2,0,0]=4 1832 B14R1.177 CCCCC(=O)OCNC1CC=CC1 ac43fd6a774d07cfdfbfb2b42e01d40e [0,1,0,1,0,0|0,0,2]=4 1833 B14R1.177 CCCCC(=O)OCNC1CCCC1 be32a938f91046240260d4cc710a411f [0,1,0,1,0,0|0,0,2]=4 1834 B14R1.177 CCCCC(=O)OCNC1CCOC1 e5d7b05e9db16f592da887e39d3a0e60 [0,1,0,1,0,0|1,0,1]=4 1835 B14R1.177 CCCCC(=O)OCNC1CCSC1 1290d2f36bf779e14f5999f12e3aced3 [0,1,0,1,0,0|1,0,1]=4 1836 B14R1.177 CCCCC(=O)OCN[C@@H]1CCOC1 e6b3059ff1827e8df4f0df8c8ea30089 [0,1,0,1,0,0|1,0,1]=4 1837 B14R1.177 CCCCC(=O)OCN[C@H]1CCOC1 3271eabbff263f752219521635a90f6f [0,1,0,1,0,0|1,0,1]=4 1838 B14R1.177 CCCCC(=O)OCOC1C=CCC1 73b562986f697f29160c201567c5729e [0,1,0,1,0,0|0,0,0]=2 1839 B14R1.177 CCCCC(=O)OCOC1CC=CC1 31e92dccc15fbeaf2edfa4623f8951b5 [0,1,0,1,0,0|0,0,2]=4 1840 B14R1.177 CCCCC(=O)OCOC1CCCC1 2ab9517ace00e26384650b57c4966e1b [0,1,0,1,0,0|0,0,2]=4 1841 B14R1.177 CCCCC(=O)OCOC1CCCO1 373794c1fd6cae33d7199b239b0e1af3 [0,1,0,1,0,0|1,0,1]=4 1842 B14R1.177 CCCCC(=O)OCOC1CCOC1 65a6368de4dd5b57830df868a9deae09 [0,1,0,1,0,0|1,0,1]=4 1843 B14R1.177 CCCCC(=O)OCOC1CCSC1 8bf315f72c19f0509d3b657ebbf9b2e3 [0,1,0,1,0,0|1,0,1]=4 1844 B14R1.177 CCCCC(=O)OCO[C@@H]1CCOC1 ab7664e07a054dcc43e2361024317d31 [0,1,0,1,0,0|1,0,1]=4 1845 B14R1.177 CCCCC(=O)OCO[C@@H]1CCSC1 c7f528ccdde2971221dbfc241622fde1 [0,1,0,1,0,0|1,0,1]=4 1846 B14R1.177 CCCCC(=O)OCO[C@H]1CCOC1 e15bd834bc90bdd06bbdbd8ddb814d74 [0,1,0,1,0,0|1,0,1]=4 1847 B14R1.177 CCCCC(=O)OCO[C@H]1CCSC1 5df39a87aaf8c5c8f063884052e14cf4 [0,1,0,1,0,0|1,0,1]=4 1848 B14R1.177 CCCNC(=O)COCC1C=CCC1 371a2cfd7041ad11c9260dc98c224656 [0,1,0,1,0,0|1,0,0]=3 1849 B14R1.177 CCCOC(=O)COCC1C=CCC1 bfd73e1a443a863cf6aec0e7c29a76b8 [0,1,0,1,0,0|1,0,0]=3 1850 B14R1.177 CCCOC(=O)OCOC1C=CCC1 ff11c9d72978cf7c74a6b295338f4146 [0,1,0,1,0,0|1,0,0]=3 1851 B14R1.177 CSCCC(=O)COCC1C=CCC1 cc04c010969b068ad43ddd3fb0fe9e04 [0,1,0,1,0,0|1,0,0]=3 1852 B14R1.218 CC/C=C\CCN1CC(=O)NCC1C 822423811caa3bf8ef80c8ffb3af2927 [0,1,0,1,0,0|2,0,0]=4 1853 B14R1.218 CC/C=C\CCN1CC(=O)NC[C@@H]1C 53f5c11c1d7f84a8cea2dd02766a64b8 [0,1,0,1,0,0|2,0,0]=4 1854 B14R1.218 CC/C=C\CCN1CC(=O)NC[C@H]1C bb44d1d8aa756d9ca4a06ffc999cfd3a [0,1,0,1,0,0|2,0,0]=4 1855 B14R1.461 CC/C=C/CN1CCC(=O)CC1CO 72ab25d6126b33005fa779ffed400461 [0,1,0,1,0,0|2,0,0]=4 1856 B14R1.461 CC/C=C/CN1CNC(=O)CC1CO c910bb8732429f09493cdf3c88b630b2 [0,1,0,1,0,0|2,0,0]=4 1857 B14R1.882 C/C=C/C=C/COC1CCCCC1=O 06b6242457a6ea8b6f5689c64b9d9582 [0,1,0,1,0,0|0,0,2]=4 1858 B14R1.882 C/C=C/CCCOC1CCCCC1=O 02333071042d72885d625c6c57f982a7 [0,1,0,1,0,0|0,0,2]=4 1859 B14R1.882 C/C=C\CCCOC1CCCCC1=O 53782cc993c9f49e700246f6d63cbc00 [0,1,0,1,0,0|0,0,2]=4 1860 B14R1.882 CC/C=C/CCOC1CCCCC1=O 8e9d5eb25116a6bfe2a9cf72a7f3c372 [0,1,0,1,0,0|0,0,0]=2 1861 B14R1.882 CC/C=C/CCOC1CCCCC1F 5c399f4c7b3a7662ec3f19421056551d [0,1,0,1,0,0|1,0,1]=4 1862 B14R1.882 CC/C=C/CCOC1CCCNC1=O f693905394dc82edb81b5249f3c5be70 [0,1,0,1,0,0|1,0,0]=3 1863 B14R1.882 CC/C=C/CCOC1COCCC1=O e3a5f6be414dbf6abd88e49ef8b10ac8 [0,1,0,1,0,0|1,0,0]=3 1864 B14R1.882 CC/C=C/CCOC1SCCCC1=O c057315849c13461fefab1d8072bfae9 [0,1,0,1,0,0|1,0,0]=3 1865 B14R1.882 CC/C=C/CCO[C@H]1CCCC[C@H]1C 3ab58e1fc8c84a6906b45fb9e82ba6cd [0,1,0,1,0,0|1,0,1]=4 1866 B14R1.882 CC/C=C/COCC1=C(CCCC1)Br 56e3e9f1152cb7b07d987c43303f7999 [0,1,0,1,0,0|2,0,0]=4 1867 B14R1.882 CC/C=C/COCC1=CCCCC1=O baa802845939112a30c7ac0484d78f50 [0,1,0,1,0,0|1,0,1]=4 1868 B14R1.882 CC/C=C/COCC1CCCCC1=O 7598250aec58876887905e88c4a64cc7 [0,1,0,1,0,0|1,0,0]=3 1869 B14R1.882 CC/C=C/COCC1CCCNC1=O 4b1f60c65dd179a05e75f0d74966d985 [0,1,0,1,0,0|2,0,0]=4 1870 B14R1.882 CC/C=C\CCNC1CCCNC1=O c56c3c389fc599d98f2ea7b186366266 [0,1,0,1,0,0|2,0,0]=4 1871 B14R1.882 CC/C=C\CCN[C@@H]1CCCNC1=O 08e13a7a5d1fe50eaeb6e15a73201e07 [0,1,0,1,0,0|2,0,0]=4 1872 B14R1.882 CC/C=C\CCN[C@H]1CCCNC1=O c13516be2f16723d0ab5be2210594a30 [0,1,0,1,0,0|2,0,0]=4 1873 B14R1.882 CC/C=C\CCOC1CCCC=C1Br 60bdaac764324a82a0cd137449d7edb2 [0,1,0,1,0,0|1,0,1]=4 1874 B14R1.882 CC/C=C\CCOC1CCCCC1=O 1b30fb3f45f64b3b6544458ebc3fde1c [0,1,0,1,0,0|0,0,0]=2 1875 B14R1.882 CC/C=C\CCOC1CCCCC1C 961ebb9c6359f52a26583990d7b1ceeb [0,1,0,1,0,0|1,0,1]=4 1876 B14R1.882 CC/C=C\CCOC1CCCCC1F 56e28985872180d4eeb1f40ef71c3239 [0,1,0,1,0,0|1,0,1]=4 1877 B14R1.882 CC/C=C\CCOC1CCCNC1=O 6931230913b42f716d457b3dbfd2dc9d [0,1,0,1,0,0|1,0,0]=3 1878 B14R1.882 CC/C=C\CCOC1CCCOC1=O b29321eb92ebdd9f257d4a23838b7f7b [0,1,0,1,0,0|1,0,0]=3 1879 B14R1.882 CC/C=C\CCOC1COCCC1=O 042e7f76fa36e894792d64cbc8ca03c8 [0,1,0,1,0,0|1,0,0]=3 1880 B14R1.882 CC/C=C\CCOC1SCCCC1=O ee64e4d757d0aee2d0b84dd830385dd1 [0,1,0,1,0,0|1,0,0]=3 1881 B14R1.882 CC/C=C\CCO[C@@H]1CCCC[C@@H]1C d3c9a82c28bd881561acb76342072f3e [0,1,0,1,0,0|1,0,1]=4 1882 B14R1.882 CC/C=C\CCO[C@@H]1CCCC[C@H]1F a9469364ee754a9d2aa2382e5237be75 [0,1,0,1,0,0|1,0,1]=4 1883 B14R1.882 CC/C=C\CCO[C@@H]1CCCNC1=O 4467d739ea185c0ce64b318f1504326c [0,1,0,1,0,0|1,0,0]=3 1884 B14R1.882 CC/C=C\CCO[C@H]1CCCC[C@@H]1C 8a77d4a7d74f287f240065692fb84970 [0,1,0,1,0,0|1,0,1]=4 1885 B14R1.882 CC/C=C\CCO[C@H]1CCCC[C@H]1C af75dc94b6acbcabcc81322d1d005ce5 [0,1,0,1,0,0|1,0,1]=4 1886 B14R1.882 CC/C=C\CCO[C@H]1CCCNC1=O b87f7d5aaa3eaa6a408f66a4a8d731fc [0,1,0,1,0,0|1,0,0]=3 1887 B14R1.882 CC=C=CCCOC1CCCCC1=O 1b0d6172c28afd68c2404ee62c153c11 [0,1,0,1,0,0|0,0,2]=4 1888 B14R1.882 CC=CC=CCOC1CCCCC1=O 7434c1826e2d4df2288a76488fb0bdf2 [0,1,0,1,0,0|0,0,2]=4 1889 B14R1.882 CC=CCCCOC1CCCCC1=O d2c463b4b5b2eb8504e0adb35aa67b13 [0,1,0,1,0,0|0,0,2]=4 1890 B14R1.882 CCC/C=C/COC1CCCCC1=O 22bff3ce4aa7000e8410d145d89859de [0,1,0,1,0,0|0,0,2]=4 1891 B14R1.882 CCC/C=C\COC1CCCCC1=O e4a26308db6a89eef8b851a67a82b6fc [0,1,0,1,0,0|0,0,2]=4 1892 B14R1.882 CCCCCCOC1CCCCC1=O 1040c77266405f0f28dcbb55d1012461 [0,1,0,1,0,0|0,0,2]=4 1893 B14R1.882 CCCOCCOC1CCCCC1=O 9fca03b33efc45c104ca7fae30383b9b [0,1,0,1,0,0|1,0,1]=4 1894 B14R1.882 CCOCCCOC1CCCCC1=O cf0ecf44157f6f96dead18d8ce4033a6 [0,1,0,1,0,0|1,0,1]=4 1895 B14R1.916 CCCCC(=O)NCC1CCNC1=O 71402c4432f03f997cc59069fab8b066 [0,1,0,1,0,0|2,0,0]=4 1896 B14R1.916 CCCCC(=O)OCN1CCCC1C 705787cb2c05af515645ac6fef2ad8d0 [0,1,0,1,0,0|0,0,2]=4 1897 B14R1.916 CCCCC(=O)OCN1CCC[C@@H]1C f1f4107ffea08d97158e3171279555bb [0,1,0,1,0,0|0,0,2]=4 1898 B14R1.916 CCCCC(=O)OCN1CCC[C@H]1C aa59cc4879437ab0a1236c4bd7a01846 [0,1,0,1,0,0|0,0,2]=4 1899 B14R1.916 CCCCC(=O)OCN1CCSC1C 4c072f1f4fb04faf995fb554acc0e43e [0,1,0,1,0,0|1,0,1]=4 1900 B14R1.917 CCCCC(=O)OCN1CCC1CC ec906b6d5b6ea3284ecba4d8cad5c5e8 [0,1,0,1,0,0|0,0,2]=4 1901 B14R1.919 CCCCC(=O)OCOCC1CC1C ba65e85c2e50f22293ac47e8c9816a4e [0,1,0,1,0,0|0,0,2]=4 1902 B14R1.919 CCCCC(=O)OCOC[C@@H]1C[C@@H]1C 9cdf9fd92a8fe3fad4f967f0ff227aa2 [0,1,0,1,0,0|0,0,2]=4 1903 B14R1.919 CCCCC(=O)OCOC[C@@H]1C[C@H]1C c280ed30fce5dcedbd465987e980f13c [0,1,0,1,0,0|0,0,2]=4 1904 B14R1.919 CCCCC(=O)OCOC[C@H]1C[C@@H]1C d0f82807a8886cfb3e8e432d407299d5 [0,1,0,1,0,0|0,0,2]=4 1905 B14R1.920 CCCCC(=O)OCNCC1CCC1 68cabea5a484d7ce6a51469915864db5 [0,1,0,1,0,0|0,0,2]=4 1906 B14R1.920 CCCCC(=O)OCNCC1CCO1 45a830261f9637f6fc5ea60152f8c576 [0,1,0,1,0,0|1,0,1]=4 1907 B14R1.920 CCCCC(=O)OCNC[C@@H]1CCO1 57b56ef7d63afdffbf4937f93883b468 [0,1,0,1,0,0|1,0,1]=4 1908 B14R1.920 CCCCC(=O)OCNC[C@H]1CCO1 bb4aa8cf81a571d0cc5d12aa13a6547e [0,1,0,1,0,0|1,0,1]=4 1909 B14R1.920 CCCCC(=O)OCOCC1CCC1 0547d7274d6f15c3bc3c6dc1f4b6b700 [0,1,0,1,0,0|0,0,2]=4 1910 B14R1.920 CCCCC(=O)OCOCC1CCO1 4eb1733b1725fe5887b76a3bf02d922c [0,1,0,1,0,0|1,0,1]=4 1911 B14R1.920 CCCCC(=O)OCOC[C@@H]1CCO1 1f0c79ff11aaba7a8fc0b67c3723915e [0,1,0,1,0,0|1,0,1]=4 1912 B14R1.920 CCCCC(=O)OCOC[C@H]1CCO1 cce9b0c39b16d7c80a62fd3be3e5c8ff [0,1,0,1,0,0|1,0,1]=4 1913 B14R1.927 CCCCC(=O)OCNCCC1CC1 ed1ebb0e598b95b02798422a274073a4 [0,1,0,1,0,0|0,0,2]=4 1914 B14R1.927 CCCCC(=O)OCNCCN1CC1 39cc40a94a5467cb85f6c1e2008f88f6 [0,1,0,1,0,0|1,0,1]=4 1915 B14R1.927 CCCCC(=O)OCOCCC1CC1 de0421fff5e1dd5d2b26bf0a5a5d0b99 [0,1,0,1,0,0|0,0,2]=4 1916 B14R1.927 CCCCC(=O)OCOCCN1CC1 f8b8f731dc8217e522f8b0ed7c228658 [0,1,0,1,0,0|1,0,1]=4 1917 B14R1.927 CCCCC(C)OCCCC=C1CC1 6ed5e6098c69cf328db1145f56ed3a0f [0,1,0,1,0,0|1,0,1]=4 1918 B14R1.927 CCCC[C@@H](C)OCCCC=C1CC1 55e16da66f09324e3f87778b5b5a4856 [0,1,0,1,0,0|1,0,1]=4 1919 B14R1.927 CCCC[C@H](C)OCCCC=C1CC1 1abcaac1d033d6d6f3161fb0168f0dfb [0,1,0,1,0,0|1,0,1]=4 1920 B14R1.935 CCCCC(=O)OCNC1COC1C 05325e4bd053f8008fd4767ef645c394 [0,1,0,1,0,0|1,0,1]=4 1921 B14R1.935 CCCCC(=O)OCN[C@@H]1CC[C@H]1C 2b72d9922a5c54db2cfbb8011d584e85 [0,1,0,1,0,0|0,0,2]=4 1922 B14R1.935 CCCCC(=O)OCN[C@H]1CC[C@H]1C 42de643c64de213b0950a1b8ff78739d [0,1,0,1,0,0|0,0,2]=4 1923 B14R1.935 CCCCC(=O)OCOC1CCC1=O a9b904386b5beebb9c0f0c4d648cc59c [0,1,0,1,0,0|1,0,1]=4 1924 B14R1.935 CCCCC(=O)OCOC1COC1C c70b0c02b77e41784972d04396fd9912 [0,1,0,1,0,0|1,0,1]=4 1925 B14R1.1237 CC/C=C/CCOC1C(=O)CCC1=O 43da419562977dac34179713a5df4c2e [0,1,0,1,0,0|1,0,1]=4 1926 B14R1.1237 CC/C=C\CCOC1=C(CCC1=O)C c7a5a9f776b7d379e91e271744eb3e51 [0,1,0,1,0,0|0,0,1]=3 1927 B14R1.1237 CC/C=C\CCOC1=C(COC1=O)C e6da2f5f2c1efe201628d3ec8f5c091c [0,1,0,1,0,0|1,0,1]=4 1928 B14R1.1237 CC/C=C\CCOC1=C(OCC1=O)C 536ab3f407bd04b44c055abd83cee868 [0,1,0,1,0,0|1,0,1]=4 1929 B14R1.1237 CC/C=C\CCOC1C(=O)CCC1=O 9744bda655986b25759e820298138540 [0,1,0,1,0,0|1,0,1]=4 1930 B14R1.1252 CC/C=C/COC1CCCNC(=O)C1 e2ec52ad35ddf940440838e0470511d9 [0,1,0,1,0,0|2,0,0]=4 1931 B14R1.1252 CC/C=C\CCN1CCCNC(=O)C1 3ea06a1b9263ca413e4342d9454b3bb6 [0,1,0,1,0,0|2,0,0]=4 1932 B14R1.2596 CCCCC(=O)NC1CCC=CCC1 8a2f3d932a335bd2663fd789f04306be [0,1,0,1,0,0|1,0,0]=3 1933 B14R1.2596 CCCNC(=O)NC1CCC=CCC1 283b68c0b9afde06ccd90f464009d573 [0,1,0,1,0,0|2,0,0]=4 1934 B14R1.2596 CCOCC(=O)NC1CCC=CCC1 e150bcfe0d6c70be19212e246441de39 [0,1,0,1,0,0|2,0,0]=4 1935 B14R1.2596 CCSCC(=O)NC1CCC=CCC1 c4ca849d4475f1f0cb13008beb70f283 [0,1,0,1,0,0|2,0,0]=4 1936 B14R1.2596 COCCC(=O)NC1CCC=CCC1 d6fa9a1f7460f630a6a2c8ca4127c93c [0,1,0,1,0,0|2,0,0]=4 1937 B14R1.2596 O=C(CCCF)NC1CCC=CCC1 954198f01787798cea94116172329879 [0,1,0,1,0,0|2,0,0]=4 1938 B14R1.2596 O=C(CCCS)NC1CCC=CCC1 1356a3cea78de69ba719e72bf06ddfb5 [0,1,0,1,0,0|2,0,0]=4 1939 B14R1.3768 C/C=C/C=C/COCC(=O)C1CCC1 ed59c823521c039af9fdf176be3e2cb2 [0,1,0,1,0,0|0,0,2]=4 1940 B14R1.3768 C/C=C/CCCOCC(=O)C1CCC1 1efe57d32d821f0bfc9a36e73da33837 [0,1,0,1,0,0|0,0,2]=4 1941 B14R1.3768 C/C=C\CCCOCC(=O)C1CCC1 5e3528f8d2feb06e4012ae559d382b46 [0,1,0,1,0,0|0,0,2]=4 1942 B14R1.3768 CC/C=C/CCOCC(=O)C1CCC1 725b97e90f62ef1c022713abd483463d [0,1,0,1,0,0|0,0,0]=2 1943 B14R1.3768 CC/C=C/CCOCC(=O)N1CCC1 22834a6500691d5a2f59ca215b2c0da6 [0,1,0,1,0,0|1,0,0]=3 1944 B14R1.3768 CC/C=C/COCCC(=O)N1CCC1 4b8c74fcd2cb306fa309c2cc11a064fb [0,1,0,1,0,0|2,0,0]=4 1945 B14R1.3768 CC/C=C\CCOCC(=O)C1CCC1 5fe80ec1e5b1b79debb7caad0f6b797e [0,1,0,1,0,0|0,0,0]=2 1946 B14R1.3768 CC/C=C\CCOCC(=O)N1CCC1 bd3688b8d0b3eb618870d0c540eb48e4 [0,1,0,1,0,0|1,0,0]=3 1947 B14R1.3768 CC/C=C\COCCC(=O)N1CCC1 8143d01b90c09cf137aaf5dd6e7c1bdf [0,1,0,1,0,0|2,0,0]=4 1948 B14R1.3768 CC=C=CCCOCC(=O)C1CCC1 d17847f7a7da9e602ef251400d3d0a37 [0,1,0,1,0,0|0,0,2]=4 1949 B14R1.3768 CC=CC=CCOCC(=O)C1CCC1 45e09d9326cd114e40e943ed89d126a6 [0,1,0,1,0,0|0,0,2]=4 1950 B14R1.3768 CC=CCCCOCC(=O)C1CCC1 00978c59b5d681accdc8d8b260af5ad5 [0,1,0,1,0,0|0,0,2]=4 1951 B14R1.3768 CCC#CCCOCC(=O)C1CCC1 b0bac35230959fb1447f177504925f36 [0,1,0,1,0,0|0,0,2]=4 1952 B14R1.3768 CCC/C=C/CCCC(=O)N1CCC1 3bbec082ef42f7ea93ca7629c68e9d2c [0,1,0,1,0,0|2,0,0]=4 1953 B14R1.3768 CCC/C=C/COCC(=O)C1CCC1 fd13e3e7c3bb7872d26330f968f5b313 [0,1,0,1,0,0|0,0,2]=4 1954 B14R1.3768 CCC/C=C\COCC(=O)C1CCC1 598581f002d66c362988a23496155807 [0,1,0,1,0,0|0,0,2]=4 1955 B14R1.3768 CCCCCCOCC(=O)C1CCC1 13557d687f034c5a87421b10361258eb [0,1,0,1,0,0|0,0,2]=4 1956 B14R1.3768 CCCOCCOCC(=O)C1CCC1 8d6a2ffcb5621dd7359c36b0d7a2fbf7 [0,1,0,1,0,0|1,0,1]=4 1957 B14R1.3768 CCCSCCOCC(=O)C1CCC1 5b1ee46e4ee4410283046a1b637e1ae4 [0,1,0,1,0,0|1,0,1]=4 1958 B14R1.3768 CCOCCCOCC(=O)C1CCC1 98a5a114c80b336efddc67764733d492 [0,1,0,1,0,0|1,0,1]=4 1959 B14R1.3768 CCSCCCOCC(=O)C1CCC1 de496079ca41003effb496b5abc248df [0,1,0,1,0,0|1,0,1]=4 1960 B14R1.3770 CC/C=C/CCOCC(=O)NC1CC1 99f321bdd2b77b3cb0568e850b048ab0 [0,1,0,1,0,0|1,0,0]=3 1961 B14R1.3770 CC/C=C/COCCC(=O)NC1CC1 db65e852f1e090e31d852c8af6bd402e [0,1,0,1,0,0|2,0,0]=4 1962 B14R1.3770 CC/C=C\CCNCC(=O)NC1CC1 3adc4f89489d4475ff28218958fcfbd9 [0,1,0,1,0,0|2,0,0]=4 1963 B14R1.3770 CC/C=C\CCOCC(=O)NC1CC1 6457e07e8fc72c850142a54bb31ccd40 [0,1,0,1,0,0|1,0,0]=3 1964 B14R1.3770 CC/C=C\COCCC(=O)NC1CC1 6a09a90661e8705bf9111db566a84179 [0,1,0,1,0,0|2,0,0]=4 1965 B14R1.3770 CCC/C=C/CCCC(=O)NC1CC1 5df03334753eb62f6f5b868a54126acd [0,1,0,1,0,0|2,0,0]=4 1966 B14R1.4731 CC/C=C/CCOCC1(CCCC1)C d628a96f09b5ef7df759b10cce0306c8 [0,1,0,1,0,0|1,0,1]=4 1967 B14R1.4731 CC/C=C/CCOCC1(CCCC1)F 4f365e30f4ac8b117d0c78e4a8941652 [0,1,0,1,0,0|1,0,1]=4 1968 B14R1.4731 CC/C=C\CCOCC1(CCCC1)C f6edbdd430e1da163c930e508b789e4f [0,1,0,1,0,0|1,0,1]=4 1969 B14R1.4731 CC/C=C\CCOCC1(CCCC1)F 982efcc8489ff12b8d7d6eeb56fd9380 [0,1,0,1,0,0|1,0,1]=4 1970 B14R1.16 CCCCC(=O)N1CCNC(=O)C1C 5bbb1a3cb392f62b07b71dbb64b89e01 [0,1,0,1,0,0|2,0,0]=4 1971 B14R1.16 CCCCC(=O)N1CCNC(=O)[C@@H]1C 50cd6d40cba0b196d20f3143b38f9a96 [0,1,0,1,0,0|2,0,0]=4 1972 B14R1.16 CCCCC(=O)N1CCNC(=O)[C@H]1C 413eee52a238a7874cbe90eada206038 [0,1,0,1,0,0|2,0,0]=4 1973 B14R1.33 CCCCC(=O)NC1CCC(=O)NC1 60a2bdd34b5ad50bec1992fb6405432e [0,1,0,1,0,0|2,0,0]=4 1974 B14R1.33 CCCCC(=O)N[C@@H]1CCC(=O)NC1 823f505b986969c734915db115697a91 [0,1,0,1,0,0|2,0,0]=4 1975 B14R1.33 CCCCC(=O)N[C@H]1CCC(=O)NC1 42b08158a9a41fae07290d0edc01957d [0,1,0,1,0,0|2,0,0]=4 1976 B14R1.33 CCCCC(C)OC1CC=C(CC1)Br 908625740ca50554f533588bfa242a1c [0,1,0,1,0,0|1,0,1]=4 1977 B14R1.155 CCCCC(=O)NCC1CCC(=O)N1 fffdceec0ae2bbbc1b8d42fb494be88b [0,1,0,1,0,0|2,0,0]=4 1978 B14R1.155 CCCCC(=O)NC[C@@H]1CCC(=O)N1 dfd68a1bca2e7b2811c4e22c176f8eb7 [0,1,0,1,0,0|2,0,0]=4 1979 B14R1.155 CCCCC(=O)NC[C@H]1CCC(=O)N1 50ca99420727b0950129ce8385330edf [0,1,0,1,0,0|2,0,0]=4 1980 B14R1.837 CCC(=O)NCCN1CCCCC1=O 61384307e1b724cf91f153e4a306392f [0,1,0,1,0,0|2,0,0]=4 1981 B14R1.2469 CCCCC(=O)N1CCCC(=O)CC1 e5fe6a03c21232946af2d17ea063fcbf [0,1,0,1,0,0|1,0,1]=4 1982 B14R1.2469 CCCCC(=O)N1CCNC(=O)CC1 7e6a58b96eb560f18ec314ac091c0a83 [0,1,0,1,0,0|2,0,0]=4 1983 B14R1.7730 CCC(=O)NCCNC(=O)CC1CC1 1977ded082147c86c45a9db9616b0c67 [0,1,0,1,0,0|2,0,0]=4 1984 B14R1.34 CCCCC(=O)NC1CCNC(=O)C1 88d7921a563156296ccd551c015a14ad [0,1,0,1,0,0|2,0,0]=4 1985 B14R1.34 CCCCC(=O)N[C@@H]1CCNC(=O)C1 1cc2707ce9510e4a1865acf562a1cd82 [0,1,0,1,0,0|2,0,0]=4 1986 B14R1.34 CCCCC(=O)N[C@H]1CCNC(=O)C1 3b38e39fa85fa8944ae205fe53d882e8 [0,1,0,1,0,0|2,0,0]=4 1987 B14R1.159 CC(C)/C=C/COC1CCCCC1=O 1a1ff842aca8747ee637e84fe4d3cbc8 [0,1,0,1,0,0|2,0,0]=4 1988 B14R1.14 CC/C=C/CCOC1CCC(CC1)C 518736efd398bec76deb522351887871 [0,1,0,1,0,0|1,0,1]=4 1989 B14R1.14 CC/C=C\CCOC1CCC(CC1)C cd4fe7ca6e4d5e28d1fa21981d324552 [0,1,0,1,0,0|1,0,1]=4 1990 B14R1.14 CC/C=C\CCOC1CCC(CC1)F d2f50e0f28b69c7b59fe77e47893e2b5 [0,1,0,1,0,0|1,0,1]=4 1991 B14R1.14 CC/C=C\CCO[C@H]1CC[C@@H](CC1)C e7458aaa04146c3c36de95d308aaa364 [0,1,0,1,0,0|1,0,1]=4 1992 B14R1.14 CC/C=C\CCO[C@H]1CC[C@H](CC1)C 7fb5c7934dd3e94c9addf887040c9528 [0,1,0,1,0,0|1,0,1]=4 1993 B14R1.423 CC(C)CCC(C)OC1CC=CCC1 e330d62385cba6705cfa882e1e6b9435 [0,1,0,1,0,0|1,0,1]=4 1994 B14R1.3453 CC/C=C/CCOC1CCC(C1)(C)C ba39412c2a2e4f69898c949bf0384330 [0,1,0,1,0,0|1,0,1]=4 1995 B14R1.3453 CC/C=C\CCOC1CCC(C1)(C)C 64cfc5bd82eb17a499b0f4bf1a3f2a30 [0,1,0,1,0,0|1,0,1]=4 1996 B14R1.4518 CC/C=C/COCC(=O)NCC1CC1 c8f233a5432d152395e91f05f48174cc [0,1,0,1,0,0|2,0,0]=4 1997 B14R1.4518 CC/C=C\COCC(=O)NCC1CC1 5398afed006f35a227e48bf04e5342eb [0,1,0,1,0,0|2,0,0]=4 1998 B14R1.4526 CC(C)CCC(C)OCC1C=CCC1 763413cddf043eba24504e8cbc266f26 [0,1,0,1,0,0|1,0,1]=4 1999 B14R1.7176 CCOC(=O)CCNC(=O)CC1CC1 568ec0d8117e598fde4acfd87852509e [0,1,0,1,0,0|2,0,0]=4 2000 B14R1.158 CCCCCC(=O)CN1CC=CCC1 362173a97f589af91a44c0cacb92e550 [0,1,0,1,0,0|2,0,0]=4 2001 B14R1.158 CCCCCC(C)OC1CC=CCC1 3d5c410b9965a3100ea7f30865e77375 [0,1,0,1,0,0|1,0,1]=4 2002 B14R1.158 CCCCC[C@H](C)OC1CC=CCC1 e9c04b6b861735b84427eff257661dd4 [0,1,0,1,0,0|1,0,1]=4 2003 B14R1.158 CCCCNC(=O)CN1CC=CCC1 3923c4f1ddc12dd354fef1bd0e3769ce [0,1,0,1,0,0|2,0,0]=4 2004 B14R1.158 CCCCOC(=O)CN1CC=CCC1 683e251add7b92e571abb9b1ef3c2410 [0,1,0,1,0,0|2,0,0]=4 2005 B14R1.158 CCCNCC(=O)OC1CCCCC1 000eb4498185cf186e8755d84ef79657 [0,1,0,1,0,0|0,0,2]=4 2006 B14R1.158 CCCOCC(=O)OC1CCCCC1 4ab42ad6ac56d3e54e99f34c5f30b775 [0,1,0,1,0,0|0,0,2]=4 2007 B14R1.467 CCCCC(CC)OC1CC=CCC1 43621234bd0d42469c2e908be30bf644 [0,1,0,1,0,0|1,0,1]=4 2008 B14R1.476 CC/C=C\CCN1CCCCC1C=O abb40c00aa665e0d457b2754a2660ac6 [0,1,0,1,0,0|1,0,1]=4 2009 B14R1.2352 CC/C=C/CCOC1CCCCCC1 1caf889bfd5c40d16db6fd70ed88fbe5 [0,1,0,1,0,0|1,0,1]=4 2010 B14R1.2352 CC/C=C/CCOC1CCCOCC1 c1ccfa27c0593f624f9621d2997b04b1 [0,1,0,1,0,0|1,0,1]=4 2011 B14R1.2352 CC/C=C\CCOC1CCCCCC1 cee4af4427ce285aaa3b565783ff590b [0,1,0,1,0,0|1,0,1]=4 2012 B14R1.2352 CC/C=C\CCOC1CCCOCC1 2ef3b0e6bccd4950c7dc28f74065ea3c [0,1,0,1,0,0|1,0,1]=4 2013 B14R1.3343 CCCCC(CC)OCC1C=CCC1 e294882886f4a68238939a4429018078 [0,1,0,1,0,0|1,0,1]=4 2014 B14R1.3452 CC/C=C/CCOC1CCN(C1=O)C 08643f2069ffe0b9cebbc14f3a007740 [0,1,0,1,0,0|1,0,1]=4 2015 B14R1.3452 CC/C=C\CCOC1CCN(C1=O)C 8500d53d8f1c9a5045830a29bbe28e8e [0,1,0,1,0,0|1,0,1]=4 2016 B14R1.3452 CC/C=C\CCO[C@@H]1CCN(C1=O)C 5d7053ecf2283d80cec507df6b0a59e5 [0,1,0,1,0,0|1,0,1]=4 2017 B14R1.3454 CC/C=C/CCOC1CCC(C1)OC 07620943b49dba7b7a75cbdd4a8ced0d [0,1,0,1,0,0|1,0,1]=4 2018 B14R1.3454 CC/C=C/CCOC1CCN(C1)CC 293bff901cb48636744bc032fe5e4186 [0,1,0,1,0,0|1,0,1]=4 2019 B14R1.3454 CC/C=C\CCOC1CCC(C1)OC 172479e7fc108abf751894872b24a902 [0,1,0,1,0,0|1,0,1]=4 2020 B14R1.3454 CC/C=C\CCOC1CCN(C1)CC a67867b78c113fd28a3e36bfc564080c [0,1,0,1,0,0|1,0,1]=4 2021 B14R1.3454 CC/C=C\CCO[C@@H]1CC[C@H](C1)OC 65788faa896ad2e989793be8e9fc32e2 [0,1,0,1,0,0|1,0,1]=4 2022 B14R1.3454 CC/C=C\CCO[C@H]1CC[C@H](C1)OC 39e90e83176a0f97c666fef4b1c83530 [0,1,0,1,0,0|1,0,1]=4 2023 B14R1.6507 CC/C=C/COC1=C(CCC1=O)CC ae1d66db7202c1547d6c9223d4a9c10d [0,1,0,1,0,0|2,0,0]=4 2024 B14R1.26 CC/C=C/CCO[C@@H]1CCCN(C1)C 21082a38b63a5335874383791c6b24d2 [0,1,0,1,0,0|1,0,1]=4 2025 B14R1.26 CC/C=C/CCO[C@H]1CCCN(C1)C 286882aaa558365323760ea5f623073e [0,1,0,1,0,0|1,0,1]=4 2026 B14R1.26 CC/C=C\CCOC1=CC(=O)CCC1 1b59bff1f40c720eb91187a6982e71c9 [0,1,0,1,0,0|1,0,1]=4 2027 B14R1.26 CC/C=C\CCOC1C=C(CCC1)C 86fad9342016d8c16d55d2cfc891c877 [0,1,0,1,0,0|1,0,1]=4 2028 B14R1.26 CC/C=C\CCOC1CCCC(C1)C 94a82b6287d4f7f1f7618c23cda8ccf8 [0,1,0,1,0,0|1,0,1]=4 2029 B14R1.26 CC/C=C\CCOC1CCCN(C1)C ad253cea41abb1ad9707f20ba2141d0d [0,1,0,1,0,0|1,0,1]=4 2030 B14R1.26 CC/C=C\CCOC1CCOC(C1)C 7b86430111ef0e836d0b43b2107d30c1 [0,1,0,1,0,0|1,0,1]=4 2031 B14R1.26 CC/C=C\CCO[C@@H]1CCCN(C1)C e9df6fc613dd2dd6a2d80217f8e774c0 [0,1,0,1,0,0|1,0,1]=4 2032 B14R1.26 CC/C=C\CCO[C@@H]1CCC[C@@H](C1)C 1775a3ccef934235c39b2410c965a645 [0,1,0,1,0,0|1,0,1]=4 2033 B14R1.26 CC/C=C\CCO[C@@H]1CCO[C@@H](C1)C 93bf4c6c2c73ea592fe0c651a2eaea59 [0,1,0,1,0,0|1,0,1]=4 2034 B14R1.26 CC/C=C\CCO[C@@H]1CCO[C@H](C1)C 9ed7dfc863ff7fa8e4188d4588e8fd9a [0,1,0,1,0,0|1,0,1]=4 2035 B14R1.26 CC/C=C\CCO[C@H]1CCCN(C1)C c0442618662c5e59584ea511a22d3e0c [0,1,0,1,0,0|1,0,1]=4 2036 B14R1.26 CC/C=C\CCO[C@H]1CCC[C@@H](C1)C f92686e779353e625e909c5ed65e9d4a [0,1,0,1,0,0|1,0,1]=4 2037 B14R1.26 CC/C=C\CCO[C@H]1CCC[C@H](C1)C c490827265c0ece7a714d2cbbf71fc44 [0,1,0,1,0,0|1,0,1]=4 2038 B14R1.26 CC/C=C\CCO[C@H]1CCO[C@@H](C1)C f5589396471b65f7728d08cb0449b335 [0,1,0,1,0,0|1,0,1]=4 2039 B14R1.26 CC/C=C\CCO[C@H]1CCO[C@H](C1)C 673da89e9e0ddd55151917364de70e3c [0,1,0,1,0,0|1,0,1]=4 2040 B14R1.4517 CC/C=C/CNCC(=O)NC1CCC1 e468b45ab2974efc20340960b343bd73 [0,1,0,1,0,0|2,0,0]=4 2041 B14R1.169 CC/C=C/CNCC(=O)N1CCCC1 b170fcf1c21aef12ee1f7dd647d192a0 [0,1,0,1,0,0|2,0,0]=4 2042 B14R1.169 CC/C=C/COCC(=O)C1CCCC1 a826708ac3bdc50f309ffdc093f8ebff [0,1,0,1,0,0|2,0,0]=4 2043 B14R1.169 CC/C=C/COCC(=O)N1CCCC1 1d377830a08f55d899c43312472a7aaa [0,1,0,1,0,0|2,0,0]=4 2044 B14R1.169 CC/C=C\CCOC(C)C1CCCC1 a546530d4d437ab37e0c1bc2f3a96c08 [0,1,0,1,0,0|1,0,1]=4 2045 B14R1.169 CC/C=C\CCOC(C)C1CCOC1 a3d0f13f2280d97d489b6dbda7169d88 [0,1,0,1,0,0|1,0,1]=4 2046 B14R1.169 CC/C=C\CCO[C@H](C)[C@H]1CCCO1 e13337622aabd2717b1a8b7286216c36 [0,1,0,1,0,0|1,0,1]=4 2047 B14R1.169 CC/C=C\COCC(=O)C1CCCC1 3b95c97cf24774016f5008474b4c309e [0,1,0,1,0,0|2,0,0]=4 2048 B14R1.169 CC/C=C\COCC(=O)N1CCCC1 f57fddee797e56ff2e3ab85f94f7bd88 [0,1,0,1,0,0|2,0,0]=4 2049 B14R1.86 CCCCCC(=O)COC1C=CCC1 0ab81133e32a917907bf587ed54bde74 [0,1,0,1,0,0|2,0,0]=4 2050 B14R1.86 CCCCCC(C)OCC1C=CCC1 6da02623e8e05bc526c4849a182e1688 [0,1,0,1,0,0|1,0,1]=4 2051 B14R1.86 CCCCC[C@H](C)OCC1C=CCC1 db4ab73bd499993e2864075dd5908078 [0,1,0,1,0,0|1,0,1]=4 2052 B14R1.86 CCCCNC(=O)COC1C=CCC1 8a59625e9c54828320ea3fa301946512 [0,1,0,1,0,0|2,0,0]=4 2053 B14R1.86 CCCCOC(=O)COC1C=CCC1 c181d696a40a61e3c9aff207d8c6e58c [0,1,0,1,0,0|2,0,0]=4 2054 B14R1.138 CC/C=C/CNC1CCCCNC1=O 6faa669a3d83449a5a6acfde4ab8b7f4 [0,1,0,1,0,0|2,0,0]=4 2055 B14R1.138 CC/C=C/CN[C@@H]1CCCCNC1=O e6220b77ab79631a77b93a9cfb561796 [0,1,0,1,0,0|2,0,0]=4 2056 B14R1.138 CC/C=C/CN[C@H]1CCCCNC1=O 8e52c4efb308d0a80c2c9a860903e0ed [0,1,0,1,0,0|2,0,0]=4 2057 B14R1.138 CC/C=C/COC1CCCCCC1=O a8d41c0d81344f78e5bc8e7ecbc417d5 [0,1,0,1,0,0|2,0,0]=4 2058 B14R1.138 CC/C=C/COC1CCCCNC1=O 5b24e044cc765f4a795d87b0c287c646 [0,1,0,1,0,0|2,0,0]=4 2059 B14R1.138 CC/C=C\COC1CCCCCC1=O 3437fd7be7694a9021b71c7fec5a99fa [0,1,0,1,0,0|2,0,0]=4 2060 B14R1.138 CC/C=C\COC1CCCCNC1=O 88cacb779e18c0dfbbe0b57085f61ae9 [0,1,0,1,0,0|2,0,0]=4 2061 B14R1.2357 CC/C=C\CCOC1CN(C1)CCC 7acfa8f06df4b44adaedb2e91d570d32 [0,1,0,1,0,0|1,0,1]=4 2062 B14R1.2357 CC/C=C\CCO[C@H]1C[C@@H](C1)COC c1a010119b1c1eb17c9c88ba31f45e9f [0,1,0,1,0,0|1,0,1]=4 2063 B14R1.2357 CC/C=C\CCO[C@H]1C[C@@H](C1)OCC a78aac7f11c8ddd5a5044520cc2e2f79 [0,1,0,1,0,0|1,0,1]=4 2064 B14R1.2357 CC/C=C\CCO[C@H]1C[C@H](C1)COC 5088340f99b0e92f84c6695988bbc196 [0,1,0,1,0,0|1,0,1]=4 2065 B14R1.2357 CC/C=C\CCO[C@H]1C[C@H](C1)OCC a12066ba3f1cbc49e1ed269af0506480 [0,1,0,1,0,0|1,0,1]=4 2066 B14R1.166 CCCCC(=O)C(=O)N1CC=CCC1 51829befd10a42fa79317441ee3e1ac3 [0,1,0,1,0,0|2,0,0]=4 2067 B14R2.10953 CC/C=C\CCOC1CC2CC2C1 3bd43ef1aead5b097b8757e65fcb8bd1 [0,0,0,2,0,0|1,0,1]=4 2068 B14R2.10953 CC/C=C\CCOC1C[C@@H]2C[C@@H]2C1 41156b48812ccb7b2f6e566363071535 [0,0,0,2,0,0|1,0,1]=4 2069 B14R2.10953 CC/C=C\CCO[C@@H]1C[C@@H]2C[C@@H]2C1 ef9096a34866a6ecd0acd0d76e65e5c3 [0,0,0,2,0,0|1,0,1]=4 2070 B14R2.10953 CC/C=C\CCO[C@H]1C[C@@H]2C[C@@H]2C1 96e737103dd4cdae0e7b35c79314ca27 [0,0,0,2,0,0|1,0,1]=4 2071 B14R2.13702 CC/C=C\CCOC1CCC2C1C2 6d7f73b6815f1602710b31c0451c7cc0 [0,0,0,2,0,0|1,0,1]=4 2072 B14R2.13702 CC/C=C\CCO[C@@H]1CC[C@@H]2[C@H]1C2 0cb50963e5410f16560064c2a43eb711 [0,0,0,2,0,0|1,0,1]=4 2073 B14R2.6 C1=CCC(CC1)OC2CCCCC2 a743c093bba06ad1dc0c329c41c1740a [0,0,0,2,0,0|1,0,1]=4 2074 B14R2.6 C1=CCC(CC1)OC2CCCCO2 8936e77af42e3be17f76e30abe0c771b [0,0,0,2,0,0|0,0,2]=4 2075 B14R2.101 C1=CC(CC1)COC2CCCCC2 b1196eb4a1812ddf98886c831557b2c0 [0,0,0,2,0,0|1,0,1]=4 2076 B14R2.101 C1=CC(CC1)COC2CCCCO2 bbaf79c02c9b25c2b2121ea7883c1ed2 [0,0,0,2,0,0|0,0,2]=4 2077 B14R2.9589 O=C(CN1CC=CCC1)C2CCC2 315f382fdac813db111de2e9cf173d0d [0,0,0,2,0,0|2,0,0]=4 2078 B14R2.2647 CCCCC(=O)N1CC2C=CC1C2 8669046304e178aefdf7761e25d10143 [0,0,0,2,0,0|1,0,0]=3 2079 B14R2.2647 CCCCC(=O)N1C[C@H]2C=C[C@@H]1C2 0fe5d3ed298069714d02e852e594c406 [0,0,0,2,0,0|1,0,0]=3 2080 B14R2.2647 CCCNC(=O)N1CC2C=CC1C2 5514381868d84d953ea7325190dbbb78 [0,0,0,2,0,0|2,0,0]=4 2081 B14R2.2647 CCCNC(=O)N1C[C@H]2C=C[C@@H]1C2 bf7c2b1efadb2287935a9699bab6adf9 [0,0,0,2,0,0|2,0,0]=4 2082 B14R2.2647 CCOCC(=O)N1CC2C=CC1C2 15cdfc180d7f7db0b911c55798958a41 [0,0,0,2,0,0|2,0,0]=4 2083 B14R2.2647 CCOCC(=O)N1C[C@H]2C=C[C@@H]1C2 069a7ce3530c9aebdb8d592de63ea869 [0,0,0,2,0,0|2,0,0]=4 2084 B14R2.2647 CCSCC(=O)N1CC2C=CC1C2 92f00f48d6887b83397508898ad7569d [0,0,0,2,0,0|2,0,0]=4 2085 B14R2.2647 CCSCC(=O)N1C[C@H]2C=C[C@@H]1C2 73bcaf134f153466ba23aa6910d03bb6 [0,0,0,2,0,0|2,0,0]=4 2086 B14R2.2647 COCCC(=O)N1CC2C=CC1C2 3d75a0ccec802e00ff8c27d020947b3d [0,0,0,2,0,0|2,0,0]=4 2087 B14R2.2647 COCCC(=O)N1C[C@H]2C=C[C@@H]1C2 829354a918ef72af5455b6879fb8a3a2 [0,0,0,2,0,0|2,0,0]=4 2088 B14R2.2647 CSCCC(=O)N1CC2C=CC1C2 75451beec38a1e55852a9188d6933b45 [0,0,0,2,0,0|2,0,0]=4 2089 B14R2.2647 CSCCC(=O)N1C[C@H]2C=C[C@@H]1C2 0f509816b5f0fb969de4276f69ce45b3 [0,0,0,2,0,0|2,0,0]=4 2090 B14R2.2647 O=C(CCCF)N1CC2C=CC1C2 508fdd24b6ed30b238eda8955206d0d7 [0,0,0,2,0,0|2,0,0]=4 2091 B14R2.2647 O=C(CCCF)N1C[C@H]2C=C[C@@H]1C2 983f1607d27dc9f8e3fcae9f13ede733 [0,0,0,2,0,0|2,0,0]=4 2092 B14R2.2647 O=C(CCCS)N1CC2C=CC1C2 b0bfccda9a11d7c42923144f19cd4a0f [0,0,0,2,0,0|2,0,0]=4 2093 B14R2.2647 O=C(CCCS)N1C[C@H]2C=C[C@@H]1C2 36726427011f8276928a7c0583626a75 [0,0,0,2,0,0|2,0,0]=4 2094 B14R2.40225 O=C(COC1C=CCC1)C2CCC2 815a3e11482734bb87629aa10564c182 [0,0,0,2,0,0|2,0,0]=4 2095 B14R2.12259 CC/C=C/CCOC1CC12CCC2 4eb7defd5317a33242f5e2a893fcf414 [0,0,0,2,0,0|1,0,1]=4 2096 B14R2.12259 CC/C=C\CCOC1CC12CCC2 672be3e780a6f974bb51256457302542 [0,0,0,2,0,0|1,0,1]=4 2097 B14R2.16188 CC/C=C\CCOC1CC2(C1)CC2 d594eb76f6954f5fcc0e300df8b99340 [0,0,0,2,0,0|1,0,1]=4