0 B10R0.91 C#CCCC(=O)CCOCC 506a2383ca2595e8e13b670912e7ea9a [0,0,0,0,0,0|2,0,2]=4 1 B10R0.91 C#CCCC(=O)NCCCC 5fe7a91e626a115b7fd20a7f46a80c67 [0,0,0,0,0,0|2,0,2]=4 2 B10R0.91 C#CCCCC(=O)NCCBr 00877a5d0464ca847f0fa87fbae37670 [0,0,0,0,0,0|2,0,2]=4 3 B10R0.91 C#CCCCC(=O)NCCC 00bffe1ead2ef89b93dfcf498f5db805 [0,0,0,0,0,0|1,0,2]=3 4 B10R0.91 C#CCCCC(=O)NCCF ab7a4ec0c7e1e119d32f09973f5d45b0 [0,0,0,0,0,0|2,0,2]=4 5 B10R0.91 C#CCCCC(=O)NCCI 221dc93ab60e4ec08ca1d256c63d0161 [0,0,0,0,0,0|2,0,2]=4 6 B10R0.91 C#CCCCC(=O)NCCO d3702de6ec2a38639042c37573cde610 [0,0,0,0,0,0|2,0,2]=4 7 B10R0.91 C#CCCCC(=O)NCCS d579a09fdee76e152a678994401f1cf9 [0,0,0,0,0,0|2,0,2]=4 8 B10R0.91 C#CCCNC(=O)CCCC c8302cc1acec9376d30dd65bdc276a6b [0,0,0,0,0,0|2,0,2]=4 9 B10R0.91 C#CCCNC(=O)NCCC a6720a9e3184d69c8f59a1f6b0fee9d7 [0,0,0,0,0,0|2,0,2]=4 10 B10R0.91 C#CCNC(=O)CCCCC 3a9539c168538be171be7576ea899a5d [0,0,0,0,0,0|1,0,2]=3 11 B10R0.91 C#CCNC(=O)CCCCF ad36018b73d81eae6e529af8c40956d0 [0,0,0,0,0,0|2,0,2]=4 12 B10R0.91 C#CCNC(=O)CCCCO 6b3fe968e3538f9442e7d10e44ef758b [0,0,0,0,0,0|2,0,2]=4 13 B10R0.91 C#CCNC(=O)CCCCS d0511196f29b7d6d178116306d43675c [0,0,0,0,0,0|2,0,2]=4 14 B10R0.91 C#CCNC(=O)CCCOC 31aa327cf5072111b31637882b0a01f5 [0,0,0,0,0,0|2,0,2]=4 15 B10R0.91 C#CCNC(=O)CCCSC 38f7e38b3a55bd951a303a8a56a3152b [0,0,0,0,0,0|2,0,2]=4 16 B10R0.91 C#CCNC(=O)CCOCC d6913d6a6a552e0982f2d61f9cb743e7 [0,0,0,0,0,0|2,0,2]=4 17 B10R0.91 C#CCNC(=O)CCSCC 93bed56541019f17fbf6b13677b3aaef [0,0,0,0,0,0|2,0,2]=4 18 B10R0.91 C#CCNC(=O)CNCCC cf0cfcd24393b6f877609328ae5d91ba [0,0,0,0,0,0|2,0,2]=4 19 B10R0.91 C#CCNC(=O)COCCC e8d96f4cf7e0b9f3e4c1cbc0dc135535 [0,0,0,0,0,0|2,0,2]=4 20 B10R0.91 C#CCNC(=O)CSCCC 349c4065780f1fb1023678dcd6ee026a [0,0,0,0,0,0|2,0,2]=4 21 B10R0.91 C#CCNC(=O)NCCCC 4aa797a674b73b7fbfc52e1a35845adc [0,0,0,0,0,0|2,0,2]=4 22 B10R0.91 C#CCNCC(=O)NCCC 8f468c5000287abb6161e4bccceb8912 [0,0,0,0,0,0|2,0,2]=4 23 B10R0.91 C#CCNCC(=O)OCCC 81a2c5bf7689e80e792a6478604fa2ed [0,0,0,0,0,0|1,0,2]=3 24 B10R0.91 C#CCOC(C)CCCCC a8729f5e1a0c3993bc391d3120cc9bbc [0,0,0,0,0,0|1,0,3]=4 25 B10R0.91 C#CCOCC(=O)NCCC 04ab1b46fdd1370b3cf79317c6120619 [0,0,0,0,0,0|2,0,2]=4 26 B10R0.91 C#CCOCC(=O)OCCC 10671fefafd95ec9e6a7349c99539ca9 [0,0,0,0,0,0|1,0,2]=3 27 B10R0.91 C#CCO[C@@H](C)CCCCC 83e5d1f334830f590dcc6fcba1377328 [0,0,0,0,0,0|1,0,3]=4 28 B10R0.91 C#CCO[C@H](C)CCCCC e8321078f174bf84515abb2e51a6efa4 [0,0,0,0,0,0|1,0,3]=4 29 B10R0.91 C/C=C/CC(=O)NCCCC 36087e9f780b7b5769d5a09c52717782 [0,0,0,0,0,0|2,0,2]=4 30 B10R0.91 C=C(CNCCBr)OCOC bef65db1fa951acdf3633651b75f459e [0,0,0,0,0,0|4,0,0]=4 31 B10R0.91 C=C(CNCCC)OCOC a5e6d804f2943483fdb49aaeb4099288 [0,0,0,0,0,0|3,0,0]=3 32 B10R0.91 C=C(CNCCF)OCOC fe79b2061c59ac54e7751793b1f244b3 [0,0,0,0,0,0|4,0,0]=4 33 B10R0.91 C=C(CNCCI)OCOC 944fefb8467f8d44f4588fa27ad260c8 [0,0,0,0,0,0|4,0,0]=4 34 B10R0.91 C=C(CNCCO)OCOC f26c1f08a2178a6375701e05cfa1cfee [0,0,0,0,0,0|4,0,0]=4 35 B10R0.91 C=C(CNCCS)OCOC 96d7ce6ce690fdc82bcd4366c873d543 [0,0,0,0,0,0|4,0,0]=4 36 B10R0.91 C=C(COCCC)OCOC 8e45b0744926a43356dc2431ae291191 [0,0,0,0,0,0|3,0,0]=3 37 B10R0.91 C=C(COCCS)OCOC c3b0d90a1f668d67d9468cf04755ea57 [0,0,0,0,0,0|4,0,0]=4 38 B10R0.91 C=C(COCOC)OCOC 6b080d58d252f626c79fdc47b20b1a55 [0,0,0,0,0,0|4,0,0]=4 39 B10R0.91 C=CCCC(=O)NCCCC c179eac9e1b3e18e9a6dfaa5dad688c2 [0,0,0,0,0,0|2,0,2]=4 40 B10R0.91 C=CCCCC(=O)NCCBr 839d9300d2c7ebacfee6aad7b1e4002e [0,0,0,0,0,0|2,0,2]=4 41 B10R0.91 C=CCCCC(=O)NCCC 711c26831a61ec4c93ba9b4bcdfa02df [0,0,0,0,0,0|1,0,2]=3 42 B10R0.91 C=CCCCC(=O)NCCF d06f05a2ba0624e66696731666e4075b [0,0,0,0,0,0|2,0,2]=4 43 B10R0.91 C=CCCCC(=O)NCCI 122353b534b3d465575b0fce22009659 [0,0,0,0,0,0|2,0,2]=4 44 B10R0.91 C=CCCCC(=O)NCCO 40ba5e96a72b4b77dc84d26078804085 [0,0,0,0,0,0|2,0,2]=4 45 B10R0.91 C=CCCCC(=O)NCCS f6748715f411776cd7affbc1a4231d48 [0,0,0,0,0,0|2,0,2]=4 46 B10R0.91 C=CCCC[C@H](C)OCCC f2f8647b904d51e806a58b2daa4392bf [0,0,0,0,0,0|1,0,3]=4 47 B10R0.91 C=CCCNC(=O)CCCC 69c4edbb5c60d786a453503b63dbd91a [0,0,0,0,0,0|2,0,2]=4 48 B10R0.91 C=CCCNC(=O)NCCC 24529862e5cb083f4bec92859e0314d5 [0,0,0,0,0,0|2,0,2]=4 49 B10R0.91 C=CCNC(=O)CNCCC c766befecc0bd8e61fcde973a06fe6e3 [0,0,0,0,0,0|2,0,2]=4 50 B10R0.91 C=CCNC(=O)COCCC ac0adfc604812b2ddf898cc747eec467 [0,0,0,0,0,0|2,0,2]=4 51 B10R0.91 C=CCNCC(=O)NCCC f3f804c27731123c4eeffa7683f26fe3 [0,0,0,0,0,0|2,0,2]=4 52 B10R0.91 C=CCOC(=O)CNCCBr 292b101b7aa5e6b716fdb0c615c4cd40 [0,0,0,0,0,0|2,0,2]=4 53 B10R0.91 C=CCOC(=O)CNCCC 67648fc925c12c4956dc2099905c7d17 [0,0,0,0,0,0|1,0,2]=3 54 B10R0.91 C=CCOC(=O)CNCCF b27292c97099dfd687c732b99fb28d53 [0,0,0,0,0,0|2,0,2]=4 55 B10R0.91 C=CCOC(=O)CNCCI caf122bb7c9fdfd7150684f86d353266 [0,0,0,0,0,0|2,0,2]=4 56 B10R0.91 C=CCOC(=O)CNCCO 9c633adb142dcd984b91721bc7ab005c [0,0,0,0,0,0|2,0,2]=4 57 B10R0.91 C=CCOC(=O)CNCCS 7ca69f62294d91ee5f88719fab08effe [0,0,0,0,0,0|2,0,2]=4 58 B10R0.91 C=CCOC(=O)COCCC 22ef072aef512cb24bc01a19df239852 [0,0,0,0,0,0|1,0,2]=3 59 B10R0.91 C=CCOC(=O)COCCF 367cd8af4661d625a1cea3c1688f164c [0,0,0,0,0,0|2,0,2]=4 60 B10R0.91 C=CCOC(=O)COCCS ffb47eaf41ea89e7343ceefc800a94da [0,0,0,0,0,0|2,0,2]=4 61 B10R0.91 C=CCOC(=O)COCOC 04044bbf632059c4fb831d738e93150b [0,0,0,0,0,0|2,0,2]=4 62 B10R0.91 C=CCOC(C)CCCCC 1bf318c09ab551e6504949fb18974eac [0,0,0,0,0,0|1,0,3]=4 63 B10R0.91 C=CCOCC(=O)NCCC 669229a3d827ee8564ec608831f19999 [0,0,0,0,0,0|2,0,2]=4 64 B10R0.91 C=CCO[C@@H](C)CCCCC 2ee769b365c5d7600b33a7d7cbc56689 [0,0,0,0,0,0|1,0,3]=4 65 B10R0.91 C=CCO[C@H](C)CCCCC ee38a79dc4d8a69b1a244e1fe20b43b0 [0,0,0,0,0,0|1,0,3]=4 66 B10R0.91 C=CCSCC(=O)NCCC 818b0bafb143438299d9ab2b3a08019e [0,0,0,0,0,0|2,0,2]=4 67 B10R0.91 CC#CCC(=O)NCCCC 820fba93e19e4e4d93f26dd4d797f9b5 [0,0,0,0,0,0|2,0,2]=4 68 B10R0.91 CC#CCCC(=O)NCCBr 21232cc2f19b654dea3d09e02b17f10c [0,0,0,0,0,0|2,0,2]=4 69 B10R0.91 CC#CCCC(=O)NCCC a69a6537b22482b96f5a4f4081226422 [0,0,0,0,0,0|1,0,2]=3 70 B10R0.91 CC#CCCC(=O)NCCF 61d0d07c182a948df67e2103a6fabdf8 [0,0,0,0,0,0|2,0,2]=4 71 B10R0.91 CC#CCCC(=O)NCCI 1c2407dca3d1b516038db9ecf46d273a [0,0,0,0,0,0|2,0,2]=4 72 B10R0.91 CC#CCCC(=O)NCCO 90e336dfeb644854965a7604b9e7a582 [0,0,0,0,0,0|2,0,2]=4 73 B10R0.91 CC#CCCC(=O)NCCS 1a6064814c5b7077ec8fdda584165d09 [0,0,0,0,0,0|2,0,2]=4 74 B10R0.91 CC#CCNC(=O)CCCC eff42074a14e595a0328f5a244791b85 [0,0,0,0,0,0|2,0,2]=4 75 B10R0.91 CC#CCNC(=O)NCCC 02290d5c887f7dfc1e326887bdaae265 [0,0,0,0,0,0|2,0,2]=4 76 B10R0.91 CC/C=C/C(=O)NCCCC c9d7698c45e961917c65b16fe10c228c [0,0,0,0,0,0|2,0,1]=3 77 B10R0.91 CC/C=C/C(=O)NCCCCl 23e09d293afdf166f3481074faf54d94 [0,0,0,0,0,0|3,0,1]=4 78 B10R0.91 CC/C=C/C(=O)NCCCO af01563a9a52397606feca75c69a0aeb [0,0,0,0,0,0|3,0,1]=4 79 B10R0.91 CC/C=C/C(=O)NCCOC 8f0503dbfee3011df592fab03f88100a [0,0,0,0,0,0|3,0,1]=4 80 B10R0.91 CC/C=C/C(=O)NCCSC 5ebb757ce444b70cc045f224db592db5 [0,0,0,0,0,0|3,0,1]=4 81 B10R0.91 CC/C=C/CC(=O)NCCBr f37bb003bd92ac4d0e7cc45c4e88a7eb [0,0,0,0,0,0|2,0,2]=4 82 B10R0.91 CC/C=C/CC(=O)NCCC b0c6d67b89af1fa4f0f3663914f15094 [0,0,0,0,0,0|1,0,2]=3 83 B10R0.91 CC/C=C/CC(=O)NCCF 6ccce12a3a16451ecc358edbc609a87d [0,0,0,0,0,0|2,0,2]=4 84 B10R0.91 CC/C=C/CC(=O)NCCI 877695eb6ccb7bae8126ea0e3f7d2a09 [0,0,0,0,0,0|2,0,2]=4 85 B10R0.91 CC/C=C/CC(=O)NCCO 1493eb8bad76a81488488c5bdbf69ab1 [0,0,0,0,0,0|2,0,2]=4 86 B10R0.91 CC/C=C/CC(=O)NCCS 367058fa9e112455fe65bda7cc17162c [0,0,0,0,0,0|2,0,2]=4 87 B10R0.91 CC/C=C\C(=O)NCCCC e763bdcbf0afee106f8b1aa0242ce88a [0,0,0,0,0,0|2,0,1]=3 88 B10R0.91 CC/C=C\C(=O)NCCCCl 69cac1db561c400d22a96058d4c41c46 [0,0,0,0,0,0|3,0,1]=4 89 B10R0.91 CC/C=C\C(=O)NCCCO 3f93d99667937d6c137571aabc0551d2 [0,0,0,0,0,0|3,0,1]=4 90 B10R0.91 CC/C=C\C(=O)NCCOC 7f1fbdf1ab44a6083662ca5baf9f0274 [0,0,0,0,0,0|3,0,1]=4 91 B10R0.91 CC/C=C\C(=O)NCCSC 5ecf0a550e9db08d07c6e54677e940c4 [0,0,0,0,0,0|3,0,1]=4 92 B10R0.91 CC/C=C\CC(=O)NCCBr c0101c05d2438d6ed71558e7cde4095f [0,0,0,0,0,0|2,0,2]=4 93 B10R0.91 CC/C=C\CC(=O)NCCC 9766dbc28eb370933ff877484a58deff [0,0,0,0,0,0|1,0,2]=3 94 B10R0.91 CC/C=C\CC(=O)NCCF e65bb59268044b1f7314ea58bb5f6e07 [0,0,0,0,0,0|2,0,2]=4 95 B10R0.91 CC/C=C\CC(=O)NCCI d89e075bdc8a92a3e8bd3b05823c36a0 [0,0,0,0,0,0|2,0,2]=4 96 B10R0.91 CC/C=C\CC(=O)NCCO df1f53ca458cf9749adbc2c1d5e2ca50 [0,0,0,0,0,0|2,0,2]=4 97 B10R0.91 CC/C=C\CC(=O)NCCS 27c10c71c15987e41baa09236f98e5b5 [0,0,0,0,0,0|2,0,2]=4 98 B10R0.91 CC=CCCC(=O)NCCBr 6c4d019b5685c6db3a6467179c26d402 [0,0,0,0,0,0|2,0,2]=4 99 B10R0.91 CC=CCCC(=O)NCCC df5f18c0a3dc2e8e1c690fac3e9556f8 [0,0,0,0,0,0|1,0,2]=3 100 B10R0.91 CC=CCCC(=O)NCCF f6d521b73e99faafc1e6f299f6d731f2 [0,0,0,0,0,0|2,0,2]=4 101 B10R0.91 CC=CCCC(=O)NCCI 3bed3ab473dfc6e1a4a9cdd6a9beac36 [0,0,0,0,0,0|2,0,2]=4 102 B10R0.91 CC=CCCC(=O)NCCO 7cef69a4c86bf6dff344085c46317eee [0,0,0,0,0,0|2,0,2]=4 103 B10R0.91 CC=CCCC(=O)NCCS a7941efaa5a0e3a28cf1ead94f3582fa [0,0,0,0,0,0|2,0,2]=4 104 B10R0.91 CC=CCNC(=O)CCCC 4d197d152214c72ad748c812327bf472 [0,0,0,0,0,0|2,0,2]=4 105 B10R0.91 CC=CCNC(=O)NCCC e946524fbac89a871414fdd4f189d293 [0,0,0,0,0,0|2,0,2]=4 106 B10R0.91 CCC#CC(=O)NCCCC eb0d5ef3057613a48ba20ba5c7d222fb [0,0,0,0,0,0|2,0,1]=3 107 B10R0.91 CCC#CC(=O)NCCCCl 308a27d76aad811cc51af2b6f79b5eb4 [0,0,0,0,0,0|3,0,1]=4 108 B10R0.91 CCC#CC(=O)NCCCO 3929447105f3406eb3e5166047cfe048 [0,0,0,0,0,0|3,0,1]=4 109 B10R0.91 CCC#CC(=O)NCCOC 528567dbc4088e8b7460374e81777316 [0,0,0,0,0,0|3,0,1]=4 110 B10R0.91 CCC#CC(=O)NCCSC 33ce38487028985b0be56f896991025c [0,0,0,0,0,0|3,0,1]=4 111 B10R0.91 CCC#CCC(C)OCCC 7a05502df174e06d36b5c96f156bcb9a [0,0,0,0,0,0|1,0,3]=4 112 B10R0.91 CCC/C=C/C(=O)NCCBr a686f173d6186d0ca988f83a73aa5242 [0,0,0,0,0,0|2,0,2]=4 113 B10R0.91 CCC/C=C/C(=O)NCCC d392f1b784a241f143e2ff6e6c67f397 [0,0,0,0,0,0|1,0,2]=3 114 B10R0.91 CCC/C=C/C(=O)NCCF 2f573eb2c1f2a0b089426f0889eabcf4 [0,0,0,0,0,0|2,0,2]=4 115 B10R0.91 CCC/C=C/C(=O)NCCI 0c7fdc3a561263b8dc85026eaa44b746 [0,0,0,0,0,0|2,0,2]=4 116 B10R0.91 CCC/C=C/C(=O)NCCO fa8eed13f99c723ef74714f573f02297 [0,0,0,0,0,0|2,0,2]=4 117 B10R0.91 CCC/C=C/C(=O)NCCS 34af2f14e8f787a0c910d6db75f16264 [0,0,0,0,0,0|2,0,2]=4 118 B10R0.91 CCC=CC(=O)NCCCC 7db747ae7974c9974839229645987c28 [0,0,0,0,0,0|2,0,1]=3 119 B10R0.91 CCC=CC(=O)NCCCCl 8a3219c8de80265144c37ae8ffcc852d [0,0,0,0,0,0|3,0,1]=4 120 B10R0.91 CCC=CC(=O)NCCCO 6715ddeb1baeba3b8a7492966e757d12 [0,0,0,0,0,0|3,0,1]=4 121 B10R0.91 CCC=CC(=O)NCCOC 690013a9051a6db444a298258bb8a61e [0,0,0,0,0,0|3,0,1]=4 122 B10R0.91 CCC=CC(=O)NCCSC 54061f5554f2fd61d0dc8fa37903b158 [0,0,0,0,0,0|3,0,1]=4 123 B10R0.91 CCC=CCC(=O)NCCBr 607d96fa4830625c95836bf1f67186f9 [0,0,0,0,0,0|2,0,2]=4 124 B10R0.91 CCC=CCC(=O)NCCC b4918c368f0d79faa2e9aca1f273b1d5 [0,0,0,0,0,0|1,0,2]=3 125 B10R0.91 CCC=CCC(=O)NCCF 941cf05b6dbb56480ad7c05509d9b82b [0,0,0,0,0,0|2,0,2]=4 126 B10R0.91 CCC=CCC(=O)NCCI af10a6f29d14c73cfd4c037a1e9897fd [0,0,0,0,0,0|2,0,2]=4 127 B10R0.91 CCC=CCC(=O)NCCO 99327469f7c996e817d65b2988d32523 [0,0,0,0,0,0|2,0,2]=4 128 B10R0.91 CCC=CCC(=O)NCCS 5e1838a202a426d3ced347a4547ed136 [0,0,0,0,0,0|2,0,2]=4 129 B10R0.91 CCCC#CC(=O)NCCBr 40f563c5a2a878165cd90bdf156c30b7 [0,0,0,0,0,0|2,0,2]=4 130 B10R0.91 CCCC#CC(=O)NCCC bd0faf45af765227fba34862d826c3f5 [0,0,0,0,0,0|1,0,2]=3 131 B10R0.91 CCCC#CC(=O)NCCF b8b1832573c740793fceaf49f8d4469f [0,0,0,0,0,0|2,0,2]=4 132 B10R0.91 CCCC#CC(=O)NCCI 38d94c612ad152e2216853b2e44a666a [0,0,0,0,0,0|2,0,2]=4 133 B10R0.91 CCCC#CC(=O)NCCO 8801fb277a8641db1041a0a5b0e903e7 [0,0,0,0,0,0|2,0,2]=4 134 B10R0.91 CCCC#CC(=O)NCCS 402d654fd09aedf67e4e71b03d4ee262 [0,0,0,0,0,0|2,0,2]=4 135 B10R0.91 CCCC=CC(=O)NCCBr dc014f383f11e372546c5827dd326441 [0,0,0,0,0,0|2,0,2]=4 136 B10R0.91 CCCC=CC(=O)NCCC 7f0c42e078f87c7991322000d746efa0 [0,0,0,0,0,0|1,0,2]=3 137 B10R0.91 CCCC=CC(=O)NCCF 7bc69b5d153d86120496dc55794e718c [0,0,0,0,0,0|2,0,2]=4 138 B10R0.91 CCCC=CC(=O)NCCI a086cec0d10693a3a01942a98060e364 [0,0,0,0,0,0|2,0,2]=4 139 B10R0.91 CCCC=CC(=O)NCCO 1c0d6441b4f39bed42b617dd2f9eefe5 [0,0,0,0,0,0|2,0,2]=4 140 B10R0.91 CCCC=CC(=O)NCCS 9d2b811e910c09ed1b5c022455683580 [0,0,0,0,0,0|2,0,2]=4 141 B10R0.91 CCCCC(=O)NCCC#N 3701e446f87a1b91c6ee9e6403ace12d [0,0,0,0,0,0|3,0,1]=4 142 B10R0.91 CCCCC(=O)NCCCCl 33a4b5638fdb717aefdcf6539c550173 [0,0,0,0,0,0|3,0,0]=3 143 B10R0.91 CCCCC(=O)NCCCO a506e03803236b22b3ae12611eccbe7c [0,0,0,0,0,0|3,0,0]=3 144 B10R0.91 CCCCC(=O)NCCOC 5ea5ee64f6f2aa6ec9332a0ab051832d [0,0,0,0,0,0|3,0,0]=3 145 B10R0.91 CCCCC(=O)NCCON ab7288323b65f0a16112fec518fc543a [0,0,0,0,0,0|4,0,0]=4 146 B10R0.91 CCCCC(=O)NCCSC 8fb8629ea12736b986b6b7c52fdb4519 [0,0,0,0,0,0|3,0,0]=3 147 B10R0.91 CCCCC(C)CCOCC dcfcf3050acc252f88392f069e85bccb [0,0,0,0,0,0|3,0,1]=4 148 B10R0.91 CCCCC(C)COCCC 78887e02645acac996820306d15e15f3 [0,0,0,0,0,0|3,0,1]=4 149 B10R0.91 CCCCC(O)CNCCC 82254e64d17d29f6bf92ce5d9eb8395d [0,0,0,0,0,0|2,0,2]=4 150 B10R0.91 CCCCCC(=O)CNC#N 59eec95b45132f0bb48e8a41497ffd57 [0,0,0,0,0,0|3,0,1]=4 151 B10R0.91 CCCCCC(=O)NCC#N 99acbb342bd90a5ac939699382b951cb [0,0,0,0,0,0|2,0,1]=3 152 B10R0.91 CCCCCC(=O)NCCBr fec600b048b9d57116c2b5748a328020 [0,0,0,0,0,0|2,0,0]=2 153 B10R0.91 CCCCCC(=O)NCCC 476273c2f4455ec9a0886335ed7ef341 [0,0,0,0,0,0|1,0,0]=1 154 B10R0.91 CCCCCC(=O)NCCF 37faddc206bd3b00f66a7e3bde923aa9 [0,0,0,0,0,0|2,0,0]=2 155 B10R0.91 CCCCCC(=O)NCCI 369522553d6e91903d542a4f6550697a [0,0,0,0,0,0|2,0,0]=2 156 B10R0.91 CCCCCC(=O)NCCO 92903432fe4eb247c90d29401a47cf8c [0,0,0,0,0,0|2,0,0]=2 157 B10R0.91 CCCCCC(=O)NCCS 4780dcd137d64b0482a6c8e0700623f7 [0,0,0,0,0,0|2,0,0]=2 158 B10R0.91 CCCCCC(C)COCC 147727976b090f1dbf99e69e5a726500 [0,0,0,0,0,0|3,0,1]=4 159 B10R0.91 CCCCCC(C)NCCC 4156bf435f60ce49ce25cee90de14564 [0,0,0,0,0,0|2,0,1]=3 160 B10R0.91 CCCCCC(C)NCCF 3e62f89cf5534a2492491fbb598d14bd [0,0,0,0,0,0|3,0,1]=4 161 B10R0.91 CCCCCC(C)NCCI 78ad95dfbe56d7adfeefcffb21ce7886 [0,0,0,0,0,0|3,0,1]=4 162 B10R0.91 CCCCCC(C)NCCO fa0bb457d4449c1ef05d49c1ba4c7526 [0,0,0,0,0,0|3,0,1]=4 163 B10R0.91 CCCCCC(C)NCCS 946e43e75ba9eb48d02df84faf95e262 [0,0,0,0,0,0|3,0,1]=4 164 B10R0.91 CCCCCC(C)NCOC 7971d52f02d4c795e2b836a755f5202c [0,0,0,0,0,0|3,0,1]=4 165 B10R0.91 CCCCCC(C)NCSC 8fba0e639c1d6a53d7edd90d114813c8 [0,0,0,0,0,0|3,0,1]=4 166 B10R0.91 CCCCCC(C)OCC#N 4de5bd27f279deb4a08fb47da7b2fb6b [0,0,0,0,0,0|2,0,2]=4 167 B10R0.91 CCCCCC(C)OCC=O b8c5585eaae6e000325f96773525d1b7 [0,0,0,0,0,0|2,0,2]=4 168 B10R0.91 CCCCCC(C)OCCC 6eceaa249e6a01f1402a1eee4363e708 [0,0,0,0,0,0|1,0,1]=2 169 B10R0.91 CCCCCC(C)OCCF f19c301b6639b7c6f7116bdd69fb99f9 [0,0,0,0,0,0|2,0,1]=3 170 B10R0.91 CCCCCC(C)OCCS 32ca888c5d68a1ca7818563c2e14f78d [0,0,0,0,0,0|2,0,1]=3 171 B10R0.91 CCCCCC(C)OCOC 581b6703cfce4165387dde73d76d6295 [0,0,0,0,0,0|2,0,1]=3 172 B10R0.91 CCCCCC(C)OCSC 3e728d4c259efd8baf9530cf3c3cf442 [0,0,0,0,0,0|2,0,1]=3 173 B10R0.91 CCCCCN(C)CCCC ae015dd3bcf455f801be1b6a9ddc8016 [0,0,0,0,0,0|3,0,0]=3 174 B10R0.91 CCCCCN(C)CCCF 2c4cb7fea4e45a08d0766b7f97fe9cf6 [0,0,0,0,0,0|4,0,0]=4 175 B10R0.91 CCCCCN(C)CCCO 7c2b776f124070e940545f38821e057a [0,0,0,0,0,0|4,0,0]=4 176 B10R0.91 CCCCCN(C)CCCS 9241895cd29c0b67c14a902e73d91ad4 [0,0,0,0,0,0|4,0,0]=4 177 B10R0.91 CCCCCN(C)CCOC 8ecf4802ab17e9994dec88d6771e2716 [0,0,0,0,0,0|4,0,0]=4 178 B10R0.91 CCCCCN(C)CCSC 6f477410e260fb1ed6ff14a785da6d41 [0,0,0,0,0,0|4,0,0]=4 179 B10R0.91 CCCCCN(C)COCC 3e053a2cc3028e0b1a9571fd4c5717f2 [0,0,0,0,0,0|4,0,0]=4 180 B10R0.91 CCCCC[C@@H](C)OCC#N f7a9778ebb9f8cf3fde152224b6abc29 [0,0,0,0,0,0|2,0,2]=4 181 B10R0.91 CCCCC[C@@H](C)OCC=O 5d597290901426621601c215c0b29b48 [0,0,0,0,0,0|2,0,2]=4 182 B10R0.91 CCCCC[C@@H](C)OCCC 3679ace7923186b0bcb825f4feeef123 [0,0,0,0,0,0|1,0,1]=2 183 B10R0.91 CCCCC[C@@H](C)OCCF 3609dc02c2c277c78b6dfc8738a8c6f8 [0,0,0,0,0,0|2,0,1]=3 184 B10R0.91 CCCCC[C@@H](C)OCCS 10cf499c838151dd02b61a1ad442f632 [0,0,0,0,0,0|2,0,1]=3 185 B10R0.91 CCCCC[C@@H](C)OCSC e09d7d0313ae79078f858087b69fbd75 [0,0,0,0,0,0|2,0,1]=3 186 B10R0.91 CCCCC[C@H](C)NCCBr 1854b842dbec1863461a83237e7b6c5a [0,0,0,0,0,0|3,0,1]=4 187 B10R0.91 CCCCC[C@H](C)NCCC 8398d593d667db0fd774223a271466cd [0,0,0,0,0,0|2,0,1]=3 188 B10R0.91 CCCCC[C@H](C)NCCF d4f4276688beed176effa745d6154bb7 [0,0,0,0,0,0|3,0,1]=4 189 B10R0.91 CCCCC[C@H](C)NCCI 85afa542e59bf555bab253963e40c2ca [0,0,0,0,0,0|3,0,1]=4 190 B10R0.91 CCCCC[C@H](C)NCCO 3307dfa6e21c72858fcd3cfc3dd52fc5 [0,0,0,0,0,0|3,0,1]=4 191 B10R0.91 CCCCC[C@H](C)NCCS 8c74fa6a417738bf7bdc93f73cf39974 [0,0,0,0,0,0|3,0,1]=4 192 B10R0.91 CCCCC[C@H](C)NCOC 1dd527f9b5422b3a9215887d9ebf28fb [0,0,0,0,0,0|3,0,1]=4 193 B10R0.91 CCCCC[C@H](C)NCSC b2ff2f5b257108a000f9b352771c5fba [0,0,0,0,0,0|3,0,1]=4 194 B10R0.91 CCCCC[C@H](C)OCC#N 6d8676ab392a298c19419822e0505a32 [0,0,0,0,0,0|2,0,2]=4 195 B10R0.91 CCCCC[C@H](C)OCC=O a46961302ad7e0a9ddd3f577a4f840a9 [0,0,0,0,0,0|2,0,2]=4 196 B10R0.91 CCCCC[C@H](C)OCCC 592af913246f5124bacdc41f8045c3f5 [0,0,0,0,0,0|1,0,1]=2 197 B10R0.91 CCCCC[C@H](C)OCCF d93368bb1eebf4fed6d9d6be2c141c26 [0,0,0,0,0,0|2,0,1]=3 198 B10R0.91 CCCCC[C@H](C)OCCS 51fdc76104556955d3129a6b84fac3dc [0,0,0,0,0,0|2,0,1]=3 199 B10R0.91 CCCCC[C@H](C)OCOC 6714ac506a47a9a7f1b4c53006f7dd2a [0,0,0,0,0,0|2,0,1]=3 200 B10R0.91 CCCCC[C@H](C)OCSC b80ba12d550283b0f163b728b738ba1e [0,0,0,0,0,0|2,0,1]=3 201 B10R0.91 CCCCN(C)CCCCF 0574b839d9e7c1042ecea22e354d0db5 [0,0,0,0,0,0|4,0,0]=4 202 B10R0.91 CCCCN(C)CCCCO bdca003f8f75d9bb51d804e121720507 [0,0,0,0,0,0|4,0,0]=4 203 B10R0.91 CCCCN(C)CCCOC 2435dbe0060524c27d148d27e377fc53 [0,0,0,0,0,0|4,0,0]=4 204 B10R0.91 CCCCN(C)CCCSC 0f0620d41fd7e9facb077d23de9721f6 [0,0,0,0,0,0|4,0,0]=4 205 B10R0.91 CCCCN(C)CCNCC 8d0adb847e65d1f32298940174d794d9 [0,0,0,0,0,0|4,0,0]=4 206 B10R0.91 CCCCN(C)CCOCC b203280423c3beee9173f5e6f5183179 [0,0,0,0,0,0|4,0,0]=4 207 B10R0.91 CCCCN(C)CCSCC 6758287a4ad2a67bba9a8a9931a18ef4 [0,0,0,0,0,0|4,0,0]=4 208 B10R0.91 CCCCNC(=O)/C=C/CF 8667a45f327c3048a0920a861f1269e2 [0,0,0,0,0,0|3,0,1]=4 209 B10R0.91 CCCCNC(=O)/C=C/CO 2ac8c685ff9390416ab8532d6a061444 [0,0,0,0,0,0|3,0,1]=4 210 B10R0.91 CCCCNC(=O)/C=C/OC 3ddb36a096aff7b4f218a15538d36db8 [0,0,0,0,0,0|3,0,1]=4 211 B10R0.91 CCCCNC(=O)C#CCO 303581e4c1610ea2e05ad82e28a36721 [0,0,0,0,0,0|3,0,1]=4 212 B10R0.91 CCCCNC(=O)C=CCO 60490383cd93829693fec948905d1cea [0,0,0,0,0,0|3,0,1]=4 213 B10R0.91 CCCCNC(=O)C=COC f50f47380a7d25dd694197dbc461442f [0,0,0,0,0,0|3,0,1]=4 214 B10R0.91 CCCCNC(=O)CCC#N 93c8bdd209851ca74100c559d61cba00 [0,0,0,0,0,0|3,0,1]=4 215 B10R0.91 CCCCNC(=O)CCC=O 16ee83c32f77bd6cec353975767c82cb [0,0,0,0,0,0|3,0,1]=4 216 B10R0.91 CCCCNC(=O)CCCC 5b6c1a774ebc9cf6b3cca95003cc944e [0,0,0,0,0,0|2,0,0]=2 217 B10R0.91 CCCCNC(=O)CCCF 2018023c6b79f86bf88e0ae98d70f56e [0,0,0,0,0,0|3,0,0]=3 218 B10R0.91 CCCCNC(=O)CCCS 1acf0f095503723b4d5b3e9341583954 [0,0,0,0,0,0|3,0,0]=3 219 B10R0.91 CCCCNC(=O)CCOC 6f0c7655b0241fead5cc4be83519576f [0,0,0,0,0,0|3,0,0]=3 220 B10R0.91 CCCCNC(=O)CCSC 6faaa951076ffc1f5066685857593ae9 [0,0,0,0,0,0|3,0,0]=3 221 B10R0.91 CCCCNC(=O)CNCC c8a7f81d189a0f129789cdd44548f084 [0,0,0,0,0,0|3,0,0]=3 222 B10R0.91 CCCCNC(=O)CNCF db89eb86f902596dde56fd91da4f9feb [0,0,0,0,0,0|4,0,0]=4 223 B10R0.91 CCCCNC(=O)CNCO 4a393d383ee0c344b4ad1ec1b76c773b [0,0,0,0,0,0|4,0,0]=4 224 B10R0.91 CCCCNC(=O)COCC cfe07acc4d092a3a207ae22828e3982e [0,0,0,0,0,0|3,0,0]=3 225 B10R0.91 CCCCNC(=O)CSCC 833d758cb45613aad283ee5c135a2097 [0,0,0,0,0,0|3,0,0]=3 226 B10R0.91 CCCCNC(=O)CSSC f360af222a3dccfabe61f8306373bde8 [0,0,0,0,0,0|4,0,0]=4 227 B10R0.91 CCCCNC(=O)NCC#N 87f40224ab0329bd491491b2eaafdf48 [0,0,0,0,0,0|3,0,1]=4 228 B10R0.91 CCCCNC(=O)NCCC 3b1fa47b4b47d4900a6dc31a059123bf [0,0,0,0,0,0|2,0,0]=2 229 B10R0.91 CCCCNC(=O)NCCF a47ebad6a4344a8cd6d64af41a55ef59 [0,0,0,0,0,0|3,0,0]=3 230 B10R0.91 CCCCNC(=O)NCCN e4608c7e9103e64951b3b3e91bede52b [0,0,0,0,0,0|3,0,0]=3 231 B10R0.91 CCCCNC(=O)NCCO 5ce976866a1b734a0c37601e6cd8a545 [0,0,0,0,0,0|3,0,0]=3 232 B10R0.91 CCCCNC(=O)NCCS 811b9b16ef161d504f08855ff40cdae4 [0,0,0,0,0,0|3,0,0]=3 233 B10R0.91 CCCCNC(=S)NCCC 2d59550982b008190310ae7fe640daa6 [0,0,0,0,0,0|2,1,0]=3 234 B10R0.91 CCCCNC(=S)NCCF 13a55e38e39de8f2283cd36f70c0da26 [0,0,0,0,0,0|3,1,0]=4 235 B10R0.91 CCCCNC(=S)NCCN f336650ac6be6c006e8687abd35e8d4a [0,0,0,0,0,0|3,1,0]=4 236 B10R0.91 CCCCNC(=S)NCCO 7d16272428061c84bd72ed8454c26f44 [0,0,0,0,0,0|3,1,0]=4 237 B10R0.91 CCCCNC(=S)NCCS f2c50652fe1ec64074872181e010b573 [0,0,0,0,0,0|3,1,0]=4 238 B10R0.91 CCCCNC(C)CCCC 889d2f9f2940f3e2e7fd486d81326386 [0,0,0,0,0,0|3,0,1]=4 239 B10R0.91 CCCCN[C@H](C)CCCC ab5e4a8639063a5ef8f9b98267076fc7 [0,0,0,0,0,0|3,0,1]=4 240 B10R0.91 CCCCOC(=O)COCC d484bc8a8e1cb9f1bc7a12a52a402449 [0,0,0,0,0,0|3,0,0]=3 241 B10R0.91 CCCCOC(=O)COCF 977c18c762e99407307de342070f2942 [0,0,0,0,0,0|4,0,0]=4 242 B10R0.91 CCCCOC(C)CCCC 7752635d00cac0640dd2ec5dbf9e52a3 [0,0,0,0,0,0|3,0,1]=4 243 B10R0.91 CCCCO[C@@H](C)CCCC c6c923102de856d0f10b7d64a1c257c9 [0,0,0,0,0,0|3,0,1]=4 244 B10R0.91 CCCCO[C@H](C)CCCC 281397569e3850d5ee5ca2dbdbe8e8e7 [0,0,0,0,0,0|3,0,1]=4 245 B10R0.91 CCCNC(=O)/C=C/COC 07454464971e2491cd718d2f3f77ba7a [0,0,0,0,0,0|2,0,2]=4 246 B10R0.91 CCCNC(=O)/C=C/OCC cc247fb8637fe4bfc2b2593ad7144243 [0,0,0,0,0,0|2,0,2]=4 247 B10R0.91 CCCNC(=O)C#CCCO 76f8ff9f00458d8e9a412bbdca4b4ac1 [0,0,0,0,0,0|2,0,2]=4 248 B10R0.91 CCCNC(=O)C#CCOC e7c451b2a649655f0c69861d68bdf9bb [0,0,0,0,0,0|2,0,2]=4 249 B10R0.91 CCCNC(=O)C=CCOC 5bea32fa3ca576ef07fb047016a97d9e [0,0,0,0,0,0|2,0,2]=4 250 B10R0.91 CCCNC(=O)C=COCC a404ee66c724579d385bc0981296227c [0,0,0,0,0,0|2,0,2]=4 251 B10R0.91 CCCNC(=O)CCCC#N a08c5f31792f4e0cb1d5c764d02ffc67 [0,0,0,0,0,0|2,0,1]=3 252 B10R0.91 CCCNC(=O)CCCC=O c163bedd16275fcbbd59f71dd0276dd1 [0,0,0,0,0,0|2,0,1]=3 253 B10R0.91 CCCNC(=O)CCCCF 52b734d8c4d54e3a8a30180636c55039 [0,0,0,0,0,0|2,0,0]=2 254 B10R0.91 CCCNC(=O)CCCCO 8579912c0ebfc7cd5885587b4db2a847 [0,0,0,0,0,0|2,0,0]=2 255 B10R0.91 CCCNC(=O)CCCCS 835528c0eae9e13b3d035166dc558ccf [0,0,0,0,0,0|2,0,0]=2 256 B10R0.91 CCCNC(=O)CCCOC a5e2d1ac29c442ac5d22076049e634e1 [0,0,0,0,0,0|2,0,0]=2 257 B10R0.91 CCCNC(=O)CCCSC aa203c0b5604f7443b39ec139b1594a1 [0,0,0,0,0,0|2,0,0]=2 258 B10R0.91 CCCNC(=O)CCOCC 346f5ddb484887d61ec41ac0a6570f48 [0,0,0,0,0,0|2,0,0]=2 259 B10R0.91 CCCNC(=O)CCSCC 6fe01c91f2feda5344fc25c7a6443960 [0,0,0,0,0,0|2,0,0]=2 260 B10R0.91 CCCNC(=O)CCSSC a586cedd66243b971adeb1cec9001124 [0,0,0,0,0,0|3,0,0]=3 261 B10R0.91 CCCNC(=O)CNCC#N 667a229ec3ab52cf08b149c3b9398de0 [0,0,0,0,0,0|3,0,1]=4 262 B10R0.91 CCCNC(=O)CNCC=O fa1651a087fec2aa0d07c1c1b524108d [0,0,0,0,0,0|3,0,1]=4 263 B10R0.91 CCCNC(=O)CNCCBr b4d77959e74b1aaf09637e4ac11815c1 [0,0,0,0,0,0|3,0,0]=3 264 B10R0.91 CCCNC(=O)CNCCF ac592040b54edaff760e232d75588665 [0,0,0,0,0,0|3,0,0]=3 265 B10R0.91 CCCNC(=O)CNCCI 9eb43510c82fa6c68c328f4f59f41ebf [0,0,0,0,0,0|3,0,0]=3 266 B10R0.91 CCCNC(=O)CNCCO 88c13b2efc5eb89db657fde1c0255197 [0,0,0,0,0,0|3,0,0]=3 267 B10R0.91 CCCNC(=O)CNCCS ebb79838d4bf29bd5bd94c9e74eac425 [0,0,0,0,0,0|3,0,0]=3 268 B10R0.91 CCCNC(=O)CNCOC b894c6b11c1f5b7b92e2446ab086abbf [0,0,0,0,0,0|3,0,0]=3 269 B10R0.91 CCCNC(=O)CNCSC 718edd5808d058178f3a6725a7515acc [0,0,0,0,0,0|3,0,0]=3 270 B10R0.91 CCCNC(=O)COCC#N 2e0de662e57a49a0c1cd06f549cb715d [0,0,0,0,0,0|3,0,1]=4 271 B10R0.91 CCCNC(=O)COCCC 5ab770845b9dc23dab9a6ba7b394ac07 [0,0,0,0,0,0|2,0,0]=2 272 B10R0.91 CCCNC(=O)COCCF 69c9a973dafe2c21ccb3d3c4ae054744 [0,0,0,0,0,0|3,0,0]=3 273 B10R0.91 CCCNC(=O)COCCO 02df34206146785ad6594f0d2fd4c6ae [0,0,0,0,0,0|3,0,0]=3 274 B10R0.91 CCCNC(=O)COCCS daa3be21706e609ecfdc5aa2216fb3fd [0,0,0,0,0,0|3,0,0]=3 275 B10R0.91 CCCNC(=O)COCOC dee2f53d1b1287b7e47398f6938c6d74 [0,0,0,0,0,0|3,0,0]=3 276 B10R0.91 CCCNC(=O)CSCC#N 4888434a27a3728815c1e523b9200585 [0,0,0,0,0,0|3,0,1]=4 277 B10R0.91 CCCNC(=O)CSCCC c50ee73842a3ee50027f989f32b96f00 [0,0,0,0,0,0|2,0,0]=2 278 B10R0.91 CCCNC(=O)NCCC#N d462a4906c3a500f17002540ecc90e40 [0,0,0,0,0,0|3,0,1]=4 279 B10R0.91 CCCNC(=O)NCCCN 0bf407d5632b4101f8cf633915f4e96d [0,0,0,0,0,0|3,0,0]=3 280 B10R0.91 CCCNC(=O)NCCCO 63a6a2a86470ccd63a7e40c0827e9a44 [0,0,0,0,0,0|3,0,0]=3 281 B10R0.91 CCCNC(=O)NCCOC c16b91ad1ebe777bb6a620f9870cf478 [0,0,0,0,0,0|3,0,0]=3 282 B10R0.91 CCCNC(=O)NCCON 63f28b39539d47e931525c3f16d398e1 [0,0,0,0,0,0|4,0,0]=4 283 B10R0.91 CCCNC(=O)NCCSC 049f212894e8dccddc3ee91084c21bf8 [0,0,0,0,0,0|3,0,0]=3 284 B10R0.91 CCCNC(=S)NCCCN 1ab5dd88982036a66835fce1a0fff2de [0,0,0,0,0,0|3,1,0]=4 285 B10R0.91 CCCNC(=S)NCCCO da3ca8f8983455f602b10af4e3328d4c [0,0,0,0,0,0|3,1,0]=4 286 B10R0.91 CCCNC(=S)NCCOC 636c7acfbaea04e807e4e16d879ae361 [0,0,0,0,0,0|3,1,0]=4 287 B10R0.91 CCCNC(=S)NCCSC bca65eabb59ead136aebf40f25558285 [0,0,0,0,0,0|3,1,0]=4 288 B10R0.91 CCCNC(C)CCCCO 01c462df2fecd03dab1173b67820d0f8 [0,0,0,0,0,0|3,0,1]=4 289 B10R0.91 CCCNCC(=O)CCSC e99b18891702742d95fcbf5b0385ae01 [0,0,0,0,0,0|3,0,0]=3 290 B10R0.91 CCCNCC(=O)NCC#N 2d4ecea2ba37dc53f1af857693b31a81 [0,0,0,0,0,0|3,0,1]=4 291 B10R0.91 CCCNCC(=O)NCCC 78f724898d671a946b9a4cbff0b855a1 [0,0,0,0,0,0|2,0,0]=2 292 B10R0.91 CCCNCC(=O)NCCO e71fbeb67243be87941f698bb93adf9b [0,0,0,0,0,0|3,0,0]=3 293 B10R0.91 CCCNCC(=O)OCCC 9e84091f29a5e60de22e3fa48f4a379f [0,0,0,0,0,0|1,0,0]=1 294 B10R0.91 CCCOC(=O)CCOCC eb2288e0eb1e17d54ff3e8eb454761b3 [0,0,0,0,0,0|1,0,0]=1 295 B10R0.91 CCCOC(=O)CCOCF e5231c5da343fd32d24ca5beab344c41 [0,0,0,0,0,0|2,0,0]=2 296 B10R0.91 CCCOC(=O)CNCC#N dedb1f8f2e49f09595158023230807f2 [0,0,0,0,0,0|2,0,1]=3 297 B10R0.91 CCCOC(=O)CNCCBr a6925e3e7f30943d7dcc7fac64844ac4 [0,0,0,0,0,0|2,0,0]=2 298 B10R0.91 CCCOC(=O)CNCCF 5a255f9ba955616a120bef5b8e263ed9 [0,0,0,0,0,0|2,0,0]=2 299 B10R0.91 CCCOC(=O)CNCCI e94b4716e7884d6f08c9c3f4262158d6 [0,0,0,0,0,0|2,0,0]=2 300 B10R0.91 CCCOC(=O)CNCCO fac9a011e620b586dab4b1bbde0f7f1c [0,0,0,0,0,0|2,0,0]=2 301 B10R0.91 CCCOC(=O)CNCCS 6f0202421fe191eb229548231c18f72d [0,0,0,0,0,0|2,0,0]=2 302 B10R0.91 CCCOC(=O)COCC#N e04f00dbe5f1947ca81f10e3ea6a499e [0,0,0,0,0,0|2,0,1]=3 303 B10R0.91 CCCOC(=O)COCCF fd677765fc7901029836be54cc3a4d6e [0,0,0,0,0,0|2,0,0]=2 304 B10R0.91 CCCOC(=O)COCCS 2d0e5d8fd198b8d342124bc68be406df [0,0,0,0,0,0|2,0,0]=2 305 B10R0.91 CCCOC(=O)COCOC bee7b4d6d82b371b424906b8122478ef [0,0,0,0,0,0|2,0,0]=2 306 B10R0.91 CCCOC(=O)OCNC#N dbca01cae557491bf0360a2e0ef159f0 [0,0,0,0,0,0|3,0,1]=4 307 B10R0.91 CCCOCC(=O)CCSC 804bf7535409b65ab8bc61b4a21bc9b3 [0,0,0,0,0,0|3,0,0]=3 308 B10R0.91 CCCOCC(=O)NCC#N 98a0bf3e1579ae1a810b437bcc952c20 [0,0,0,0,0,0|3,0,1]=4 309 B10R0.91 CCCOCC(=O)NCCBr 83b089cb5c4dc1074e9ac5b638dca30c [0,0,0,0,0,0|3,0,0]=3 310 B10R0.91 CCCOCC(=O)NCCF 5099dc3b6df417e9667fe16b8ff44ab5 [0,0,0,0,0,0|3,0,0]=3 311 B10R0.91 CCCOCC(=O)NCCI 34e9cb6d25b3b9905b8136df9b2a6b17 [0,0,0,0,0,0|3,0,0]=3 312 B10R0.91 CCCOCC(=O)NCCO c58631d1d90d9b0c4967336d1224f977 [0,0,0,0,0,0|3,0,0]=3 313 B10R0.91 CCCOCC(=O)NCCS 8a845939d3bb21de636e16b0f52c78df [0,0,0,0,0,0|3,0,0]=3 314 B10R0.91 CCCOCC(=O)OCCC fd9823e87b4eb570e52bf2a10033572b [0,0,0,0,0,0|1,0,0]=1 315 B10R0.91 CCCOCC(C)OCCC 83c68e7f5d058e12706d8ad64a24ded4 [0,0,0,0,0,0|2,0,1]=3 316 B10R0.91 CCCOCC(C)OCCF 9890ec3f6bd9d8b7b466d8c5601c90d8 [0,0,0,0,0,0|3,0,1]=4 317 B10R0.91 CCCOCC(C)OCCS bc253b1cf2b46a8fe4bc9d505c241cac [0,0,0,0,0,0|3,0,1]=4 318 B10R0.91 CCCOCC(C)OCOC 1c1600ded6c1c5ddb5f624e9289d98bc [0,0,0,0,0,0|3,0,1]=4 319 B10R0.91 CCCOCC(C)OCSC d79bc23ccfad9455815aa204d2ea82f9 [0,0,0,0,0,0|3,0,1]=4 320 B10R0.91 CCCOC[C@@H](C)OCOC bd9d0812967fd07329c2a0887ceed63d [0,0,0,0,0,0|3,0,1]=4 321 B10R0.91 CCCSCC(=O)NCC#N ccd107d6bf2f0528d7d1855725348e7f [0,0,0,0,0,0|3,0,1]=4 322 B10R0.91 CCCSCC(=O)NCCBr 8c7d5c643c836cb7508e6e9baa5d0871 [0,0,0,0,0,0|3,0,0]=3 323 B10R0.91 CCCSCC(=O)NCCF 50fb4c977bad5c23e1365a52248d4581 [0,0,0,0,0,0|3,0,0]=3 324 B10R0.91 CCCSCC(=O)NCCI 2162e320c93abe7f22dec38b0965c8b7 [0,0,0,0,0,0|3,0,0]=3 325 B10R0.91 CCCSCC(=O)NCCO a2ccfad2b1135b13d7ac183b9e9a4e32 [0,0,0,0,0,0|3,0,0]=3 326 B10R0.91 CCCSCC(=O)NCCS eae3fd5400928ad32fc805b6bb51e2d6 [0,0,0,0,0,0|3,0,0]=3 327 B10R0.91 CCOCC(=O)NCCCCl 1c5fe844ec1f78a372588a0dd9ba19e2 [0,0,0,0,0,0|4,0,0]=4 328 B10R0.91 CCOCC(=O)NCCCO 73ecebf06bfaf05fcf351a839b737112 [0,0,0,0,0,0|4,0,0]=4 329 B10R0.91 CCOCC(=O)NCCOC 6a17a354ed9d99dcdb3aee364e835bce [0,0,0,0,0,0|4,0,0]=4 330 B10R0.91 CCOCC(=O)NCCSC 69b0e7bd02a25fede9c9260a702a20b4 [0,0,0,0,0,0|4,0,0]=4 331 B10R0.91 CCOCCC(=O)NCC#N a461d62ed3635acae6b3422343b9a67c [0,0,0,0,0,0|3,0,1]=4 332 B10R0.91 CCOCCC(=O)NCCBr 349d2ca10c479c00debc44929a0b9d07 [0,0,0,0,0,0|3,0,0]=3 333 B10R0.91 CCOCCC(=O)NCCF 45796d0d5e4a17e11c7420204be5ee79 [0,0,0,0,0,0|3,0,0]=3 334 B10R0.91 CCOCCC(=O)NCCI c8419e3db062fd21b60429caf827c4e9 [0,0,0,0,0,0|3,0,0]=3 335 B10R0.91 CCOCCC(=O)NCCO 0c48f59b882ed030de56b7d473f9d08d [0,0,0,0,0,0|3,0,0]=3 336 B10R0.91 CCOCCC(=O)NCCS 7585474f429057d3ae22421edcd5cff8 [0,0,0,0,0,0|3,0,0]=3 337 B10R0.91 CCSCC(=O)NCCCCl 16619a0caa424666c6a59d8f3ab7a63a [0,0,0,0,0,0|4,0,0]=4 338 B10R0.91 CCSCC(=O)NCCCO 17a32710ac22e4a99af6a47df5d1b9d2 [0,0,0,0,0,0|4,0,0]=4 339 B10R0.91 CCSCC(=O)NCCOC 39ec8b303fe26850fbaaa3dbc59d7c39 [0,0,0,0,0,0|4,0,0]=4 340 B10R0.91 CCSCC(=O)NCCSC bda454679b331580e1a1c31d63580097 [0,0,0,0,0,0|4,0,0]=4 341 B10R0.91 CCSCCC(=O)NCC#N da895b06532dc43d7e722a8d9a03883b [0,0,0,0,0,0|3,0,1]=4 342 B10R0.91 CCSCCC(=O)NCCBr e9638a12c7ca73077c1b72ca7887e845 [0,0,0,0,0,0|3,0,0]=3 343 B10R0.91 CCSCCC(=O)NCCF cdc8827f4326dd47b2a9f6b4705e9752 [0,0,0,0,0,0|3,0,0]=3 344 B10R0.91 CCSCCC(=O)NCCI a9cb61be72151a8f052bacdfeae6b9f1 [0,0,0,0,0,0|3,0,0]=3 345 B10R0.91 CCSCCC(=O)NCCO 78ca03fec8a46f4d2c0726bc921c2e12 [0,0,0,0,0,0|3,0,0]=3 346 B10R0.91 CCSCCC(=O)NCCS d7f114633068842d291a92607eb8a701 [0,0,0,0,0,0|3,0,0]=3 347 B10R0.91 COCCC(=O)NCCCCl 4cfc99097fc092f2d3271625aa77c24c [0,0,0,0,0,0|4,0,0]=4 348 B10R0.91 COCCC(=O)NCCCO 60610cf07fc72f4151953b16ec38236a [0,0,0,0,0,0|4,0,0]=4 349 B10R0.91 COCCC(=O)NCCSC c1e50ed9f2fce5df6afae47fcc81580f [0,0,0,0,0,0|4,0,0]=4 350 B10R0.91 COCCCC(=O)NCC#N e7168598487dd905cc8fb1d6cc0fcf01 [0,0,0,0,0,0|3,0,1]=4 351 B10R0.91 COCCCC(=O)NCCBr 69579cef714b284df45530cd391998e3 [0,0,0,0,0,0|3,0,0]=3 352 B10R0.91 COCCCC(=O)NCCF 8610c379e817fc83b88139c9da213fed [0,0,0,0,0,0|3,0,0]=3 353 B10R0.91 COCCCC(=O)NCCI bbe05139d67451d253262b1a8abc85ce [0,0,0,0,0,0|3,0,0]=3 354 B10R0.91 COCCCC(=O)NCCO 1ca4e331c899e404ce340d7125852550 [0,0,0,0,0,0|3,0,0]=3 355 B10R0.91 COCCCC(=O)NCCS 6aa20831b553942e5121e2a5a533b916 [0,0,0,0,0,0|3,0,0]=3 356 B10R0.91 COCCNC(=O)CCCF bb675c74f1478f8cc484cd546eb95196 [0,0,0,0,0,0|4,0,0]=4 357 B10R0.91 COCCNC(=O)CCCS 1bc83e37b979e45d1459dfaccae155a3 [0,0,0,0,0,0|4,0,0]=4 358 B10R0.91 COCCNC(=O)CCOC 49628ed3613ea8f314910694a3e08343 [0,0,0,0,0,0|4,0,0]=4 359 B10R0.91 COCCNC(=O)CCSC d79753d91e2bd15e05ce9e83e2d1fe01 [0,0,0,0,0,0|4,0,0]=4 360 B10R0.91 COCCNC(=O)NCCF 5ff983b516a6585279bc867258031507 [0,0,0,0,0,0|4,0,0]=4 361 B10R0.91 COCCNC(=O)NCCN a942d0f98911d1da6c802c1aeb9e1ee7 [0,0,0,0,0,0|4,0,0]=4 362 B10R0.91 COCCNC(=O)NCCO 748dbd8b0ba658788eac482ac99ae001 [0,0,0,0,0,0|4,0,0]=4 363 B10R0.91 COCCNC(=O)NCCS 2014a6adb20ab662d0040789010913cf [0,0,0,0,0,0|4,0,0]=4 364 B10R0.91 COCNCC(=O)NCCO d9c6b59111b0fce8a111b2c0910136ae [0,0,0,0,0,0|4,0,0]=4 365 B10R0.91 COCOCC(=O)CCSC 6402d57b1f90bfc08b77471f6f458fd3 [0,0,0,0,0,0|4,0,0]=4 366 B10R0.91 CSCCC(=O)CNCCBr ed462bcd4e9d77ced3e9c486ef7b4453 [0,0,0,0,0,0|4,0,0]=4 367 B10R0.91 CSCCC(=O)CNCCF b76e7f03c9fab58e9d9202fb2b7e5673 [0,0,0,0,0,0|4,0,0]=4 368 B10R0.91 CSCCC(=O)CNCCI 1b81bf749a3a91bd9f909962c0356c1c [0,0,0,0,0,0|4,0,0]=4 369 B10R0.91 CSCCC(=O)CNCCO deafc8766db36e787fcf704cb801720a [0,0,0,0,0,0|4,0,0]=4 370 B10R0.91 CSCCC(=O)CNCCS 1b95bc3c250e9e79a9d59a36f72be809 [0,0,0,0,0,0|4,0,0]=4 371 B10R0.91 CSCCC(=O)COCCF 3c2b36d879bdef75ce2c2559cae1d2f3 [0,0,0,0,0,0|4,0,0]=4 372 B10R0.91 CSCCC(=O)COCCS f2aae06708d279893e4e356dc26380f1 [0,0,0,0,0,0|4,0,0]=4 373 B10R0.91 CSCCC(=O)NCCCCl 24c9dcf0018a36e9a6aa8e98018a7181 [0,0,0,0,0,0|4,0,0]=4 374 B10R0.91 CSCCC(=O)NCCCO c311576971c5628c54601762b2c2ff76 [0,0,0,0,0,0|4,0,0]=4 375 B10R0.91 CSCCCC(=O)NCC#N f8a7497228cb4a1e06e4c7978cf516c1 [0,0,0,0,0,0|3,0,1]=4 376 B10R0.91 CSCCCC(=O)NCCBr 16c6407f316466ef2c30a9b2a9f4f694 [0,0,0,0,0,0|3,0,0]=3 377 B10R0.91 CSCCCC(=O)NCCF 39fdf5352062a718f056bcf81f963cad [0,0,0,0,0,0|3,0,0]=3 378 B10R0.91 CSCCCC(=O)NCCI 8a04a981a621cf0d21dda383e035d313 [0,0,0,0,0,0|3,0,0]=3 379 B10R0.91 CSCCCC(=O)NCCO 668cf9338ab3e2523d24ea0718969596 [0,0,0,0,0,0|3,0,0]=3 380 B10R0.91 CSCCCC(=O)NCCS c79fa2c79345973be82aa373fc9ec068 [0,0,0,0,0,0|3,0,0]=3 381 B10R0.91 CSCCNC(=O)CCCF bc6e3b87addd1d5ae083441932958941 [0,0,0,0,0,0|4,0,0]=4 382 B10R0.91 CSCCNC(=O)CCCS ab3470d66a5f0a54e6803ed4542a106f [0,0,0,0,0,0|4,0,0]=4 383 B10R0.91 CSCCNC(=O)CCSC 4d9fd7d13b8966be8fbf009ce35931e0 [0,0,0,0,0,0|4,0,0]=4 384 B10R0.91 CSCCNC(=O)NCCF 9670f9e5bffa1826ee8bd1d5fb7d4659 [0,0,0,0,0,0|4,0,0]=4 385 B10R0.91 CSCCNC(=O)NCCN 9ac53e9643d7e3a9794daf24d36d9d68 [0,0,0,0,0,0|4,0,0]=4 386 B10R0.91 CSCCNC(=O)NCCO ed4cf07b1a224bc4a0a0fe9f222e79d5 [0,0,0,0,0,0|4,0,0]=4 387 B10R0.91 CSCCNC(=O)NCCS b42d9a023547399dd1af57ea9023207e [0,0,0,0,0,0|4,0,0]=4 388 B10R0.91 CSCNCC(=O)NCCO 1660cb806bddadde0c827a82e6906be7 [0,0,0,0,0,0|4,0,0]=4 389 B10R0.91 CSSCCC(=O)NCCBr ef8fa187e3e45e89497c1fe8578d1cfc [0,0,0,0,0,0|4,0,0]=4 390 B10R0.91 CSSCCC(=O)NCCF d5b30138d2e8168200bd3c8cab721068 [0,0,0,0,0,0|4,0,0]=4 391 B10R0.91 CSSCCC(=O)NCCI adf4f519d49458fea97e4159cb30f42d [0,0,0,0,0,0|4,0,0]=4 392 B10R0.91 CSSCCC(=O)NCCO e4b87ce0ae0b992addc59a82f8fd1a63 [0,0,0,0,0,0|4,0,0]=4 393 B10R0.91 CSSCCC(=O)NCCS 4963b058bef3f4ac301e2d653d6b76ea [0,0,0,0,0,0|4,0,0]=4 394 B10R0.91 N#CCCCC(=O)NCCBr 7deb1351b199a87561478e8ba010ccd9 [0,0,0,0,0,0|3,0,1]=4 395 B10R0.91 N#CCCCC(=O)NCCF b1e4b705d590e091ecbc4be3c7ba3c36 [0,0,0,0,0,0|3,0,1]=4 396 B10R0.91 N#CCCCC(=O)NCCI 05f70dcc3bebc8197145f840cb9d7deb [0,0,0,0,0,0|3,0,1]=4 397 B10R0.91 N#CCCCC(=O)NCCO cf771820a5586130f36cd22c5650a25d [0,0,0,0,0,0|3,0,1]=4 398 B10R0.91 N#CCCCC(=O)NCCS 2d29af1970cb8b444b14414168e4b46a [0,0,0,0,0,0|3,0,1]=4 399 B10R0.91 N#CCNC(=O)CCCCF 9a40268f5e67a6cbc7d59f4767fbf07a [0,0,0,0,0,0|3,0,1]=4 400 B10R0.91 N#CCNC(=O)CCCCO cf0ff47bdfb8f4033e34d34228d45483 [0,0,0,0,0,0|3,0,1]=4 401 B10R0.91 N#CCNC(=O)CCCCS a968f1fae6d4aa03ee2b38067f754b29 [0,0,0,0,0,0|3,0,1]=4 402 B10R0.91 NCCCNC(=O)NCCF 6d8d740b011b946dea4bf5937ed952ac [0,0,0,0,0,0|4,0,0]=4 403 B10R0.91 NCCCNC(=O)NCCN b933492d0f0ef8aca9e80cdb0081151b [0,0,0,0,0,0|4,0,0]=4 404 B10R0.91 NCCCNC(=O)NCCO 92e8933397b02e59b13fa1691495c151 [0,0,0,0,0,0|4,0,0]=4 405 B10R0.91 NCCCNC(=O)NCCS 193a561afafc0a3df603b3ae7542fe27 [0,0,0,0,0,0|4,0,0]=4 406 B10R0.91 NCCNC(=O)NCCCO fbb0510691434f092469bddc42fa0b25 [0,0,0,0,0,0|4,0,0]=4 407 B10R0.91 O=C(CCCCF)NCCBr 899636aba359a465c06f93f99f092141 [0,0,0,0,0,0|3,0,0]=3 408 B10R0.91 O=C(CCCCF)NCCF f21ac79ffc756ad22b28e3e7fefbe64b [0,0,0,0,0,0|3,0,0]=3 409 B10R0.91 O=C(CCCCF)NCCI 7844a2ca692dc7dca3153a2c7a0d6ad8 [0,0,0,0,0,0|3,0,0]=3 410 B10R0.91 O=C(CCCCF)NCCO 046e2acbb500ed018495a134f9bd0d91 [0,0,0,0,0,0|3,0,0]=3 411 B10R0.91 O=C(CCCCF)NCCS 4a4b6e037dc7cea4584c4194f2ad460f [0,0,0,0,0,0|3,0,0]=3 412 B10R0.91 O=C(CCCCO)NCCBr b7c9f480e1e59ebe4a533c746f47433d [0,0,0,0,0,0|3,0,0]=3 413 B10R0.91 O=C(CCCCO)NCCF e32d9a6c722de4d9a992a4550b59b6d3 [0,0,0,0,0,0|3,0,0]=3 414 B10R0.91 O=C(CCCCO)NCCI 7ad2aff4977ec9ad838fca2c90655771 [0,0,0,0,0,0|3,0,0]=3 415 B10R0.91 O=C(CCCCO)NCCO 323cb3b6a3e52221c1c90102c8d5b244 [0,0,0,0,0,0|3,0,0]=3 416 B10R0.91 O=C(CCCCO)NCCS 16f8b71945f3e8be5969be0ad59245bb [0,0,0,0,0,0|3,0,0]=3 417 B10R0.91 O=C(CCCCS)NCCBr cc65fa075aa8cf94ac4584df1287123c [0,0,0,0,0,0|3,0,0]=3 418 B10R0.91 O=C(CCCCS)NCCF 834b3be0eeb6b5890b4d23f2272c10a3 [0,0,0,0,0,0|3,0,0]=3 419 B10R0.91 O=C(CCCCS)NCCI b2dc6156f533a5569d77d1770c8d1867 [0,0,0,0,0,0|3,0,0]=3 420 B10R0.91 O=C(CCCCS)NCCO 024156c3cc63180e90c9e06e17fd4975 [0,0,0,0,0,0|3,0,0]=3 421 B10R0.91 O=C(CCCCS)NCCS a2472c317a96761c78fb3d399765f396 [0,0,0,0,0,0|3,0,0]=3 422 B10R0.91 O=C(CCCF)NCCCCl 2aa5c38e88c915e3b0f70c9a9fb205e3 [0,0,0,0,0,0|4,0,0]=4 423 B10R0.91 O=C(CCCF)NCCCO 53b45cc0798c01ecdd0a631d3019c370 [0,0,0,0,0,0|4,0,0]=4 424 B10R0.91 O=C(CCCS)NCCCCl e08b728979d13cb529e767a0ec246a93 [0,0,0,0,0,0|4,0,0]=4 425 B10R0.91 O=C(CCCS)NCCCO 09206a1384d82aefe8cc7f5957fb30d6 [0,0,0,0,0,0|4,0,0]=4 426 B10R0.91 O=C(CNCCF)NCCO 5deefd8043de74a16afac33f04a3b4ee [0,0,0,0,0,0|4,0,0]=4 427 B10R0.91 O=C(CNCCO)NCCO 59a1722976aa95dcebe27080b3398bd2 [0,0,0,0,0,0|4,0,0]=4 428 B10R0.91 O=C(CNCCS)NCCO 6c6f896dbd2e5453b3b54d9b0934ecc3 [0,0,0,0,0,0|4,0,0]=4 429 B10R0.91 O=C(COCCO)NCCBr d155204e7540a29ca1f8bdb2057853b5 [0,0,0,0,0,0|4,0,0]=4 430 B10R0.91 O=C(COCCO)NCCF 0c67d707850a60709413c24e1503e3e4 [0,0,0,0,0,0|4,0,0]=4 431 B10R0.91 O=C(COCCO)NCCI bf5bb3a31459ab2d808bbd2cd295925d [0,0,0,0,0,0|4,0,0]=4 432 B10R0.91 O=C(COCCO)NCCO c46b94587023a153cecfc7c1d72fdeb2 [0,0,0,0,0,0|4,0,0]=4 433 B10R0.91 O=C(COCCO)NCCS bd50980da65553612ce3513817eb8f71 [0,0,0,0,0,0|4,0,0]=4 434 B10R0.91 O=C(COCCS)NCCBr c7c446312e263e3bfc1da3276bb6c148 [0,0,0,0,0,0|4,0,0]=4 435 B10R0.91 O=C(COCCS)NCCF 1de4ee1782859af33451a4f639cb7cfa [0,0,0,0,0,0|4,0,0]=4 436 B10R0.91 O=C(COCCS)NCCI d3f0b436b453993779dd5cebf0530d81 [0,0,0,0,0,0|4,0,0]=4 437 B10R0.91 O=C(COCCS)NCCO 804a2509466d8d46e9ccde9e8cc7453d [0,0,0,0,0,0|4,0,0]=4 438 B10R0.91 O=C(COCCS)NCCS 82d737663abb11513760327d4612ffbb [0,0,0,0,0,0|4,0,0]=4 439 B10R0.91 O=C(NCCF)NCCCO 1f3e0fdffcc413eda3ddc68e560670d3 [0,0,0,0,0,0|4,0,0]=4 440 B10R0.91 O=C(NCCO)NCCCO b6c678567de64322a963260e9f0fcc44 [0,0,0,0,0,0|4,0,0]=4 441 B10R0.91 O=C(NCCS)NCCCO 27628157d8f4ec20677886b8f9a5fae6 [0,0,0,0,0,0|4,0,0]=4 442 B10R0.91 O=CCCCC(=O)NCCBr d2d0456759f451dcd97f914ac95f09f2 [0,0,0,0,0,0|3,0,1]=4 443 B10R0.91 O=CCCCC(=O)NCCF 8a8ec10c811566fdbc42e07afa373227 [0,0,0,0,0,0|3,0,1]=4 444 B10R0.91 O=CCCCC(=O)NCCI 81b31ad549d98f0b12df3b46a3b236a8 [0,0,0,0,0,0|3,0,1]=4 445 B10R0.91 O=CCCCC(=O)NCCO f5a3b7f2ab9b67a2a6429499bf07400b [0,0,0,0,0,0|3,0,1]=4 446 B10R0.91 O=CCCCC(=O)NCCS 884e19bccb6c46acb0aed66e7de0afb7 [0,0,0,0,0,0|3,0,1]=4 447 B9R0.5 C#CCC(=O)NCCCC ba93a74075d3af473d0ae40cb1c8a7e9 [1,0,0,0,0,0|1,0,2]=4 448 B9R0.5 C#CCCNC(=O)CCC 010ec079c645d74cd5f900edc483ff97 [1,0,0,0,0,0|1,0,2]=4 449 B9R0.5 C#CCNCC(=O)CCC 7c95775097695a11b7d7b3efd3645dc6 [1,0,0,0,0,0|1,0,2]=4 450 B9R0.5 C#CCNCC(=O)OCC 3caaed1b796817b3e6405fbf790c0d84 [1,0,0,0,0,0|1,0,2]=4 451 B9R0.5 C#CCOCC(=O)CCC 7694f2ae952970840898af50771d0440 [1,0,0,0,0,0|1,0,2]=4 452 B9R0.5 C#CCOCC(=O)OCC 5491ddb425f5118c7f41ad7bdc7f8f32 [1,0,0,0,0,0|1,0,2]=4 453 B9R0.5 C/C=C/C(=O)NCCCC 44c051192513db47c1c826c71178c208 [1,0,0,0,0,0|1,0,2]=4 454 B9R0.5 C=CCC(=O)NCCCC aa4e9cc01c944a911bc93657ec8591fa [1,0,0,0,0,0|1,0,2]=4 455 B9R0.5 C=CCCNC(=O)CCC cf53a2db9c6b8bf112b423fceb3e3e88 [1,0,0,0,0,0|1,0,2]=4 456 B9R0.5 C=CCNCC(=O)OCC 9c75fab8aca43806fda755027554c371 [1,0,0,0,0,0|1,0,2]=4 457 B9R0.5 C=CCOCC(=O)OCC 9a263b5396d3bde89fbebf34ff6fb949 [1,0,0,0,0,0|1,0,2]=4 458 B9R0.5 C=COC(=O)CNCCC 3fcb2e78c6d37ddb589d8fb06a6c54d6 [1,0,0,0,0,0|1,0,2]=4 459 B9R0.5 C=COC(=O)COCCC 5f1ff34a229b00591eee62972bb38422 [1,0,0,0,0,0|1,0,2]=4 460 B9R0.5 CC#CC(=O)NCCCC 41434018c71b7cd84c9c1094b4f5059d [1,0,0,0,0,0|1,0,2]=4 461 B9R0.5 CC#CCNC(=O)CCC 48984c428da435490cd648d1556c7272 [1,0,0,0,0,0|1,0,2]=4 462 B9R0.5 CC=CCNC(=O)CCC a2189c9a5e101c26f476080a5e98ae2b [1,0,0,0,0,0|1,0,2]=4 463 B9R0.5 CCCC(=O)CNCC#N 4c48844f89f54e85c6e419aa1980f836 [1,0,0,0,0,0|2,0,1]=4 464 B9R0.5 CCCC(=O)CNCCBr 580d9097d971fedfdfa14df158dde72d [1,0,0,0,0,0|2,0,0]=3 465 B9R0.5 CCCC(=O)CNCCF 90b6a3d4e2b646692ac2f8be60f35cfc [1,0,0,0,0,0|2,0,0]=3 466 B9R0.5 CCCC(=O)CNCCI e6c431c6a36f932e7e7bd540be83f7d4 [1,0,0,0,0,0|2,0,0]=3 467 B9R0.5 CCCC(=O)CNCCO 19eaae24439cf65d8d2d752c6a63c8d7 [1,0,0,0,0,0|2,0,0]=3 468 B9R0.5 CCCC(=O)CNCCS 1dd21d52255aa998e3f67c462a833edf [1,0,0,0,0,0|2,0,0]=3 469 B9R0.5 CCCC(=O)COCC#N 35c92dcfc70a5aabec5ac519eee3f9a5 [1,0,0,0,0,0|2,0,1]=4 470 B9R0.5 CCCC(=O)COCCF 51c78131a5436c656772daa28f0121d0 [1,0,0,0,0,0|2,0,0]=3 471 B9R0.5 CCCC(=O)COCCS 77d185d452b3bc72588d0bc7dfa35de5 [1,0,0,0,0,0|2,0,0]=3 472 B9R0.5 CCCC(=O)COCOC 2e9034a32d4ad47f72112a5c4899eca9 [1,0,0,0,0,0|2,0,0]=3 473 B9R0.5 CCCC(=O)NCCC#N df36b052b03aa9feb90916eec413467f [1,0,0,0,0,0|2,0,1]=4 474 B9R0.5 CCCC(=O)NCCCCl f1d9e9d02a2632caa1296262930794c7 [1,0,0,0,0,0|2,0,0]=3 475 B9R0.5 CCCC(=O)NCCCO 592c3668cf1954e32eae53f9d9310fe4 [1,0,0,0,0,0|2,0,0]=3 476 B9R0.5 CCCC(=O)NCCOC d85beb1e2ae7c191540a491c38a5bdee [1,0,0,0,0,0|2,0,0]=3 477 B9R0.5 CCCC(=O)NCCON 2667b617ce33939f360a2d9f69c758c4 [1,0,0,0,0,0|3,0,0]=4 478 B9R0.5 CCCC(=O)NCCSC a7f90a8bca211f42c79fa85f13ca66c5 [1,0,0,0,0,0|2,0,0]=3 479 B9R0.5 CCCC(=S)OCCCF 656dc88ae36c655edad34b161382f41a [1,0,0,0,0,0|2,1,0]=4 480 B9R0.5 CCCC(=S)OCCCS 23b64448f461e9f987487e187aec0d4a [1,0,0,0,0,0|2,1,0]=4 481 B9R0.5 CCCC(=S)OCCOC d3db63e9a9ba0e487e0033504dd762c1 [1,0,0,0,0,0|2,1,0]=4 482 B9R0.5 CCCC(=S)OCCSC ea004ea4cab93907812e5d91a99ec056 [1,0,0,0,0,0|2,1,0]=4 483 B9R0.5 CCCC(=S)OCOCC adf12bc5807344f3b284867173cde60b [1,0,0,0,0,0|2,1,0]=4 484 B9R0.5 CCCC(C)CCOCC fe67a7cc659ef52bef19a5dc944a29b6 [1,0,0,0,0,0|2,0,1]=4 485 B9R0.5 CCCC(S)CCOCC b7c7a04a4d8fea2f0d1d7d9042f682ae [1,0,0,0,0,0|1,1,1]=4 486 B9R0.5 CCCCCC(=O)NC#N 608ac8706cb8f7927089caf9f4c8964c [1,0,0,0,0,0|2,0,1]=4 487 B9R0.5 CCCCCC(C)NCC 212b1664d44bb18b1fa24a16f6d72877 [1,0,0,0,0,0|2,0,1]=4 488 B9R0.5 CCCCCC(C)OCC 730550df732f69eef1e6a549de510b2c [1,0,0,0,0,0|1,0,1]=3 489 B9R0.5 CCCCCC(C)OCF 91cb6ddeef5e8a675eb7cdefedcad036 [1,0,0,0,0,0|2,0,1]=4 490 B9R0.5 CCCCCN(C)CCC b853278094c2f82fca4e6dd3977c6a67 [1,0,0,0,0,0|2,0,0]=3 491 B9R0.5 CCCCCN(C)CCF c929099b696e86ca8a9f711c65c978ae [1,0,0,0,0,0|3,0,0]=4 492 B9R0.5 CCCCCN(C)CCO 34410e1ec8513358afcc09dffe161858 [1,0,0,0,0,0|3,0,0]=4 493 B9R0.5 CCCCCN(C)CCS 4f1dccd506465b82e3719d813f1669cf [1,0,0,0,0,0|3,0,0]=4 494 B9R0.5 CCCCCN(C)COC 962ac7aa69c9adf59a4c23134026ede4 [1,0,0,0,0,0|3,0,0]=4 495 B9R0.5 CCCCCN(C)CSC 538501ec3ee1a432d2305140357b5c2c [1,0,0,0,0,0|3,0,0]=4 496 B9R0.5 CCCCC[C@@H](C)OCC 8f2bb2e64349b01f8c7137850e01df92 [1,0,0,0,0,0|1,0,1]=3 497 B9R0.5 CCCCC[C@@H](C)OCF dddbd16c736b0cf2a41037d9959ad3e8 [1,0,0,0,0,0|2,0,1]=4 498 B9R0.5 CCCCC[C@H](C)NCC 0e1700ce314a2064321bc997ef4f9348 [1,0,0,0,0,0|2,0,1]=4 499 B9R0.5 CCCCC[C@H](C)OCC 2cf9a829d5eb89110544892bd459dee4 [1,0,0,0,0,0|1,0,1]=3 500 B9R0.5 CCCCC[C@H](C)OCF 127043f0fb9c13be21bff612ac563c1b [1,0,0,0,0,0|2,0,1]=4 501 B9R0.5 CCCCNC(=O)CC#N 053d3ec5d1d045be31522ff85b2cf2ec [1,0,0,0,0,0|2,0,1]=4 502 B9R0.5 CCCCNC(=O)CC=O 836473a80945117a02207b121e995b64 [1,0,0,0,0,0|2,0,1]=4 503 B9R0.5 CCCCNC(=O)CCC 2cce597b848ae107def59bee54a0a0bb [1,0,0,0,0,0|1,0,0]=2 504 B9R0.5 CCCCNC(=O)CCF 53b9813d116057ff8c4b15658e94e51c [1,0,0,0,0,0|2,0,0]=3 505 B9R0.5 CCCCNC(=O)CCO 0298cd2468e4d9499261be651df2adcd [1,0,0,0,0,0|2,0,0]=3 506 B9R0.5 CCCCNC(=O)CCS 1641ac5db70e3fc675ef1771e3defee2 [1,0,0,0,0,0|2,0,0]=3 507 B9R0.5 CCCCNC(=O)COC 36ff378b0254a17f19e8bd23cda67723 [1,0,0,0,0,0|2,0,0]=3 508 B9R0.5 CCCCNC(=O)CON ff8aaf07597bc421ccecffa926ce5e77 [1,0,0,0,0,0|3,0,0]=4 509 B9R0.5 CCCCNC(=O)CSC fd9e07d4285a6169aceb5bd025ecd890 [1,0,0,0,0,0|2,0,0]=3 510 B9R0.5 CCCCNC(C)CCC 06cd3d4eadb838cea410097bf17bae5e [1,0,0,0,0,0|2,0,1]=4 511 B9R0.5 CCCCN[C@@H](C)CCC ab2be22024a2e965b1370aa5fe48dbdb [1,0,0,0,0,0|2,0,1]=4 512 B9R0.5 CCCCOC(=S)CCC f1235a4363bf9e2174e43a15f0090624 [1,0,0,0,0,0|1,1,0]=3 513 B9R0.5 CCCCOC(C)CCC 92f21439e18e4a0212372a80f0159639 [1,0,0,0,0,0|2,0,1]=4 514 B9R0.5 CCCCO[C@@H](C)CCC 5b752837ff25253bec29faef567e59b2 [1,0,0,0,0,0|2,0,1]=4 515 B9R0.5 CCCCO[C@H](C)CCC 5384ca464c5bc70cb67ae7c0e1b63cd2 [1,0,0,0,0,0|2,0,1]=4 516 B9R0.5 CCCN(C)CCCCF e9f7620b25cc1b11cc58a4773b3440d8 [1,0,0,0,0,0|3,0,0]=4 517 B9R0.5 CCCN(C)CCCCO 3d32b13ab18b3ef9a88401c3421fd62f [1,0,0,0,0,0|3,0,0]=4 518 B9R0.5 CCCN(C)CCCOC ad2eae02b2bb95cfc8387466db00f5d9 [1,0,0,0,0,0|3,0,0]=4 519 B9R0.5 CCCN(C)CCCSC f37fcd165281d2dbd151714cacb81d9c [1,0,0,0,0,0|3,0,0]=4 520 B9R0.5 CCCN(C)CCOCC 3efa632175c182f0136a621fef8d4de7 [1,0,0,0,0,0|3,0,0]=4 521 B9R0.5 CCCN(C)CCSCC bd455319f75a94bc5c501e0018a20f8c [1,0,0,0,0,0|3,0,0]=4 522 B9R0.5 CCCNCC(=O)CCC 3eec0edc7aa18c3c159d3b72b32db52a [1,0,0,0,0,0|1,0,0]=2 523 B9R0.5 CCCNCC(=O)COC 9c76efdc9995e8503c8a81dc87078b10 [1,0,0,0,0,0|2,0,0]=3 524 B9R0.5 CCCNCC(=O)NCC ce07571aa3fa6f7b572f45c714e29f13 [1,0,0,0,0,0|2,0,0]=3 525 B9R0.5 CCCNCC(=O)NCO 0eb1e391e229900686c61210a46d0652 [1,0,0,0,0,0|3,0,0]=4 526 B9R0.5 CCCNCC(=O)OCC 96e18210e8c47913fa01fa11b9b136be [1,0,0,0,0,0|1,0,0]=2 527 B9R0.5 CCCNCC(C)CCC 54d28908b8e1ac09d7a9108b606f57e0 [1,0,0,0,0,0|2,0,1]=4 528 B9R0.5 CCCNCC(C)OCC 67b61dd333dbaac4f86976019539379e [1,0,0,0,0,0|2,0,1]=4 529 B9R0.5 CCCNCC(O)CCC 3d957147f5d37c2bce44ac77f80f84a5 [1,0,0,0,0,0|1,0,2]=4 530 B9R0.5 CCCOCC(=O)CCC 74c3c5e5bd02e359466cf1cc878b65e0 [1,0,0,0,0,0|1,0,0]=2 531 B9R0.5 CCCOCC(=O)COC 3d7dfb506e9c0757447f18e9df05797b [1,0,0,0,0,0|2,0,0]=3 532 B9R0.5 CCCOCC(=O)NCC 76f4c6de17f53497034323fd5e6ef599 [1,0,0,0,0,0|2,0,0]=3 533 B9R0.5 CCCOCC(=O)OCC 0b34840e3da522061b00dd308581ea5c [1,0,0,0,0,0|1,0,0]=2 534 B9R0.5 CCCOCC(C)CCC 991f1db54286263be3e664fb478a931d [1,0,0,0,0,0|2,0,1]=4 535 B9R0.5 CCCOCC(C)OCC a9309e87d325b6f2b1644b3d0636499f [1,0,0,0,0,0|2,0,1]=4 536 B9R0.5 CCNC(=O)CNCCBr eba0f553ee6b07591a41e44f3a5aa8e2 [1,0,0,0,0,0|3,0,0]=4 537 B9R0.5 CCNC(=O)CNCCF 0f5dd9d468b31da44c24ebb652eb530c [1,0,0,0,0,0|3,0,0]=4 538 B9R0.5 CCNC(=O)CNCCI 90892e8fd08d23d8cb8012740b700d11 [1,0,0,0,0,0|3,0,0]=4 539 B9R0.5 CCNC(=O)CNCCO 442a95bc56d02077e9b0f659a35d10bf [1,0,0,0,0,0|3,0,0]=4 540 B9R0.5 CCNC(=O)CNCCS 336193fa38be46171431893753910df2 [1,0,0,0,0,0|3,0,0]=4 541 B9R0.5 CCNC(=O)CNCOC 418fc9ea4e66286d14d012781355c640 [1,0,0,0,0,0|3,0,0]=4 542 B9R0.5 CCNC(=O)CNCSC 581cd0eb74e9a8a8bdc513b22d20213a [1,0,0,0,0,0|3,0,0]=4 543 B9R0.5 CCNC(=O)COCCF 812c23840362a8ca0725db39d692bb07 [1,0,0,0,0,0|3,0,0]=4 544 B9R0.5 CCNC(=O)COCCS 72830f9544a815a06bd3444d77122c12 [1,0,0,0,0,0|3,0,0]=4 545 B9R0.5 CCNC(=O)COCOC f4b52e7b701729895cf1ba81b82493e5 [1,0,0,0,0,0|3,0,0]=4 546 B9R0.5 CCNC(=O)COCSC 36a6937f66bbc3380df8d44f8b9020d8 [1,0,0,0,0,0|3,0,0]=4 547 B9R0.5 CCNCCC(=O)OCC 2335a4402c7edabd02b888af3e7ee79f [1,0,0,0,0,0|1,0,0]=2 548 B9R0.5 CCOC(=O)CCNC#N 2970a7082d564ca9a0ac60d8e6dde822 [1,0,0,0,0,0|2,0,1]=4 549 B9R0.5 CCOC(=O)CCNC=O f014a3a016d6b2ab3edecfa8ad9e1400 [1,0,0,0,0,0|2,0,1]=4 550 B9R0.5 CCOC(=O)CCNCF dc0e8e938f3e0f9376067101916fab11 [1,0,0,0,0,0|2,0,0]=3 551 B9R0.5 CCOC(=O)CCNCO 0d43318aba0286304d28e6f5f875b75e [1,0,0,0,0,0|2,0,0]=3 552 B9R0.5 CCOC(=O)CCOCF b923097280e6d745523067d0f7821723 [1,0,0,0,0,0|2,0,0]=3 553 B9R0.5 CCOC(=O)CNCC#N 57c0a5d0ba92ba22cb60b1db3fae37f4 [1,0,0,0,0,0|2,0,1]=4 554 B9R0.5 CCOC(=O)CNCC=O 13639f7e3d69faa2001497754bfed8b5 [1,0,0,0,0,0|2,0,1]=4 555 B9R0.5 CCOC(=O)CNCCBr 2d8ed3ea34766b7d343241f665b80229 [1,0,0,0,0,0|2,0,0]=3 556 B9R0.5 CCOC(=O)CNCCF 99d39e110ac23618c63f1317b2282cce [1,0,0,0,0,0|2,0,0]=3 557 B9R0.5 CCOC(=O)CNCCI 75072515d706cd5c15a349fb418110fa [1,0,0,0,0,0|2,0,0]=3 558 B9R0.5 CCOC(=O)CNCCO a3891831c63b1d5fc3c5a1b6e875e04a [1,0,0,0,0,0|2,0,0]=3 559 B9R0.5 CCOC(=O)CNCCS 2d2d40dfd5cc8614b9490097a11bc9af [1,0,0,0,0,0|2,0,0]=3 560 B9R0.5 CCOC(=O)CNCOC 3338587ded14e7c228302d0aec1db622 [1,0,0,0,0,0|2,0,0]=3 561 B9R0.5 CCOC(=O)CNCSC 83cee1aea68795d140c24e1cd1c34d73 [1,0,0,0,0,0|2,0,0]=3 562 B9R0.5 CCOC(=O)COCC#N c09a17fd9d8768b76ffa5a569bc14f50 [1,0,0,0,0,0|2,0,1]=4 563 B9R0.5 CCOC(=O)COCC=O 934135784a2711e60bdbd22faf98fe13 [1,0,0,0,0,0|2,0,1]=4 564 B9R0.5 CCOC(=O)COCCF 8ab9a071055414651ab59279d1d89a94 [1,0,0,0,0,0|2,0,0]=3 565 B9R0.5 CCOC(=O)COCCS 5b2c52a4049396ac0e633dc62c60b2f2 [1,0,0,0,0,0|2,0,0]=3 566 B9R0.5 CCOC(=O)COCOC cae80a72de3b9dd4c77bad68b601ad39 [1,0,0,0,0,0|2,0,0]=3 567 B9R0.5 CCOC(=O)COCSC d1c9bb1a8c14847f19476af8bd4e260f [1,0,0,0,0,0|2,0,0]=3 568 B9R0.5 CCOCCC(=O)OCC 09e1caf8e51242de5bdcbf4174bb2e9c [1,0,0,0,0,0|1,0,0]=2 569 B9R0.5 COCC(=O)CNCCI de001d33d2a83ecbcdbf60168bdb71b4 [1,0,0,0,0,0|3,0,0]=4 570 B9R0.5 COCC(=O)CNCCO 2826556ba2b391e97043cba9d2c76ebb [1,0,0,0,0,0|3,0,0]=4 571 B9R0.5 COCC(=O)CNCCS 998c86e7067a208995617aaf569ee24d [1,0,0,0,0,0|3,0,0]=4 572 B9R0.5 COCC(=O)COCCS 4c50ce8dad8eb47119f9c3bca158fc1a [1,0,0,0,0,0|3,0,0]=4 573 B9R0.5 COCC(=O)NCCCCl 9b8e00a91bd11b43b2cced22d7f8490f [1,0,0,0,0,0|3,0,0]=4 574 B9R0.5 COCC(=O)NCCCO 8066d497a25e88f2387cdf27e9376a33 [1,0,0,0,0,0|3,0,0]=4 575 B9R0.5 COCC(=O)NCCSC ae9802b73da9588e64754d62c956dbe2 [1,0,0,0,0,0|3,0,0]=4 576 B9R0.5 COCCNC(=O)CCF 703c6442db6e4c16b32cf0385fe1f071 [1,0,0,0,0,0|3,0,0]=4 577 B9R0.5 COCCNC(=O)CCO da506b7eb06569e31b2bdbe6c4e1e62a [1,0,0,0,0,0|3,0,0]=4 578 B9R0.5 COCCNC(=O)CCS b8ee435c0e502f7ec824944f584c26af [1,0,0,0,0,0|3,0,0]=4 579 B9R0.5 COCCNC(=O)COC b53dbf929afbe9b06300c313013c1089 [1,0,0,0,0,0|3,0,0]=4 580 B9R0.5 COCCNC(=O)CSC 3a940bbcc690a26481b40d716f51d75b [1,0,0,0,0,0|3,0,0]=4 581 B9R0.5 COCOCC(=O)COC 7449521e3687d4ca34f0ee79710cdd82 [1,0,0,0,0,0|3,0,0]=4 582 B9R0.5 CSCC(=O)NCCCCl f8e5807b04533e1f0294eb15b05b589e [1,0,0,0,0,0|3,0,0]=4 583 B9R0.5 CSCC(=O)NCCCO 5640a773b24a2079e88c1538d74a13f3 [1,0,0,0,0,0|3,0,0]=4 584 B9R0.5 CSCCNC(=O)CCF 976855bf6bbc92279851c6db72b3fe06 [1,0,0,0,0,0|3,0,0]=4 585 B9R0.5 CSCCNC(=O)CCO 43f57de6b29a2d1d41363767bdf0c9f1 [1,0,0,0,0,0|3,0,0]=4 586 B9R0.5 CSCCNC(=O)CCS cc2a240397388430a40e2a34c43c5050 [1,0,0,0,0,0|3,0,0]=4 587 B9R0.5 CSCCNC(=O)CSC 2dbace4ea8ec9c7a8b0a6a20b93d81ea [1,0,0,0,0,0|3,0,0]=4 588 B9R0.5 O=C(CCF)NCCCCl 450f9e397437565bfe33b39b053c4245 [1,0,0,0,0,0|3,0,0]=4 589 B9R0.5 O=C(CCF)NCCCO 3c99316c0047228a6d04ddef64744a30 [1,0,0,0,0,0|3,0,0]=4 590 B9R0.5 O=C(CCO)NCCCCl abeaa24b07e6d3bdfe3ff6d05860a8be [1,0,0,0,0,0|3,0,0]=4 591 B9R0.5 O=C(CCO)NCCCO 2d4903d2493c9af6a68704182db4d55c [1,0,0,0,0,0|3,0,0]=4 592 B9R0.5 O=C(CCS)NCCCCl 5d4cbf1d3f8d26cc0fcfe1598b77ca0e [1,0,0,0,0,0|3,0,0]=4 593 B9R0.5 O=C(CCS)NCCCO d39ac9fd8653d19eae81484da48b1f73 [1,0,0,0,0,0|3,0,0]=4 594 B9R0.18 C#CCCC(=O)NCCC f3c64f5165b1f279b3da708a35c3c2e4 [1,0,0,0,0,0|1,0,2]=4 595 B9R0.18 C#CCNC(=O)CCCC 3d3f3bc88905304d134b4af31dd48618 [1,0,0,0,0,0|1,0,2]=4 596 B9R0.18 C/C=C/CC(=O)NCCC c4000eced9c5a645f9e27eaa7bbc369b [1,0,0,0,0,0|1,0,2]=4 597 B9R0.18 C=CCCC(=O)NCCC 9f74062b96148fe9af5f57a314993165 [1,0,0,0,0,0|1,0,2]=4 598 B9R0.18 CC#CCC(=O)NCCC 82aa0b33116e485698eabb2e8d0819b1 [1,0,0,0,0,0|1,0,2]=4 599 B9R0.18 CC/C=C/C(=O)NCCC 097750926e3d99168c7ae958e0b63aa1 [1,0,0,0,0,0|1,0,2]=4 600 B9R0.18 CC/C=C\C(=O)NCCC 2e01bf87a7f45ff1d01b0bf52ce2e79c [1,0,0,0,0,0|1,0,2]=4 601 B9R0.18 CCC#CC(=O)NCCC 05296c469ef7c084017f21a8abf9ef42 [1,0,0,0,0,0|1,0,2]=4 602 B9R0.18 CCC=CC(=O)NCCC a3276d4bfec7425f957ca6583de8d8a3 [1,0,0,0,0,0|1,0,2]=4 603 B9R0.18 CCCCC(=O)NCC#N 647f3326e822a65de00523bd57231ccf [1,0,0,0,0,0|2,0,1]=4 604 B9R0.18 CCCCC(=O)NCCBr 8af219e0e77c4fc0ca9d539df0908bd7 [1,0,0,0,0,0|2,0,0]=3 605 B9R0.18 CCCCC(=O)NCCC b85686110cd08860fec3169645c4d3bc [1,0,0,0,0,0|1,0,0]=2 606 B9R0.18 CCCCC(=O)NCCF b275f982f0ad827f00e9f57eb71a2f59 [1,0,0,0,0,0|2,0,0]=3 607 B9R0.18 CCCCC(=O)NCCI 9863fe9ac927a6229bfaad02f965a727 [1,0,0,0,0,0|2,0,0]=3 608 B9R0.18 CCCCC(=O)NCCO 7ece651dd2827f5e83d2c51f7847968d [1,0,0,0,0,0|2,0,0]=3 609 B9R0.18 CCCCC(=O)NCCS 7815db24b5b4c021be3fed7542d4cbf1 [1,0,0,0,0,0|2,0,0]=3 610 B9R0.18 CCCCC(C)NCCC 2d290a5f42eca09ba83265f4a79377f0 [1,0,0,0,0,0|2,0,1]=4 611 B9R0.18 CCCCC(C)OCCC 03a9a54da7ce8074115dc5963e2487d3 [1,0,0,0,0,0|1,0,1]=3 612 B9R0.18 CCCCC(C)OCCF 3f799a7d24890a960e30edb9bb965fe5 [1,0,0,0,0,0|2,0,1]=4 613 B9R0.18 CCCCC(C)OCCS 498240fa81efc48a364f781ba80a2136 [1,0,0,0,0,0|2,0,1]=4 614 B9R0.18 CCCCC(C)OCOC 2647a8351841aefd7767410eec944f14 [1,0,0,0,0,0|2,0,1]=4 615 B9R0.18 CCCCC(C)OCSC 675cf4242578276faef054101752fff5 [1,0,0,0,0,0|2,0,1]=4 616 B9R0.18 CCCCN(C)CCCC 01d114e8ba11630440d2533ff68d32a7 [1,0,0,0,0,0|3,0,0]=4 617 B9R0.18 CCCC[C@@H](C)NCCC 681a66d3f2656eddcb965975aeb1cfd0 [1,0,0,0,0,0|2,0,1]=4 618 B9R0.18 CCCC[C@@H](C)OCCC 3919e2b8d370ec3c53a10b41264f7777 [1,0,0,0,0,0|1,0,1]=3 619 B9R0.18 CCCC[C@@H](C)OCCF 9e6e7d202edc7f99d8130b72feff99d7 [1,0,0,0,0,0|2,0,1]=4 620 B9R0.18 CCCC[C@@H](C)OCCS da0dc6ff36920e5da60fbd4660080dd8 [1,0,0,0,0,0|2,0,1]=4 621 B9R0.18 CCCC[C@@H](C)OCSC 5f93169fe26264ec85ba889f3f1492c7 [1,0,0,0,0,0|2,0,1]=4 622 B9R0.18 CCCC[C@H](C)OCCC 66356f9f032d16fe1fbfbbab77eafd41 [1,0,0,0,0,0|1,0,1]=3 623 B9R0.18 CCCC[C@H](C)OCCF 452211e2967f01206ae8ab89031a98ce [1,0,0,0,0,0|2,0,1]=4 624 B9R0.18 CCCC[C@H](C)OCCS e7099a214ea1736c512624854b8788ff [1,0,0,0,0,0|2,0,1]=4 625 B9R0.18 CCCC[C@H](C)OCSC 6f25ee6b4cd5695fd2c5f7349596b758 [1,0,0,0,0,0|2,0,1]=4 626 B9R0.18 CCCNC(=O)CCC#N 3c84da86740a9537b1394a17edc981f5 [1,0,0,0,0,0|2,0,1]=4 627 B9R0.18 CCCNC(=O)CCC=O 5522fa26a355fc8eec3036c5a7687322 [1,0,0,0,0,0|2,0,1]=4 628 B9R0.18 CCCNC(=O)CCCF 1f823bbe5c8060566b13c81465e061c7 [1,0,0,0,0,0|2,0,0]=3 629 B9R0.18 CCCNC(=O)CCCS 2bfa96a35c081404d84a7b0215640a85 [1,0,0,0,0,0|2,0,0]=3 630 B9R0.18 CCCNC(=O)CCOC 6cd117ddc5922928321b15c7b6e23d01 [1,0,0,0,0,0|2,0,0]=3 631 B9R0.18 CCCNC(=O)CCSC 37189979a283ab62744d36502a721481 [1,0,0,0,0,0|2,0,0]=3 632 B9R0.18 CCCNC(=O)CNCC fcfe70edc98518cf0e869dd652d9d1b9 [1,0,0,0,0,0|2,0,0]=3 633 B9R0.18 CCCNC(=O)CNCF 3c826b0ceeef47dc0f5a92ae2f804d94 [1,0,0,0,0,0|3,0,0]=4 634 B9R0.18 CCCNC(=O)CNCO 675781d24e7cbc9b6ef31ada5f732a91 [1,0,0,0,0,0|3,0,0]=4 635 B9R0.18 CCCNC(=O)COCC 8f39e652af99ce623f6f9a406b6adee9 [1,0,0,0,0,0|2,0,0]=3 636 B9R0.18 CCCNC(=O)CSCC d0b8c7d2c46af0543f3335fa1ed7e543 [1,0,0,0,0,0|2,0,0]=3 637 B9R0.18 CCCNC(=O)CSSC 8af2df8b10dc9638c50f82a7925427c1 [1,0,0,0,0,0|3,0,0]=4 638 B9R0.18 CCCNC(=O)NCCC d4084f6e2865e431e7a6757193be77c9 [1,0,0,0,0,0|2,0,0]=3 639 B9R0.18 CCCNC(=O)NCCF 1e1fa57d0f12245420d7bb7dd77d774b [1,0,0,0,0,0|3,0,0]=4 640 B9R0.18 CCCNC(=O)NCCN 579d0d35eef03875b16c127daf572c7f [1,0,0,0,0,0|3,0,0]=4 641 B9R0.18 CCCNC(=O)NCCO 09e60de9b5b425950f0cc31f8f757e7a [1,0,0,0,0,0|3,0,0]=4 642 B9R0.18 CCCNC(=O)NCCS cd43bb96619ec48c12746abcdc470aa6 [1,0,0,0,0,0|3,0,0]=4 643 B9R0.18 CCCNC(=S)NCCC 6ec9ab92b07d85044cc71568d2e3cf68 [1,0,0,0,0,0|2,1,0]=4 644 B9R0.18 CCCOC(=O)CNC#N de93106f3bb02f5f7374c15436377378 [1,0,0,0,0,0|2,0,1]=4 645 B9R0.18 CCCOC(C)CCOC 747f19116197a3930af98e143e45dd61 [1,0,0,0,0,0|2,0,1]=4 646 B9R0.18 CCCOC(C)CCSC 73142708a2860b7c297104e6b288642f [1,0,0,0,0,0|2,0,1]=4 647 B9R0.18 CCCOC(C)COCC f8832bba2994252896d2ff4eb2c06c9a [1,0,0,0,0,0|2,0,1]=4 648 B9R0.18 CCNCC(=O)NCCO f0dbceae271282c3ff6663714718cc77 [1,0,0,0,0,0|3,0,0]=4 649 B9R0.18 CCOCC(=O)NCCBr 188a5c5950b7b078c6d2717759c5919e [1,0,0,0,0,0|3,0,0]=4 650 B9R0.18 CCOCC(=O)NCCF 23c51c0b7cd288963975af6a7cb94ce6 [1,0,0,0,0,0|3,0,0]=4 651 B9R0.18 CCOCC(=O)NCCI 048e96141a0b58286305185326e10bdc [1,0,0,0,0,0|3,0,0]=4 652 B9R0.18 CCOCC(=O)NCCO 4232164c729662df753fa9da7f624b37 [1,0,0,0,0,0|3,0,0]=4 653 B9R0.18 CCOCC(=O)NCCS 36147fd132ce902e715f1828cc95a3ca [1,0,0,0,0,0|3,0,0]=4 654 B9R0.18 CCSCC(=O)NCCBr a67e006949a9953368b6c21f66576225 [1,0,0,0,0,0|3,0,0]=4 655 B9R0.18 CCSCC(=O)NCCF 9ffbdf7bfac13ccb02a4df4b9c5c1ec1 [1,0,0,0,0,0|3,0,0]=4 656 B9R0.18 CCSCC(=O)NCCI e94bf45e297d3d690354c1a36393ba19 [1,0,0,0,0,0|3,0,0]=4 657 B9R0.18 CCSCC(=O)NCCO 36045fca78fe19f762e8c359711722ec [1,0,0,0,0,0|3,0,0]=4 658 B9R0.18 CCSCC(=O)NCCS db55e1bb3f66dedad6adeb56cf765a83 [1,0,0,0,0,0|3,0,0]=4 659 B9R0.18 COCCC(=O)NCCBr f130c056ed3790213fdd2960494db613 [1,0,0,0,0,0|3,0,0]=4 660 B9R0.18 COCCC(=O)NCCF 3b79550f64f4a7039b2c4be8e9b846c4 [1,0,0,0,0,0|3,0,0]=4 661 B9R0.18 COCCC(=O)NCCI a733b34d537a87c545ba48cdc7acc291 [1,0,0,0,0,0|3,0,0]=4 662 B9R0.18 COCCC(=O)NCCO b5e285b41937c9aa98027cb971fe056b [1,0,0,0,0,0|3,0,0]=4 663 B9R0.18 COCCC(=O)NCCS a993c904600b344252bc84f04a69db79 [1,0,0,0,0,0|3,0,0]=4 664 B9R0.18 CSCCC(=O)NCCBr ea08a7bfbf45e1f8a38b3f26dca6c117 [1,0,0,0,0,0|3,0,0]=4 665 B9R0.18 CSCCC(=O)NCCF 6f7acbde84975c223e97e32c1cc35da8 [1,0,0,0,0,0|3,0,0]=4 666 B9R0.18 CSCCC(=O)NCCI 93f1353dc20c43b8184cf13e3552539a [1,0,0,0,0,0|3,0,0]=4 667 B9R0.18 CSCCC(=O)NCCO cd589d7a0e4d026a26420d69f13f3bd8 [1,0,0,0,0,0|3,0,0]=4 668 B9R0.18 CSCCC(=O)NCCS fe572177d565b550f9b6d1c54b01450c [1,0,0,0,0,0|3,0,0]=4 669 B9R0.18 O=C(CCCF)NCCBr 454639c983ec3682f4d57d1ec2bcf026 [1,0,0,0,0,0|3,0,0]=4 670 B9R0.18 O=C(CCCF)NCCF ad34e8af339b2a31998448cfc17501be [1,0,0,0,0,0|3,0,0]=4 671 B9R0.18 O=C(CCCF)NCCI 96be9ab611733cd089ece9902e243128 [1,0,0,0,0,0|3,0,0]=4 672 B9R0.18 O=C(CCCF)NCCO 148332670bdbe57694e65e058f1387a4 [1,0,0,0,0,0|3,0,0]=4 673 B9R0.18 O=C(CCCF)NCCS ee612c15499d17690d17e81f91cd16af [1,0,0,0,0,0|3,0,0]=4 674 B9R0.18 O=C(CCCS)NCCBr d43e0b043b9a5c392004a1608afa85bb [1,0,0,0,0,0|3,0,0]=4 675 B9R0.18 O=C(CCCS)NCCF 97df33e2c026134fbbc15142e58eeed1 [1,0,0,0,0,0|3,0,0]=4 676 B9R0.18 O=C(CCCS)NCCI b85b8b41742ef5e4f7e1a76ff50bec0a [1,0,0,0,0,0|3,0,0]=4 677 B9R0.18 O=C(CCCS)NCCO 2fdce65150ecd2129b2fa88f848eb2d0 [1,0,0,0,0,0|3,0,0]=4 678 B9R0.18 O=C(CCCS)NCCS 755924664cd9a54b9c9a50d8b854021e [1,0,0,0,0,0|3,0,0]=4 679 B9R0.45 C#CCCCCOCCC 88be43598906413b514321fe6489b41b [1,0,0,0,0,0|0,0,3]=4 680 B9R0.45 C#CCOCCCCCC f5db1c348f2482ec2d74aff14ea6fbb8 [1,0,0,0,0,0|0,0,3]=4 681 B9R0.45 C/C=C/CCCOCCC 6078f7ffc27dfa8185f6236738ef681e [1,0,0,0,0,0|0,0,3]=4 682 B9R0.45 C/C=C\CCCOCCC 083c73f409535e210af3eb7849dd56ad [1,0,0,0,0,0|0,0,3]=4 683 B9R0.45 C=CCCCCOCCC f624e5cfeefd7c8f70f95b431a05113e [1,0,0,0,0,0|0,0,3]=4 684 B9R0.45 C=CCOCCCCCC 87e2c78ad35addafbe1ba3af3a2416ee [1,0,0,0,0,0|0,0,3]=4 685 B9R0.45 CC#CCCCOCCC 4902122539f36e7166b52eecca3e8eb9 [1,0,0,0,0,0|0,0,3]=4 686 B9R0.45 CC/C=C/CCOCCC 0a76c2aa4cb5309f57046e961567e1f0 [1,0,0,0,0,0|0,0,3]=4 687 B9R0.45 CC/C=C\CCOCCC 5fdb5a65a47740420a9d274005a3115f [1,0,0,0,0,0|0,0,3]=4 688 B9R0.45 CC=CCCCOCCC 544004ad9efa2af2fea80f1c7a474136 [1,0,0,0,0,0|0,0,3]=4 689 B9R0.45 CCC#CCCOCCC 4cc8a61a8d84e6a0c5e1fcd690fd5b56 [1,0,0,0,0,0|0,0,3]=4 690 B9R0.45 CCC/C=C/CNCCBr d3e07a232209fe5440777ccc661728b3 [1,0,0,0,0,0|3,0,0]=4 691 B9R0.45 CCC/C=C/CNCCC 859277d10260fb4868f057b0beb905a9 [1,0,0,0,0,0|2,0,0]=3 692 B9R0.45 CCC/C=C/CNCCF 0dab72024f268ec4fe15718f8c6d16aa [1,0,0,0,0,0|3,0,0]=4 693 B9R0.45 CCC/C=C/CNCCI 14cbd69f62801cb004945a1ced893a63 [1,0,0,0,0,0|3,0,0]=4 694 B9R0.45 CCC/C=C/CNCCO f36a34dbc29fb4af4c73acfa4003430e [1,0,0,0,0,0|3,0,0]=4 695 B9R0.45 CCC/C=C/CNCCS a4179fa1a875de08e09efe6fda165673 [1,0,0,0,0,0|3,0,0]=4 696 B9R0.45 CCC/C=C/COCCC e2603f506af8247235a50f3fd3dcc6bb [1,0,0,0,0,0|2,0,0]=3 697 B9R0.45 CCC/C=C/COCCF 978a5208ddf8dbd1daab1fe6009fa3a9 [1,0,0,0,0,0|3,0,0]=4 698 B9R0.45 CCC/C=C/COCCS 70b6887423dff1b8abacdf0010010f4d [1,0,0,0,0,0|3,0,0]=4 699 B9R0.45 CCC/C=C/COCOC 2ed18a1d7b328c128b9c9b7fe376ba14 [1,0,0,0,0,0|3,0,0]=4 700 B9R0.45 CCC/C=C/COCSC 0ed1754b723aa10b4a46ff1120cdef70 [1,0,0,0,0,0|3,0,0]=4 701 B9R0.45 CCC/C=C\CCOCC 22a9a7febcfe7dc866e40e1f973d5118 [1,0,0,0,0,0|2,0,0]=3 702 B9R0.45 CCC/C=C\CCOCF 2b67d157ac69da426b717a823272f886 [1,0,0,0,0,0|3,0,0]=4 703 B9R0.45 CCC/C=C\CNCCBr 1aaf2cfe08984012d1434b649e6912e9 [1,0,0,0,0,0|3,0,0]=4 704 B9R0.45 CCC/C=C\CNCCC 7ec0844d7fbfce65ba4c3c1af89a7542 [1,0,0,0,0,0|2,0,0]=3 705 B9R0.45 CCC/C=C\CNCCF 5c94f11b70b72a7893a0fbf9a05ecedd [1,0,0,0,0,0|3,0,0]=4 706 B9R0.45 CCC/C=C\CNCCI df01ebe4e9c691b07bce3ffc9f21436a [1,0,0,0,0,0|3,0,0]=4 707 B9R0.45 CCC/C=C\CNCCO cfdbb07d9a559faa9d3964c84bf4e450 [1,0,0,0,0,0|3,0,0]=4 708 B9R0.45 CCC/C=C\CNCCS 3cb85b4e8829d8514180b7119d194cda [1,0,0,0,0,0|3,0,0]=4 709 B9R0.45 CCC/C=C\COCCC c19f5c31ee9318be226094f6198923ec [1,0,0,0,0,0|2,0,0]=3 710 B9R0.45 CCC/C=C\COCCF 511c03796cf7185b66b2da83396e230d [1,0,0,0,0,0|3,0,0]=4 711 B9R0.45 CCC/C=C\COCCS 069417b43be98e62668d665c91d715b3 [1,0,0,0,0,0|3,0,0]=4 712 B9R0.45 CCC/C=C\COCOC 55ea190b49bb7f6c2655f389f986e42c [1,0,0,0,0,0|3,0,0]=4 713 B9R0.45 CCC/C=C\COCSC b8b2c6e8294ce2f2ef38018053320a26 [1,0,0,0,0,0|3,0,0]=4 714 B9R0.45 CCCC#CCCOCC 87cce18b1526d1564fd256422e3a5c87 [1,0,0,0,0,0|2,0,1]=4 715 B9R0.45 CCCC#CCOCCC ff72fbd1d49bd3be22c26f820479a5f0 [1,0,0,0,0,0|0,0,3]=4 716 B9R0.45 CCCC/C=C/COCC 054a7450f451f94427ddda8cd9685a27 [1,0,0,0,0,0|2,0,1]=4 717 B9R0.45 CCCCCCCNCC 31fa4e94f188453162c86e218e83a3fe [1,0,0,0,0,0|2,0,1]=4 718 B9R0.45 CCCCCCCOCC afc5a86de4d9d2aada96fa893fe06937 [1,0,0,0,0,0|2,0,1]=4 719 B9R0.45 CCCCCCNCCBr 432851e349f9c8ac31da8524f48578e2 [1,0,0,0,0,0|2,0,1]=4 720 B9R0.45 CCCCCCNCCC e9c4dc74296e69be276b9ef8aee733d2 [1,0,0,0,0,0|1,0,1]=3 721 B9R0.45 CCCCCCNCCF 9254cc0c3491162ddb811a1ca350686d [1,0,0,0,0,0|2,0,1]=4 722 B9R0.45 CCCCCCNCCI 211348b41f09447d155ab96e959b3555 [1,0,0,0,0,0|2,0,1]=4 723 B9R0.45 CCCCCCNCCO 2c640e5cf0d398eb15c3da8e201ff9a9 [1,0,0,0,0,0|2,0,1]=4 724 B9R0.45 CCCCCCNCCS 295b56fa02564919637f2af1760de842 [1,0,0,0,0,0|2,0,1]=4 725 B9R0.45 CCCCCCNCOC aba2e41598bd49d27de9d216a6960960 [1,0,0,0,0,0|2,0,1]=4 726 B9R0.45 CCCCCCNCSC 26b8d5c53ba2ffb7a0ad7aeefcef29cb [1,0,0,0,0,0|2,0,1]=4 727 B9R0.45 CCCCCCOCC#N 41f322377cad05989d164a4262163638 [1,0,0,0,0,0|1,0,2]=4 728 B9R0.45 CCCCCCOCC=O bd855bb441849ecb00a1d491cea228b2 [1,0,0,0,0,0|1,0,2]=4 729 B9R0.45 CCCCCCOCCC e53b5b4f9e861a4f0969c775813c954e [1,0,0,0,0,0|0,0,1]=2 730 B9R0.45 CCCCCCOCCF 5c07b9abefb4c7383b2510ed2f25aa7d [1,0,0,0,0,0|1,0,1]=3 731 B9R0.45 CCCCCCOCCS dfca5cb8f17cf53fc21013be4aea075a [1,0,0,0,0,0|1,0,1]=3 732 B9R0.45 CCCCCCOCOC 6663dbbf181def3e6cf6b976451eb0e9 [1,0,0,0,0,0|1,0,1]=3 733 B9R0.45 CCCCCCOCSC ea8aeb7aec2e44107948b184f1a2484b [1,0,0,0,0,0|1,0,1]=3 734 B9R0.45 CCCCCNCCCC 4b3b475ebd19f4e81120126dc44604b9 [1,0,0,0,0,0|2,0,0]=3 735 B9R0.45 CCCCCNCCCCl 109aece1b500375b78357a337e9896e4 [1,0,0,0,0,0|3,0,0]=4 736 B9R0.45 CCCCCNCCCF 5ad689e26c296fbe8637b1c72c8b1ac8 [1,0,0,0,0,0|3,0,0]=4 737 B9R0.45 CCCCCNCCCO 3cb5b804fc7f29c415be4738c214f571 [1,0,0,0,0,0|3,0,0]=4 738 B9R0.45 CCCCCNCCCS 7d387ec49be60b8d3336c43db9a47159 [1,0,0,0,0,0|3,0,0]=4 739 B9R0.45 CCCCCNCCOC 0d0c9f836b1b0f565b919320cde5807e [1,0,0,0,0,0|3,0,0]=4 740 B9R0.45 CCCCCNCCSC 738dc92cc1ee7c68b53e333bc3c1249e [1,0,0,0,0,0|3,0,0]=4 741 B9R0.45 CCCCCNCOCC 106dd0a5d7506881af71fe2f076cb844 [1,0,0,0,0,0|3,0,0]=4 742 B9R0.45 CCCCCOCCCC 452d4f5e08ae861a8237c2e4edaffcee [1,0,0,0,0,0|2,0,0]=3 743 B9R0.45 CCCCCOCCCF fafa7792cbca75bb6104f416c496b552 [1,0,0,0,0,0|3,0,0]=4 744 B9R0.45 CCCCCOCCCS d7a2eff0ce3ac908cbe201d57fc422a2 [1,0,0,0,0,0|3,0,0]=4 745 B9R0.45 CCCCCOCCOC 64d0f3f4ad4f7f2b3f2cc5427c5eba08 [1,0,0,0,0,0|3,0,0]=4 746 B9R0.45 CCCCCOCCSC 35787b22863a0bdd2a717cb23597facb [1,0,0,0,0,0|3,0,0]=4 747 B9R0.45 CCCCCOCOCC 61d6517ecd367dc788621782453f190f [1,0,0,0,0,0|3,0,0]=4 748 B9R0.45 CCCCNCCCCCl 8e0e9ebf8dfb1495f624013ef828e19e [1,0,0,0,0,0|3,0,0]=4 749 B9R0.45 CCCCNCCCCF 953d043841cd25eff2ef5c3d0831f1dd [1,0,0,0,0,0|3,0,0]=4 750 B9R0.45 CCCCNCCCCO 74a60cb017e8f2dcfff3bd80cde22232 [1,0,0,0,0,0|3,0,0]=4 751 B9R0.45 CCCCNCCCCS 293a84436b4673ea4650c3832cb6a843 [1,0,0,0,0,0|3,0,0]=4 752 B9R0.45 CCCCNCCCOC 788f960a3da4a154a6d1eb4fd6357034 [1,0,0,0,0,0|3,0,0]=4 753 B9R0.45 CCCCNCCCSC 1307aea73f697be7347c70961c337c72 [1,0,0,0,0,0|3,0,0]=4 754 B9R0.45 CCCCNCCOCC 39271ffac0a4948f82700c61c9eec153 [1,0,0,0,0,0|3,0,0]=4 755 B9R0.45 CCCCNCCSCC b1ef8d1aa777f7abf26f9f2c6eb99f55 [1,0,0,0,0,0|3,0,0]=4 756 B9R0.45 CCCCOCCCCF 42830ea441c5128d22602f571e3205b9 [1,0,0,0,0,0|3,0,0]=4 757 B9R0.45 CCCCOCCCCS ec359e1317d20b353c1e6ee1fa4be1a0 [1,0,0,0,0,0|3,0,0]=4 758 B9R0.45 CCCCOCCCOC 94ce11a6d684ef526eb2e193b6598c58 [1,0,0,0,0,0|3,0,0]=4 759 B9R0.45 CCCCOCCCSC 62b74f8edfba0d3c5255c58121a65cb5 [1,0,0,0,0,0|3,0,0]=4 760 B9R0.45 CCCCOCCNCC c0f6eb404167932e0e88f86a69bff347 [1,0,0,0,0,0|3,0,0]=4 761 B9R0.45 CCCCOCCOCC bc40d3f7a271e2ee8715a56f03d564ef [1,0,0,0,0,0|3,0,0]=4 762 B9R0.45 CCCCOCCSCC 4b27bedc971633e9128e01c7169daa62 [1,0,0,0,0,0|3,0,0]=4 763 B9R0.45 CCCCOCNCCC a731432b21a93145f59a9eee5ade548a [1,0,0,0,0,0|2,0,1]=4 764 B9R0.45 CCCCOCOCCC bf8c796cfd1bba6ec2766c9548b22b8d [1,0,0,0,0,0|1,0,1]=3 765 B9R0.45 CCCCOCOCCF 36b5a84efa8f0d923bd230c7ea60f543 [1,0,0,0,0,0|2,0,1]=4 766 B9R0.45 CCCCOCOCCS b89141989678ee8d6f2313dbbd0de5e4 [1,0,0,0,0,0|2,0,1]=4 767 B9R0.45 CCCCOCOCOC 562738b96117a23492409bdce5892cd9 [1,0,0,0,0,0|2,0,1]=4 768 B9R0.45 CCCCSCCOCC 696d57545195b0a32e7d1cb44c602929 [1,0,0,0,0,0|3,0,0]=4 769 B9R0.45 CCCNCCCCCCl 2d5ae8cd51b6a7e591941cb7b0622e55 [1,0,0,0,0,0|2,0,1]=4 770 B9R0.45 CCCNCCCCCF 7ddf79ca6b37ad2b5e8ddc392231f404 [1,0,0,0,0,0|2,0,1]=4 771 B9R0.45 CCCNCCCCCO f3d6f4913e5f254c1bf460b36dd70b4c [1,0,0,0,0,0|2,0,1]=4 772 B9R0.45 CCCNCCCCOC 3a911d7832cca15ffba1db8d75c3525f [1,0,0,0,0,0|2,0,1]=4 773 B9R0.45 CCCNCCCCSC 83af594d195aec376428f00fc6e6852d [1,0,0,0,0,0|2,0,1]=4 774 B9R0.45 CCCNCCCOCC a836c1341cedce3cb982b7dda3393120 [1,0,0,0,0,0|2,0,1]=4 775 B9R0.45 CCCNCCCSCC da25d421765166ddce276c23e4b27d3a [1,0,0,0,0,0|2,0,1]=4 776 B9R0.45 CCCNCCOCCC c9636642ffae561b1adc5cd9ae1dccad [1,0,0,0,0,0|1,0,1]=3 777 B9R0.45 CCCNCCOCCO 26e2580fee42af23b6bec1a5344f6efe [1,0,0,0,0,0|2,0,1]=4 778 B9R0.45 CCCNCCOCCS 22947c1b954d0143303aa38649974027 [1,0,0,0,0,0|2,0,1]=4 779 B9R0.45 CCCNCCOCOC bd87fbe1594af723cfb8d704107437f4 [1,0,0,0,0,0|2,0,1]=4 780 B9R0.45 CCCOCCCCC#N 609dbdde15359686ba1703d0b40c485a [1,0,0,0,0,0|1,0,2]=4 781 B9R0.45 CCCOCCCCC=O 8b78d2c4a466c2768be601b9198fb016 [1,0,0,0,0,0|1,0,2]=4 782 B9R0.45 CCCOCCCCCF b14e93115958730ea8214bff1c89eb77 [1,0,0,0,0,0|1,0,1]=3 783 B9R0.45 CCCOCCCCOC 3aa974714759e935d3dbeb5a361d1541 [1,0,0,0,0,0|1,0,1]=3 784 B9R0.45 CCCOCCCCSC 28df677e6e1829a07cbf3784e5a5b453 [1,0,0,0,0,0|1,0,1]=3 785 B9R0.45 CCCOCCCNCC 9c5f9e1a8eab534703971dfcd50dc3a4 [1,0,0,0,0,0|1,0,1]=3 786 B9R0.45 CCCOCCCNCF 1fa8ea4c53f6c4f7a20f066d63c8c48a [1,0,0,0,0,0|2,0,1]=4 787 B9R0.45 CCCOCCCNCO f453546a549baebba8d4dda9dd1f2b96 [1,0,0,0,0,0|2,0,1]=4 788 B9R0.45 CCCOCCCOCC 7ae5cc2cef81f72870de148e55495f6e [1,0,0,0,0,0|1,0,1]=3 789 B9R0.45 CCCOCCCSCC a587632712094e0a386067bb302c3743 [1,0,0,0,0,0|1,0,1]=3 790 B9R0.45 CCCOCCNCCBr 9f86e90a071edec2de61cdfd8199e5e2 [1,0,0,0,0,0|2,0,1]=4 791 B9R0.45 CCCOCCNCCF 1fb0f4589ef80568471bce7090c2014c [1,0,0,0,0,0|2,0,1]=4 792 B9R0.45 CCCOCCNCCI 8da2f45844ac2d978f81e207bd134493 [1,0,0,0,0,0|2,0,1]=4 793 B9R0.45 CCCOCCNCCO 2fe038760c01b7075e45b162c476ceb9 [1,0,0,0,0,0|2,0,1]=4 794 B9R0.45 CCCOCCNCCS 92de6dd4d0d6e015f57d04ac9b343cce [1,0,0,0,0,0|2,0,1]=4 795 B9R0.45 CCCOCCNCOC 8cb8215fa14e9a27a7b43ec8cd96ceda [1,0,0,0,0,0|2,0,1]=4 796 B9R0.45 CCCOCCNCSC 6bd7872fd3e7ce7d9d4aa75a52835035 [1,0,0,0,0,0|2,0,1]=4 797 B9R0.45 CCCOCCOCCC 96ef823798ad295a7793168e0a9a50d1 [1,0,0,0,0,0|1,0,1]=3 798 B9R0.45 CCCOCCOCCF 8a699727db0990fdbea753b75227c0f9 [1,0,0,0,0,0|2,0,1]=4 799 B9R0.45 CCCOCCOCCS 135d5deeb48c2dba9fda7000503f9b47 [1,0,0,0,0,0|2,0,1]=4 800 B9R0.45 CCCOCCOCOC d883cdf177c224a93accb6f6a22cfd33 [1,0,0,0,0,0|2,0,1]=4 801 B9R0.45 CCCOCCOCSC 6797f3697f583a66f6057547c0c4920a [1,0,0,0,0,0|2,0,1]=4 802 B9R0.45 CCCOCCSCCC ef95f0015148e44bf9c71ec82f7f1f36 [1,0,0,0,0,0|1,0,1]=3 803 B9R0.45 CCCOCOCCOC f5c30870d8f3cceba2555c383ac9ca27 [1,0,0,0,0,0|2,0,1]=4 804 B9R0.45 CCCSCCOCCF db000028d4bac3c185ca2424cafce511 [1,0,0,0,0,0|2,0,1]=4 805 B9R0.45 CCCSCCOCCS 839eda13d2fd3df796a512bffa6ac820 [1,0,0,0,0,0|2,0,1]=4 806 B9R0.45 CCCSCCOCOC a9485f0728bb45c5a3674595a8b65d75 [1,0,0,0,0,0|2,0,1]=4 807 B9R0.45 CCCSCCOCSC 9c50d16cbbe0474e2767510f403e1fbb [1,0,0,0,0,0|2,0,1]=4 808 B9R0.45 CCNCCCOCCO 6c261c514fd28efb5350d358913fae05 [1,0,0,0,0,0|2,0,1]=4 809 B9R0.45 CCOCCCOCCF 714535e9c21efd3dc0f9881edb097992 [1,0,0,0,0,0|2,0,1]=4 810 B9R0.45 CCOCCCOCCS 3a94e0b4ae2eb58123f7cf02194f57c1 [1,0,0,0,0,0|2,0,1]=4 811 B9R0.45 CCOCCCOCOC 49ca5418b13db09e21d4436e86edc1d1 [1,0,0,0,0,0|2,0,1]=4 812 B9R0.45 CCOCCCOCSC 5933fe00c4fae79c8d73e60929d6345a [1,0,0,0,0,0|2,0,1]=4 813 B9R0.45 CCSCCCOCCF ea17b98cdecfe1376818aaae8fa7edc5 [1,0,0,0,0,0|2,0,1]=4 814 B9R0.45 CCSCCCOCCS a30e9d31c5017336afd5e6cff0a5615d [1,0,0,0,0,0|2,0,1]=4 815 B9R0.45 CCSCCCOCOC 5cadd01a1a128aae76cfa321e1740b2e [1,0,0,0,0,0|2,0,1]=4 816 B9R0.45 CCSCCCOCSC c724d727513d8badfd80e3cc53a1bf48 [1,0,0,0,0,0|2,0,1]=4 817 B9R0.45 COCCCCOCCF 8d811c473848c1b9e465e0faa6d2b7f8 [1,0,0,0,0,0|2,0,1]=4 818 B9R0.45 COCCCCOCCS 9c136081df91fabb4e2b6ddd13f67835 [1,0,0,0,0,0|2,0,1]=4 819 B9R0.45 COCCCCOCOC 079bab4bc7a5d63b09a4a47180aaff22 [1,0,0,0,0,0|2,0,1]=4 820 B9R0.45 COCCCCOCSC b96665b11f1788b8d409908b6cf086a3 [1,0,0,0,0,0|2,0,1]=4 821 B9R0.45 COCOCCCCCF 552d473a9e75c6c60097fb0f63ff4725 [1,0,0,0,0,0|2,0,1]=4 822 B9R0.45 COCOCCCCSC 5a8925a203895139b02568d02e8838f1 [1,0,0,0,0,0|2,0,1]=4 823 B9R0.45 CSCCCCOCCF aac887e51d5db9e5aa39f268153a3254 [1,0,0,0,0,0|2,0,1]=4 824 B9R0.45 CSCCCCOCCS 33de980d5fadef5f1403ffcc395bac65 [1,0,0,0,0,0|2,0,1]=4 825 B9R0.45 CSCCCCOCSC 417291c6267fa98c1c8e9917f938c6b4 [1,0,0,0,0,0|2,0,1]=4 826 B9R0.45 FCCCCCOCCF 730daee247e71afcf11a456cbc27167d [1,0,0,0,0,0|2,0,1]=4 827 B9R0.45 FCCCCCOCCS c444156405502fbe4bce7524fa0a32df [1,0,0,0,0,0|2,0,1]=4 828 B11R0.5 C#CCN(C)CC(=O)OCCC 7505210a4a4417ba7e4701171314c8fb [0,1,0,0,0,0|1,0,2]=4 829 B11R0.5 C#CCNC(=O)CC(C)CCC 02fd3c2b02891cdbbf80d2b0197398d6 [0,1,0,0,0,0|1,0,2]=4 830 B11R0.5 C#CCNC(=O)CC(O)CCC 7f1391cc074d6f89fe3cb32b1b833034 [0,1,0,0,0,0|1,0,2]=4 831 B11R0.5 C=C(CCC)CC(=O)NCCBr c80bec02d6cf302ff7e846f19d75a349 [0,1,0,0,0,0|2,0,1]=4 832 B11R0.5 C=C(CCC)CC(=O)NCCC f8568e6d5a728e34730352a7bbc0ccd7 [0,1,0,0,0,0|1,0,1]=3 833 B11R0.5 C=C(CCC)CC(=O)NCCF 0015e1be48c714a1505c88f8ce9bee08 [0,1,0,0,0,0|2,0,1]=4 834 B11R0.5 C=C(CCC)CC(=O)NCCI d6fd07bce5dabe6bd9038a7ec5299717 [0,1,0,0,0,0|2,0,1]=4 835 B11R0.5 C=C(CCC)CC(=O)NCCO a5704dae546699dd823c9037caaedc59 [0,1,0,0,0,0|2,0,1]=4 836 B11R0.5 C=C(CCC)CC(=O)NCCS 340d091a9a4804090449a28d3e552938 [0,1,0,0,0,0|2,0,1]=4 837 B11R0.5 C=C(CN(C)CCC)OCOC e1086c13f51adf121bca6cd09df4387d [0,1,0,0,0,0|3,0,0]=4 838 B11R0.5 C=CCN(C)CC(=O)OCCC 9646a1bf3d9cb1d2dad3748591d78382 [0,1,0,0,0,0|1,0,2]=4 839 B11R0.5 C=CCOC(=O)CN(C)CCC 4e0c790774532530cc9aee23512350e4 [0,1,0,0,0,0|1,0,2]=4 840 B11R0.5 C=CC[C@H](C)CC(=O)NCCC 85b3a276e30dbc9fda429a90181a3a78 [0,1,0,0,0,0|1,0,2]=4 841 B11R0.5 CC/C=C/C(=O)NC(C)CCC d47fda4e4f9639e8deaab1ae8f5c098f [0,1,0,0,0,0|2,0,1]=4 842 B11R0.5 CC/C=C/C(=O)N[C@@H](C)CCC 275536acce008e54691cb1ec2072c7b1 [0,1,0,0,0,0|2,0,1]=4 843 B11R0.5 CC/C=C\C(=O)NC(C)CCC 30660ba614524e5b98b4c4f36ee2015f [0,1,0,0,0,0|2,0,1]=4 844 B11R0.5 CC/C=C\C(=O)N[C@@H](C)CCC fa47cebc24a630e155fe3fa0ebe8860a [0,1,0,0,0,0|2,0,1]=4 845 B11R0.5 CCC#CC(=O)NC(C)CCC 8e717945904d90fdcfb30eb1fc5d7dbb [0,1,0,0,0,0|2,0,1]=4 846 B11R0.5 CCC#CC(=O)N[C@@H](C)CCC ccfb33a27451917ae9ed239af261790d [0,1,0,0,0,0|2,0,1]=4 847 B11R0.5 CCC=CC(=O)NC(C)CCC 03e9e1a3236db6b1560e59b669675f55 [0,1,0,0,0,0|2,0,1]=4 848 B11R0.5 CCC=CC(=O)N[C@@H](C)CCC 13e3c6df8e9d235502e8eb33531af509 [0,1,0,0,0,0|2,0,1]=4 849 B11R0.5 CCCC(=O)CC(=O)NCCBr 31c9e585a20577d5f057927ef3fa78da [0,1,0,0,0,0|2,0,1]=4 850 B11R0.5 CCCC(=O)CC(=O)NCCF a3e59f13b9a699de6ea006113bff205c [0,1,0,0,0,0|2,0,1]=4 851 B11R0.5 CCCC(=O)CC(=O)NCCI c0f9ef05f63b8dd084e6bee7ddd0eb81 [0,1,0,0,0,0|2,0,1]=4 852 B11R0.5 CCCC(=O)CC(=O)NCCO 43d63bcd2fd85cd6782fef4e70d2e99e [0,1,0,0,0,0|2,0,1]=4 853 B11R0.5 CCCC(=O)CC(=O)NCCS d843acfb2dbc5c78fa09d1730dbcf910 [0,1,0,0,0,0|2,0,1]=4 854 B11R0.5 CCCC(C)CC(=O)NCC#N 39d3c132632177c20c429a072364e8b2 [0,1,0,0,0,0|2,0,1]=4 855 B11R0.5 CCCC(C)CC(=O)NCCBr b215c9c5c5f38640bec3aefafa9813bd [0,1,0,0,0,0|2,0,0]=3 856 B11R0.5 CCCC(C)CC(=O)NCCF a6f5ea174702ae0b49bf2f6b7033df8e [0,1,0,0,0,0|2,0,0]=3 857 B11R0.5 CCCC(C)CC(=O)NCCI 98b4160edea245d1baaaac0cd9eecf41 [0,1,0,0,0,0|2,0,0]=3 858 B11R0.5 CCCC(C)CC(=O)NCCO d7bca58a8685417d4ffd11738ef8cb2e [0,1,0,0,0,0|2,0,0]=3 859 B11R0.5 CCCC(C)CC(=O)NCCS 06c0d0a8a94d4d5e97344580715593b6 [0,1,0,0,0,0|2,0,0]=3 860 B11R0.5 CCCC(C)CC(C)OCCF 5d871e68ddfc5a63cef6b4f3086bb3ee [0,1,0,0,0,0|2,0,1]=4 861 B11R0.5 CCCC(C)CC(C)OCCS 7822fc946135e5b86e0c4f9d1ab8ec03 [0,1,0,0,0,0|2,0,1]=4 862 B11R0.5 CCCC(C)CC(C)OCSC ae69498b1697c95aaa7b3742ba72d319 [0,1,0,0,0,0|2,0,1]=4 863 B11R0.5 CCCC(C)NC(=O)CCCF 92bdb7d1bc59add44700162076c57080 [0,1,0,0,0,0|3,0,0]=4 864 B11R0.5 CCCC(C)NC(=O)CCCS bdd0df91e872958d03733fec92a7a186 [0,1,0,0,0,0|3,0,0]=4 865 B11R0.5 CCCC(C)NC(=O)CCOC 782d47eb43499747d538d81f804c049f [0,1,0,0,0,0|3,0,0]=4 866 B11R0.5 CCCC(C)NC(=O)CCSC 53c2e29689a9dd390ba7c8f87ac68cbc [0,1,0,0,0,0|3,0,0]=4 867 B11R0.5 CCCC(C)NC(=O)COCC 49b8d30883e6213dde846c40afd62774 [0,1,0,0,0,0|3,0,0]=4 868 B11R0.5 CCCC(C)NC(=O)CSCC 8141e3f6517636b1afcb9b2c6ab5d756 [0,1,0,0,0,0|3,0,0]=4 869 B11R0.5 CCCC(C)NC(=O)NCCF 6ddb29bb266b3fe0e3aaec1219b167a0 [0,1,0,0,0,0|3,0,0]=4 870 B11R0.5 CCCC(C)NC(=O)NCCN f074823e0771714cad8d6fdf380f6d98 [0,1,0,0,0,0|3,0,0]=4 871 B11R0.5 CCCC(C)NC(=O)NCCO 6e9059519bdd3a57ac253336627f46da [0,1,0,0,0,0|3,0,0]=4 872 B11R0.5 CCCC(C)NC(=O)NCCS de1fbcf2fea42bf7e8e325efc89f2e05 [0,1,0,0,0,0|3,0,0]=4 873 B11R0.5 CCCC(O)CC(=O)NCC#N bffd65e6464873827a4940b83f202781 [0,1,0,0,0,0|2,0,1]=4 874 B11R0.5 CCCC(O)CC(=O)NCCBr 403266d4aeff00f6c8c302baa3c782db [0,1,0,0,0,0|2,0,0]=3 875 B11R0.5 CCCC(O)CC(=O)NCCF 39868ef53cea6c9c94219d5f952638d7 [0,1,0,0,0,0|2,0,0]=3 876 B11R0.5 CCCC(O)CC(=O)NCCI ac3fb4bcb830d54fdf2cf8585532a646 [0,1,0,0,0,0|2,0,0]=3 877 B11R0.5 CCCC(O)CC(=O)NCCO 053f97898f8c263a00e9205ba8829ffb [0,1,0,0,0,0|2,0,0]=3 878 B11R0.5 CCCC(O)CC(=O)NCCS 33394ed470ae52479640fd7a83bb42c4 [0,1,0,0,0,0|2,0,0]=3 879 B11R0.5 CCCCC(=O)NC(C)CCC 06b75c8ed502847831974c3beb293115 [0,1,0,0,0,0|2,0,0]=3 880 B11R0.5 CCCCC(=O)NC(C)CCO f2f6baed6c8888b17699ce22a65b77c8 [0,1,0,0,0,0|3,0,0]=4 881 B11R0.5 CCCCC(=O)NC(C)COC a14ce5a5a7a11d8642d5c531a761b408 [0,1,0,0,0,0|3,0,0]=4 882 B11R0.5 CCCCC(=O)N[C@@H](C)CCC d44d2e3ce3090614354e888e02ab6cb9 [0,1,0,0,0,0|2,0,0]=3 883 B11R0.5 CCCCC(=O)N[C@@H](C)CCO fcb01b83713d6d3d2548c0519b75736e [0,1,0,0,0,0|3,0,0]=4 884 B11R0.5 CCCCC(=O)N[C@@H](C)COC 2f1d56aeed1023f756c78e343312573e [0,1,0,0,0,0|3,0,0]=4 885 B11R0.5 CCCCC(=O)N[C@H](C)CCO 42cf41b5c448b60ab9ca2bc4a3872089 [0,1,0,0,0,0|3,0,0]=4 886 B11R0.5 CCCCC(=O)N[C@H](C)COC 5b25d4500b021470da8de2edc369af89 [0,1,0,0,0,0|3,0,0]=4 887 B11R0.5 CCCCN(C)CC(C)CCC 428af2d2a31b6889d0a09b292ba5fa84 [0,1,0,0,0,0|3,0,0]=4 888 B11R0.5 CCCN(C)CC(=O)CCSC eebe96254f9b6ed4aad569ec10bbc0ac [0,1,0,0,0,0|3,0,0]=4 889 B11R0.5 CCCNC(=O)/C=C(\C)/CCC 61129490ae587ada088b6bbe9bb745a8 [0,1,0,0,0,0|1,0,2]=4 890 B11R0.5 CCCNC(=O)CC(=O)CCC 30d8467f4d3826bdfaf412166a0af84b [0,1,0,0,0,0|1,0,1]=3 891 B11R0.5 CCCNC(=O)CC(=O)NCC 0e9673cc2fc8bb2d049b5e468572ed5c [0,1,0,0,0,0|2,0,1]=4 892 B11R0.5 CCCNC(=O)CC(=O)OCC 7d4549fd34c04c74498c844ec80d3370 [0,1,0,0,0,0|2,0,1]=4 893 B11R0.5 CCCNC(=O)CC(C)CCC 770df29d3463093fa9d923c103cabdeb [0,1,0,0,0,0|1,0,0]=2 894 B11R0.5 CCCNC(=O)CC(C)COC 6ed34fe4e79c56443731c6405711d51e [0,1,0,0,0,0|2,0,0]=3 895 B11R0.5 CCCNC(=O)CC(C)NOC 2ae6945ea451cc74090dbf9882b81df3 [0,1,0,0,0,0|3,0,0]=4 896 B11R0.5 CCCNC(=O)CC(C)SCC 34a1249b2ffd0e47a2b01204e314bae6 [0,1,0,0,0,0|2,0,0]=3 897 B11R0.5 CCCNC(=O)CC(O)CCC 347d2fd032ec3e8346c1406202ef2590 [0,1,0,0,0,0|1,0,0]=2 898 B11R0.5 CCCNC(=O)CN(C)CCC b79c4b97136430b60d1778e086ddf6f2 [0,1,0,0,0,0|2,0,0]=3 899 B11R0.5 CCCNC(=O)CN(C)CCF 34b1587699a01e48a9f58b4904c1455c [0,1,0,0,0,0|3,0,0]=4 900 B11R0.5 CCCNC(=O)CN(C)CCO 672851e4160e8f2e66543b412632cd95 [0,1,0,0,0,0|3,0,0]=4 901 B11R0.5 CCCNC(=O)CN(C)CCS bd6299ab919e36d2e59efdc5db50a93c [0,1,0,0,0,0|3,0,0]=4 902 B11R0.5 CCCNC(=O)CN(C)COC 1c142e547a49fbfa112c5ca0c425bea5 [0,1,0,0,0,0|3,0,0]=4 903 B11R0.5 CCCNC(=O)CN(C)CSC 00ef477059f8f10ca6dacd4ac4c3135d [0,1,0,0,0,0|3,0,0]=4 904 B11R0.5 CCCNC(=O)CS(=O)CCC e1370883c6e4c46984d78266968c018c [0,1,0,0,0,0|2,0,0]=3 905 B11R0.5 CCCNC(=O)NC(C)CCC 4e883f0b07ecfab59776b618f7af278c [0,1,0,0,0,0|2,0,0]=3 906 B11R0.5 CCCNC(=O)NC(C)CCO d71d1fbb7061f7f68e6e64137c0c265f [0,1,0,0,0,0|3,0,0]=4 907 B11R0.5 CCCNC(=O)NC(C)COC 384de26bb4eaa1bbec278f49f67544f0 [0,1,0,0,0,0|3,0,0]=4 908 B11R0.5 CCCNC(=O)N[C@@H](C)CCC ac40825efab4e721b8b04f89fa9a8af1 [0,1,0,0,0,0|2,0,0]=3 909 B11R0.5 CCCNC(=O)N[C@@H](C)CCO becde43008275d65336c9d80b5dbaac4 [0,1,0,0,0,0|3,0,0]=4 910 B11R0.5 CCCNC(=O)N[C@@H](C)COC e9bd53d34a1e43d96f4657937eef92ed [0,1,0,0,0,0|3,0,0]=4 911 B11R0.5 CCCNC(=O)N[C@H](C)CCO 5ea37e5e07cc92273e9ea6bd90e9877a [0,1,0,0,0,0|3,0,0]=4 912 B11R0.5 CCCNC(=O)N[C@H](C)COC 51894cdb3a83d19a32fb74622a94710f [0,1,0,0,0,0|3,0,0]=4 913 B11R0.5 CCCNC(=S)NC(C)CCC 3400151adaca18de9fb599c2eb299878 [0,1,0,0,0,0|2,1,0]=4 914 B11R0.5 CCCNC(=S)N[C@@H](C)CCC 06f0b3d8d3bb60947dab86480236c748 [0,1,0,0,0,0|2,1,0]=4 915 B11R0.5 CCCOC(=O)CN(C)CC#N 40bc6683c4d873eec7521ed2d4b4828b [0,1,0,0,0,0|2,0,1]=4 916 B11R0.5 CCCOC(=O)CN(C)CCC 2108cad64365c8875250565c54fcddad [0,1,0,0,0,0|1,0,0]=2 917 B11R0.5 CCCOC(=O)CN(C)CCF 7802988c9a90b24f30ba3dae641fdc34 [0,1,0,0,0,0|2,0,0]=3 918 B11R0.5 CCCOC(=O)CN(C)CCO e864733593019363881c7ea92d3164c5 [0,1,0,0,0,0|2,0,0]=3 919 B11R0.5 CCCOC(C)CC(C)CCC e074e59321627f673bc606f13426d330 [0,1,0,0,0,0|1,0,1]=3 920 B11R0.5 CCCS(=O)CC(=O)NCCBr d52d954b3059915f8361b101dd5d9556 [0,1,0,0,0,0|3,0,0]=4 921 B11R0.5 CCCS(=O)CC(=O)NCCF 5bda876421d523f0e9922b34bb816a56 [0,1,0,0,0,0|3,0,0]=4 922 B11R0.5 CCCS(=O)CC(=O)NCCI b1fcad0eefae7873d01c68ae0c73351b [0,1,0,0,0,0|3,0,0]=4 923 B11R0.5 CCCS(=O)CC(=O)NCCO 5128a55a23b7f45053cf28e2468985a9 [0,1,0,0,0,0|3,0,0]=4 924 B11R0.5 CCCS(=O)CC(=O)NCCS e86f078709ea4c49c2e16faa8e8c32ef [0,1,0,0,0,0|3,0,0]=4 925 B11R0.5 CCC[C@H](C)NC(=O)CCCF 6b25c3e8a28e36d4d23a091c6267bceb [0,1,0,0,0,0|3,0,0]=4 926 B11R0.5 CCC[C@H](C)NC(=O)CCCS 009b931235a81a3a0224c407ae4aa4c5 [0,1,0,0,0,0|3,0,0]=4 927 B11R0.5 CCC[C@H](C)NC(=O)CCOC 08fb20ab9f59b183f11b288dd85ef352 [0,1,0,0,0,0|3,0,0]=4 928 B11R0.5 CCC[C@H](C)NC(=O)CCSC 29ed3e42954091eb0a25b5ff1a9f5f25 [0,1,0,0,0,0|3,0,0]=4 929 B11R0.5 CCC[C@H](C)NC(=O)COCC 74c412d8f2c5028ec082fb8c8130c686 [0,1,0,0,0,0|3,0,0]=4 930 B11R0.5 CCC[C@H](C)NC(=O)CSCC 67c974205de8e79e18b831a1f00aba9e [0,1,0,0,0,0|3,0,0]=4 931 B11R0.5 CCC[C@H](C)NC(=O)NCCF bd71b866d3b07acc93458549485b2016 [0,1,0,0,0,0|3,0,0]=4 932 B11R0.5 CCC[C@H](C)NC(=O)NCCN 6472da23671ea443b606a42c0ba661c9 [0,1,0,0,0,0|3,0,0]=4 933 B11R0.5 CCC[C@H](C)NC(=O)NCCO 919e6a9ec0a5f7470f3aee1ba541ebe5 [0,1,0,0,0,0|3,0,0]=4 934 B11R0.5 CCC[C@H](C)NC(=O)NCCS a9c24b5824b68060d68b8766f47cdfb6 [0,1,0,0,0,0|3,0,0]=4 935 B11R0.5 CCSC(C)CC(=O)NCCF 6fff1c023b8ddf70225e6c0e0ce88470 [0,1,0,0,0,0|3,0,0]=4 936 B11R0.5 CCSC(C)CC(=O)NCCI 489dd86f087a9752331ed76b2d2a0cfa [0,1,0,0,0,0|3,0,0]=4 937 B11R0.5 CCSC(C)CC(=O)NCCO 5720fb1e90602313fc347d0159545fca [0,1,0,0,0,0|3,0,0]=4 938 B11R0.5 CCSC(C)CC(=O)NCCS e625a152d758e500610af6c4ff2fbad6 [0,1,0,0,0,0|3,0,0]=4 939 B11R0.5 COCC(C)CC(=O)NCCBr 54c0768aee7421cf4ff5f351a26c23d2 [0,1,0,0,0,0|3,0,0]=4 940 B11R0.5 COCC(C)CC(=O)NCCF 5bcaedcaeb26307ebdb75041f742860e [0,1,0,0,0,0|3,0,0]=4 941 B11R0.5 COCC(C)CC(=O)NCCI a418dd8c13c4ca6d547ca95b08052a91 [0,1,0,0,0,0|3,0,0]=4 942 B11R0.5 COCC(C)CC(=O)NCCO 7692dfc509931e4a62bff6698ec246d6 [0,1,0,0,0,0|3,0,0]=4 943 B11R0.5 COCC(C)CC(=O)NCCS 09b0e0c32c1995ad0da70323ea63e2f3 [0,1,0,0,0,0|3,0,0]=4 944 B11R0.11 C#CCNC(C)C(=O)OCCC 8af2586a9ac3e1dd77b6a8be78385754 [0,1,0,0,0,0|1,0,2]=4 945 B11R0.11 C#CCN[C@@H](C)C(=O)OCCC d9afb1600e4b163dfca5d8165e9c986e [0,1,0,0,0,0|1,0,2]=4 946 B11R0.11 C#CCOC(C)C(=O)OCCC 104bb54ccc02dd6d8f881ea4a1b5b3ed [0,1,0,0,0,0|1,0,2]=4 947 B11R0.11 C#CCO[C@@H](C)C(=O)OCCC 09088c86c574fe02a31273f96ea8cfda [0,1,0,0,0,0|1,0,2]=4 948 B11R0.11 C=CCNC(C)C(=O)OCCC 43dd074ab6df12c314de57156ad65f30 [0,1,0,0,0,0|1,0,2]=4 949 B11R0.11 C=CCN[C@@H](C)C(=O)OCCC 548ea8672fa55f377ee40635469ff978 [0,1,0,0,0,0|1,0,2]=4 950 B11R0.11 C=CCOC(=O)[C@H](C)NCCC 8833bf154d9143ad1961ec58d4144120 [0,1,0,0,0,0|1,0,2]=4 951 B11R0.11 C=CCOC(C)C(=O)OCCC d32d89c949debacb47b39359ae70155c [0,1,0,0,0,0|1,0,2]=4 952 B11R0.11 C=CCO[C@@H](C)C(=O)OCCC d7a948b59d1ffaa5120daad5b65613ab [0,1,0,0,0,0|1,0,2]=4 953 B11R0.11 CC/C=C/C(=O)N(C)CCCC ba2881e2daee3e5d22431b94f5d06917 [0,1,0,0,0,0|2,0,1]=4 954 B11R0.11 CC/C=C\C(=O)N(C)CCCC 31d74eef32333eae03962c3f3c44fb7d [0,1,0,0,0,0|2,0,1]=4 955 B11R0.11 CCC#CC(=O)N(C)CCCC b8a883e6bc22e67158e5b509c36151cd [0,1,0,0,0,0|2,0,1]=4 956 B11R0.11 CCC/C=C(\C)/C(=O)NCCC 630e66c8f2fa04a9f1e7e4a0be13eff0 [0,1,0,0,0,0|1,0,2]=4 957 B11R0.11 CCC=CC(=O)N(C)CCCC 45b99ca61563efe1def59eef0accd30b [0,1,0,0,0,0|2,0,1]=4 958 B11R0.11 CCCCC(=O)C(=O)NCCBr c9ad310b8cd4798d59afe4b7ac5a43ec [0,1,0,0,0,0|2,0,1]=4 959 B11R0.11 CCCCC(=O)C(=O)NCCC e1804b67f5cab6647a646a4771ff5ea2 [0,1,0,0,0,0|1,0,1]=3 960 B11R0.11 CCCCC(=O)C(=O)NCCF 781087f821303b07888f68747ca8d17d [0,1,0,0,0,0|2,0,1]=4 961 B11R0.11 CCCCC(=O)C(=O)NCCI 12dd3a8c5a9fdf8029622398bc791480 [0,1,0,0,0,0|2,0,1]=4 962 B11R0.11 CCCCC(=O)C(=O)NCCO 5e40d9cce485eb6ef227b16863614385 [0,1,0,0,0,0|2,0,1]=4 963 B11R0.11 CCCCC(=O)C(=O)NCCS c133a926fda2b57bbe90f009b2b9b978 [0,1,0,0,0,0|2,0,1]=4 964 B11R0.11 CCCCC(=O)N(C)CCCC 7dad5d8e8bfe9b0ddfef2e09d45a8eda [0,1,0,0,0,0|2,0,0]=3 965 B11R0.11 CCCCC(=O)N(C)CCCO a9278fdd25b3920f5b6d1910e103cbcf [0,1,0,0,0,0|3,0,0]=4 966 B11R0.11 CCCCC(=O)N(C)CCOC f5f5ce99a62b3f39452b8495180df8e1 [0,1,0,0,0,0|3,0,0]=4 967 B11R0.11 CCCCC(=O)N(C)CCSC 63eec1202423a877142c180f7a9f12be [0,1,0,0,0,0|3,0,0]=4 968 B11R0.11 CCCCC(C)N(C)CCCC 31ec6d4694b083d3602a1d85126446b3 [0,1,0,0,0,0|3,0,0]=4 969 B11R0.11 CCCCC(O)C(=O)NCCC 08018766b6839562ad7bd788da1df983 [0,1,0,0,0,0|1,0,0]=2 970 B11R0.11 CCCCC(O)C(=O)NCCF b54bf0d966ec10d1d066831bce774865 [0,1,0,0,0,0|2,0,0]=3 971 B11R0.11 CCCCC(O)C(=O)NCCI 5d4e6792c586e00f102d94205b30a4a3 [0,1,0,0,0,0|2,0,0]=3 972 B11R0.11 CCCCC(O)C(=O)NCCO 5149671f7e2069a8cea9eb99c58eed28 [0,1,0,0,0,0|2,0,0]=3 973 B11R0.11 CCCCC(O)C(=O)NCCS 03efb6fd89818e7d8c7576f7b6647d99 [0,1,0,0,0,0|2,0,0]=3 974 B11R0.11 CCCCN(C)C(=O)CCCF 9f40afa2d92b99be5de5abf1b028fbdd [0,1,0,0,0,0|3,0,0]=4 975 B11R0.11 CCCCN(C)C(=O)CCCS 0221bb21ef873f339ce551eed9780b83 [0,1,0,0,0,0|3,0,0]=4 976 B11R0.11 CCCCN(C)C(=O)CCOC d34a6e6c9c3a91482b3e5b0f0ebbe6dc [0,1,0,0,0,0|3,0,0]=4 977 B11R0.11 CCCCN(C)C(=O)CCSC 72f40417428e79b41f72dac066910b9c [0,1,0,0,0,0|3,0,0]=4 978 B11R0.11 CCCCN(C)C(=O)COCC b25351f0c8f155bad8decb46626aa368 [0,1,0,0,0,0|3,0,0]=4 979 B11R0.11 CCCCN(C)C(=O)CSCC 73741d1539e5d7f6b198b9252c14215f [0,1,0,0,0,0|3,0,0]=4 980 B11R0.11 CCCCN(C)C(=O)NCCC 05a16d8f5ddef3936b05506204558473 [0,1,0,0,0,0|2,0,0]=3 981 B11R0.11 CCCCN(C)C(=O)NCCF f219bfa89c17468a5361d3ec387fd84f [0,1,0,0,0,0|3,0,0]=4 982 B11R0.11 CCCCN(C)C(=O)NCCN 55e935ad42591cbfd0bc81e180aeafd4 [0,1,0,0,0,0|3,0,0]=4 983 B11R0.11 CCCCN(C)C(=O)NCCO 61f0d81c79f0041f44feb2baafdc55c7 [0,1,0,0,0,0|3,0,0]=4 984 B11R0.11 CCCCN(C)C(=O)NCCS a7ecbe9442b3573c0ae36d690c4b537a [0,1,0,0,0,0|3,0,0]=4 985 B11R0.11 CCCCN(C)C(=S)NCCC 344f3f5ce931aabefa079a23a7d46fab [0,1,0,0,0,0|2,1,0]=4 986 B11R0.11 CCCC[C@@H](O)C(=O)NCCC b494a02b34c330a020a33f32c0dcfa27 [0,1,0,0,0,0|1,0,0]=2 987 B11R0.11 CCCC[C@@H](O)C(=O)NCCF 3e633f05afcdc84aa9aa17b1590ec4c4 [0,1,0,0,0,0|2,0,0]=3 988 B11R0.11 CCCC[C@@H](O)C(=O)NCCI 09bb7bf2c4507d3e1795a627fdf9e6c5 [0,1,0,0,0,0|2,0,0]=3 989 B11R0.11 CCCC[C@@H](O)C(=O)NCCO 8fc2793404e364001d95d858d96f078f [0,1,0,0,0,0|2,0,0]=3 990 B11R0.11 CCCC[C@@H](O)C(=O)NCCS b4bd831ce868c50ecccf2bca30bf7bc1 [0,1,0,0,0,0|2,0,0]=3 991 B11R0.11 CCCC[C@H](O)C(=O)NCCC b77f17f943bd1faa8f4b7bb97452a886 [0,1,0,0,0,0|1,0,0]=2 992 B11R0.11 CCCC[C@H](O)C(=O)NCCF e46aba56cbeffede8ff9b1a228ae4fa1 [0,1,0,0,0,0|2,0,0]=3 993 B11R0.11 CCCC[C@H](O)C(=O)NCCI 294337f2d9e6fa3581c50c563cf50ea9 [0,1,0,0,0,0|2,0,0]=3 994 B11R0.11 CCCC[C@H](O)C(=O)NCCO 4ca5908f106a4ae30204cd9bb01b3f81 [0,1,0,0,0,0|2,0,0]=3 995 B11R0.11 CCCC[C@H](O)C(=O)NCCS 833ad9db1501d136e8e1d17ac3856269 [0,1,0,0,0,0|2,0,0]=3 996 B11R0.11 CCCNC(=O)C(C)NCCBr 852a6749a7e180c9625a2e75ab04a79a [0,1,0,0,0,0|3,0,0]=4 997 B11R0.11 CCCNC(=O)C(C)NCCC 7a48518f332890dcb8c6138ab791572d [0,1,0,0,0,0|2,0,0]=3 998 B11R0.11 CCCNC(=O)C(C)NCCF 8cd9ca4a87b94967749b602c8de49c8a [0,1,0,0,0,0|3,0,0]=4 999 B11R0.11 CCCNC(=O)C(C)NCCI 8045e5b0a80ebca3f27925ecc61df399 [0,1,0,0,0,0|3,0,0]=4 1000 B11R0.11 CCCNC(=O)C(C)NCCO 84ac751ede34eccb7b2b920a96c29ba3 [0,1,0,0,0,0|3,0,0]=4 1001 B11R0.11 CCCNC(=O)C(C)NCCS a27a5f3ce23c5f41cea4b0573ac02519 [0,1,0,0,0,0|3,0,0]=4 1002 B11R0.11 CCCNC(=O)C(C)NCOC 0dce77c3bfa90954fe6f8a4009707cb4 [0,1,0,0,0,0|3,0,0]=4 1003 B11R0.11 CCCNC(=O)C(C)NCSC a8bb18f784d520ec75d4bb6bb25cbc98 [0,1,0,0,0,0|3,0,0]=4 1004 B11R0.11 CCCNC(=O)C(C)OCCC 1de2e816ad9e83948061886135d6e923 [0,1,0,0,0,0|2,0,0]=3 1005 B11R0.11 CCCNC(=O)C(C)OCCF 3d78ede2ca93aa5c820839e532878d9e [0,1,0,0,0,0|3,0,0]=4 1006 B11R0.11 CCCNC(=O)C(C)OCCS a6214ac2164efce0de2fc8d60f1e52a3 [0,1,0,0,0,0|3,0,0]=4 1007 B11R0.11 CCCNC(=O)C(C)OCOC ea920ad4796a9f76b3e89eb6836ea086 [0,1,0,0,0,0|3,0,0]=4 1008 B11R0.11 CCCNC(=O)C(O)CCSC a3beb08de3cbe6fb9baa7c248be528b5 [0,1,0,0,0,0|2,0,0]=3 1009 B11R0.11 CCCNC(=O)N(C)CCCO 58a09d4f539ba5d70cd18eb46c2388f4 [0,1,0,0,0,0|3,0,0]=4 1010 B11R0.11 CCCNC(=O)N(C)CCNC 87b3bad66f8094b69803a1fc798514bf [0,1,0,0,0,0|3,0,0]=4 1011 B11R0.11 CCCNC(=O)N(C)CCOC 64977ea40732580a4aabc9e2c841e08d [0,1,0,0,0,0|3,0,0]=4 1012 B11R0.11 CCCNC(=O)N(C)CCSC 924b45ade2590c5cb0810f51f7ad1617 [0,1,0,0,0,0|3,0,0]=4 1013 B11R0.11 CCCNC(C)C(=O)OCCC 39f5bc371d2278f8a0fde19bb4d45c08 [0,1,0,0,0,0|1,0,0]=2 1014 B11R0.11 CCCN[C@@H](C)C(=O)OCCC 6d5e148c7e1793253671fcfe52eb33cb [0,1,0,0,0,0|1,0,0]=2 1015 B11R0.11 CCCOC(=O)C(C)NCC#N 7e75dbf0bba286ea9bd81c54936b0785 [0,1,0,0,0,0|2,0,1]=4 1016 B11R0.11 CCCOC(=O)C(C)NCC=O d6ab8ad16268b5ca78b22731825093e5 [0,1,0,0,0,0|2,0,1]=4 1017 B11R0.11 CCCOC(=O)C(C)NCCBr 0b9ea4a9e488218ec2e6dc88a538cdd3 [0,1,0,0,0,0|2,0,0]=3 1018 B11R0.11 CCCOC(=O)C(C)NCCF 1ae914e3feb01bf2e3ffe5a19dda384b [0,1,0,0,0,0|2,0,0]=3 1019 B11R0.11 CCCOC(=O)C(C)NCCI 4e79b94265aa8f3b3edcb942eacabb0d [0,1,0,0,0,0|2,0,0]=3 1020 B11R0.11 CCCOC(=O)C(C)NCCO 91ccbfc8e5cb072e6ee246e06459d1b0 [0,1,0,0,0,0|2,0,0]=3 1021 B11R0.11 CCCOC(=O)C(C)NCCS 9978260cda7de332f93b05ab762c8f30 [0,1,0,0,0,0|2,0,0]=3 1022 B11R0.11 CCCOC(=O)C(C)NCOC 266365b564c93770ec15d05f4e6b9100 [0,1,0,0,0,0|2,0,0]=3 1023 B11R0.11 CCCOC(=O)C(C)NCSC 1cf3caf1965b7f84cddbca71b0bff9bc [0,1,0,0,0,0|2,0,0]=3 1024 B11R0.11 CCCOC(=O)C(C)OCC#N 6e0a4c063bedda00c4c55fcb1c2919dc [0,1,0,0,0,0|2,0,1]=4 1025 B11R0.11 CCCOC(=O)C(C)OCC=O 79453ff879e76040439857b41b0495ed [0,1,0,0,0,0|2,0,1]=4 1026 B11R0.11 CCCOC(=O)C(C)OCCC e1e6326dfd25a114a204406121cbf89e [0,1,0,0,0,0|1,0,0]=2 1027 B11R0.11 CCCOC(=O)C(C)OCCF 333575422a7830a5335ea45e51441bae [0,1,0,0,0,0|2,0,0]=3 1028 B11R0.11 CCCOC(=O)C(C)OCCS 98d3265664178d1534d5a9f12c599033 [0,1,0,0,0,0|2,0,0]=3 1029 B11R0.11 CCCOC(=O)C(C)OCOC 26f4b52c07df7628dccd84ca7ebe1d51 [0,1,0,0,0,0|2,0,0]=3 1030 B11R0.11 CCCOC(=O)C(C)OCSC 363ed3ac455fda7a0fb44a5ff1ed0a0f [0,1,0,0,0,0|2,0,0]=3 1031 B11R0.11 CCCOC(=O)[C@H](C)NCC#N 74a89a5e720b30101c72b4d4c2185877 [0,1,0,0,0,0|2,0,1]=4 1032 B11R0.11 CCCOC(=O)[C@H](C)NCC=O b758c35633cac36c755c292bb01a3117 [0,1,0,0,0,0|2,0,1]=4 1033 B11R0.11 CCCOC(=O)[C@H](C)NCCF b6619eda23ac0a0641e69fc9b982edec [0,1,0,0,0,0|2,0,0]=3 1034 B11R0.11 CCCOC(=O)[C@H](C)NCCO eeb6009e00560319bb373816f4ba3473 [0,1,0,0,0,0|2,0,0]=3 1035 B11R0.11 CCCOC(=O)[C@H](C)NCCS f2b5f7d79d3bcb85dce24dca5a7df255 [0,1,0,0,0,0|2,0,0]=3 1036 B11R0.11 CCCOC(=O)[C@H](C)NCOC da980b18ad5ee394c91613a93cb1c648 [0,1,0,0,0,0|2,0,0]=3 1037 B11R0.11 CCCOC(=O)[C@H](C)NCSC 1cb5b64e76f652cde5fd87990f13a1b8 [0,1,0,0,0,0|2,0,0]=3 1038 B11R0.11 CCCOC(=O)[C@H](C)OCC#N dd336a88c1480d8dbd0f5a3a0c99a207 [0,1,0,0,0,0|2,0,1]=4 1039 B11R0.11 CCCOC(=O)[C@H](C)OCC=O 8bfa2ccb9e06e4201eaf62109471e899 [0,1,0,0,0,0|2,0,1]=4 1040 B11R0.11 CCCOC(=O)[C@H](C)OCCC 7e33cae870c8912c3eed794ebfa294da [0,1,0,0,0,0|1,0,0]=2 1041 B11R0.11 CCCOC(=O)[C@H](C)OCCF c95e40056efae04b8952d7223d41873b [0,1,0,0,0,0|2,0,0]=3 1042 B11R0.11 CCCOC(=O)[C@H](C)OCCS a6fe470dc226381a167c9216693ceb85 [0,1,0,0,0,0|2,0,0]=3 1043 B11R0.11 CCCOC(=O)[C@H](C)OCOC ef0a852b63fc21b2bd8e5f524e2200a1 [0,1,0,0,0,0|2,0,0]=3 1044 B11R0.11 CCCOC(=O)[C@H](C)OCSC 7b343e088b7c93f2b25a7e444bee981e [0,1,0,0,0,0|2,0,0]=3 1045 B11R0.11 CCCOC(C)C(=O)NCCF d7986605e1a4d27afa15c710fe03b3e4 [0,1,0,0,0,0|3,0,0]=4 1046 B11R0.11 CCCOC(C)C(=O)NCCI 1e84f7dae2811872fa7301d0d610f382 [0,1,0,0,0,0|3,0,0]=4 1047 B11R0.11 CCCOC(C)C(=O)NCCO 9efc0c43a66ed9fdb4f1dd16b2d34539 [0,1,0,0,0,0|3,0,0]=4 1048 B11R0.11 CCCOC(C)C(=O)NCCS 2a7e504acde71f31c3cd887464fce766 [0,1,0,0,0,0|3,0,0]=4 1049 B11R0.11 CSCCC(O)C(=O)NCCBr 7a37b8a8adf496462ac69641d91187e1 [0,1,0,0,0,0|3,0,0]=4 1050 B11R0.11 CSCCC(O)C(=O)NCCF cc65188ca6fd744d47a71dd09c5394ef [0,1,0,0,0,0|3,0,0]=4 1051 B11R0.11 CSCCC(O)C(=O)NCCI 9e24322ce9a6c07036a38b61c7c4498e [0,1,0,0,0,0|3,0,0]=4 1052 B11R0.11 CSCCC(O)C(=O)NCCO 3b6d530082fdd520d77de482d8e84340 [0,1,0,0,0,0|3,0,0]=4 1053 B11R0.11 CSCCC(O)C(=O)NCCS 108cc3cc8487d806db4288494a39844e [0,1,0,0,0,0|3,0,0]=4 1054 B11R0.46 C#CCCCC(=O)NCC(C)C 5c0df4755fc31f2bc8f4c95c59d01c35 [0,1,0,0,0,0|1,0,2]=4 1055 B11R0.46 C#CCCCC(=O)NCC(C)O 01a32301b7fb6db424df29871864c8e2 [0,1,0,0,0,0|1,0,2]=4 1056 B11R0.46 C#CCCCC(=O)NC[C@@H](C)O b68a5e7249b3ca337e19272eb5aed920 [0,1,0,0,0,0|1,0,2]=4 1057 B11R0.46 C#CCCCC(=O)NC[C@H](C)O 4aba9dd516425d2468a57cad1ecbc2a4 [0,1,0,0,0,0|1,0,2]=4 1058 B11R0.46 C=C(Br)CNC(=O)CCCCC 892237aaa8c8d47c74c4ae35215a799f [0,1,0,0,0,0|1,0,2]=4 1059 B11R0.46 C=C(C)CCC(=O)NCCCC faff7cdad66f11b901eb6b2a646c3f27 [0,1,0,0,0,0|2,0,1]=4 1060 B11R0.46 C=C(C)CNC(=O)CCCCC 3b2a207aa10a164b6be1cbe722afd767 [0,1,0,0,0,0|1,0,1]=3 1061 B11R0.46 C=C(C)CNC(=O)CCCCF 7b8146e6a0f611dafeb259d9e281ae6c [0,1,0,0,0,0|2,0,1]=4 1062 B11R0.46 C=C(C)CNC(=O)CCCCO f48cbb486d6da7a7608d41cfcb82bfd7 [0,1,0,0,0,0|2,0,1]=4 1063 B11R0.46 C=C(C)CNC(=O)CCCCS 2cd7a60f58b3fab09c5c557c148191f8 [0,1,0,0,0,0|2,0,1]=4 1064 B11R0.46 C=C(C)CNC(=O)CCCOC 1e84469d24c23ec6b9d1d96ba260b803 [0,1,0,0,0,0|2,0,1]=4 1065 B11R0.46 C=C(C)CNC(=O)CCCSC 3bc5c94bb37d1ac066d544287f2b0f3c [0,1,0,0,0,0|2,0,1]=4 1066 B11R0.46 C=C(C)CNC(=O)CCOCC d48fa6e90b1ca9d7a12460de844ed2c0 [0,1,0,0,0,0|2,0,1]=4 1067 B11R0.46 C=C(C)CNC(=O)CCSCC 47b2af03349b04e03bf0314e04980537 [0,1,0,0,0,0|2,0,1]=4 1068 B11R0.46 C=C(C)CNC(=O)COCCC 26f3741b77cec1ff5f1ce820e0843873 [0,1,0,0,0,0|2,0,1]=4 1069 B11R0.46 C=C(C)CNC(=O)CSCCC 4d89c50c8c8900ebb325ac75b203c01b [0,1,0,0,0,0|2,0,1]=4 1070 B11R0.46 C=C(C)CNC(=O)NCCCC 2a3308f37f044de607ed4afbd29cc354 [0,1,0,0,0,0|2,0,1]=4 1071 B11R0.46 C=C(C)COC(C)CCCCC 5f71ffe34a8da49aa1b10660377a3a7b [0,1,0,0,0,0|1,0,2]=4 1072 B11R0.46 C=C(C)CO[C@@H](C)CCCCC 029736e522b1ff54daf75ccd32dc7b1c [0,1,0,0,0,0|1,0,2]=4 1073 B11R0.46 C=C(C)CO[C@H](C)CCCCC 9a8fd0300f8e5446c2402737d59be034 [0,1,0,0,0,0|1,0,2]=4 1074 B11R0.46 C=CCCCC(=O)NCC(C)C a9135eb8b0ac7ae2950db20f22364f50 [0,1,0,0,0,0|1,0,2]=4 1075 B11R0.46 C=CCCCC(=O)NCC(C)O 16c3fb55da23655eac23701c56769e39 [0,1,0,0,0,0|1,0,2]=4 1076 B11R0.46 C=CCCCC(=O)NC[C@@H](C)O b9f8c7a81031d12eff93cec0573bd0d9 [0,1,0,0,0,0|1,0,2]=4 1077 B11R0.46 C=CCCCC(=O)NC[C@H](C)O db94216dfdba5632b66e93bd491409fd [0,1,0,0,0,0|1,0,2]=4 1078 B11R0.46 CC#CCCC(=O)NCC(C)C 7e6cc1f045bbf5e5bfdd4cdc2bf36c86 [0,1,0,0,0,0|1,0,2]=4 1079 B11R0.46 CC#CCCC(=O)NCC(C)O 9283b281c8e15533d17d92adf6f3848b [0,1,0,0,0,0|1,0,2]=4 1080 B11R0.46 CC#CCCC(=O)NC[C@@H](C)O 1903bb545c705b689d440e46698b4e9d [0,1,0,0,0,0|1,0,2]=4 1081 B11R0.46 CC#CCCC(=O)NC[C@H](C)O 09e56adae117e8c6479f5635f09e33c3 [0,1,0,0,0,0|1,0,2]=4 1082 B11R0.46 CC(=O)CNC(=O)CCCCF 211e312ac924b3100bce37fd5b9f38c4 [0,1,0,0,0,0|2,0,1]=4 1083 B11R0.46 CC(=O)CNC(=O)CCCCO ace72e756d8f2ff81295538279c932f3 [0,1,0,0,0,0|2,0,1]=4 1084 B11R0.46 CC(=O)CNC(=O)CCCCS fe8b0f28deb82f8a2ed05f11faea02fb [0,1,0,0,0,0|2,0,1]=4 1085 B11R0.46 CC(C)CCC(=O)NCCCCl 7e8831652884f404df5d5fdc212fb97d [0,1,0,0,0,0|3,0,0]=4 1086 B11R0.46 CC(C)CCC(=O)NCCCO c89d767fcf2fb894a34762052fdc4d20 [0,1,0,0,0,0|3,0,0]=4 1087 B11R0.46 CC(C)CNC(=O)CCCC#N a75f4137f325c816c297a763a6a0e274 [0,1,0,0,0,0|2,0,1]=4 1088 B11R0.46 CC(C)CNC(=O)CCCC=O ee522579e6e7b554c27692173d3d25a5 [0,1,0,0,0,0|2,0,1]=4 1089 B11R0.46 CC(C)CNC(=O)CCCCF 66d42502e27325f3580cbe21d503f603 [0,1,0,0,0,0|2,0,0]=3 1090 B11R0.46 CC(C)CNC(=O)CCCCO 7268f06137b8d20d2f3b677016afbeb9 [0,1,0,0,0,0|2,0,0]=3 1091 B11R0.46 CC(C)CNC(=O)CCCCS d873bca0787ec76faf2fbcb3e4bbba2a [0,1,0,0,0,0|2,0,0]=3 1092 B11R0.46 CC(C)CNC(=O)CNCCBr da2e539e93710a63bca20278d3f9d12a [0,1,0,0,0,0|3,0,0]=4 1093 B11R0.46 CC(C)CNC(=O)CNCCF 73510d7378f1f73715ab7fc424cf2a0e [0,1,0,0,0,0|3,0,0]=4 1094 B11R0.46 CC(C)CNC(=O)CNCCI 52badb046473512e021f04555873c9f9 [0,1,0,0,0,0|3,0,0]=4 1095 B11R0.46 CC(C)CNC(=O)CNCCO ecd8a1b015885d364dcf4c26ba90f91d [0,1,0,0,0,0|3,0,0]=4 1096 B11R0.46 CC(C)CNC(=O)CNCCS e21ada89864725bc8013578433c87677 [0,1,0,0,0,0|3,0,0]=4 1097 B11R0.46 CC(C)CNC(=O)COCCF 518f6115a4d003976c6b842f86ce036a [0,1,0,0,0,0|3,0,0]=4 1098 B11R0.46 CC(C)CNC(=O)COCCO aeb1435e6c71e591dbcaf4b6b469d81a [0,1,0,0,0,0|3,0,0]=4 1099 B11R0.46 CC(C)CNC(=O)COCCS 43ee90373c6469971c627a66ef09b1f3 [0,1,0,0,0,0|3,0,0]=4 1100 B11R0.46 CC(C)CNC(=O)NCCCN 83e83a472f3e23258fc81aab07e809e4 [0,1,0,0,0,0|3,0,0]=4 1101 B11R0.46 CC(C)CNC(=O)NCCCO ca8088f25e9ca3dba36714997222cbd5 [0,1,0,0,0,0|3,0,0]=4 1102 B11R0.46 CC(O)CCC(=O)NCCCCl 135d1e4b9cf05eb4752068198a164d4d [0,1,0,0,0,0|3,0,0]=4 1103 B11R0.46 CC(O)CCC(=O)NCCCO 875fe685923b509159f6a827124093c7 [0,1,0,0,0,0|3,0,0]=4 1104 B11R0.46 CC(O)CNC(=O)CCCC#N 3ecf220d25a84211dd8dd80d4b7f6022 [0,1,0,0,0,0|2,0,1]=4 1105 B11R0.46 CC(O)CNC(=O)CCCC=O b4c1fc19e5fb62a50a433b22293d0553 [0,1,0,0,0,0|2,0,1]=4 1106 B11R0.46 CC(O)CNC(=O)CCCCF 9b7e78c4d15599d2a8b2ff030e5bbdeb [0,1,0,0,0,0|2,0,0]=3 1107 B11R0.46 CC(O)CNC(=O)CCCCO 833a2aff3bcbe2657c47eb9c97ed952a [0,1,0,0,0,0|2,0,0]=3 1108 B11R0.46 CC(O)CNC(=O)CCCCS 7b37aa830a9870e2bc36c255d7be5b3e [0,1,0,0,0,0|2,0,0]=3 1109 B11R0.46 CC(O)CNC(=O)COCCO 9ecf81d2007ce468b76c925e017b2a51 [0,1,0,0,0,0|3,0,0]=4 1110 B11R0.46 CC(O)CNC(=O)COCCS ba37d67bbec976a2fe0dd06182f7d76b [0,1,0,0,0,0|3,0,0]=4 1111 B11R0.46 CC(O)CNC(=O)NCCCN 35143afe18767a67a74fd1d01b62b092 [0,1,0,0,0,0|3,0,0]=4 1112 B11R0.46 CC(O)CNC(=O)NCCCO d797910051b75d71719768b7bb785425 [0,1,0,0,0,0|3,0,0]=4 1113 B11R0.46 CC(S)CCC(=O)NCCCCl 27108833bc6eff8cd62024e130e29c1f [0,1,0,0,0,0|3,0,0]=4 1114 B11R0.46 CC(S)CCC(=O)NCCCO d104b2823add760c06c2f23f8e176fdb [0,1,0,0,0,0|3,0,0]=4 1115 B11R0.46 CC/C=C/CC(=O)NCC(C)C b96b80593499e704620ca0972549b948 [0,1,0,0,0,0|1,0,2]=4 1116 B11R0.46 CC/C=C/CC(=O)NCC(C)O 35712f914425ba292cb3223f7d51d1e0 [0,1,0,0,0,0|1,0,2]=4 1117 B11R0.46 CC/C=C/CC(=O)NC[C@@H](C)O 96a529d4772fbb8ceb9f564998b61fd9 [0,1,0,0,0,0|1,0,2]=4 1118 B11R0.46 CC/C=C/CC(=O)NC[C@H](C)O aba08103c827aadbf012dcc4974b2e4c [0,1,0,0,0,0|1,0,2]=4 1119 B11R0.46 CC/C=C\CC(=O)NCC(C)C b4b4bef473014801f556dc17c531ed80 [0,1,0,0,0,0|1,0,2]=4 1120 B11R0.46 CC/C=C\CC(=O)NCC(C)O 67b89a73cbe972a6b17fc5cd1cd4adcf [0,1,0,0,0,0|1,0,2]=4 1121 B11R0.46 CC/C=C\CC(=O)NC[C@@H](C)O 23b595361ce720753dea4cb9b0831eea [0,1,0,0,0,0|1,0,2]=4 1122 B11R0.46 CC/C=C\CC(=O)NC[C@H](C)O 7e9f1c43e9c3899c80c25dc2e92fe1e3 [0,1,0,0,0,0|1,0,2]=4 1123 B11R0.46 CC=CCCC(=O)NCC(C)C a7444ecd0d3e98dbe5ee9af055dadeed [0,1,0,0,0,0|1,0,2]=4 1124 B11R0.46 CC=CCCC(=O)NCC(C)O a0c0973f658e1fc76467494ee79ef9ea [0,1,0,0,0,0|1,0,2]=4 1125 B11R0.46 CC=CCCC(=O)NC[C@@H](C)O 3f3b233af5b61b5d285ba12ece8b9716 [0,1,0,0,0,0|1,0,2]=4 1126 B11R0.46 CC=CCCC(=O)NC[C@H](C)O 8ceb42a07a7a82e71f45b1687396a3fa [0,1,0,0,0,0|1,0,2]=4 1127 B11R0.46 CCC/C=C/C(=O)NCC(C)C 119bd56c61c82b87765a45cb5256589e [0,1,0,0,0,0|1,0,2]=4 1128 B11R0.46 CCC/C=C/C(=O)NCC(C)O 105bdeffe9e1fcbc1bce80f74150acc5 [0,1,0,0,0,0|1,0,2]=4 1129 B11R0.46 CCC/C=C/C(=O)NC[C@@H](C)O 69678d05dff99d84b5464be2120f58fb [0,1,0,0,0,0|1,0,2]=4 1130 B11R0.46 CCC/C=C/C(=O)NC[C@H](C)O 20f767e57d88967cb6ecaf774933ebbc [0,1,0,0,0,0|1,0,2]=4 1131 B11R0.46 CCC=CCC(=O)NCC(C)C e8095f6656d929bc4139cfe93e55da04 [0,1,0,0,0,0|1,0,2]=4 1132 B11R0.46 CCC=CCC(=O)NCC(C)O c5cc6898d14becff995dbf27831b955f [0,1,0,0,0,0|1,0,2]=4 1133 B11R0.46 CCC=CCC(=O)NC[C@@H](C)O 5c436d80a318be16f486f2a5fd28cbcd [0,1,0,0,0,0|1,0,2]=4 1134 B11R0.46 CCC=CCC(=O)NC[C@H](C)O 49bb575bf7bcee8ff4e791ceebf4cdb9 [0,1,0,0,0,0|1,0,2]=4 1135 B11R0.46 CCCC#CC(=O)NCC(C)C 31ead05b92c3915f956862d042bc800e [0,1,0,0,0,0|1,0,2]=4 1136 B11R0.46 CCCC#CC(=O)NCC(C)O c0b91f59f9b2135b79a930c0538b14ae [0,1,0,0,0,0|1,0,2]=4 1137 B11R0.46 CCCC#CC(=O)NC[C@@H](C)O f5cbb824f8eb187b16e1b9b2f968ba43 [0,1,0,0,0,0|1,0,2]=4 1138 B11R0.46 CCCC#CC(=O)NC[C@H](C)O 05bc7c5f50f5359462087481e348e3ae [0,1,0,0,0,0|1,0,2]=4 1139 B11R0.46 CCCC=CC(=O)NCC(C)C d1f79b636e085d9662e5d339805de57b [0,1,0,0,0,0|1,0,2]=4 1140 B11R0.46 CCCC=CC(=O)NCC(C)O da80bd9779f760a3deb2b4f59e37f9f9 [0,1,0,0,0,0|1,0,2]=4 1141 B11R0.46 CCCC=CC(=O)NC[C@@H](C)O 598dbea03cf3784e10f66a6019b628d2 [0,1,0,0,0,0|1,0,2]=4 1142 B11R0.46 CCCC=CC(=O)NC[C@H](C)O 86a6998cf46ba2e80ced1b460fb7afef [0,1,0,0,0,0|1,0,2]=4 1143 B11R0.46 CCCCCC(=O)COC(C)C f4a75465bb71332bbe66328ae27f1030 [0,1,0,0,0,0|2,0,0]=3 1144 B11R0.46 CCCCCC(=O)NCC(=O)C af3e7d92608982622598a3f3607f3171 [0,1,0,0,0,0|1,0,1]=3 1145 B11R0.46 CCCCCC(=O)NCC(=O)N 4521510cb11ba808a1551dcba164917e [0,1,0,0,0,0|2,0,1]=4 1146 B11R0.46 CCCCCC(=O)NCC(C)C cc6df7a020818c516a69acc1b1fdb708 [0,1,0,0,0,0|1,0,0]=2 1147 B11R0.46 CCCCCC(=O)NCC(C)O 05f56c5405c5e4ab6efccb9ccc3eb9e2 [0,1,0,0,0,0|1,0,0]=2 1148 B11R0.46 CCCCCC(=O)NCC(F)F 51c26ed8997c9477cb8eeb0f80fc4aff [0,1,0,0,0,0|2,0,0]=3 1149 B11R0.46 CCCCCC(=O)NC[C@@H](C)O 9ce11b18501ba715b77c5295184f797d [0,1,0,0,0,0|1,0,0]=2 1150 B11R0.46 CCCCCC(=O)NC[C@H](C)O 854c0186202639065caeea0f38f58624 [0,1,0,0,0,0|1,0,0]=2 1151 B11R0.46 CCCCCC(C)NCC(C)C 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8aff48d5fcc04ecbea46dfbdf55e8a38 [0,1,0,0,0,0|3,0,0]=4 1241 B11R0.46 COCCNC(=O)NCC(C)O 77fb494a3bd7d294c58954b3615316af [0,1,0,0,0,0|3,0,0]=4 1242 B11R0.46 COCCNC(=O)NC[C@@H](C)O e22389cde1be353fa29ae205f1dd5d69 [0,1,0,0,0,0|3,0,0]=4 1243 B11R0.46 COCCNC(=O)NC[C@H](C)O 8c2abde3a0d9b6e3bb3a608f1fadc390 [0,1,0,0,0,0|3,0,0]=4 1244 B11R0.46 COCOCC(=O)NCC(C)C 68c38013be0c2f62412542b85061bef1 [0,1,0,0,0,0|3,0,0]=4 1245 B11R0.46 CSCCCC(=O)NCC(=O)C 45af4c2ac4549403ecc4c6cde63f6154 [0,1,0,0,0,0|2,0,1]=4 1246 B11R0.46 CSCCCC(=O)NCC(C)C 62605bb9fd08173c0edc81e09cb82c0f [0,1,0,0,0,0|2,0,0]=3 1247 B11R0.46 CSCCCC(=O)NCC(C)O af520165fee5e27cb8ae020041e924e7 [0,1,0,0,0,0|2,0,0]=3 1248 B11R0.46 CSCCCC(=O)NCC(F)F 51a417dd754950990b4ad850a5ce2e7b [0,1,0,0,0,0|3,0,0]=4 1249 B11R0.46 CSCCCC(=O)NC[C@@H](C)O 8b09e4ed55c013f34488ac07d7435111 [0,1,0,0,0,0|2,0,0]=3 1250 B11R0.46 CSCCCC(=O)NC[C@H](C)O 50fbf219545c08ba59e29b4b8a2f214b [0,1,0,0,0,0|2,0,0]=3 1251 B11R0.46 CSCCNC(=O)CCC(C)C 3f3b461e8f7e3086096a45ade9f47f50 [0,1,0,0,0,0|3,0,0]=4 1252 B11R0.46 CSCCNC(=O)CCC(C)O 22569efdcf8fed6811a7e18cd03514ca [0,1,0,0,0,0|3,0,0]=4 1253 B11R0.46 CSCCNC(=O)CCC(C)S 8d85ee02aab42232a16ad2e51adf905a [0,1,0,0,0,0|3,0,0]=4 1254 B11R0.46 CSCCNC(=O)CC[C@H](C)S e95c34ef13b41ef883e0d7f56adddfed [0,1,0,0,0,0|3,0,0]=4 1255 B11R0.46 CSCCNC(=O)NCC(C)C f2874add905dfbf77090612b9bf19a68 [0,1,0,0,0,0|3,0,0]=4 1256 B11R0.46 CSCCNC(=O)NCC(C)O ae9de0d819c04d8ed6e77dfa4f325d32 [0,1,0,0,0,0|3,0,0]=4 1257 B11R0.46 CSCCNC(=O)NC[C@@H](C)O 33d83d987b2f5967fecb13cc11dc21df [0,1,0,0,0,0|3,0,0]=4 1258 B11R0.46 CSCCNC(=O)NC[C@H](C)O 699c0be108f705eafda4acc9af44d129 [0,1,0,0,0,0|3,0,0]=4 1259 B11R0.46 CSSCCC(=O)NCC(C)C 1a38fd69f4fed78cea4f9f411bbc9f09 [0,1,0,0,0,0|3,0,0]=4 1260 B11R0.46 CSSCCC(=O)NCC(C)O 89d0cd3402ea4698e01397d03b67db08 [0,1,0,0,0,0|3,0,0]=4 1261 B11R0.46 CSSCCC(=O)NC[C@@H](C)O ae8c52d1348acce7be2f9a16ca4bf180 [0,1,0,0,0,0|3,0,0]=4 1262 B11R0.46 CSSCCC(=O)NC[C@H](C)O 4bc10e79a7cb21d4245fa68c482e1958 [0,1,0,0,0,0|3,0,0]=4 1263 B11R0.46 C[C@@H](O)CNC(=O)CCCC#N 5d2bae2037f6269c64f9272b818fcea0 [0,1,0,0,0,0|2,0,1]=4 1264 B11R0.46 C[C@@H](O)CNC(=O)CCCC=O a853e9502322b15c1a78da55899ddae1 [0,1,0,0,0,0|2,0,1]=4 1265 B11R0.46 C[C@@H](O)CNC(=O)CCCCF aaf784aff3573b3fe4a7549c4a2f083a [0,1,0,0,0,0|2,0,0]=3 1266 B11R0.46 C[C@@H](O)CNC(=O)CCCCO b37c0277ff6dd083180aef7352279966 [0,1,0,0,0,0|2,0,0]=3 1267 B11R0.46 C[C@@H](O)CNC(=O)CCCCS 9f0c770f4e7a5a60e079aec3a1cc7691 [0,1,0,0,0,0|2,0,0]=3 1268 B11R0.46 C[C@@H](O)CNC(=O)COCCO 7003b341eaa09169a9df39ef04efa586 [0,1,0,0,0,0|3,0,0]=4 1269 B11R0.46 C[C@@H](O)CNC(=O)COCCS 1c158c7b94bf968644b85f2d6f7698a8 [0,1,0,0,0,0|3,0,0]=4 1270 B11R0.46 C[C@@H](O)CNC(=O)NCCCN 2d483ac8df9bb39a0728d5957954642a [0,1,0,0,0,0|3,0,0]=4 1271 B11R0.46 C[C@@H](O)CNC(=O)NCCCO aef52e1092ee867499b844ff9ef1aaa3 [0,1,0,0,0,0|3,0,0]=4 1272 B11R0.46 C[C@H](O)CNC(=O)CCCC#N 5a6743c3024a545e8968afca814fc426 [0,1,0,0,0,0|2,0,1]=4 1273 B11R0.46 C[C@H](O)CNC(=O)CCCC=O f4065c2b416b1684fb49fb91e62e01f8 [0,1,0,0,0,0|2,0,1]=4 1274 B11R0.46 C[C@H](O)CNC(=O)CCCCF 0cd74487e5c8bf513a981fa354c664f7 [0,1,0,0,0,0|2,0,0]=3 1275 B11R0.46 C[C@H](O)CNC(=O)CCCCO d601ef4406b311060894c986ad0553d3 [0,1,0,0,0,0|2,0,0]=3 1276 B11R0.46 C[C@H](O)CNC(=O)CCCCS 20da90708d4a6e8baf22432dba018a89 [0,1,0,0,0,0|2,0,0]=3 1277 B11R0.46 C[C@H](O)CNC(=O)COCCO 0a1c8ce477312571d0a9112fb5133900 [0,1,0,0,0,0|3,0,0]=4 1278 B11R0.46 C[C@H](O)CNC(=O)COCCS d485cde62efbf0e1bc2a22c782827814 [0,1,0,0,0,0|3,0,0]=4 1279 B11R0.46 C[C@H](O)CNC(=O)NCCCN 7862ed66f6a47c54bd0dc01da00a006b [0,1,0,0,0,0|3,0,0]=4 1280 B11R0.46 C[C@H](O)CNC(=O)NCCCO bccb0d227fca9a8a1f0fcd24439beaf8 [0,1,0,0,0,0|3,0,0]=4 1281 B11R0.46 C[C@H](S)CCC(=O)NCCCCl 7e4d1fecc153a49bb2b1aea43242b5aa [0,1,0,0,0,0|3,0,0]=4 1282 B11R0.46 C[C@H](S)CCC(=O)NCCCO 426abde1fcce831b2b9f1c3aee951b06 [0,1,0,0,0,0|3,0,0]=4 1283 B11R0.46 O=C(CCCCF)NCC(F)F 240ad1189a86b556e2155f260258c5fc [0,1,0,0,0,0|3,0,0]=4 1284 B11R0.46 O=C(CCCCO)NCC(F)F 7f36a651363c3d317c66955ec59331cf [0,1,0,0,0,0|3,0,0]=4 1285 B11R0.46 O=C(CCCCS)NCC(F)F b0acff2f2d63aa8bca9ed6a5ff5a0aac [0,1,0,0,0,0|3,0,0]=4 1286 B11R0.70 C#CC(C)NCC(=O)OCCC 5aa2f8dc9be13e7d91fca0681e1e6018 [0,1,0,0,0,0|1,0,2]=4 1287 B11R0.70 C#CC(C)OCC(=O)OCCC c4f12fe4b50dd042a3158d661f1e25a1 [0,1,0,0,0,0|1,0,2]=4 1288 B11R0.70 C#CCNC(=O)CCC(C)CC f56b95fd6dec3d756512471fb33f2acb [0,1,0,0,0,0|1,0,2]=4 1289 B11R0.70 C#C[C@@H](C)NCC(=O)OCCC 4e18094598b851b2cc1e90e4168edfa6 [0,1,0,0,0,0|1,0,2]=4 1290 B11R0.70 C#C[C@@H](C)OCC(=O)OCCC bc46c387ebde446cc50645466c7988ae [0,1,0,0,0,0|1,0,2]=4 1291 B11R0.70 C#C[C@H](C)NCC(=O)OCCC 7a635b2f8a2d3171e1b97870c469d239 [0,1,0,0,0,0|1,0,2]=4 1292 B11R0.70 C#C[C@H](C)OCC(=O)OCCC 12c23266a37109bd631da5c20d24e80e [0,1,0,0,0,0|1,0,2]=4 1293 B11R0.70 C=C(CNC(C)CC)OCOC 4b95111109950f0fab53103c4cbddefd [0,1,0,0,0,0|3,0,0]=4 1294 B11R0.70 C=C(CN[C@@H](C)CC)OCOC 16590dc109b1a6ce1699b8c083b8164c [0,1,0,0,0,0|3,0,0]=4 1295 B11R0.70 C=C(CN[C@H](C)CC)OCOC 9aa5215938d8c73c47b1300f8274a622 [0,1,0,0,0,0|3,0,0]=4 1296 B11R0.70 C=C(COC(C)CC)OCOC d2da35ce765a295ee1009d31dafcfd68 [0,1,0,0,0,0|3,0,0]=4 1297 B11R0.70 C=C(CO[C@@H](C)CC)OCOC c907080d25806e8cbb94a3cda4e4fb70 [0,1,0,0,0,0|3,0,0]=4 1298 B11R0.70 C=C(CO[C@H](C)CC)OCOC 98b0596401c2e5713a81a84f3199c829 [0,1,0,0,0,0|3,0,0]=4 1299 B11R0.70 C=CC(C)NCC(=O)OCCC cd3aaa5b2cc353c01a860c404b47c43a [0,1,0,0,0,0|1,0,2]=4 1300 B11R0.70 C=CC(C)OCC(=O)OCCC 1e2f7d91f6894d8ac5fa370b452409c2 [0,1,0,0,0,0|1,0,2]=4 1301 B11R0.70 C=CCOC(=O)CNC(C)CC 798d824391b6ef9e1e3ffe9611d68467 [0,1,0,0,0,0|1,0,2]=4 1302 B11R0.70 C=CCOC(=O)CN[C@@H](C)CC f8f513429c31695b26e22679d6ff082f [0,1,0,0,0,0|1,0,2]=4 1303 B11R0.70 C=CCOC(=O)CN[C@H](C)CC c411660cc2fa90ce5a6b5fb47adae7c7 [0,1,0,0,0,0|1,0,2]=4 1304 B11R0.70 C=CCOC(=O)COC(C)CC 1e479d00923367169d9641286d1fa451 [0,1,0,0,0,0|1,0,2]=4 1305 B11R0.70 C=CCOC(=O)CO[C@@H](C)CC a48b99e461ec3d4bbb94421243428da4 [0,1,0,0,0,0|1,0,2]=4 1306 B11R0.70 C=CCOC(=O)CO[C@H](C)CC e29f7e96780b900c2d419a97f218dc40 [0,1,0,0,0,0|1,0,2]=4 1307 B11R0.70 C=C[C@H](C)OCC(=O)OCCC a013c2970d7737baaa886f51fba67b4e [0,1,0,0,0,0|1,0,2]=4 1308 B11R0.70 CC/C=C/C(=O)NCC(C)CC f57ae766b2e457d9bb97ee96d1994b2e [0,1,0,0,0,0|2,0,1]=4 1309 B11R0.70 CC/C=C/C(=O)NCC(O)CC 22cb54ba4a9a60dc0d8d71fccc241b06 [0,1,0,0,0,0|2,0,1]=4 1310 B11R0.70 CC/C=C/C(=O)NC[C@@H](C)CC e58846bc5372005fdedfa9b7297266ee [0,1,0,0,0,0|2,0,1]=4 1311 B11R0.70 CC/C=C/C(=O)NC[C@H](O)CC 54f82ef20885547cff6894100bb56fd3 [0,1,0,0,0,0|2,0,1]=4 1312 B11R0.70 CC/C=C\C(=O)NCC(C)CC 34a704ccadfab79685575ecf50f8873a [0,1,0,0,0,0|2,0,1]=4 1313 B11R0.70 CC/C=C\C(=O)NCC(O)CC d6a1380ac6c9fbbdfff2b9c0cbe5146d [0,1,0,0,0,0|2,0,1]=4 1314 B11R0.70 CC/C=C\C(=O)NC[C@@H](C)CC f59af868f49c657f85362d6553a53b4e [0,1,0,0,0,0|2,0,1]=4 1315 B11R0.70 CC/C=C\C(=O)NC[C@H](O)CC a9094f91fd2de7cb5d538a158018fa6d [0,1,0,0,0,0|2,0,1]=4 1316 B11R0.70 CCC#CC(=O)NCC(C)CC c2817e8b7e2f3e840363c9231d8e255d [0,1,0,0,0,0|2,0,1]=4 1317 B11R0.70 CCC#CC(=O)NCC(O)CC 20710765850e1a09e8cde3314e8fb53e [0,1,0,0,0,0|2,0,1]=4 1318 B11R0.70 CCC#CC(=O)NC[C@@H](C)CC db49dea293da28dc18befce0779f1176 [0,1,0,0,0,0|2,0,1]=4 1319 B11R0.70 CCC#CC(=O)NC[C@H](O)CC c6a2bf3800e411a01608b370a562b5c9 [0,1,0,0,0,0|2,0,1]=4 1320 B11R0.70 CCC(=O)CCC(=O)NCCBr 740389e7b31f72ec80a2dc0e7cf700dd [0,1,0,0,0,0|2,0,1]=4 1321 B11R0.70 CCC(=O)CCC(=O)NCCF b819aa9aca11206eac57237015424a0a [0,1,0,0,0,0|2,0,1]=4 1322 B11R0.70 CCC(=O)CCC(=O)NCCI 294daa4b7a88a6fede201dab2980d823 [0,1,0,0,0,0|2,0,1]=4 1323 B11R0.70 CCC(=O)CCC(=O)NCCO eceb1157f6a21305d15c31cc3ea038bb [0,1,0,0,0,0|2,0,1]=4 1324 B11R0.70 CCC(=O)CCC(=O)NCCS 0c8193a9e335db8ca3c967bf5c81d754 [0,1,0,0,0,0|2,0,1]=4 1325 B11R0.70 CCC(C)CCC(=O)NCC#N 3845423c983318a0d8d063419d7035f7 [0,1,0,0,0,0|2,0,1]=4 1326 B11R0.70 CCC(C)CCC(=O)NCCBr 2804852b0cdbe217c390c82240efbc34 [0,1,0,0,0,0|2,0,0]=3 1327 B11R0.70 CCC(C)CCC(=O)NCCF 644ec96d11b4c0d137f1814a889e6ec9 [0,1,0,0,0,0|2,0,0]=3 1328 B11R0.70 CCC(C)CCC(=O)NCCI 0ff5f622985963a48513265e9140d5ed [0,1,0,0,0,0|2,0,0]=3 1329 B11R0.70 CCC(C)CCC(=O)NCCO 9bf08954f8eb014405195fe3e84af31b [0,1,0,0,0,0|2,0,0]=3 1330 B11R0.70 CCC(C)CCC(=O)NCCS 1fb349bdb5fb7a8b5023aaa824d000d4 [0,1,0,0,0,0|2,0,0]=3 1331 B11R0.70 CCC(C)CCC(C)OCCF 0b8e97c9b9f8f78b067a53143d4efb47 [0,1,0,0,0,0|2,0,1]=4 1332 B11R0.70 CCC(C)CCC(C)OCCS 29c9afd555b28431a45f386e68403ec6 [0,1,0,0,0,0|2,0,1]=4 1333 B11R0.70 CCC(C)CCC(C)OCSC 396877d13ef124750489d2f1f6cad137 [0,1,0,0,0,0|2,0,1]=4 1334 B11R0.70 CCC(C)CNC(=O)CCCF bcfa009f61cf334606487bfff8992ca8 [0,1,0,0,0,0|3,0,0]=4 1335 B11R0.70 CCC(C)CNC(=O)CCCS f9a59c91555caab33b0e96e4b5aa0656 [0,1,0,0,0,0|3,0,0]=4 1336 B11R0.70 CCC(C)CNC(=O)CCOC aea617e253d12efea8fad0bc0661a9e9 [0,1,0,0,0,0|3,0,0]=4 1337 B11R0.70 CCC(C)CNC(=O)CCSC 88be8a6f99fdd2f4317e1724a1de067e [0,1,0,0,0,0|3,0,0]=4 1338 B11R0.70 CCC(C)CNC(=O)NCCF 9196579fb41e639112489729172d4f9a [0,1,0,0,0,0|3,0,0]=4 1339 B11R0.70 CCC(C)CNC(=O)NCCN 4742e1c3be2f541dfb86010e94a761c1 [0,1,0,0,0,0|3,0,0]=4 1340 B11R0.70 CCC(C)CNC(=O)NCCO 31b16799063765729da13107f64f68d4 [0,1,0,0,0,0|3,0,0]=4 1341 B11R0.70 CCC(C)CNC(=O)NCCS 0b1767e3af010748bfa5a2461c4bf9d5 [0,1,0,0,0,0|3,0,0]=4 1342 B11R0.70 CCC(C)NCC(=O)CCSC e28120bf97299406864986d99cbef5ac [0,1,0,0,0,0|3,0,0]=4 1343 B11R0.70 CCC(C)NCC(=O)NCCO d7770359c16e79dc5fba3a3e7c83071e [0,1,0,0,0,0|3,0,0]=4 1344 B11R0.70 CCC(C)OCC(=O)CCSC 0e5b0fbf2dd52c7c13e5d7c6e7386ca3 [0,1,0,0,0,0|3,0,0]=4 1345 B11R0.70 CCC(C)OCC(=O)NCCF a333bb58177564c5d216c00925edf9de [0,1,0,0,0,0|3,0,0]=4 1346 B11R0.70 CCC(C)OCC(=O)NCCI 49e9eb5a4f000e06e67bdd2e43d12f46 [0,1,0,0,0,0|3,0,0]=4 1347 B11R0.70 CCC(C)OCC(=O)NCCO 3900e271384ecf4785e39b5a773d10fe [0,1,0,0,0,0|3,0,0]=4 1348 B11R0.70 CCC(C)OCC(=O)NCCS 30ca1ddbf008155cbabcb826512170ef [0,1,0,0,0,0|3,0,0]=4 1349 B11R0.70 CCC(O)CNC(=O)CCCF 03507255771b080d4429daa1f71e13e7 [0,1,0,0,0,0|3,0,0]=4 1350 B11R0.70 CCC(O)CNC(=O)CCCS e5576b592a32f026d63ac71b8d0d5279 [0,1,0,0,0,0|3,0,0]=4 1351 B11R0.70 CCC(O)CNC(=O)CCOC 94e1d606c3a82947531c8b09e69fd55d [0,1,0,0,0,0|3,0,0]=4 1352 B11R0.70 CCC(O)CNC(=O)CCSC 987f1369a57a07f98012a4dd1dc460ea [0,1,0,0,0,0|3,0,0]=4 1353 B11R0.70 CCC(O)CNC(=O)NCCF 73ee38c5a8acfeab0487305edea1af87 [0,1,0,0,0,0|3,0,0]=4 1354 B11R0.70 CCC(O)CNC(=O)NCCN 2cba936f389091e46c53252d25fca07c [0,1,0,0,0,0|3,0,0]=4 1355 B11R0.70 CCC(O)CNC(=O)NCCO 716f177d79b4e6f1fc4c8efbb7968caf [0,1,0,0,0,0|3,0,0]=4 1356 B11R0.70 CCC(O)CNC(=O)NCCS 94996264c50e9539c683e706ad036bf5 [0,1,0,0,0,0|3,0,0]=4 1357 B11R0.70 CCC=CC(=O)NCC(C)CC 87e50201f8763d1b36137cd2d5fa5e4e [0,1,0,0,0,0|2,0,1]=4 1358 B11R0.70 CCC=CC(=O)NCC(O)CC 89aa8dac556e7c62563b22c088310137 [0,1,0,0,0,0|2,0,1]=4 1359 B11R0.70 CCC=CC(=O)NC[C@@H](C)CC ea72af06410aec4f399a0f3895a968a5 [0,1,0,0,0,0|2,0,1]=4 1360 B11R0.70 CCC=CC(=O)NC[C@H](O)CC b1af1ba9a1dbc513c9e968a8ca4a071b [0,1,0,0,0,0|2,0,1]=4 1361 B11R0.70 CCCCC(=O)NCC(Br)CBr f2b6202a80431620a4ff9a9aed2f48df [0,1,0,0,0,0|3,0,0]=4 1362 B11R0.70 CCCCC(=O)NCC(C)CC 99f68098368170419d4b26874c9c0ea8 [0,1,0,0,0,0|2,0,0]=3 1363 B11R0.70 CCCCC(=O)NCC(C)CO f7d72011eae240a7e0fec8e32e9a06c0 [0,1,0,0,0,0|3,0,0]=4 1364 B11R0.70 CCCCC(=O)NCC(F)CO 81dea4ea3eb58c7f83ba07b14257b817 [0,1,0,0,0,0|3,0,0]=4 1365 B11R0.70 CCCCC(=O)NCC(O)CC 0ef1ba2a8e93fe275e31ff937b4c456e [0,1,0,0,0,0|2,0,0]=3 1366 B11R0.70 CCCCC(=O)NCC(O)CO f5af1a95975d47d039c2524a0a229d52 [0,1,0,0,0,0|3,0,0]=4 1367 B11R0.70 CCCCC(=O)NC[C@@H](C)CC 1535d54c1236f13f9b7c923c52ddbb50 [0,1,0,0,0,0|2,0,0]=3 1368 B11R0.70 CCCCC(=O)NC[C@@H](C)OC 7da86fbdbe3574cdf1b38dc0b82c2717 [0,1,0,0,0,0|3,0,0]=4 1369 B11R0.70 CCCCC(=O)NC[C@@H](F)CO d105202f365f410729eeadb1a86d8526 [0,1,0,0,0,0|3,0,0]=4 1370 B11R0.70 CCCCC(=O)NC[C@@H](O)CO fac5813a4c89b20e7c5bcc4b6c6aae3e [0,1,0,0,0,0|3,0,0]=4 1371 B11R0.70 CCCCC(=O)NC[C@H](C)CO c91887c0bf273f093b324149911d8261 [0,1,0,0,0,0|3,0,0]=4 1372 B11R0.70 CCCCC(=O)NC[C@H](C)OC 6bba4709defe21cf4722987e1e341b20 [0,1,0,0,0,0|3,0,0]=4 1373 B11R0.70 CCCCC(=O)NC[C@H](F)CO 6087851012d058bffffb9d511519702c [0,1,0,0,0,0|3,0,0]=4 1374 B11R0.70 CCCCC(=O)NC[C@H](O)CC ba14b0808244f4fa9a5429817d69c048 [0,1,0,0,0,0|2,0,0]=3 1375 B11R0.70 CCCCC(=O)NC[C@H](O)CO f51472800a54c23a0596ed78f01a4342 [0,1,0,0,0,0|3,0,0]=4 1376 B11R0.70 CCCCC(=O)OCN(C)CC 8f35c305ea2080aba04fca0215a3d614 [0,1,0,0,0,0|3,0,0]=4 1377 B11R0.70 CCCCN(C)CCC(C)CC 8dba757cad7dd4d7aa50f64d01a6b693 [0,1,0,0,0,0|3,0,0]=4 1378 B11R0.70 CCCNC(=O)C/C=C(\C)/CC 0a115048044ba4095ede90ef278da611 [0,1,0,0,0,0|1,0,2]=4 1379 B11R0.70 CCCNC(=O)CC=C(C)CC 620da99a43a34ec15a18b627f06ef174 [0,1,0,0,0,0|1,0,2]=4 1380 B11R0.70 CCCNC(=O)CCC(=O)CC 7fded08e2f1cc2bde0c3de3ad8501609 [0,1,0,0,0,0|1,0,1]=3 1381 B11R0.70 CCCNC(=O)CCC(=O)NC 90ff864182d7ab72111625d9f491ab04 [0,1,0,0,0,0|2,0,1]=4 1382 B11R0.70 CCCNC(=O)CCC(=O)OC 0f91cc319eb7044065dbfb4b9ca7a263 [0,1,0,0,0,0|2,0,1]=4 1383 B11R0.70 CCCNC(=O)CCC(C)CC cd72b1d8efec351864d4a1ddfe235b8b [0,1,0,0,0,0|1,0,0]=2 1384 B11R0.70 CCCNC(=O)CCN(C)CC afefd588d03346edd102e170c79955d0 [0,1,0,0,0,0|2,0,0]=3 1385 B11R0.70 CCCNC(=O)CCS(=O)CC 2e4cc78873d3835c4a91635bb30a4ed3 [0,1,0,0,0,0|2,0,0]=3 1386 B11R0.70 CCCNC(=O)CNC(=O)CC ded9d41bc32bec44747785630849d2b7 [0,1,0,0,0,0|2,0,1]=4 1387 B11R0.70 CCCNC(=O)CNC(C)CC 71159b721478811628b260da6fa9b0ce [0,1,0,0,0,0|2,0,0]=3 1388 B11R0.70 CCCNC(=O)CNC(C)CO 97cd4e49200e185f371ca9bf978f7c9c [0,1,0,0,0,0|3,0,0]=4 1389 B11R0.70 CCCNC(=O)CN[C@@H](C)CC 32485164f7b8ac242753df5576eeb5c3 [0,1,0,0,0,0|2,0,0]=3 1390 B11R0.70 CCCNC(=O)CN[C@@H](C)CO e580623fed40021b3bef2132f9e6bdf3 [0,1,0,0,0,0|3,0,0]=4 1391 B11R0.70 CCCNC(=O)CN[C@H](C)CC 9590a52e018cc3805bafe9d5add97bb8 [0,1,0,0,0,0|2,0,0]=3 1392 B11R0.70 CCCNC(=O)CN[C@H](C)CO f5c21a584d0789aa301f6068fff83813 [0,1,0,0,0,0|3,0,0]=4 1393 B11R0.70 CCCNC(=O)COC(C)CC c0998bc9facb8d422c5ce10a4b3e09fd [0,1,0,0,0,0|2,0,0]=3 1394 B11R0.70 CCCNC(=O)COC(C)CF 4b33c4c991c6b2bf710e0ddf1871b470 [0,1,0,0,0,0|3,0,0]=4 1395 B11R0.70 CCCNC(=O)COC(C)CS 463bc9c40fe829a3eb80b6682951559e [0,1,0,0,0,0|3,0,0]=4 1396 B11R0.70 CCCNC(=O)CO[C@@H](C)CC bbb4c8c6a62c2e74d38c6b0bb246a4f2 [0,1,0,0,0,0|2,0,0]=3 1397 B11R0.70 CCCNC(=O)CO[C@H](C)CC 9c55bfcf568d939e039996f402807ff1 [0,1,0,0,0,0|2,0,0]=3 1398 B11R0.70 CCCNC(=O)CO[C@H](C)CS bc634c9c3f4aa36036f0207232dc8e91 [0,1,0,0,0,0|3,0,0]=4 1399 B11R0.70 CCCNC(=O)NCC(C)CC 9b7a53668156340d91c2d4243e8197a5 [0,1,0,0,0,0|2,0,0]=3 1400 B11R0.70 CCCNC(=O)NCC(C)CN 6c6ef4b4eb659c2caa6017f82a0db5f2 [0,1,0,0,0,0|3,0,0]=4 1401 B11R0.70 CCCNC(=O)NCC(C)CO 0b7ddc442d47d1ea9717c63df2468004 [0,1,0,0,0,0|3,0,0]=4 1402 B11R0.70 CCCNC(=O)NCC(F)CO e7a3bea8451e830b2c18a9b9343ad949 [0,1,0,0,0,0|3,0,0]=4 1403 B11R0.70 CCCNC(=O)NCC(O)CC 1611b07f0963a1690093fa5be3a2980b [0,1,0,0,0,0|2,0,0]=3 1404 B11R0.70 CCCNC(=O)NCC(O)CN 100f5ebd02ede3775ea1c0f8194b943f [0,1,0,0,0,0|3,0,0]=4 1405 B11R0.70 CCCNC(=O)NCC(O)CO c8298c4a97876a957f7ad3ccbaf15861 [0,1,0,0,0,0|3,0,0]=4 1406 B11R0.70 CCCNC(=O)NC[C@@H](C)CC af77859152ccee251f6e1d98dd7d22e6 [0,1,0,0,0,0|2,0,0]=3 1407 B11R0.70 CCCNC(=O)NC[C@@H](C)OC 07a07d97b94b631024773108cfdc9c86 [0,1,0,0,0,0|3,0,0]=4 1408 B11R0.70 CCCNC(=O)NC[C@@H](F)CO 7cd99bbc066118ebf51dbc1b622209dd [0,1,0,0,0,0|3,0,0]=4 1409 B11R0.70 CCCNC(=O)NC[C@@H](O)CO 73f09f897a94ddc2ff0d4b7299f3fa13 [0,1,0,0,0,0|3,0,0]=4 1410 B11R0.70 CCCNC(=O)NC[C@H](C)CO 71a91d7ebab80951b805251b44cca3ec [0,1,0,0,0,0|3,0,0]=4 1411 B11R0.70 CCCNC(=O)NC[C@H](C)OC 07759a0f7fdbec600517267d7d559d3e [0,1,0,0,0,0|3,0,0]=4 1412 B11R0.70 CCCNC(=O)NC[C@H](F)CO 0891de321ba879cf5348df8dd6567a6a [0,1,0,0,0,0|3,0,0]=4 1413 B11R0.70 CCCNC(=O)NC[C@H](O)CC a12700826204326f09042fc103b28ffa [0,1,0,0,0,0|2,0,0]=3 1414 B11R0.70 CCCNC(=O)NC[C@H](O)CO f27f3f58a74480909d005431a09cad16 [0,1,0,0,0,0|3,0,0]=4 1415 B11R0.70 CCCNC(=S)NCC(C)CC 9e365428275876d7340f7059ecbda44f [0,1,0,0,0,0|2,1,0]=4 1416 B11R0.70 CCCNC(=S)NCC(O)CC f29ffc9e10a4e2afc33efbe1bd084e1c [0,1,0,0,0,0|2,1,0]=4 1417 B11R0.70 CCCNC(=S)NC[C@@H](C)CC 9b01065bf403cbf601a82df2db7baf9a [0,1,0,0,0,0|2,1,0]=4 1418 B11R0.70 CCCNC(=S)NC[C@H](O)CC f59cef255393e9a3bc403e29759afd9c [0,1,0,0,0,0|2,1,0]=4 1419 B11R0.70 CCCOC(=O)CNC(C)C#N df4f08b72d4b0aacb4e4bb024f8449ca [0,1,0,0,0,0|2,0,1]=4 1420 B11R0.70 CCCOC(=O)CNC(C)CC 7afdc6c457db97d8cd0bfe42a012327f [0,1,0,0,0,0|1,0,0]=2 1421 B11R0.70 CCCOC(=O)CNC(C)CO 8c5e819acf63f14cd0bbe47f6aa61d06 [0,1,0,0,0,0|2,0,0]=3 1422 B11R0.70 CCCOC(=O)CN[C@@H](C)CC 0bc88cd60dd26bc95c86df78dde6dc28 [0,1,0,0,0,0|1,0,0]=2 1423 B11R0.70 CCCOC(=O)CN[C@@H](C)CO f38ec7345639378cca99b779b0b123ba [0,1,0,0,0,0|2,0,0]=3 1424 B11R0.70 CCCOC(=O)CN[C@H](C)CC 4a7a9c41f1f7f5c935b08385aa5665da [0,1,0,0,0,0|1,0,0]=2 1425 B11R0.70 CCCOC(=O)CN[C@H](C)CO 8af69ab8f79cf73e837a357c4c2a40ae [0,1,0,0,0,0|2,0,0]=3 1426 B11R0.70 CCCOC(=O)COC(C)C=O e61b2c1037e2d322f67a63e8999c004c [0,1,0,0,0,0|2,0,1]=4 1427 B11R0.70 CCCOC(=O)COC(C)CC 6a1d10e08ed2aa28b1bffcbdb5b7f33a [0,1,0,0,0,0|1,0,0]=2 1428 B11R0.70 CCCOC(=O)COC(C)CF d89c1fa2fcf3b22586d16ae6837c730d [0,1,0,0,0,0|2,0,0]=3 1429 B11R0.70 CCCOC(=O)COC(C)CS e6f49967ab81939d81cf28c4822122c0 [0,1,0,0,0,0|2,0,0]=3 1430 B11R0.70 CCCOC(=O)CO[C@@H](C)CC 21ac632d2ccc24d03ca372883db9b5e7 [0,1,0,0,0,0|1,0,0]=2 1431 B11R0.70 CCCOC(=O)CO[C@H](C)CC 8866172f93adb44f59ed980e87f50238 [0,1,0,0,0,0|1,0,0]=2 1432 B11R0.70 CCCOC(=O)CO[C@H](C)CS 52875b94ec7d53c04eba6d95f0f741d5 [0,1,0,0,0,0|2,0,0]=3 1433 B11R0.70 CCCOC(=O)OCN(C)CC 73095f8b9cf25b807e24139a42760ae9 [0,1,0,0,0,0|2,0,0]=3 1434 B11R0.70 CCCOC(C)CCC(C)CC a7023d562249ef1cdafd19d571df9a05 [0,1,0,0,0,0|1,0,1]=3 1435 B11R0.70 CCN(C)CCC(=O)NCCBr ae0f6b42e11b862a9ed67cbacc073448 [0,1,0,0,0,0|3,0,0]=4 1436 B11R0.70 CCN(C)CCC(=O)NCCF 63f9645a95040eac2a15bb2e1b3a5d03 [0,1,0,0,0,0|3,0,0]=4 1437 B11R0.70 CCN(C)CCC(=O)NCCI 55e9e61aac0b290c9bd1a04cc0f41fc9 [0,1,0,0,0,0|3,0,0]=4 1438 B11R0.70 CCN(C)CCC(=O)NCCO 8f18630d6c05a7575387fae0e0e9f94c [0,1,0,0,0,0|3,0,0]=4 1439 B11R0.70 CCN(C)CCC(=O)NCCS 86808b583f84f404b4bdcb819620733b [0,1,0,0,0,0|3,0,0]=4 1440 B11R0.70 CCOCC(=O)NCC(C)CC ad9ceab67b05f0954fce0e4c1039b323 [0,1,0,0,0,0|3,0,0]=4 1441 B11R0.70 CCOCC(=O)NCC(O)CC 58cfd6aef080eec2eb9b2bb974373b65 [0,1,0,0,0,0|3,0,0]=4 1442 B11R0.70 CCOCC(=O)NC[C@@H](C)CC f5dfbe460488e6b7333ddf84b81cf35f [0,1,0,0,0,0|3,0,0]=4 1443 B11R0.70 CCOCC(=O)NC[C@H](O)CC a0d7b4fdf1bedd8bc2b572fcfe7dcfe4 [0,1,0,0,0,0|3,0,0]=4 1444 B11R0.70 CCS(=O)CCC(=O)NCCBr c529dabdf061c4b59b35cf9eb4e98b77 [0,1,0,0,0,0|3,0,0]=4 1445 B11R0.70 CCS(=O)CCC(=O)NCCF 938426c1154b961e62186a3b172ac903 [0,1,0,0,0,0|3,0,0]=4 1446 B11R0.70 CCS(=O)CCC(=O)NCCI 76effa30af074c96a0f0c00c0dd8f82f [0,1,0,0,0,0|3,0,0]=4 1447 B11R0.70 CCS(=O)CCC(=O)NCCO 55ecb48b024e59bcbd9c33c7bf17fad7 [0,1,0,0,0,0|3,0,0]=4 1448 B11R0.70 CCS(=O)CCC(=O)NCCS c4220a3e4c6a6212431f3dcf4830d9b8 [0,1,0,0,0,0|3,0,0]=4 1449 B11R0.70 CCSCC(=O)NCC(C)CC 004e3bee594fe24b6e5af015e09c4028 [0,1,0,0,0,0|3,0,0]=4 1450 B11R0.70 CCSCC(=O)NCC(O)CC 527dae253b51b2e8364b4fa7f25b78e9 [0,1,0,0,0,0|3,0,0]=4 1451 B11R0.70 CCSCC(=O)NC[C@@H](C)CC e55b8fc38f4655d75a123c9d18bea409 [0,1,0,0,0,0|3,0,0]=4 1452 B11R0.70 CCSCC(=O)NC[C@H](O)CC ff3ee1c91bfe8d39f7054ee7e82967e4 [0,1,0,0,0,0|3,0,0]=4 1453 B11R0.70 CC[C@@H](C)NCC(=O)CCSC 035a0c98aef64818de5330ea227f7a64 [0,1,0,0,0,0|3,0,0]=4 1454 B11R0.70 CC[C@@H](C)OCC(=O)CCSC 46ea406a1ab98c8b72bd694b514e39e5 [0,1,0,0,0,0|3,0,0]=4 1455 B11R0.70 CC[C@@H](O)CNC(=O)CCCF 1cf24fe9e2ddec2c59b0125e5236d1f9 [0,1,0,0,0,0|3,0,0]=4 1456 B11R0.70 CC[C@@H](O)CNC(=O)CCCS 1bdb70887f61fbc49d0ba8862a658fc1 [0,1,0,0,0,0|3,0,0]=4 1457 B11R0.70 CC[C@@H](O)CNC(=O)CCOC 488f0c78b11710d637c246d4ce128e9c [0,1,0,0,0,0|3,0,0]=4 1458 B11R0.70 CC[C@@H](O)CNC(=O)CCSC fe614b0579593e66f97d47bff6a41a0f [0,1,0,0,0,0|3,0,0]=4 1459 B11R0.70 CC[C@@H](O)CNC(=O)NCCF 1df756ea5db1df9837c6441465a4b914 [0,1,0,0,0,0|3,0,0]=4 1460 B11R0.70 CC[C@@H](O)CNC(=O)NCCN 44ace8ddd87de6376e81d78c1a9ab39b [0,1,0,0,0,0|3,0,0]=4 1461 B11R0.70 CC[C@@H](O)CNC(=O)NCCO 3140ffd0ce8a4a4bc5b2ac38ced10919 [0,1,0,0,0,0|3,0,0]=4 1462 B11R0.70 CC[C@@H](O)CNC(=O)NCCS a5b2eb81b284b64ffe69ca188c158ec3 [0,1,0,0,0,0|3,0,0]=4 1463 B11R0.70 CC[C@H](C)CNC(=O)CCCF 4d19d20a019e856e579abe3e336117a6 [0,1,0,0,0,0|3,0,0]=4 1464 B11R0.70 CC[C@H](C)CNC(=O)CCCS 33144b49a3084cfaf70b721de3af0c6f [0,1,0,0,0,0|3,0,0]=4 1465 B11R0.70 CC[C@H](C)CNC(=O)CCOC afe58b686ea4b976d54e71d85ec2586e [0,1,0,0,0,0|3,0,0]=4 1466 B11R0.70 CC[C@H](C)CNC(=O)CCSC ce84940c133644886e9abed17293869c [0,1,0,0,0,0|3,0,0]=4 1467 B11R0.70 CC[C@H](C)CNC(=O)NCCF 1bd331c05d1f4f016636c58f756f1b72 [0,1,0,0,0,0|3,0,0]=4 1468 B11R0.70 CC[C@H](C)CNC(=O)NCCN 33d425ce3ae8950bd327db79578495ae [0,1,0,0,0,0|3,0,0]=4 1469 B11R0.70 CC[C@H](C)CNC(=O)NCCO 10254c2559d127deb51c4a979c18e22b [0,1,0,0,0,0|3,0,0]=4 1470 B11R0.70 CC[C@H](C)CNC(=O)NCCS 8f3c10a806cd3f5143c7cb8ff81e25b1 [0,1,0,0,0,0|3,0,0]=4 1471 B11R0.70 CC[C@H](C)NCC(=O)CCSC 2ab07acb9c307469ef620aa44309cd20 [0,1,0,0,0,0|3,0,0]=4 1472 B11R0.70 CC[C@H](C)OCC(=O)CCSC 64a572effa5ee7bf4e6fd188b0e85882 [0,1,0,0,0,0|3,0,0]=4 1473 B11R0.81 C#CCCC(=O)CCOCCC 9ec7f839be61337badc09eda437d48c5 [0,1,0,0,0,0|1,0,2]=4 1474 B11R0.81 C#CCCC(=O)NCCCCC 3121f7ea77c076ecb80d6df1e79199cc [0,1,0,0,0,0|1,0,2]=4 1475 B11R0.81 C#CCCCCC(=O)NCCBr e512d391c96846ecb6e7acdc824ff153 [0,1,0,0,0,0|2,0,1]=4 1476 B11R0.81 C#CCCCCC(=O)NCCC 1dbb73605814c967193cad0f336bd06c [0,1,0,0,0,0|1,0,1]=3 1477 B11R0.81 C#CCCCCC(=O)NCCF 5643185022ccf6c06ae4733e535ecb85 [0,1,0,0,0,0|2,0,1]=4 1478 B11R0.81 C#CCCCCC(=O)NCCI eece6dffb30f9a2611c5e1d9fd60d3f3 [0,1,0,0,0,0|2,0,1]=4 1479 B11R0.81 C#CCCCCC(=O)NCCO 975583c8521fc4f08e9ae9754b960b17 [0,1,0,0,0,0|2,0,1]=4 1480 B11R0.81 C#CCCCCC(=O)NCCS c06434cbe65a18ea2fc0f1b17eba99b9 [0,1,0,0,0,0|2,0,1]=4 1481 B11R0.81 C#CCCCNC(=O)CCCC d5613b824f681dd997bc574ba6a982ed [0,1,0,0,0,0|1,0,2]=4 1482 B11R0.81 C#CCCCNC(=O)NCCC 55d36049030e32965e12995420865f31 [0,1,0,0,0,0|1,0,2]=4 1483 B11R0.81 C#CCCNCC(=O)NCCC fa264e6e8171444acd489bb77d757cfb [0,1,0,0,0,0|1,0,2]=4 1484 B11R0.81 C#CCCNCC(=O)OCCC 16a8142f7132d9fa696cd3e82f6168a4 [0,1,0,0,0,0|0,0,2]=3 1485 B11R0.81 C#CCCOCC(=O)NCCC 80468ad5ecb1caa6f006545e2d059d2c [0,1,0,0,0,0|1,0,2]=4 1486 B11R0.81 C#CCCOCC(=O)OCCC 7a298ac1e6282b8e81ad9d5f2af3aea6 [0,1,0,0,0,0|0,0,2]=3 1487 B11R0.81 C#CCNC(=O)CCCCCC b4ba5df459510b38869c766023edf1d3 [0,1,0,0,0,0|1,0,2]=4 1488 B11R0.81 C#CCNC(=O)CCCCCF bfd17ba5b247b3556d360bc0434be69f [0,1,0,0,0,0|1,0,2]=4 1489 B11R0.81 C#CCNC(=O)CCCCCO 23cf184460b18101b9ec19dd66af072b [0,1,0,0,0,0|1,0,2]=4 1490 B11R0.81 C#CCNC(=O)CCCCCS 9faedbc6aa8359da61464354f457d367 [0,1,0,0,0,0|1,0,2]=4 1491 B11R0.81 C#CCNC(=O)CCOCCC 27596b161dc19ef42c910046e4e7ff23 [0,1,0,0,0,0|1,0,2]=4 1492 B11R0.81 C#CCNC(=O)CNCCCC 6795fb42c314c2aaa5800aeaf3989035 [0,1,0,0,0,0|1,0,2]=4 1493 B11R0.81 C#CCNC(=O)COCCCC eb55d19d9659e5a5e8e19114460a1df0 [0,1,0,0,0,0|1,0,2]=4 1494 B11R0.81 C#CCNC(=O)CSCCCC 31f7eaef8d61322e3a238a9e1a63bb54 [0,1,0,0,0,0|1,0,2]=4 1495 B11R0.81 C#CCNC(=O)NCCCCC 03f47746d6d18d530fa1da70fc197490 [0,1,0,0,0,0|1,0,2]=4 1496 B11R0.81 C#CCNCOC(=O)OCCC 25dfce82077eb373177f51c3c5c09dab [0,1,0,0,0,0|1,0,2]=4 1497 B11R0.81 C#CCOCCC(=O)NCCC e2c38d3b52c837fa0e63081948ac2f2c [0,1,0,0,0,0|1,0,2]=4 1498 B11R0.81 C#CCOCCC(=O)OCCC 21a91e95643020f9b57597a202f8c23c [0,1,0,0,0,0|0,0,2]=3 1499 B11R0.81 C#CCOCOC(=O)OCCC 4f72a52bb1b48638dc7e880418409a3f [0,1,0,0,0,0|1,0,2]=4 1500 B11R0.81 C/C=C/CC(=O)NCCCCC 774328c90bf0e133b0d7bc3d5e34ebd5 [0,1,0,0,0,0|1,0,2]=4 1501 B11R0.81 C/C=C/CCCC(=O)NCCBr 3d68366afaf50874cd1e42173ab1d64c [0,1,0,0,0,0|2,0,1]=4 1502 B11R0.81 C/C=C/CCCC(=O)NCCC 320cd7ca372be81d7dd0b97c4069ce50 [0,1,0,0,0,0|1,0,1]=3 1503 B11R0.81 C/C=C/CCCC(=O)NCCF 49616904daac32934a54b1d06249e20d [0,1,0,0,0,0|2,0,1]=4 1504 B11R0.81 C/C=C/CCCC(=O)NCCI 0140a75d36510a68019392e5948384dd [0,1,0,0,0,0|2,0,1]=4 1505 B11R0.81 C/C=C/CCCC(=O)NCCO ee0d5d0d30a7a14d1f37d68caccbf7f9 [0,1,0,0,0,0|2,0,1]=4 1506 B11R0.81 C/C=C/CCCC(=O)NCCS 662dee10f1de41884d43a19ca1c0d001 [0,1,0,0,0,0|2,0,1]=4 1507 B11R0.81 C/C=C/CNCC(=O)NCCC 750b2045302869c52b8c5167974632e0 [0,1,0,0,0,0|1,0,2]=4 1508 B11R0.81 C/C=C/COCC(=O)NCCC 56ef844870fd0d49a91ad24bb67c2ae0 [0,1,0,0,0,0|1,0,2]=4 1509 B11R0.81 C/C=C/COCC(=O)OCCC fc9ddd92128015db65856ff7285f202d [0,1,0,0,0,0|0,0,2]=3 1510 B11R0.81 C/C=C\CNCC(=O)NCCC 5f30a8efa0db6abd9031888607c6eb08 [0,1,0,0,0,0|1,0,2]=4 1511 B11R0.81 C/C=C\COCC(=O)NCCC 6a8f69bdada74004404a364a1bdf613b [0,1,0,0,0,0|1,0,2]=4 1512 B11R0.81 C/C=C\COCC(=O)OCCC 663c40ab73f619bda2c225171df1ee74 [0,1,0,0,0,0|0,0,2]=3 1513 B11R0.81 C=C(CNCCCC)OCOC c604ac2c9dad96b8cee40842d4a661e6 [0,1,0,0,0,0|2,0,0]=3 1514 B11R0.81 C=C(CNCCCCl)OCOC 4d03424969945d2c699f17caaf1aa922 [0,1,0,0,0,0|3,0,0]=4 1515 B11R0.81 C=C(CNCCCO)OCOC ab6b3e02dd744724ccf190d6e1ae8a9a [0,1,0,0,0,0|3,0,0]=4 1516 B11R0.81 C=C(CNCCOC)OCOC afd8e85e6b23a6545b7b205bd7a1aa8c [0,1,0,0,0,0|3,0,0]=4 1517 B11R0.81 C=C(CNCCSC)OCOC 0ab55182503662358572161f057affcd [0,1,0,0,0,0|3,0,0]=4 1518 B11R0.81 C=C(COCCCC)OCOC cea1071227f1d3c93a41108626e5a566 [0,1,0,0,0,0|2,0,0]=3 1519 B11R0.81 C=C(COCCCF)OCOC 6dd9c347490221b922459b8ee939caf9 [0,1,0,0,0,0|3,0,0]=4 1520 B11R0.81 C=C(COCCCS)OCOC f280b1ce68ffbb56f8af232a7d412ac6 [0,1,0,0,0,0|3,0,0]=4 1521 B11R0.81 C=C(COCCOC)OCOC 5c393cdec343ddadd05acf6674d2ffb9 [0,1,0,0,0,0|3,0,0]=4 1522 B11R0.81 C=C(COCCSC)OCOC 4eaa6518f56f688c18817ba12162b535 [0,1,0,0,0,0|3,0,0]=4 1523 B11R0.81 C=CCCC(=O)NCCCCC 8331c8a4efa9f058d9d4ef6f4946e414 [0,1,0,0,0,0|1,0,2]=4 1524 B11R0.81 C=CCCCCC(=O)NCCBr c8326f60a521da300b904020032aad0f [0,1,0,0,0,0|2,0,1]=4 1525 B11R0.81 C=CCCCCC(=O)NCCC 28a0bb638f79250ce6f15a0997bbd7ad [0,1,0,0,0,0|1,0,1]=3 1526 B11R0.81 C=CCCCCC(=O)NCCF db68d25480d3a354b3d96ce06651ef52 [0,1,0,0,0,0|2,0,1]=4 1527 B11R0.81 C=CCCCCC(=O)NCCI 12162b3c7cd975ee7bb37c841df7d1f2 [0,1,0,0,0,0|2,0,1]=4 1528 B11R0.81 C=CCCCCC(=O)NCCO bcb6ec5f4f2c9b2c83bdacb4306aebb1 [0,1,0,0,0,0|2,0,1]=4 1529 B11R0.81 C=CCCCCC(=O)NCCS 6e6c22ca5bd11d8a1667f8a2df424db7 [0,1,0,0,0,0|2,0,1]=4 1530 B11R0.81 C=CCCCCC(C)OCCC af50d0d93040d589e0b82f51022e7cd2 [0,1,0,0,0,0|1,0,2]=4 1531 B11R0.81 C=CCCCC[C@@H](C)OCCC 5ad14abe1632940a453b7cc60373a5b1 [0,1,0,0,0,0|1,0,2]=4 1532 B11R0.81 C=CCCCNC(=O)CCCC 8e95d6f6c8d2bd1d97d3691b7880b49e [0,1,0,0,0,0|1,0,2]=4 1533 B11R0.81 C=CCCCNC(=O)NCCC 05d9568f66fe8865babda8532fe09651 [0,1,0,0,0,0|1,0,2]=4 1534 B11R0.81 C=CCCNCC(=O)NCCC 51c982c2aa24610c1dc5e7787cd69168 [0,1,0,0,0,0|1,0,2]=4 1535 B11R0.81 C=CCCNCC(=O)OCCC 46b9c758b9daf3bb5d371b002dc5d826 [0,1,0,0,0,0|0,0,2]=3 1536 B11R0.81 C=CCCOCC(=O)NCCC 33984866752cb7b146335d3014fa93e2 [0,1,0,0,0,0|1,0,2]=4 1537 B11R0.81 C=CCCOCC(=O)OCCC 5f7791e3ad59a7491d3058783a2c736b [0,1,0,0,0,0|0,0,2]=3 1538 B11R0.81 C=CCCSCC(=O)NCCC f9f416287b143cfaee9c12cb8d87b674 [0,1,0,0,0,0|1,0,2]=4 1539 B11R0.81 C=CCNC(=O)CCNCCC f33f6af86cca99e57cdf848637ee2415 [0,1,0,0,0,0|1,0,2]=4 1540 B11R0.81 C=CCNC(=O)CCOCCC 5c93462fb8433f69ea744c18e7e826a5 [0,1,0,0,0,0|1,0,2]=4 1541 B11R0.81 C=CCNC(=O)CNCCCC 458dfea0b295f83a7b6ba3cfa774ad6c [0,1,0,0,0,0|1,0,2]=4 1542 B11R0.81 C=CCNC(=O)COCCCC ad852ac7efe927d44c32562b633728e1 [0,1,0,0,0,0|1,0,2]=4 1543 B11R0.81 C=CCOC(=O)CNCCCC 534650d2aff0c79fa6e91928d4444da4 [0,1,0,0,0,0|0,0,2]=3 1544 B11R0.81 C=CCOC(=O)CNCCCCl 51c2ee46659dcac0a5f44389cec0790b [0,1,0,0,0,0|1,0,2]=4 1545 B11R0.81 C=CCOC(=O)CNCCCO a389a9aca7d73ebdbd87273e13c59ece [0,1,0,0,0,0|1,0,2]=4 1546 B11R0.81 C=CCOC(=O)CNCCOC 29dc30332c831e26f447300744cf1946 [0,1,0,0,0,0|1,0,2]=4 1547 B11R0.81 C=CCOC(=O)CNCCSC 37faa66a8b5465d93783e9e80f2bd689 [0,1,0,0,0,0|1,0,2]=4 1548 B11R0.81 C=CCOC(=O)COCCCC d2f9cf52c51eef615b78f4361899c10c [0,1,0,0,0,0|0,0,2]=3 1549 B11R0.81 C=CCOC(=O)COCCCF 066b4f25f7cb0ec45195e75cf5a14b53 [0,1,0,0,0,0|1,0,2]=4 1550 B11R0.81 C=CCOC(=O)COCCCS 9a56888af32ed7f98e65aa7218b8c467 [0,1,0,0,0,0|1,0,2]=4 1551 B11R0.81 C=CCOC(=O)COCCOC ef4516061cd322e32aee5c1f681ed067 [0,1,0,0,0,0|1,0,2]=4 1552 B11R0.81 C=CCOC(=O)COCCSC 4472376bfe633254fd7fbf83954e3e87 [0,1,0,0,0,0|1,0,2]=4 1553 B11R0.81 C=CCOCCC(=O)NCCC 253ba116b919d127877e21aed5149fd2 [0,1,0,0,0,0|1,0,2]=4 1554 B11R0.81 C=CCOCCC(=O)OCCC 54ffba98af589d2bc73b2d08537b4da7 [0,1,0,0,0,0|0,0,2]=3 1555 B11R0.81 CC#CCC(=O)NCCCCC 96d7b3587e44b3a746a6efa72fbdfada [0,1,0,0,0,0|1,0,2]=4 1556 B11R0.81 CC#CCNCC(=O)NCCC c88614987ed463d50a9c2be30409208e [0,1,0,0,0,0|1,0,2]=4 1557 B11R0.81 CC#CCNCC(=O)OCCC 3f4a4c36a84cf7bef699d2786f6c321c [0,1,0,0,0,0|0,0,2]=3 1558 B11R0.81 CC#CCOCC(=O)NCCC 0e0ce59bd0907ffe1238a861aa15bcd6 [0,1,0,0,0,0|1,0,2]=4 1559 B11R0.81 CC#CCOCC(=O)OCCC 7e5bd0f18eea2159182c846f67fae784 [0,1,0,0,0,0|0,0,2]=3 1560 B11R0.81 CC/C=C/C(=O)NCCCCC 63095eac04d1c62a52939bfac6587eba [0,1,0,0,0,0|1,0,1]=3 1561 B11R0.81 CC/C=C/C(=O)NCCCCCl 530e6aa8efa21a898ca44d10eaec5e97 [0,1,0,0,0,0|2,0,1]=4 1562 B11R0.81 CC/C=C/C(=O)NCCCCO 32674d6fe204d7a33bfbc30a2b2f156c [0,1,0,0,0,0|2,0,1]=4 1563 B11R0.81 CC/C=C/C(=O)NCCCCS 828d5f77bcf4dac7ca4a5b2f944c19ee [0,1,0,0,0,0|2,0,1]=4 1564 B11R0.81 CC/C=C/C(=O)NCCCOC 0b275895b33cc59cdcd06ad7ea886fba [0,1,0,0,0,0|2,0,1]=4 1565 B11R0.81 CC/C=C/C(=O)NCCCSC 2e46da48688fc51429e559811104f8a9 [0,1,0,0,0,0|2,0,1]=4 1566 B11R0.81 CC/C=C/C(=O)NCCOCC 846144aca1c3a68135ccbb0e2bd0b2c3 [0,1,0,0,0,0|2,0,1]=4 1567 B11R0.81 CC/C=C/C(=O)NCCSCC 193d1dd7231bb6d9b2069755722d1d34 [0,1,0,0,0,0|2,0,1]=4 1568 B11R0.81 CC/C=C\C(=O)NCCCCC 00a2c477e9b53f6a09878b7b0fed634a [0,1,0,0,0,0|1,0,1]=3 1569 B11R0.81 CC/C=C\C(=O)NCCCCCl 5dd56b4b36b7de275d65937496c832b8 [0,1,0,0,0,0|2,0,1]=4 1570 B11R0.81 CC/C=C\C(=O)NCCCCO 8157c7395f76566640024a7ddccca6b8 [0,1,0,0,0,0|2,0,1]=4 1571 B11R0.81 CC/C=C\C(=O)NCCCCS 3a841bf83cc7e8687c328ad2a4fc6814 [0,1,0,0,0,0|2,0,1]=4 1572 B11R0.81 CC/C=C\C(=O)NCCCOC 679e5c5b24c9fb639f5f1c18e904ba51 [0,1,0,0,0,0|2,0,1]=4 1573 B11R0.81 CC/C=C\C(=O)NCCCSC a86d1a5f6e8b9c9cc39e8cfd8b3d8b43 [0,1,0,0,0,0|2,0,1]=4 1574 B11R0.81 CC/C=C\C(=O)NCCOCC 66eeff53ed57f47ab1b5897af98af8ff [0,1,0,0,0,0|2,0,1]=4 1575 B11R0.81 CC/C=C\C(=O)NCCSCC a2b4c0e87a160a78f800a267f41e65f3 [0,1,0,0,0,0|2,0,1]=4 1576 B11R0.81 CC=CCNCC(=O)NCCC f1719c40e68e24bfd8ab298aa4a5bf70 [0,1,0,0,0,0|1,0,2]=4 1577 B11R0.81 CC=CCNCC(=O)OCCC cc9a9946aaa7efdb3824fd87e94e11bc [0,1,0,0,0,0|0,0,2]=3 1578 B11R0.81 CC=CCOCC(=O)NCCC 75ddb8adabaf44b89d339eea6f9c3ae0 [0,1,0,0,0,0|1,0,2]=4 1579 B11R0.81 CC=CCOCC(=O)OCCC 2d72f130f78b56101482ac4a54bfb905 [0,1,0,0,0,0|0,0,2]=3 1580 B11R0.81 CCC#CC(=O)NCCCCC 7458a67d0f9814e5b6cd4cf10b95ddb1 [0,1,0,0,0,0|1,0,1]=3 1581 B11R0.81 CCC#CC(=O)NCCCCCl f2432522c7e818a0cc8529f38ff5edfa [0,1,0,0,0,0|2,0,1]=4 1582 B11R0.81 CCC#CC(=O)NCCCCO b02aa8759c8dbf74e4b826404584fa32 [0,1,0,0,0,0|2,0,1]=4 1583 B11R0.81 CCC#CC(=O)NCCCCS 03bafac6f19995436436f110139ad5bf [0,1,0,0,0,0|2,0,1]=4 1584 B11R0.81 CCC#CC(=O)NCCCOC 1aa40d2f846296f9045826a1c7a24991 [0,1,0,0,0,0|2,0,1]=4 1585 B11R0.81 CCC#CC(=O)NCCCSC 6db5e48bdf17e6789b4a15cec182faf4 [0,1,0,0,0,0|2,0,1]=4 1586 B11R0.81 CCC#CC(=O)NCCOCC 47a43ff9d028c6f37cb1b601bd4851ee [0,1,0,0,0,0|2,0,1]=4 1587 B11R0.81 CCC#CC(=O)NCCSCC 6b5737db2b59932e12575c98f78a6b1c [0,1,0,0,0,0|2,0,1]=4 1588 B11R0.81 CCC/C=C/CC(=O)NCCBr 5acc12a3ce1937c1035561a5e2402215 [0,1,0,0,0,0|2,0,1]=4 1589 B11R0.81 CCC/C=C/CC(=O)NCCC 40794eac8680af8f7b27b0cc3497eac7 [0,1,0,0,0,0|1,0,1]=3 1590 B11R0.81 CCC/C=C/CC(=O)NCCF 1a18d19cf24562fcd4eef7c167d19148 [0,1,0,0,0,0|2,0,1]=4 1591 B11R0.81 CCC/C=C/CC(=O)NCCI f9d5ef6eb8705cc5a28141b463a3470d [0,1,0,0,0,0|2,0,1]=4 1592 B11R0.81 CCC/C=C/CC(=O)NCCO 8c6dc0acf23fc21e473ee1770be069a3 [0,1,0,0,0,0|2,0,1]=4 1593 B11R0.81 CCC/C=C/CC(=O)NCCS 97511e8cebbe7869e1cc9790fdaefceb [0,1,0,0,0,0|2,0,1]=4 1594 B11R0.81 CCC=CC(=O)NCCCCC d5f9dee0e9e7159b1708be5a61788ec4 [0,1,0,0,0,0|1,0,1]=3 1595 B11R0.81 CCC=CC(=O)NCCCCCl 0a9cceecaab9a73ff6584d113f1ad04e [0,1,0,0,0,0|2,0,1]=4 1596 B11R0.81 CCC=CC(=O)NCCCCO d4282e832d3d40aeca59b6ea2b8a5eed [0,1,0,0,0,0|2,0,1]=4 1597 B11R0.81 CCC=CC(=O)NCCCCS 6beabee43f36dc96d746b162517160d3 [0,1,0,0,0,0|2,0,1]=4 1598 B11R0.81 CCC=CC(=O)NCCCOC 58773b9f1a81f3a06d132043ad40eba0 [0,1,0,0,0,0|2,0,1]=4 1599 B11R0.81 CCC=CC(=O)NCCCSC 5b8b563e415bc37afc3359fb5e4ed5fb [0,1,0,0,0,0|2,0,1]=4 1600 B11R0.81 CCC=CC(=O)NCCOCC 650b9f8be20e764fafe537d04ccc4e01 [0,1,0,0,0,0|2,0,1]=4 1601 B11R0.81 CCC=CC(=O)NCCSCC ea4efb4673695caa5333f025c99caa05 [0,1,0,0,0,0|2,0,1]=4 1602 B11R0.81 CCCC/C=C/C(=O)NCCBr 0c381d32cc38779a003fab9dfde89b53 [0,1,0,0,0,0|2,0,1]=4 1603 B11R0.81 CCCC/C=C/C(=O)NCCC 96ad6cfe920fad2b1e8dcae5661c3046 [0,1,0,0,0,0|1,0,1]=3 1604 B11R0.81 CCCC/C=C/C(=O)NCCF 7f540158a6dc6ac7f335352f92019ac1 [0,1,0,0,0,0|2,0,1]=4 1605 B11R0.81 CCCC/C=C/C(=O)NCCI 05efed6e66427acff4ae21dfc4bceceb [0,1,0,0,0,0|2,0,1]=4 1606 B11R0.81 CCCC/C=C/C(=O)NCCO 7aa9a542977b61455a5567adbfa839b4 [0,1,0,0,0,0|2,0,1]=4 1607 B11R0.81 CCCC/C=C/C(=O)NCCS 987dc789e05eea1bfdb26b7bde9ac040 [0,1,0,0,0,0|2,0,1]=4 1608 B11R0.81 CCCCC#CC(=O)NCCBr bba65b5ff90a7cdc07df7c18abd999b6 [0,1,0,0,0,0|2,0,1]=4 1609 B11R0.81 CCCCC#CC(=O)NCCC 7705f0150ec4caaab8a5325172b0dc30 [0,1,0,0,0,0|1,0,1]=3 1610 B11R0.81 CCCCC#CC(=O)NCCF b612ba4b14ca05e20115b3c69d2fe205 [0,1,0,0,0,0|2,0,1]=4 1611 B11R0.81 CCCCC#CC(=O)NCCI 46d32febbb911ac5d6878e2580056fcd [0,1,0,0,0,0|2,0,1]=4 1612 B11R0.81 CCCCC#CC(=O)NCCO 5ad72106306c70b29b81cd37bd36e1dd [0,1,0,0,0,0|2,0,1]=4 1613 B11R0.81 CCCCC#CC(=O)NCCS c9329cecdb3912f088627793292c858c [0,1,0,0,0,0|2,0,1]=4 1614 B11R0.81 CCCCC(=O)NCCCC#N 69b29f419da5ba081b9996b37b3ceb11 [0,1,0,0,0,0|2,0,1]=4 1615 B11R0.81 CCCCC(=O)NCCCCCl b9536b0c8f50ac92230f25eea98ed7d1 [0,1,0,0,0,0|2,0,0]=3 1616 B11R0.81 CCCCC(=O)NCCCCO fa42fcd441c7069b7e8d15f43c375c64 [0,1,0,0,0,0|2,0,0]=3 1617 B11R0.81 CCCCC(=O)NCCCCS ce90c047aecddf54e66da494b3c8c31b [0,1,0,0,0,0|2,0,0]=3 1618 B11R0.81 CCCCC(=O)NCCCOC d86159687395af2cdbf73960d6c053a1 [0,1,0,0,0,0|2,0,0]=3 1619 B11R0.81 CCCCC(=O)NCCCSC be82751f82a49c9ebe55528be38267ca [0,1,0,0,0,0|2,0,0]=3 1620 B11R0.81 CCCCC(=O)NCCOCC bcdbd9d41426e95de40e68225afe50a3 [0,1,0,0,0,0|2,0,0]=3 1621 B11R0.81 CCCCC(=O)NCCSCC 3dc1a80f6b8f71092a353e3e3c630639 [0,1,0,0,0,0|2,0,0]=3 1622 B11R0.81 CCCCC(=O)OCNCCBr b35cf5afed991c05e50b5e7336955d2a [0,1,0,0,0,0|3,0,0]=4 1623 B11R0.81 CCCCC(=O)OCNCCC 189a0251ea5eef3ed179b78ec37eca6d [0,1,0,0,0,0|2,0,0]=3 1624 B11R0.81 CCCCC(=O)OCNCCF 92476339d76daf98486af68d9dd3ae23 [0,1,0,0,0,0|3,0,0]=4 1625 B11R0.81 CCCCC(=O)OCNCCI ec98e23477297f49500e4903c8c00086 [0,1,0,0,0,0|3,0,0]=4 1626 B11R0.81 CCCCC(=O)OCNCCO a2247b6664afd75a70edee19128d94db [0,1,0,0,0,0|3,0,0]=4 1627 B11R0.81 CCCCC(=O)OCNCCS 031b8d3582f8442adf31521fd13d67be [0,1,0,0,0,0|3,0,0]=4 1628 B11R0.81 CCCCC(=O)OCOCCC 0911490fac5c15eab77dc944203f025f [0,1,0,0,0,0|2,0,0]=3 1629 B11R0.81 CCCCC(=O)OCOCCF fc55082c71c8f0e3cdddb51d90ead405 [0,1,0,0,0,0|3,0,0]=4 1630 B11R0.81 CCCCC(=O)OCOCCS df7a84fef8a135f7e1b5bf5951308452 [0,1,0,0,0,0|3,0,0]=4 1631 B11R0.81 CCCCC(=O)OCOCOC b548ff67261092eea409be64a3c75113 [0,1,0,0,0,0|3,0,0]=4 1632 B11R0.81 CCCCC(C)CCOCCC d754160f5aff175f763be994f3b87c75 [0,1,0,0,0,0|2,0,1]=4 1633 B11R0.81 CCCCC=CC(=O)NCCBr 2b3e3c9274507bf53e050e094fc7e606 [0,1,0,0,0,0|2,0,1]=4 1634 B11R0.81 CCCCC=CC(=O)NCCC 4a74f82ed7748f3262f04de1576686f7 [0,1,0,0,0,0|1,0,1]=3 1635 B11R0.81 CCCCC=CC(=O)NCCF 5d3e1bdb7dceb622e49cbad494c3fd8f [0,1,0,0,0,0|2,0,1]=4 1636 B11R0.81 CCCCC=CC(=O)NCCI 3f023c407298c662ece7b9e87f042606 [0,1,0,0,0,0|2,0,1]=4 1637 B11R0.81 CCCCC=CC(=O)NCCO 593a54a8efde277bc6083139c5548de3 [0,1,0,0,0,0|2,0,1]=4 1638 B11R0.81 CCCCC=CC(=O)NCCS 3c0bac9435a7d1d9ded93f1966e29dc0 [0,1,0,0,0,0|2,0,1]=4 1639 B11R0.81 CCCCCCC(=O)NCC#N 5a5547990c18290cb12901a8d3539fa4 [0,1,0,0,0,0|2,0,1]=4 1640 B11R0.81 CCCCCCC(=O)NCCBr d79aaed702952d6862f568471d9edfa5 [0,1,0,0,0,0|2,0,0]=3 1641 B11R0.81 CCCCCCC(=O)NCCC 87d8790730f902707f59eb54172a1efa [0,1,0,0,0,0|1,0,0]=2 1642 B11R0.81 CCCCCCC(=O)NCCF 3a778e51e527334d4841b17c7b1ad87a [0,1,0,0,0,0|2,0,0]=3 1643 B11R0.81 CCCCCCC(=O)NCCI 520757295254017557cf28c508dc62ed [0,1,0,0,0,0|2,0,0]=3 1644 B11R0.81 CCCCCCC(=O)NCCO f49bad3fe55d361225eacdb6b24aebd1 [0,1,0,0,0,0|2,0,0]=3 1645 B11R0.81 CCCCCCC(=O)NCCS 9c8c9533bc6d8ec6506ca7c240541ac4 [0,1,0,0,0,0|2,0,0]=3 1646 B11R0.81 CCCCCCC(C)NCCC 673986824879f3e79ccf765f60ced912 [0,1,0,0,0,0|2,0,1]=4 1647 B11R0.81 CCCCCCC(C)OCCC ba224077acd3b740d8e3fb9b4d425b85 [0,1,0,0,0,0|1,0,1]=3 1648 B11R0.81 CCCCCCC(C)OCCF 4029c11da063a889235fa4189e927d2c [0,1,0,0,0,0|2,0,1]=4 1649 B11R0.81 CCCCCCC(C)OCCS 8480a7d1dac28cbecd276cfd7d327c97 [0,1,0,0,0,0|2,0,1]=4 1650 B11R0.81 CCCCCCC(C)OCOC 06f3fa4a03b800a6ed03a325da232f19 [0,1,0,0,0,0|2,0,1]=4 1651 B11R0.81 CCCCCCC(C)OCSC 0ce08d2ad40e1d3e2328da6bf608dda4 [0,1,0,0,0,0|2,0,1]=4 1652 B11R0.81 CCCCCCN(C)CCCC 68edc7b90c1a605cb81ae90468df06f8 [0,1,0,0,0,0|3,0,0]=4 1653 B11R0.81 CCCCCC[C@@H](C)NCCC 7405a222267b08859e40d01e337c8630 [0,1,0,0,0,0|2,0,1]=4 1654 B11R0.81 CCCCCC[C@@H](C)OCCC 2e5a993043dda8cbe04b4c5a7ec49973 [0,1,0,0,0,0|1,0,1]=3 1655 B11R0.81 CCCCCC[C@@H](C)OCCF b6467c74c9589cf5fb41339589cc2368 [0,1,0,0,0,0|2,0,1]=4 1656 B11R0.81 CCCCCC[C@@H](C)OCCS 3754d26fdd954c90f1c6f32ccfc437fc [0,1,0,0,0,0|2,0,1]=4 1657 B11R0.81 CCCCCC[C@@H](C)OCOC c4f6ce6ce697e0f7c254cbe51e7b0e91 [0,1,0,0,0,0|2,0,1]=4 1658 B11R0.81 CCCCCC[C@@H](C)OCSC 9f514d0333870d7a5b338269c3a53dcb [0,1,0,0,0,0|2,0,1]=4 1659 B11R0.81 CCCCCC[C@H](C)NCCC be780c73d2e2093087ff3f7aa1472464 [0,1,0,0,0,0|2,0,1]=4 1660 B11R0.81 CCCCCC[C@H](C)OCCC d12d50ac24407591cb230f2d190f19fa [0,1,0,0,0,0|1,0,1]=3 1661 B11R0.81 CCCCCC[C@H](C)OCCF 8df5cfe0970d2ffe80cceac0dc1218aa [0,1,0,0,0,0|2,0,1]=4 1662 B11R0.81 CCCCCC[C@H](C)OCCS 97e92c77de3d8a6ecd62ad2a46c3ab4f [0,1,0,0,0,0|2,0,1]=4 1663 B11R0.81 CCCCCC[C@H](C)OCOC 0d2245dbcd4d44496373623bc1bbc23a [0,1,0,0,0,0|2,0,1]=4 1664 B11R0.81 CCCCCC[C@H](C)OCSC c88ec367c5134901cf2852a687aee963 [0,1,0,0,0,0|2,0,1]=4 1665 B11R0.81 CCCCCNC(=O)/C=C/CF 8af28443ae2eb2b2d49b35a6fcd6db19 [0,1,0,0,0,0|2,0,1]=4 1666 B11R0.81 CCCCCNC(=O)/C=C/CO a41f5197cf0d690cfca6c7f3174709bc [0,1,0,0,0,0|2,0,1]=4 1667 B11R0.81 CCCCCNC(=O)/C=C/OC 7425a12715f801d68b5865f5b994b883 [0,1,0,0,0,0|2,0,1]=4 1668 B11R0.81 CCCCCNC(=O)C#CCO 5be1f96cef22942ac5b427cae0590ada [0,1,0,0,0,0|2,0,1]=4 1669 B11R0.81 CCCCCNC(=O)C=CCO 2e84c976f12d11f7b50b54648b6d2afa [0,1,0,0,0,0|2,0,1]=4 1670 B11R0.81 CCCCCNC(=O)C=COC b75738bd00a7e9032e8be9cd6d8628f6 [0,1,0,0,0,0|2,0,1]=4 1671 B11R0.81 CCCCCNC(=O)CCC#N 2fe660453d24f69d43c92da00f816b29 [0,1,0,0,0,0|2,0,1]=4 1672 B11R0.81 CCCCCNC(=O)CCC=O 4e06a1300e5289e3f929fbc06dd15cac [0,1,0,0,0,0|2,0,1]=4 1673 B11R0.81 CCCCCNC(=O)CCCC a06834419102a1558a19fb3a1406cfb0 [0,1,0,0,0,0|1,0,0]=2 1674 B11R0.81 CCCCCNC(=O)CCCF cb3b728da5cd7a0af32935f0696071b9 [0,1,0,0,0,0|2,0,0]=3 1675 B11R0.81 CCCCCNC(=O)CCCS 2ce8fa8be7e233b98c683adc51803bf5 [0,1,0,0,0,0|2,0,0]=3 1676 B11R0.81 CCCCCNC(=O)CCOC 99bac40aabd096dca01631fdf32d2a4b [0,1,0,0,0,0|2,0,0]=3 1677 B11R0.81 CCCCCNC(=O)CCSC 307383e6c5c252e00e4647926ad02c1d [0,1,0,0,0,0|2,0,0]=3 1678 B11R0.81 CCCCCNC(=O)COCC 11ebeee9fef7d60698beadcb88e4cda2 [0,1,0,0,0,0|2,0,0]=3 1679 B11R0.81 CCCCCNC(=O)CSCC bf3d4e842c78e9ee2405e5f2f5ac3c0b [0,1,0,0,0,0|2,0,0]=3 1680 B11R0.81 CCCCCNC(=O)CSSC 213fed2b239e133e90d67490111e539f [0,1,0,0,0,0|3,0,0]=4 1681 B11R0.81 CCCCCNC(=O)NCC#N 91060b67da8f284071ada1ef971fc029 [0,1,0,0,0,0|2,0,1]=4 1682 B11R0.81 CCCCCNC(=O)NCCC 2fb53f51cf25e3deb1739f07400adf03 [0,1,0,0,0,0|1,0,0]=2 1683 B11R0.81 CCCCCNC(=O)NCCF 0b4c718c69a2ba3827f9360a3aa7f6de [0,1,0,0,0,0|2,0,0]=3 1684 B11R0.81 CCCCCNC(=O)NCCN 0fa5863ecf8ff824f576c603fdbab48c [0,1,0,0,0,0|2,0,0]=3 1685 B11R0.81 CCCCCNC(=O)NCCO 7bed3c4d3d74ef1f8285ffe585b1af67 [0,1,0,0,0,0|2,0,0]=3 1686 B11R0.81 CCCCCNC(=O)NCCS b0ee850c6a99c273160aae12fd772cda [0,1,0,0,0,0|2,0,0]=3 1687 B11R0.81 CCCCCNC(=S)NCCC ed0ecaf90096623a47ce63768da8393e [0,1,0,0,0,0|1,1,0]=3 1688 B11R0.81 CCCCCNC(=S)NCCF 90a44ab46c8ba088b69c6659e64fa8f5 [0,1,0,0,0,0|2,1,0]=4 1689 B11R0.81 CCCCCNC(=S)NCCN ff15f3803e35092dc92785d88564ef57 [0,1,0,0,0,0|2,1,0]=4 1690 B11R0.81 CCCCCNC(=S)NCCO 613b0776b1ca10c38f608d01c95944b9 [0,1,0,0,0,0|2,1,0]=4 1691 B11R0.81 CCCCCNC(=S)NCCS aceed89a45029c4982610bd3c6671625 [0,1,0,0,0,0|2,1,0]=4 1692 B11R0.81 CCCCCNC(C)CCCC b51643b11e90e217951ac49e9c0fa8df [0,1,0,0,0,0|2,0,1]=4 1693 B11R0.81 CCCCCN[C@H](C)CCCC a88e430f1a54dc3ca544448f280d28fd [0,1,0,0,0,0|2,0,1]=4 1694 B11R0.81 CCCCCOC(C)CCCC c7acc1e25061124a677e93a98c4880c3 [0,1,0,0,0,0|2,0,1]=4 1695 B11R0.81 CCCCCO[C@@H](C)CCCC a39e9f1d5c06f929dc091d3b55f09321 [0,1,0,0,0,0|2,0,1]=4 1696 B11R0.81 CCCCCO[C@H](C)CCCC f537dfc938a1fd068dc349c4b7b77c37 [0,1,0,0,0,0|2,0,1]=4 1697 B11R0.81 CCCCN(C)CCCCCF 4d14758e62814a91ca9260401d3fd5e4 [0,1,0,0,0,0|3,0,0]=4 1698 B11R0.81 CCCCN(C)CCCCCO c5675d46ea3544a800eca8dfc876b4c2 [0,1,0,0,0,0|3,0,0]=4 1699 B11R0.81 CCCCN(C)CCCCOC d1a49086e35fed83caddb81e23dd5e5c [0,1,0,0,0,0|3,0,0]=4 1700 B11R0.81 CCCCN(C)CCCNCC 6e61cd18b0252f2f209015d25156d134 [0,1,0,0,0,0|3,0,0]=4 1701 B11R0.81 CCCCN(C)CCCOCC 7c044657e095600ce23589d50b73987e [0,1,0,0,0,0|3,0,0]=4 1702 B11R0.81 CCCCN(C)CCCSCC ce98f45dd349d541817d370bcf2f009a [0,1,0,0,0,0|3,0,0]=4 1703 B11R0.81 CCCCN(C)CCNCCC f26241bd65ebe7441e242827753a91d9 [0,1,0,0,0,0|3,0,0]=4 1704 B11R0.81 CCCCN(C)CCOCCC 6d0636061ab64a8f235e12af4f565931 [0,1,0,0,0,0|3,0,0]=4 1705 B11R0.81 CCCCNCC(=O)CCSC 85cdcea0a9b1cf078809a10dbbdf3702 [0,1,0,0,0,0|2,0,0]=3 1706 B11R0.81 CCCCNCC(=O)NCC#N dc22f93c3492cf774952da1c74d15867 [0,1,0,0,0,0|2,0,1]=4 1707 B11R0.81 CCCCNCC(=O)NCCC 1203a7b7d7c0248e84b16088ce84c2c6 [0,1,0,0,0,0|1,0,0]=2 1708 B11R0.81 CCCCNCC(=O)NCCO f6162a82353a460c1acb4c7b954ac9d7 [0,1,0,0,0,0|2,0,0]=3 1709 B11R0.81 CCCCNCC(=O)OCCC 5112f77fa578dbe165c4f7b30cf9dcd3 [0,1,0,0,0,0|0,0,0]=1 1710 B11R0.81 CCCCNCC(O)CCCC fead52412d0cf6070e098352c1c7fba2 [0,1,0,0,0,0|1,0,2]=4 1711 B11R0.81 CCCCOCC(=O)CCSC dbd0d7739b9bd0f4e7f18e93ebf96429 [0,1,0,0,0,0|2,0,0]=3 1712 B11R0.81 CCCCOCC(=O)NCC#N 1cda91d121ab29b6739bbd47b61d3242 [0,1,0,0,0,0|2,0,1]=4 1713 B11R0.81 CCCCOCC(=O)NCCBr 36760cee347953899875c7a6baf2be52 [0,1,0,0,0,0|2,0,0]=3 1714 B11R0.81 CCCCOCC(=O)NCCC f056b523414cfd937e64d3e95507274e [0,1,0,0,0,0|1,0,0]=2 1715 B11R0.81 CCCCOCC(=O)NCCF d0f46a978fa7f79cfc41018a3bf32e0b [0,1,0,0,0,0|2,0,0]=3 1716 B11R0.81 CCCCOCC(=O)NCCI 2e3211d82f8259a9d4b8c78d64b512dc [0,1,0,0,0,0|2,0,0]=3 1717 B11R0.81 CCCCOCC(=O)NCCO 4c155cdf47da603c7edf6d1efbf727c7 [0,1,0,0,0,0|2,0,0]=3 1718 B11R0.81 CCCCOCC(=O)NCCS 83aa5e44cc5bfb76c81802b5a9a0c183 [0,1,0,0,0,0|2,0,0]=3 1719 B11R0.81 CCCCOCC(=O)OCCC 2f30b4a3ea1d1302768c7d1388237bfc [0,1,0,0,0,0|0,0,0]=1 1720 B11R0.81 CCCCOCC(C)CCCC 3db2ee05274ae0f68ed9b24f1b358565 [0,1,0,0,0,0|2,0,1]=4 1721 B11R0.81 CCCCOCC(C)OCCC 8b31d479727942f0ab31a8163b4f1efe [0,1,0,0,0,0|1,0,1]=3 1722 B11R0.81 CCCCOCC(C)OCCF 2083cc1731677e9f0d76288bb8c3d4bd [0,1,0,0,0,0|2,0,1]=4 1723 B11R0.81 CCCCOCC(C)OCCS dfd9eb216ff95c0acffbb2539f99efc8 [0,1,0,0,0,0|2,0,1]=4 1724 B11R0.81 CCCCOCC(C)OCSC 79660bd0650dd837f9660b7c734b6704 [0,1,0,0,0,0|2,0,1]=4 1725 B11R0.81 CCCCOCN(C)CCCC 31a402937162b9c42c35cc8c301fe9fa [0,1,0,0,0,0|3,0,0]=4 1726 B11R0.81 CCCCOC[C@@H](C)OCOC 9610862535382fd94ba4c276fa335460 [0,1,0,0,0,0|2,0,1]=4 1727 B11R0.81 CCCCSCC(=O)NCC#N a2537aafd9fa643247a72076604f21b3 [0,1,0,0,0,0|2,0,1]=4 1728 B11R0.81 CCCCSCC(=O)NCCBr fc9d64bf7c03e9c445aa10027dc8e6c7 [0,1,0,0,0,0|2,0,0]=3 1729 B11R0.81 CCCCSCC(=O)NCCC 4848b6ae9b9a4132a6a654f6b4b01bb2 [0,1,0,0,0,0|1,0,0]=2 1730 B11R0.81 CCCCSCC(=O)NCCF 902133a83b4c8faa994eac9c4f6684dd [0,1,0,0,0,0|2,0,0]=3 1731 B11R0.81 CCCCSCC(=O)NCCI eb18eb49e32069cc62e1f34f650cee1b [0,1,0,0,0,0|2,0,0]=3 1732 B11R0.81 CCCCSCC(=O)NCCO 12a0aa7a7d1ee3df0aa8b8edb2fab1f6 [0,1,0,0,0,0|2,0,0]=3 1733 B11R0.81 CCCCSCC(=O)NCCS 9ec7fcb8e2cfcfa9a98d8bb34cf5292b [0,1,0,0,0,0|2,0,0]=3 1734 B11R0.81 CCCNC(=O)CCCCC=O f37aa498d6e7d7d0501b70b7c4a5f55f [0,1,0,0,0,0|1,0,1]=3 1735 B11R0.81 CCCNC(=O)CCCCCF baedcab883c63ad1db8337ad163f430a [0,1,0,0,0,0|1,0,0]=2 1736 B11R0.81 CCCNC(=O)CCCCCO a7c6a98522f11fc91ddc59d3a1df544e [0,1,0,0,0,0|1,0,0]=2 1737 B11R0.81 CCCNC(=O)CCCCCS 0c7dd76a2b4a4cc878012c4009f0ab59 [0,1,0,0,0,0|1,0,0]=2 1738 B11R0.81 CCCNC(=O)CCCNC#N 94d4b99a0d700e253823eacb7fcae609 [0,1,0,0,0,0|2,0,1]=4 1739 B11R0.81 CCCNC(=O)CCCNC=O 29af2918cbc16042b2ec9815ca860914 [0,1,0,0,0,0|2,0,1]=4 1740 B11R0.81 CCCNC(=O)CCCSSC 8f8be997b177bbc4de5da7b8c40b4dcd [0,1,0,0,0,0|2,0,0]=3 1741 B11R0.81 CCCNC(=O)CCOCCC 42553a8c8b926fca8611ff8d68aeae7a [0,1,0,0,0,0|1,0,0]=2 1742 B11R0.81 CCCNC(=O)CCOCCO 094015acedcfbaf93130fb1f0360d877 [0,1,0,0,0,0|2,0,0]=3 1743 B11R0.81 CCCNC(=O)CCOCCS 5f40d2a871036b77143414aea5a78124 [0,1,0,0,0,0|2,0,0]=3 1744 B11R0.81 CCCNC(=O)CNCCC#N 0ac0aeafd093a23d9dcc2460ca3a8ccb [0,1,0,0,0,0|2,0,1]=4 1745 B11R0.81 CCCNC(=O)CNCCC=O 8bf14af729ef204e58bfac03eec40b36 [0,1,0,0,0,0|2,0,1]=4 1746 B11R0.81 CCCNC(=O)CNCCCCl bd9f06e27449f883b3eb3a3de9a76ab2 [0,1,0,0,0,0|2,0,0]=3 1747 B11R0.81 CCCNC(=O)CNCCCF 7c1a6596c5c00fbcfcfab0b6145a677e [0,1,0,0,0,0|2,0,0]=3 1748 B11R0.81 CCCNC(=O)CNCCCO 669e1f58869b6d56cc18a45370f30a17 [0,1,0,0,0,0|2,0,0]=3 1749 B11R0.81 CCCNC(=O)CNCCCS 395cabad765bf5efce4b33fce5a10967 [0,1,0,0,0,0|2,0,0]=3 1750 B11R0.81 CCCNC(=O)CNCCOC 4cbfe21423d6e53e7a1013d3d7b95bb6 [0,1,0,0,0,0|2,0,0]=3 1751 B11R0.81 CCCNC(=O)CNCCON f4bd4ff02ba00d835bc307cb2a4fa77e [0,1,0,0,0,0|3,0,0]=4 1752 B11R0.81 CCCNC(=O)CNCCSC f99a076a73f42677a85b7c126e7db9c7 [0,1,0,0,0,0|2,0,0]=3 1753 B11R0.81 CCCNC(=O)CNCOCC 41481ad7efe243bde9c9c153fd48866d [0,1,0,0,0,0|2,0,0]=3 1754 B11R0.81 CCCNC(=O)COCCC#N 305b33b81c31241c462bf384b26950fd [0,1,0,0,0,0|2,0,1]=4 1755 B11R0.81 CCCNC(=O)COCCC=O c7978835cae8b49aa3e0cf29e500f67d [0,1,0,0,0,0|2,0,1]=4 1756 B11R0.81 CCCNC(=O)COCCCF 0000ec8366505420b7c2e6a09c2f7961 [0,1,0,0,0,0|2,0,0]=3 1757 B11R0.81 CCCNC(=O)COCCCS de63b71b0f7035966e466ae17d7a3be7 [0,1,0,0,0,0|2,0,0]=3 1758 B11R0.81 CCCNC(=O)COCCOC af33a5b5c0db067923300c8b3b6eec8e [0,1,0,0,0,0|2,0,0]=3 1759 B11R0.81 CCCNC(=O)COCCSC 059b55f6691c8ee758c6b6d54a350136 [0,1,0,0,0,0|2,0,0]=3 1760 B11R0.81 CCCNC(=O)CSCCOC dfd4f0c889bddb2e05fb752976f6468f [0,1,0,0,0,0|2,0,0]=3 1761 B11R0.81 CCCNC(=O)NCCCC#N 4873de3495a7e8e28bf3c689f61f2e46 [0,1,0,0,0,0|2,0,1]=4 1762 B11R0.81 CCCNC(=O)NCCCCN c6443e81cde3125dc7e5f758a813f88b [0,1,0,0,0,0|2,0,0]=3 1763 B11R0.81 CCCNC(=O)NCCCCO b3bc53c0ae2e58cd7b21b9f7c9d07477 [0,1,0,0,0,0|2,0,0]=3 1764 B11R0.81 CCCNC(=O)NCCCCS d3a31860c7fd41461062dfa1b06787b7 [0,1,0,0,0,0|2,0,0]=3 1765 B11R0.81 CCCNC(=O)NCCCOC 50ae98078702fa610be7540eb8edd428 [0,1,0,0,0,0|2,0,0]=3 1766 B11R0.81 CCCNC(=O)NCCCSC e117748d85d75907410464498a0a3699 [0,1,0,0,0,0|2,0,0]=3 1767 B11R0.81 CCCNC(=O)NCCOCC 80e1f0671ff882759d81829124c92ad6 [0,1,0,0,0,0|2,0,0]=3 1768 B11R0.81 CCCNC(=O)NCCSCC c2a740fdab08c6ec989b5f9aea85bf6c [0,1,0,0,0,0|2,0,0]=3 1769 B11R0.81 CCCNC(=S)NCCCCN 1f9f8885ebd8beacc92d275c20edab81 [0,1,0,0,0,0|2,1,0]=4 1770 B11R0.81 CCCNC(=S)NCCCCO 09dd35942318ee844fa74d582583a09e [0,1,0,0,0,0|2,1,0]=4 1771 B11R0.81 CCCNC(=S)NCCCCS 46f7bd58feac51e61a4d659125cf2f2c [0,1,0,0,0,0|2,1,0]=4 1772 B11R0.81 CCCNC(=S)NCCCOC f3067f75246b82bc7486299c6a97c4ef [0,1,0,0,0,0|2,1,0]=4 1773 B11R0.81 CCCNC(=S)NCCCSC 6d85ae093a74161e739cef1c5823e2c5 [0,1,0,0,0,0|2,1,0]=4 1774 B11R0.81 CCCNC(=S)NCCOCC f1b645e3cf2963a6441152edc523ce08 [0,1,0,0,0,0|2,1,0]=4 1775 B11R0.81 CCCNC(=S)NCCSCC 4016f3a0c559ba0114930d1fc9855abd [0,1,0,0,0,0|2,1,0]=4 1776 B11R0.81 CCCNCOC(=O)OCCC 4d1a92bf22713f11d028be261523bf97 [0,1,0,0,0,0|1,0,0]=2 1777 B11R0.81 CCCOC(=O)CCOCC#N f421c3c25f0d5567bd240dad262ed5f8 [0,1,0,0,0,0|1,0,1]=3 1778 B11R0.81 CCCOC(=O)CCOCC=O e635d443d931167ae3b6f8918a09790d [0,1,0,0,0,0|1,0,1]=3 1779 B11R0.81 CCCOC(=O)CCOCCF 6c164fdc8887ca8fc141e35b4a2592cf [0,1,0,0,0,0|1,0,0]=2 1780 B11R0.81 CCCOC(=O)CCOCCS 66ab5f05d7362e8ffc709deb15e32463 [0,1,0,0,0,0|1,0,0]=2 1781 B11R0.81 CCCOC(=O)CCOCOC b084930f3f6d47464f74aca37674e143 [0,1,0,0,0,0|1,0,0]=2 1782 B11R0.81 CCCOC(=O)CCOCSC 6a6b424b4a9af61c1549e425d21a4cea [0,1,0,0,0,0|1,0,0]=2 1783 B11R0.81 CCCOC(=O)CNCCC#N 2716fbec4b22840e12ce774eccbe0bd7 [0,1,0,0,0,0|1,0,1]=3 1784 B11R0.81 CCCOC(=O)CNCCCCl e06e66b7e72050bc47a6fccb635c8907 [0,1,0,0,0,0|1,0,0]=2 1785 B11R0.81 CCCOC(=O)CNCCCO 5b111bb1ca4b68c9fade23b956b2305a [0,1,0,0,0,0|1,0,0]=2 1786 B11R0.81 CCCOC(=O)CNCCOC 2bbfe3564cc32e7effe8c91738a8c149 [0,1,0,0,0,0|1,0,0]=2 1787 B11R0.81 CCCOC(=O)CNCCON 586ff05dbde859f7a64d22b61b8521de [0,1,0,0,0,0|2,0,0]=3 1788 B11R0.81 CCCOC(=O)CNCCSC de7dde377f49ccddcbfd56e3a11ac930 [0,1,0,0,0,0|1,0,0]=2 1789 B11R0.81 CCCOC(=O)COC/C=C/Cl ad4837bddad080d1b28b4bca6bb44f07 [0,1,0,0,0,0|1,0,2]=4 1790 B11R0.81 CCCOC(=O)COCC#CI 1aa0a5cf6750d0c1bbc23bce569fad80 [0,1,0,0,0,0|1,0,2]=4 1791 B11R0.81 CCCOC(=O)COCC=CCl 1318cd575b1514d9daa1a323e6403e05 [0,1,0,0,0,0|1,0,2]=4 1792 B11R0.81 CCCOC(=O)COCCC#N 89c8db5d95722e07c4ba8a560a40b89f [0,1,0,0,0,0|1,0,1]=3 1793 B11R0.81 CCCOC(=O)COCCC=O fa30ca584b5eae0c394cac23b844e73a [0,1,0,0,0,0|1,0,1]=3 1794 B11R0.81 CCCOC(=O)COCCCF 9ca752a218f7446ba1ab857544374ed1 [0,1,0,0,0,0|1,0,0]=2 1795 B11R0.81 CCCOC(=O)COCCCS ec467b7eb9b33603d2320c0156a04d36 [0,1,0,0,0,0|1,0,0]=2 1796 B11R0.81 CCCOC(=O)COCCOC ef51b9c77d5fe2c9e49043eaac4b1775 [0,1,0,0,0,0|1,0,0]=2 1797 B11R0.81 CCCOC(=O)COCCSC ed58dbd3c9afe030aafa25af7a474fbf [0,1,0,0,0,0|1,0,0]=2 1798 B11R0.81 CCCOC(=O)OCNCC#N 01d5d37d459480bd315406b4eeaabd48 [0,1,0,0,0,0|2,0,1]=4 1799 B11R0.81 CCCOC(=O)OCNCCBr 3e145e09984fac7454cb3aaa72ca303e [0,1,0,0,0,0|2,0,0]=3 1800 B11R0.81 CCCOC(=O)OCNCCF bf99e83ab09de5ccb3ad85278402b9fd [0,1,0,0,0,0|2,0,0]=3 1801 B11R0.81 CCCOC(=O)OCNCCI d7406295acb67b34c4f4ca1850df4bcd [0,1,0,0,0,0|2,0,0]=3 1802 B11R0.81 CCCOC(=O)OCNCCO 51ecc5a84297074ae649de7abd5cb6f4 [0,1,0,0,0,0|2,0,0]=3 1803 B11R0.81 CCCOC(=O)OCNCCS 9a6560d3ab220f9d033f4f6affb865ca [0,1,0,0,0,0|2,0,0]=3 1804 B11R0.81 CCCOC(=O)OCOCC#N 275a6b1d4001eccdb06f5b88e28c3ec1 [0,1,0,0,0,0|2,0,1]=4 1805 B11R0.81 CCCOC(=O)OCOCCF 8d1510b14339aa3354d2112f7e51c37b [0,1,0,0,0,0|2,0,0]=3 1806 B11R0.81 CCCOC(=O)OCOCCS ec061dc1ad214c3434a8ecd74cd12270 [0,1,0,0,0,0|2,0,0]=3 1807 B11R0.81 CCCOC(=O)OCOCOC d87c3e9f5b1d1c80c1a2dbb583aef23d [0,1,0,0,0,0|2,0,0]=3 1808 B11R0.81 CCCOCCC(=O)NCC#N 69e52d10151da556a5e339e93411aff0 [0,1,0,0,0,0|2,0,1]=4 1809 B11R0.81 CCCOCCC(=O)NCCBr ceebd061ef17bfcc61e17726c62d4413 [0,1,0,0,0,0|2,0,0]=3 1810 B11R0.81 CCCOCCC(=O)NCCF 41ebde66c79e043d15e8735c0c88abdc [0,1,0,0,0,0|2,0,0]=3 1811 B11R0.81 CCCOCCC(=O)NCCI 9ec38edeee32187bec3e4fab23b66cf6 [0,1,0,0,0,0|2,0,0]=3 1812 B11R0.81 CCCOCCC(=O)NCCO 55ebb584adce6608581830cd8e242f6c [0,1,0,0,0,0|2,0,0]=3 1813 B11R0.81 CCCOCCC(=O)NCCS dbb6d37060c484a6c1427fbc6af59f0b [0,1,0,0,0,0|2,0,0]=3 1814 B11R0.81 CCCOCCC(=O)OCCC 6ee22521ff14ec2304cdca3071c00c79 [0,1,0,0,0,0|0,0,0]=1 1815 B11R0.81 CCCOCOC(=O)OCCC 7cd19f7197089ff3a04837dd12236c27 [0,1,0,0,0,0|1,0,0]=2 1816 B11R0.81 CCOCC(=O)NCCCCCl 6b242c57133a334777c58492eae9429a [0,1,0,0,0,0|3,0,0]=4 1817 B11R0.81 CCOCC(=O)NCCCCO d71689d4b341333827c7f2a7356f4d5b [0,1,0,0,0,0|3,0,0]=4 1818 B11R0.81 CCOCC(=O)NCCCCS f6722bd841ef8213860ab15b0ed3bf21 [0,1,0,0,0,0|3,0,0]=4 1819 B11R0.81 CCOCC(=O)NCCCOC 4633d3ef9839416b0fc3d4c31079fd0c [0,1,0,0,0,0|3,0,0]=4 1820 B11R0.81 CCOCC(=O)NCCCSC 5ba31a84767d6d1cb079283943117797 [0,1,0,0,0,0|3,0,0]=4 1821 B11R0.81 CCOCC(=O)NCCSCC dc2db358571e9ce17f4f7e3af62ea85f [0,1,0,0,0,0|3,0,0]=4 1822 B11R0.81 CCOCCNC(=O)CCCF 143244bf937b80e80b1012bf493a68c2 [0,1,0,0,0,0|3,0,0]=4 1823 B11R0.81 CCOCCNC(=O)CCCS 19665b86e7c7d0a3fb523bfbe3572199 [0,1,0,0,0,0|3,0,0]=4 1824 B11R0.81 CCOCCNC(=O)CCOC ac2e4792b39278e1be00015aba1c14ba [0,1,0,0,0,0|3,0,0]=4 1825 B11R0.81 CCOCCNC(=O)CCSC e921116d3831e309cf43a8831d286efa [0,1,0,0,0,0|3,0,0]=4 1826 B11R0.81 CCOCCNC(=O)COCC ccff2589632a0830014f62e4f65641f2 [0,1,0,0,0,0|3,0,0]=4 1827 B11R0.81 CCOCCNC(=O)CSCC ad5aa08f7211c115983356636b1745f4 [0,1,0,0,0,0|3,0,0]=4 1828 B11R0.81 CCOCCNC(=O)NCCF 3c88ee0421063962993c14c400f34890 [0,1,0,0,0,0|3,0,0]=4 1829 B11R0.81 CCOCCNC(=O)NCCN abefac62758e32575f67a8fa3bd28de3 [0,1,0,0,0,0|3,0,0]=4 1830 B11R0.81 CCOCCNC(=O)NCCO 0a1b20437c49d231bb0eb2a4a890531c [0,1,0,0,0,0|3,0,0]=4 1831 B11R0.81 CCOCCNC(=O)NCCS f65bf8a4d159c6001ef3b9e1ca92b17a [0,1,0,0,0,0|3,0,0]=4 1832 B11R0.81 CCOCNCC(=O)NCCO 065cd742ba4ad6191364c2d9125bd286 [0,1,0,0,0,0|3,0,0]=4 1833 B11R0.81 CCSCC(=O)NCCCCCl 246a6e7c28dc82bf58124d553780fced [0,1,0,0,0,0|3,0,0]=4 1834 B11R0.81 CCSCC(=O)NCCCCO 5aee1709f84853436d1a76d4be86f309 [0,1,0,0,0,0|3,0,0]=4 1835 B11R0.81 CCSCC(=O)NCCCCS 24bc9424e35686c197f716b0efff2eb1 [0,1,0,0,0,0|3,0,0]=4 1836 B11R0.81 CCSCC(=O)NCCCOC 05c43d7cb671f109b6b19907a81060ff [0,1,0,0,0,0|3,0,0]=4 1837 B11R0.81 CCSCC(=O)NCCCSC 965f6fff977fde4ed0da89387e356f05 [0,1,0,0,0,0|3,0,0]=4 1838 B11R0.81 CCSCCNC(=O)CCCF 27a5d2edf7fbd02ff957d5e4ca1b276f [0,1,0,0,0,0|3,0,0]=4 1839 B11R0.81 CCSCCNC(=O)CCCS d71a7511e56051353f5f76d32534489f [0,1,0,0,0,0|3,0,0]=4 1840 B11R0.81 CCSCCNC(=O)CCOC 43174eb7b6b512a7d0afbe0b9f344a65 [0,1,0,0,0,0|3,0,0]=4 1841 B11R0.81 CCSCCNC(=O)CCSC 4dce0d397f7e5f7bb9ff360e55b32e5e [0,1,0,0,0,0|3,0,0]=4 1842 B11R0.81 CCSCCNC(=O)CSCC 618931eb3238ccd09997ba70bf359774 [0,1,0,0,0,0|3,0,0]=4 1843 B11R0.81 CCSCCNC(=O)NCCF 1d95f87a3c69cbc2021f2baf298ed2a2 [0,1,0,0,0,0|3,0,0]=4 1844 B11R0.81 CCSCCNC(=O)NCCN a9a1e81a8e9f77fe5c5d1b914497c931 [0,1,0,0,0,0|3,0,0]=4 1845 B11R0.81 CCSCCNC(=O)NCCO 1dd015585b2d61b1eba88eedbedbd447 [0,1,0,0,0,0|3,0,0]=4 1846 B11R0.81 CCSCCNC(=O)NCCS a3c72b8e4940095102ef6eff0ef34fde [0,1,0,0,0,0|3,0,0]=4 1847 B11R0.81 COCCC(=O)NCCCCCl fa66e0b355b29716ed9ecfda5f87d98a [0,1,0,0,0,0|3,0,0]=4 1848 B11R0.81 COCCC(=O)NCCCCO daa4a244695bc10ddab6adc5fc18e997 [0,1,0,0,0,0|3,0,0]=4 1849 B11R0.81 COCCC(=O)NCCCCS bac386b0d813fa61a81f3ecae28d0a64 [0,1,0,0,0,0|3,0,0]=4 1850 B11R0.81 COCCC(=O)NCCCSC 8fd445ba13081a0d2c2426e57760d0ba [0,1,0,0,0,0|3,0,0]=4 1851 B11R0.81 COCCCNC(=O)CCCF 2c531f69f62fc577656d9984208b0e22 [0,1,0,0,0,0|3,0,0]=4 1852 B11R0.81 COCCCNC(=O)CCCS 7fcfa201737bfc760d0b905122df9d90 [0,1,0,0,0,0|3,0,0]=4 1853 B11R0.81 COCCCNC(=O)CCOC 0d851eba3b5b9a8db5c33d4c3292d86c [0,1,0,0,0,0|3,0,0]=4 1854 B11R0.81 COCCCNC(=O)CCSC bd256f537cf5b60a44ed5d07cd5d7f53 [0,1,0,0,0,0|3,0,0]=4 1855 B11R0.81 COCCCNC(=O)NCCF 12b124ff709c3edc39691dc9fc12c93e [0,1,0,0,0,0|3,0,0]=4 1856 B11R0.81 COCCCNC(=O)NCCN bb7a011176a47dbb7994f38d610624cf [0,1,0,0,0,0|3,0,0]=4 1857 B11R0.81 COCCCNC(=O)NCCO 4f237309a823844bbe703c65ddaf0519 [0,1,0,0,0,0|3,0,0]=4 1858 B11R0.81 COCCCNC(=O)NCCS 8f5f9272716d7b2c795bfbfd05e4fb65 [0,1,0,0,0,0|3,0,0]=4 1859 B11R0.81 COCCNCC(=O)CCSC 5be4eb7720dabc43c193d5d4bbc19b3b [0,1,0,0,0,0|3,0,0]=4 1860 B11R0.81 COCCNCC(=O)NCCO 81bdc36d564c90a41dd8acfb110002a0 [0,1,0,0,0,0|3,0,0]=4 1861 B11R0.81 COCCOCC(=O)CCSC bf443902e1b236552ef3f67d8fe6d8d2 [0,1,0,0,0,0|3,0,0]=4 1862 B11R0.81 COCCOCC(=O)NCCBr b5847c3109d847650d2b8bdd4a0e8391 [0,1,0,0,0,0|3,0,0]=4 1863 B11R0.81 COCCOCC(=O)NCCF 2515f49b8f15241537f7e6c0efd9b2a9 [0,1,0,0,0,0|3,0,0]=4 1864 B11R0.81 COCCOCC(=O)NCCI fed40a0be37b429f1f6573963e687601 [0,1,0,0,0,0|3,0,0]=4 1865 B11R0.81 COCCOCC(=O)NCCO 6303af86a73e07769fc1e91790754b51 [0,1,0,0,0,0|3,0,0]=4 1866 B11R0.81 COCCOCC(=O)NCCS 02216fe0ef5ec913e1821c157d609b45 [0,1,0,0,0,0|3,0,0]=4 1867 B11R0.81 COCCSCC(=O)NCCBr 9fe0bcf21d5a0a1d838595eb98d705f8 [0,1,0,0,0,0|3,0,0]=4 1868 B11R0.81 COCCSCC(=O)NCCF 860bf180cf34baf895e4c61e26231c94 [0,1,0,0,0,0|3,0,0]=4 1869 B11R0.81 COCCSCC(=O)NCCI a3ab47392432981d3ced0a8317f2beab [0,1,0,0,0,0|3,0,0]=4 1870 B11R0.81 COCCSCC(=O)NCCO c76ef4ac687500ee4bd1d7ce9ebecb12 [0,1,0,0,0,0|3,0,0]=4 1871 B11R0.81 COCCSCC(=O)NCCS e5290b311e6e15c458716bab674f8d6a [0,1,0,0,0,0|3,0,0]=4 1872 B11R0.81 CSCCC(=O)CNCCCCl dd1ae7240fd1dd4e7f54014aa4723b17 [0,1,0,0,0,0|3,0,0]=4 1873 B11R0.81 CSCCC(=O)CNCCCO e9b4b7fac7f00960c612d25a105b89ea [0,1,0,0,0,0|3,0,0]=4 1874 B11R0.81 CSCCC(=O)COCCCF 6987f6fc8904dd5119a0ef8b37b5c10b [0,1,0,0,0,0|3,0,0]=4 1875 B11R0.81 CSCCC(=O)COCCCS cdac7e787767a3913cf911e7f14dbf0d [0,1,0,0,0,0|3,0,0]=4 1876 B11R0.81 CSCCC(=O)NCCCCCl e31fc2f29c10b7ed2ed8afda323e677e [0,1,0,0,0,0|3,0,0]=4 1877 B11R0.81 CSCCC(=O)NCCCCO a953872b286eb5b4d6a71a9d0a155648 [0,1,0,0,0,0|3,0,0]=4 1878 B11R0.81 CSCCC(=O)NCCCCS 23e734bd7232ee8ac3124e1dff91694c [0,1,0,0,0,0|3,0,0]=4 1879 B11R0.81 CSCCCNC(=O)CCCF 800860f237cabd272e2c8031ce8a4a65 [0,1,0,0,0,0|3,0,0]=4 1880 B11R0.81 CSCCCNC(=O)CCCS a9a8210d9fcb03a0870a9228f1e707af [0,1,0,0,0,0|3,0,0]=4 1881 B11R0.81 CSCCCNC(=O)CCSC 24992b0fd6036b5e47ab1e4f6ef55d39 [0,1,0,0,0,0|3,0,0]=4 1882 B11R0.81 CSCCCNC(=O)NCCF 8331bd1692de29b8b2e08c180ab78be2 [0,1,0,0,0,0|3,0,0]=4 1883 B11R0.81 CSCCCNC(=O)NCCN 4055091a51b35847c678d0eab53a0eac [0,1,0,0,0,0|3,0,0]=4 1884 B11R0.81 CSCCCNC(=O)NCCO b92aa979aa9fbb7b42f3d1c095891073 [0,1,0,0,0,0|3,0,0]=4 1885 B11R0.81 CSCCCNC(=O)NCCS 11af555a22ac4649591667998862f480 [0,1,0,0,0,0|3,0,0]=4 1886 B11R0.81 CSCCNCC(=O)CCSC 3fc20948f98e02d1836f75a6d80432d8 [0,1,0,0,0,0|3,0,0]=4 1887 B11R0.81 CSCCNCC(=O)NCCO 0fb50722840658c29689e360d6941155 [0,1,0,0,0,0|3,0,0]=4 1888 B11R0.81 CSCCOCC(=O)CCSC 5a133529456a1b1b3e7528e917dbbd7c [0,1,0,0,0,0|3,0,0]=4 1889 B11R0.81 CSCCOCC(=O)NCCBr 2c16959a403eb0ba6e71cf4158d15b18 [0,1,0,0,0,0|3,0,0]=4 1890 B11R0.81 CSCCOCC(=O)NCCF b15f8dbdf90846ba8ece9e290ea71891 [0,1,0,0,0,0|3,0,0]=4 1891 B11R0.81 CSCCOCC(=O)NCCI d0950ad41dd85fe34fbb7432d26ee0f8 [0,1,0,0,0,0|3,0,0]=4 1892 B11R0.81 CSCCOCC(=O)NCCO ebf0cfccffe84f365101574f72daf883 [0,1,0,0,0,0|3,0,0]=4 1893 B11R0.81 CSCCOCC(=O)NCCS 5ef1503acdd5553cbe432944a312d71d [0,1,0,0,0,0|3,0,0]=4 1894 B11R0.81 CSSCCCC(=O)NCCBr 37009ed204e47e14e0b22989a6fe8007 [0,1,0,0,0,0|3,0,0]=4 1895 B11R0.81 CSSCCCC(=O)NCCF 90afc2eff1e4fce077351c86c4f33698 [0,1,0,0,0,0|3,0,0]=4 1896 B11R0.81 CSSCCCC(=O)NCCI 6256508fdc9ac1806963b3a7abc79eba [0,1,0,0,0,0|3,0,0]=4 1897 B11R0.81 CSSCCCC(=O)NCCO d27d71dc96d7c1cff3fbd9e1d2de075e [0,1,0,0,0,0|3,0,0]=4 1898 B11R0.81 CSSCCCC(=O)NCCS c0c94ca7ec49901b1158e236d7ff5e47 [0,1,0,0,0,0|3,0,0]=4 1899 B11R0.81 N#CCNC(=O)CCCCCF 5819d534937fca986c879de51b1baa07 [0,1,0,0,0,0|2,0,1]=4 1900 B11R0.81 N#CCNC(=O)CCCCCO 2520d65a1844a02ac74b07ec7b65bb8e [0,1,0,0,0,0|2,0,1]=4 1901 B11R0.81 N#CCNC(=O)CCCCCS c41ecd00442a9705c40513a9ecd5bddf [0,1,0,0,0,0|2,0,1]=4 1902 B11R0.81 NCCCCNC(=O)NCCF 234191d0309773893be01aca564443c7 [0,1,0,0,0,0|3,0,0]=4 1903 B11R0.81 NCCCCNC(=O)NCCN 3847200ee23587604472c761d3859e43 [0,1,0,0,0,0|3,0,0]=4 1904 B11R0.81 NCCCCNC(=O)NCCO 079cdb9138aff7e94ec4fb144870865d [0,1,0,0,0,0|3,0,0]=4 1905 B11R0.81 NCCCCNC(=O)NCCS 8660b0770b1b4c8a864245dc7db0e830 [0,1,0,0,0,0|3,0,0]=4 1906 B11R0.81 NCCNC(=O)NCCCCO c83c6acac482131bf7bb7c1103fade7e [0,1,0,0,0,0|3,0,0]=4 1907 B11R0.81 NCCNC(=O)NCCCCS f0eb4d9ab2f431251d7de15abc0ec239 [0,1,0,0,0,0|3,0,0]=4 1908 B11R0.81 O=C(CCCCCF)NCCBr 8751d11b09a34136ffccc132e4c0d1e0 [0,1,0,0,0,0|2,0,0]=3 1909 B11R0.81 O=C(CCCCCF)NCCF 17498c23ec8082330daece5a4ba27aaf [0,1,0,0,0,0|2,0,0]=3 1910 B11R0.81 O=C(CCCCCF)NCCI ec57eb76c961521d0a84ef9e2f37d204 [0,1,0,0,0,0|2,0,0]=3 1911 B11R0.81 O=C(CCCCCF)NCCO a6b2e4d0a25eb301cb1af993e86e54a1 [0,1,0,0,0,0|2,0,0]=3 1912 B11R0.81 O=C(CCCCCF)NCCS 4b3f5dc5836aa35f7d7d2716d84e4426 [0,1,0,0,0,0|2,0,0]=3 1913 B11R0.81 O=C(CCCCCO)NCCBr 704ebe78e977a00f48c027ec07ffcd4a [0,1,0,0,0,0|2,0,0]=3 1914 B11R0.81 O=C(CCCCCO)NCCF 54d69f2dc2b2af65be0ddaa976883c73 [0,1,0,0,0,0|2,0,0]=3 1915 B11R0.81 O=C(CCCCCO)NCCI 2651ff58468fdc9c1833d602d182571b [0,1,0,0,0,0|2,0,0]=3 1916 B11R0.81 O=C(CCCCCO)NCCO c078daec7d9e5708816806003dfc6cfe [0,1,0,0,0,0|2,0,0]=3 1917 B11R0.81 O=C(CCCCCO)NCCS 96315123b21bd68ceb104c5965b3e411 [0,1,0,0,0,0|2,0,0]=3 1918 B11R0.81 O=C(CCCCCS)NCCBr ac072fe90b5f32df3f590db3abe50e43 [0,1,0,0,0,0|2,0,0]=3 1919 B11R0.81 O=C(CCCCCS)NCCF b0c3139a3ac88a7d1cef649196198b49 [0,1,0,0,0,0|2,0,0]=3 1920 B11R0.81 O=C(CCCCCS)NCCI 8cedde78026096d0a6a276a7aa25baa7 [0,1,0,0,0,0|2,0,0]=3 1921 B11R0.81 O=C(CCCCCS)NCCO 4421a54cfacceae52214a7abecc953e9 [0,1,0,0,0,0|2,0,0]=3 1922 B11R0.81 O=C(CCCCCS)NCCS bba35b924266de4b1f08a631536d56f6 [0,1,0,0,0,0|2,0,0]=3 1923 B11R0.81 O=C(CCCF)NCCCCCl 1f3ca6e61f6cbcdcedd9ca90bb37acfe [0,1,0,0,0,0|3,0,0]=4 1924 B11R0.81 O=C(CCCF)NCCCCO 3a667fbe15ddf93ad0ffdcade58dd1ae [0,1,0,0,0,0|3,0,0]=4 1925 B11R0.81 O=C(CCCF)NCCCCS e020cc73e10fd8bef71392a8dfe68c04 [0,1,0,0,0,0|3,0,0]=4 1926 B11R0.81 O=C(CCCS)NCCCCCl 32b280fb16e53639f9558a99d6a32d6f [0,1,0,0,0,0|3,0,0]=4 1927 B11R0.81 O=C(CCCS)NCCCCO 67ef06b7998e6d353837784fecda60c4 [0,1,0,0,0,0|3,0,0]=4 1928 B11R0.81 O=C(CCCS)NCCCCS ad4090d0613a51cc87b2e819db1232d7 [0,1,0,0,0,0|3,0,0]=4 1929 B11R0.81 O=C(CCOCCO)NCCBr 62cd0fb1c05c58ae3ddc36efc65b1ec1 [0,1,0,0,0,0|3,0,0]=4 1930 B11R0.81 O=C(CCOCCO)NCCF e5bd2929ffb957fc3fa422888baf52fc [0,1,0,0,0,0|3,0,0]=4 1931 B11R0.81 O=C(CCOCCO)NCCI 7d0b40cbdbea27351e0b1e1ab945d400 [0,1,0,0,0,0|3,0,0]=4 1932 B11R0.81 O=C(CCOCCO)NCCO b5049c9852f9ac9f33099ec6cd550cb0 [0,1,0,0,0,0|3,0,0]=4 1933 B11R0.81 O=C(CCOCCO)NCCS 3a292b67ca6564ae87b8e19706e74635 [0,1,0,0,0,0|3,0,0]=4 1934 B11R0.81 O=C(CCOCCS)NCCBr 02b0dc75eb5e3bdf518914c76f45d95d [0,1,0,0,0,0|3,0,0]=4 1935 B11R0.81 O=C(CCOCCS)NCCF a881b34e543221e780b1ea08c7eba6f0 [0,1,0,0,0,0|3,0,0]=4 1936 B11R0.81 O=C(CCOCCS)NCCI 2762de6b5e27a10a7c2ef4ffa5f39809 [0,1,0,0,0,0|3,0,0]=4 1937 B11R0.81 O=C(CCOCCS)NCCO 4463197d77a2d6449721acd73bc503fa [0,1,0,0,0,0|3,0,0]=4 1938 B11R0.81 O=C(CCOCCS)NCCS 552889446dfe5eb2434ce210ece126c7 [0,1,0,0,0,0|3,0,0]=4 1939 B11R0.81 O=C(CNCCCF)NCCO 7eba1e596c4f8c00f31f563482b7b011 [0,1,0,0,0,0|3,0,0]=4 1940 B11R0.81 O=C(CNCCCO)NCCO 29465c17514d92b0cdd04513f4288b43 [0,1,0,0,0,0|3,0,0]=4 1941 B11R0.81 O=C(CNCCCS)NCCO aafbe4e9b7adc4061d9c1f3f372ea565 [0,1,0,0,0,0|3,0,0]=4 1942 B11R0.81 O=C(NCCF)NCCCCO 417324f0aa65bb7b8b9001c643e97778 [0,1,0,0,0,0|3,0,0]=4 1943 B11R0.81 O=C(NCCF)NCCCCS f78784404c6a8e7447376ede977811ac [0,1,0,0,0,0|3,0,0]=4 1944 B11R0.81 O=C(NCCO)NCCCCO 3b386936e4a37f412318c7c8e5a4d64b [0,1,0,0,0,0|3,0,0]=4 1945 B11R0.81 O=C(NCCO)NCCCCS bf8f0dd4d7fc8aee74b8a7d0f1d2b07f [0,1,0,0,0,0|3,0,0]=4 1946 B11R0.81 O=C(NCCS)NCCCCO 48058544b9e61583d29b8e092f6909db [0,1,0,0,0,0|3,0,0]=4 1947 B11R0.81 O=C(NCCS)NCCCCS 1862ac58856473f9beb71b3a13765ad5 [0,1,0,0,0,0|3,0,0]=4 1948 B11R0.81 O=CCCCCC(=O)NCCBr 7a0245b7f929a8b112f00bf81a5923fd [0,1,0,0,0,0|2,0,1]=4 1949 B11R0.81 O=CCCCCC(=O)NCCF 0d141a5574a193d627f8b5944b873252 [0,1,0,0,0,0|2,0,1]=4 1950 B11R0.81 O=CCCCCC(=O)NCCI 26b737efbe2e9742edeefb6ed4be2691 [0,1,0,0,0,0|2,0,1]=4 1951 B11R0.81 O=CCCCCC(=O)NCCO 685de42821e67cc2efa107a2e8f04005 [0,1,0,0,0,0|2,0,1]=4 1952 B11R0.81 O=CCCCCC(=O)NCCS 4bdbe7a97cf4cb7dcc3ea1943c6ba76b [0,1,0,0,0,0|2,0,1]=4 1953 B11R0.140 C#CCCCC(=O)NCCCC 95249a78fdae8bcbc7a6a5cf290c2ffb [0,1,0,0,0,0|1,0,2]=4 1954 B11R0.140 C#CCCCC(=O)NCCCCl e5e1f1e7430cb064d0430dff100a99fc [0,1,0,0,0,0|1,0,2]=4 1955 B11R0.140 C#CCCCC(=O)NCCCO 700703f6428cf7e2fe33a68d093ace0f [0,1,0,0,0,0|1,0,2]=4 1956 B11R0.140 C#CCCCC(=O)NCCOC 7c94a99e356cc20be85fd262eae2ba72 [0,1,0,0,0,0|1,0,2]=4 1957 B11R0.140 C#CCCCC(=O)NCCSC f6602b81059dca8acf236fce4b32493e [0,1,0,0,0,0|1,0,2]=4 1958 B11R0.140 C#CCCNC(=O)CCCCC a9bbd99a35caa6f8f4b5bd0685faf30f [0,1,0,0,0,0|1,0,1]=3 1959 B11R0.140 C#CCCNC(=O)CCCCF 999ca3c075a5979b366070c84ec2f0e3 [0,1,0,0,0,0|2,0,1]=4 1960 B11R0.140 C#CCCNC(=O)CCCCO 0cfe2b839c43117df240e006e51cbd45 [0,1,0,0,0,0|2,0,1]=4 1961 B11R0.140 C#CCCNC(=O)CCCCS 88c67e017f80cca5b275a1364fd0eb46 [0,1,0,0,0,0|2,0,1]=4 1962 B11R0.140 C#CCCNC(=O)CCCOC 01805b86f6c1170467cc63ee3906b276 [0,1,0,0,0,0|2,0,1]=4 1963 B11R0.140 C#CCCNC(=O)CCCSC d2539e16e90688abe16b7d8a96a042f9 [0,1,0,0,0,0|2,0,1]=4 1964 B11R0.140 C#CCCNC(=O)CCOCC d8d9bafa18125278f4d90d679e128518 [0,1,0,0,0,0|2,0,1]=4 1965 B11R0.140 C#CCCNC(=O)CCSCC 74ed21a254291072f469e8e60fb0f22c [0,1,0,0,0,0|2,0,1]=4 1966 B11R0.140 C#CCCNC(=O)COCCC 6b57844fce1611cfbe51c5115aa3eec1 [0,1,0,0,0,0|1,0,2]=4 1967 B11R0.140 C#CCCNC(=O)CSCCC 41b6fb51851ace0c86b544bd4a56aeea [0,1,0,0,0,0|2,0,1]=4 1968 B11R0.140 C#CCCNC(=O)NCCCC a767c34bcda075fc306fb28d6d62f441 [0,1,0,0,0,0|2,0,1]=4 1969 B11R0.140 C#CCCOC(C)CCCCC bcd266bfa3d01ab80830202bf8052441 [0,1,0,0,0,0|1,0,2]=4 1970 B11R0.140 C#CCCO[C@@H](C)CCCCC d54cb69f9199441efd44ae59370d27d4 [0,1,0,0,0,0|1,0,2]=4 1971 B11R0.140 C#CCCO[C@H](C)CCCCC aac0b59a3618736cfa12231583aad515 [0,1,0,0,0,0|1,0,2]=4 1972 B11R0.140 C#CCNCC(=O)CCCCC 5918c2c4a787e0b46ab1aaefb6488f54 [0,1,0,0,0,0|1,0,2]=4 1973 B11R0.140 C#CCNCC(=O)OCCCC 5c0534c91f8d5747a5e1a27dc7e81478 [0,1,0,0,0,0|1,0,2]=4 1974 B11R0.140 C#CCNCC(=O)OCCOC 71ceede397836b01c1e4040eeadf1eed [0,1,0,0,0,0|1,0,2]=4 1975 B11R0.140 C#CCOCC(=O)CCCCC 45e42a6b26bc80ba2f4228742a887060 [0,1,0,0,0,0|0,0,2]=3 1976 B11R0.140 C#CCOCC(=O)NCCCC 98cc5a8793230b6a46c8be1cbf1bbf2f [0,1,0,0,0,0|1,0,2]=4 1977 B11R0.140 C#CCOCC(=O)OCCCC edf06f632d7ffa06ce3595cf93ef3d3c [0,1,0,0,0,0|1,0,2]=4 1978 B11R0.140 C#CCOCC(=O)OCCOC a6f269b54d5de7364fad5d236be07f57 [0,1,0,0,0,0|1,0,2]=4 1979 B11R0.140 C/C=C/COC(C)CCCCC 77edce5e1f30cd6a3da66dfc67688109 [0,1,0,0,0,0|1,0,2]=4 1980 B11R0.140 C/C=C/CO[C@@H](C)CCCCC 597df5ea4894014a88d84ac3692dc051 [0,1,0,0,0,0|1,0,2]=4 1981 B11R0.140 C/C=C/CO[C@H](C)CCCCC 65192d271f93182bbe16e8ef03423efa [0,1,0,0,0,0|1,0,2]=4 1982 B11R0.140 C/C=C\COC(C)CCCCC 61108ccd8912e90374f2c527331982bf [0,1,0,0,0,0|1,0,2]=4 1983 B11R0.140 C/C=C\CO[C@@H](C)CCCCC f324ed47ae8365f25bba4580d4c66f10 [0,1,0,0,0,0|1,0,2]=4 1984 B11R0.140 C/C=C\CO[C@H](C)CCCCC b35955222a9d1240cc101bd57a321e15 [0,1,0,0,0,0|1,0,2]=4 1985 B11R0.140 C=CCCCC(=O)NCCCC 6d2132f42daac5448f208f6d84f25184 [0,1,0,0,0,0|1,0,2]=4 1986 B11R0.140 C=CCCCC(=O)NCCCCl e39162b9c05762b0875e6ed173054c93 [0,1,0,0,0,0|1,0,2]=4 1987 B11R0.140 C=CCCCC(=O)NCCCO bfb9b3e96f69f398e1c904670f5b95a8 [0,1,0,0,0,0|1,0,2]=4 1988 B11R0.140 C=CCCCC(=O)NCCOC 9414d7d2d1ef561b874288ab1e7102f3 [0,1,0,0,0,0|1,0,2]=4 1989 B11R0.140 C=CCCCC(=O)NCCSC 57fda57586bab5de7203b59ba748be49 [0,1,0,0,0,0|1,0,2]=4 1990 B11R0.140 C=CCCNC(=O)CCCCC ccfc1d4e79a22e0330d2fa7d1df94d4d [0,1,0,0,0,0|1,0,1]=3 1991 B11R0.140 C=CCCNC(=O)CCCCF 9c9e553a0ff384a737aadac408858a52 [0,1,0,0,0,0|2,0,1]=4 1992 B11R0.140 C=CCCNC(=O)CCCCO 9ef4977266b5f91804a36698f79b139e [0,1,0,0,0,0|2,0,1]=4 1993 B11R0.140 C=CCCNC(=O)CCCCS 98514e276313048ded55db3c868f212c [0,1,0,0,0,0|2,0,1]=4 1994 B11R0.140 C=CCCNC(=O)CCCOC aa6c34b86f2e85c36c32c68106ba68b2 [0,1,0,0,0,0|2,0,1]=4 1995 B11R0.140 C=CCCNC(=O)CCCSC 2bd8a4da3b8974394d82284e8a059908 [0,1,0,0,0,0|2,0,1]=4 1996 B11R0.140 C=CCCNC(=O)CCOCC 87beeafd000e0dfd8a4ce8aa2780f644 [0,1,0,0,0,0|2,0,1]=4 1997 B11R0.140 C=CCCNC(=O)CCSCC 1e2d6721128920b6e596651e612bc06a [0,1,0,0,0,0|2,0,1]=4 1998 B11R0.140 C=CCCNC(=O)COCCC 64fac8e13ed0a34b200e7a822320d620 [0,1,0,0,0,0|1,0,2]=4 1999 B11R0.140 C=CCCNC(=O)CSCCC f84cd108c5d6be57edb8b1af7653a556 [0,1,0,0,0,0|2,0,1]=4 2000 B11R0.140 C=CCCNC(=O)NCCCC de2d7ba75d475196bb82b6d5d3e79b46 [0,1,0,0,0,0|2,0,1]=4 2001 B11R0.140 C=CCCOC(C)CCCCC 0674bd7ad4b82713d3054fec519b7071 [0,1,0,0,0,0|1,0,2]=4 2002 B11R0.140 C=CCCO[C@@H](C)CCCCC e94794e481d64dafbcfd2292f8da503f [0,1,0,0,0,0|1,0,2]=4 2003 B11R0.140 C=CCCO[C@H](C)CCCCC d489e0f89e8de2a7a5c798580c64906a [0,1,0,0,0,0|1,0,2]=4 2004 B11R0.140 C=CCOCC(=O)NCCCC d455ebae115b3b968e174f8dd4a40e63 [0,1,0,0,0,0|1,0,2]=4 2005 B11R0.140 C=CCOCC(=O)OCCCC 71db131d5b82554b7d5eeddd2e3cb12d [0,1,0,0,0,0|1,0,2]=4 2006 B11R0.140 CC#CCCC(=O)NCCCC 4f73b7b0c7d56ee8a5f65c5dd5eb0b41 [0,1,0,0,0,0|1,0,2]=4 2007 B11R0.140 CC#CCCC(=O)NCCCCl 654f2532f86acb0620c1116923c42cc7 [0,1,0,0,0,0|1,0,2]=4 2008 B11R0.140 CC#CCCC(=O)NCCCO 58d28f38e70bf8870bf63da030182496 [0,1,0,0,0,0|1,0,2]=4 2009 B11R0.140 CC#CCCC(=O)NCCOC 281d6192234df288b3b578051440caac [0,1,0,0,0,0|1,0,2]=4 2010 B11R0.140 CC#CCCC(=O)NCCSC 764264a1f66319de986f402b901477cd [0,1,0,0,0,0|1,0,2]=4 2011 B11R0.140 CC#CCNC(=O)CCCCC 17c7dc449bc105e8680d59d1b56c7cf1 [0,1,0,0,0,0|1,0,1]=3 2012 B11R0.140 CC#CCNC(=O)CCCCF 9c4e17abc2784e69c730724c5e1448b8 [0,1,0,0,0,0|2,0,1]=4 2013 B11R0.140 CC#CCNC(=O)CCCCO 45bddf340eee4773282da2a7878fa933 [0,1,0,0,0,0|2,0,1]=4 2014 B11R0.140 CC#CCNC(=O)CCCCS 57773b932cb8b193c938fa9dc9ca45b0 [0,1,0,0,0,0|2,0,1]=4 2015 B11R0.140 CC#CCNC(=O)CCCOC 52dd6aa189a9a4b9c7849ba548942e93 [0,1,0,0,0,0|2,0,1]=4 2016 B11R0.140 CC#CCNC(=O)CCCSC a095a9f12623cb1390d29a244462e231 [0,1,0,0,0,0|2,0,1]=4 2017 B11R0.140 CC#CCNC(=O)CCOCC c7bf975172e9782036b4a876b7f1796c [0,1,0,0,0,0|2,0,1]=4 2018 B11R0.140 CC#CCNC(=O)CCSCC 9969a58da5703c0fc6b965c1b2136f37 [0,1,0,0,0,0|2,0,1]=4 2019 B11R0.140 CC#CCNC(=O)COCCC 7c07c20df7fc0bbde983b0b1f8ad65f9 [0,1,0,0,0,0|1,0,2]=4 2020 B11R0.140 CC#CCNC(=O)CSCCC 52b948331ad0e18840824a9bce559ae2 [0,1,0,0,0,0|2,0,1]=4 2021 B11R0.140 CC#CCNC(=O)NCCCC 8ca63fa603a8a16485876f00754be343 [0,1,0,0,0,0|2,0,1]=4 2022 B11R0.140 CC#CCOC(C)CCCCC d1b415d76b04f1acf73d242d2c3fde2d [0,1,0,0,0,0|1,0,2]=4 2023 B11R0.140 CC#CCO[C@@H](C)CCCCC 26190bc701f8260d6e2db9ba102e8e68 [0,1,0,0,0,0|1,0,2]=4 2024 B11R0.140 CC/C=C/CC(=O)NCCCC f5d19303ca4643ec0b658b5bc9971b9e [0,1,0,0,0,0|1,0,2]=4 2025 B11R0.140 CC/C=C/CC(=O)NCCCCl 8525e0b6ea541fbbd3e6db87d90a9925 [0,1,0,0,0,0|1,0,2]=4 2026 B11R0.140 CC/C=C/CC(=O)NCCCO 230b9f9150c999c429977e2f0ec6c7bc [0,1,0,0,0,0|1,0,2]=4 2027 B11R0.140 CC/C=C/CC(=O)NCCOC 5d7bd38deee03771f1ef7864387b0638 [0,1,0,0,0,0|1,0,2]=4 2028 B11R0.140 CC/C=C/CC(=O)NCCSC d7d550f9130ab9b668edd871739b4043 [0,1,0,0,0,0|1,0,2]=4 2029 B11R0.140 CC/C=C\CC(=O)NCCCC 11d0e998387eba551162e4eef8a7f350 [0,1,0,0,0,0|1,0,2]=4 2030 B11R0.140 CC/C=C\CC(=O)NCCCCl 838a81a953622da8e2da91dba2939cbe [0,1,0,0,0,0|1,0,2]=4 2031 B11R0.140 CC/C=C\CC(=O)NCCCO f5fc1f256f9474793d2ba36c86b57d81 [0,1,0,0,0,0|1,0,2]=4 2032 B11R0.140 CC/C=C\CC(=O)NCCOC 8cc15dc72cf8415749b2baacf2d8b569 [0,1,0,0,0,0|1,0,2]=4 2033 B11R0.140 CC/C=C\CC(=O)NCCSC 8c4eb3cfaf6c31eb4912aece402dfca1 [0,1,0,0,0,0|1,0,2]=4 2034 B11R0.140 CC=CCCC(=O)NCCCC cb7b4f363ee80a4e8c2f125d20ba6811 [0,1,0,0,0,0|1,0,2]=4 2035 B11R0.140 CC=CCCC(=O)NCCCCl 2ec3279cd40e7e9bfe2b15bc239eb833 [0,1,0,0,0,0|1,0,2]=4 2036 B11R0.140 CC=CCCC(=O)NCCCO 2893c1db8edea7eafd09c8d22061f316 [0,1,0,0,0,0|1,0,2]=4 2037 B11R0.140 CC=CCCC(=O)NCCOC 0df831c1aa69673b3d14b8cff481cb35 [0,1,0,0,0,0|1,0,2]=4 2038 B11R0.140 CC=CCCC(=O)NCCSC 8b087c537bc71d2be3869f883dd9c710 [0,1,0,0,0,0|1,0,2]=4 2039 B11R0.140 CC=CCNC(=O)CCCCC 26655ea04bc309f17742144a729b0fd4 [0,1,0,0,0,0|1,0,1]=3 2040 B11R0.140 CC=CCNC(=O)CCCCF f87ced2e984f89ea87e8e498ba036483 [0,1,0,0,0,0|2,0,1]=4 2041 B11R0.140 CC=CCNC(=O)CCCCO 3125145a42026e0988b60a1ba6e7f50f [0,1,0,0,0,0|2,0,1]=4 2042 B11R0.140 CC=CCNC(=O)CCCCS cc3447f5f00937aec9877dbbcd00e5a1 [0,1,0,0,0,0|2,0,1]=4 2043 B11R0.140 CC=CCNC(=O)CCCOC e546d96b2df4bfaba88a71b8fd693c78 [0,1,0,0,0,0|2,0,1]=4 2044 B11R0.140 CC=CCNC(=O)CCCSC a83527fcfcaf43a8314a379bba7c8c29 [0,1,0,0,0,0|2,0,1]=4 2045 B11R0.140 CC=CCNC(=O)CCOCC 39cffaf99432733d1f60b7f495d7ae90 [0,1,0,0,0,0|2,0,1]=4 2046 B11R0.140 CC=CCNC(=O)CCSCC b1ff1dba938b55e069ee8bbd8df5c9ce [0,1,0,0,0,0|2,0,1]=4 2047 B11R0.140 CC=CCNC(=O)COCCC 70111631e28069ee0aff9fe0bfe37ea7 [0,1,0,0,0,0|1,0,2]=4 2048 B11R0.140 CC=CCNC(=O)CSCCC 238a05904fd8cf21a2d8ec4896a66833 [0,1,0,0,0,0|2,0,1]=4 2049 B11R0.140 CC=CCNC(=O)NCCCC 67c895ef16224c0adf1c9128f8cbb59e [0,1,0,0,0,0|2,0,1]=4 2050 B11R0.140 CC=CCOC(C)CCCCC 4b171f95f050f4e502840e022150e218 [0,1,0,0,0,0|1,0,2]=4 2051 B11R0.140 CC=CCO[C@@H](C)CCCCC db6495fe183ce091d7516f693f8a9ca5 [0,1,0,0,0,0|1,0,2]=4 2052 B11R0.140 CCC/C=C/C(=O)NCCCC 80625e1947178f3df8755baf6735f5ae [0,1,0,0,0,0|2,0,0]=3 2053 B11R0.140 CCC/C=C/C(=O)NCCCCl 78e591479872c98c0a2869aa626289a5 [0,1,0,0,0,0|1,0,2]=4 2054 B11R0.140 CCC/C=C/C(=O)NCCCO af752e45c8cc94188d87d0e1bef80d4c [0,1,0,0,0,0|1,0,2]=4 2055 B11R0.140 CCC/C=C/C(=O)NCCOC 36c423860f4b5048bc8c8f1b85892806 [0,1,0,0,0,0|1,0,2]=4 2056 B11R0.140 CCC/C=C/C(=O)NCCSC 1e507c4e7f156c3942d8eb0fbdbd7c34 [0,1,0,0,0,0|1,0,2]=4 2057 B11R0.140 CCC=CCC(=O)NCCCC 276c36d7376bcaaf663c9582d9b22ece [0,1,0,0,0,0|1,0,2]=4 2058 B11R0.140 CCC=CCC(=O)NCCCCl f3eb546bb758e6d39def49e2c727c2db [0,1,0,0,0,0|1,0,2]=4 2059 B11R0.140 CCC=CCC(=O)NCCCO 9171facbf23869c20f5493ce2b3d543f [0,1,0,0,0,0|1,0,2]=4 2060 B11R0.140 CCC=CCC(=O)NCCOC 8ba98a68b69686608513d7f27954602a [0,1,0,0,0,0|1,0,2]=4 2061 B11R0.140 CCC=CCC(=O)NCCSC 0a639c7c611351fbb2559e2e19759851 [0,1,0,0,0,0|1,0,2]=4 2062 B11R0.140 CCCC#CC(=O)NCCCC d2087476454a2787d265bcad65b6b021 [0,1,0,0,0,0|2,0,0]=3 2063 B11R0.140 CCCC#CC(=O)NCCCCl f4b057e7bf184328e5b7212449993561 [0,1,0,0,0,0|1,0,2]=4 2064 B11R0.140 CCCC#CC(=O)NCCCO 7874657706f9882110e6c43b16aa531d [0,1,0,0,0,0|1,0,2]=4 2065 B11R0.140 CCCC#CC(=O)NCCOC ab446d7f9fa5fc33401666bf4490a93f [0,1,0,0,0,0|1,0,2]=4 2066 B11R0.140 CCCC#CC(=O)NCCSC d49a7fc2eb75ab88a39d14e7ede3713b [0,1,0,0,0,0|1,0,2]=4 2067 B11R0.140 CCCC=CC(=O)NCCCC 5acc6713e2bf0daf22650fcba518ad75 [0,1,0,0,0,0|2,0,0]=3 2068 B11R0.140 CCCC=CC(=O)NCCCCl ad619252ced2f5e8634fab08346fa3c9 [0,1,0,0,0,0|1,0,2]=4 2069 B11R0.140 CCCC=CC(=O)NCCCO cc37160b37c3881a88774026b02c4615 [0,1,0,0,0,0|1,0,2]=4 2070 B11R0.140 CCCC=CC(=O)NCCOC c0a1f53b13a45d03e5bf2f9022555dfd [0,1,0,0,0,0|1,0,2]=4 2071 B11R0.140 CCCC=CC(=O)NCCSC 9720e97efd5394bcfc24411bd1d0a022 [0,1,0,0,0,0|1,0,2]=4 2072 B11R0.140 CCCCCC(=O)CNCC#N ad0aefd5375e91cc934d29081eb9d15b [0,1,0,0,0,0|2,0,1]=4 2073 B11R0.140 CCCCCC(=O)CNCCBr 1f10a721c01d3ecd43612e8ec8b7d052 [0,1,0,0,0,0|2,0,0]=3 2074 B11R0.140 CCCCCC(=O)CNCCC fd232b76e9f9bbb3d7db54487f370b06 [0,1,0,0,0,0|1,0,0]=2 2075 B11R0.140 CCCCCC(=O)CNCCF d4ae106a8baf93b45a9f483b54893c49 [0,1,0,0,0,0|2,0,0]=3 2076 B11R0.140 CCCCCC(=O)CNCCI b08eadaceb0f499f070584823e374e3e [0,1,0,0,0,0|2,0,0]=3 2077 B11R0.140 CCCCCC(=O)CNCCO c5d05f98699f342415f344c3b79de128 [0,1,0,0,0,0|2,0,0]=3 2078 B11R0.140 CCCCCC(=O)CNCCS d6e40d1e7bd9311a00319d1ffcbab0fc [0,1,0,0,0,0|2,0,0]=3 2079 B11R0.140 CCCCCC(=O)COCC#N 5ce55c5cd0291b6188ba4c51c9d044dc [0,1,0,0,0,0|1,0,1]=3 2080 B11R0.140 CCCCCC(=O)COCCC cb320e50d7832de1cd1f91018c6e947e [0,1,0,0,0,0|0,0,0]=1 2081 B11R0.140 CCCCCC(=O)COCCF 92596ed2150951e3083a3787b1447f18 [0,1,0,0,0,0|1,0,0]=2 2082 B11R0.140 CCCCCC(=O)COCCS 605f1193c8ad05368871ad071cabfb34 [0,1,0,0,0,0|1,0,0]=2 2083 B11R0.140 CCCCCC(=O)COCOC 2fb3c5e1def92cce3b62e37ffde3bede [0,1,0,0,0,0|1,0,0]=2 2084 B11R0.140 CCCCCC(=O)NCCC#N eaebb4eb2b88a90dc0fa42c88e019855 [0,1,0,0,0,0|1,0,1]=3 2085 B11R0.140 CCCCCC(=O)NCCCC 8be837e1d42ad87c18e70b4bc1ddd96f [0,1,0,0,0,0|1,0,0]=2 2086 B11R0.140 CCCCCC(=O)NCCCCl 132fcd57cec9a23dfc44f19df4200b8b [0,1,0,0,0,0|1,0,0]=2 2087 B11R0.140 CCCCCC(=O)NCCCO f8b52b861e5b967b7710b4587a208b00 [0,1,0,0,0,0|1,0,0]=2 2088 B11R0.140 CCCCCC(=O)NCCOC 980741143c21106326804f2bfe601a35 [0,1,0,0,0,0|1,0,0]=2 2089 B11R0.140 CCCCCC(=O)NCCON d5df58e2ae6bafbc45f4e0a862432087 [0,1,0,0,0,0|2,0,0]=3 2090 B11R0.140 CCCCCC(=O)NCCSC 38106bfebf89c16a4d800be8f109d509 [0,1,0,0,0,0|1,0,0]=2 2091 B11R0.140 CCCCCC(=O)OCNC#N 6c91708ce187d13a05f8398699a2af53 [0,1,0,0,0,0|1,0,1]=3 2092 B11R0.140 CCCCCC(C)COCCC e611647d8511f40641ce15108dbc184c [0,1,0,0,0,0|1,0,1]=3 2093 B11R0.140 CCCCCC(C)COCCF 9c93c489ac8f71ad7c00da7795c505ad [0,1,0,0,0,0|2,0,1]=4 2094 B11R0.140 CCCCCC(C)COCCS 429b7290aef38d64b0d126c93c8fecae [0,1,0,0,0,0|2,0,1]=4 2095 B11R0.140 CCCCCC(C)COCOC a876db46dc7c22a9ddfbaba218876d1f [0,1,0,0,0,0|2,0,1]=4 2096 B11R0.140 CCCCCC(C)COCSC 9e9473f910cc17d934b84d6b85904a53 [0,1,0,0,0,0|2,0,1]=4 2097 B11R0.140 CCCCCC(C)NCCCC 9cf51aeb7bb493ad3dd8f6014e839675 [0,1,0,0,0,0|2,0,1]=4 2098 B11R0.140 CCCCCC(C)NCCCCl 213b8604b34558a2465dd7f4561c52bd [0,1,0,0,0,0|2,0,1]=4 2099 B11R0.140 CCCCCC(C)NCCCF 89b81dd327f265743bf9e5f18c3e333c [0,1,0,0,0,0|2,0,1]=4 2100 B11R0.140 CCCCCC(C)NCCCO 6ce8b1ff6fc28b8f96fcabf18f1f4835 [0,1,0,0,0,0|2,0,1]=4 2101 B11R0.140 CCCCCC(C)NCCCS 990672f0a8283534c1e1f957ef909830 [0,1,0,0,0,0|2,0,1]=4 2102 B11R0.140 CCCCCC(C)NCCOC b9a41d07284af229c8d3ffaa7956e984 [0,1,0,0,0,0|2,0,1]=4 2103 B11R0.140 CCCCCC(C)NCCSC e27eaa6c5a2ec3e1184e22e7525a8573 [0,1,0,0,0,0|2,0,1]=4 2104 B11R0.140 CCCCCC(C)NCOCC 741e2b0bd6a926f03c46ffe258a7a0e7 [0,1,0,0,0,0|2,0,1]=4 2105 B11R0.140 CCCCCC(C)OCCC#N ac348f65840ead7e012850b95085e6b3 [0,1,0,0,0,0|1,0,2]=4 2106 B11R0.140 CCCCCC(C)OCCC=O e6ec618b11d1c9bc00062141befcba74 [0,1,0,0,0,0|1,0,2]=4 2107 B11R0.140 CCCCCC(C)OCCCC 8a76446f0e285bd36a48a8d4c0c453d8 [0,1,0,0,0,0|1,0,1]=3 2108 B11R0.140 CCCCCC(C)OCCCF af3c9d7ac023d74404e5924b271ad6a1 [0,1,0,0,0,0|1,0,1]=3 2109 B11R0.140 CCCCCC(C)OCCCS 64e43f0c4600cdbeda7011f6ac422054 [0,1,0,0,0,0|1,0,1]=3 2110 B11R0.140 CCCCCC(C)OCCOC fe2352d541dfe6afb562c5239062c49c [0,1,0,0,0,0|1,0,1]=3 2111 B11R0.140 CCCCCC(C)OCCSC ad005d5bb77c3394b16814bde151db6c [0,1,0,0,0,0|1,0,1]=3 2112 B11R0.140 CCCCCN(C)CCCCC 0dab6e2b91abba48f221038b801f3e1f [0,1,0,0,0,0|3,0,0]=4 2113 B11R0.140 CCCCCN(C)CCCCF 6bb3274f80ef6608ce7c1b60f5ee59ee [0,1,0,0,0,0|3,0,0]=4 2114 B11R0.140 CCCCCN(C)CCCCO c1bda2d7c23ebff2ff15e9d21aa7f778 [0,1,0,0,0,0|3,0,0]=4 2115 B11R0.140 CCCCCN(C)CCCOC 7e278de42d4eb9c9f876ef14dc97c126 [0,1,0,0,0,0|3,0,0]=4 2116 B11R0.140 CCCCCN(C)CCCSC 841b1c3d5932711b07081d229371e5ec [0,1,0,0,0,0|3,0,0]=4 2117 B11R0.140 CCCCCN(C)CCOCC 6a3ee0dcd8dbea1498d511ddaaa3892e [0,1,0,0,0,0|3,0,0]=4 2118 B11R0.140 CCCCCN(C)CCSCC 4142d1ff41069c040d4c2adc29bab99f [0,1,0,0,0,0|3,0,0]=4 2119 B11R0.140 CCCCC[C@@H](C)OCCC#N 697092edbbb8f979b3dfb48802facaec [0,1,0,0,0,0|1,0,2]=4 2120 B11R0.140 CCCCC[C@@H](C)OCCC=O 13f5044c60c38ddef72f4178a1d792f0 [0,1,0,0,0,0|1,0,2]=4 2121 B11R0.140 CCCCC[C@@H](C)OCCCC e4672e1cdf0741af9395631f9acfa8ae [0,1,0,0,0,0|1,0,1]=3 2122 B11R0.140 CCCCC[C@@H](C)OCCCF 947a200163ddd103689858af03c8fa82 [0,1,0,0,0,0|1,0,1]=3 2123 B11R0.140 CCCCC[C@@H](C)OCCCS f8f162d02601cdcdbf5406c55d35334f [0,1,0,0,0,0|1,0,1]=3 2124 B11R0.140 CCCCC[C@@H](C)OCCOC a1e09d1892506018d0d3ba1d7bccfcb4 [0,1,0,0,0,0|1,0,1]=3 2125 B11R0.140 CCCCC[C@@H](C)OCCSC 4672d3bd14f2fc2d8e5f9d73df823b8b [0,1,0,0,0,0|1,0,1]=3 2126 B11R0.140 CCCCC[C@H](C)NCCCC 44052af2bf03dfdfdd8813c66ebb23ff [0,1,0,0,0,0|2,0,1]=4 2127 B11R0.140 CCCCC[C@H](C)NCCCCl eca3abef46f82ea34efc5c65f000a418 [0,1,0,0,0,0|2,0,1]=4 2128 B11R0.140 CCCCC[C@H](C)NCCCF 44d05d58f4fe96443d012ef8f32d55c3 [0,1,0,0,0,0|2,0,1]=4 2129 B11R0.140 CCCCC[C@H](C)NCCCO f42f4f5af4e85d656812f8de0a549128 [0,1,0,0,0,0|2,0,1]=4 2130 B11R0.140 CCCCC[C@H](C)NCCCS b9f0335a2443baff56fae2feb119fa9e [0,1,0,0,0,0|2,0,1]=4 2131 B11R0.140 CCCCC[C@H](C)NCCOC a73310a53211c572a3d6b34d838651a9 [0,1,0,0,0,0|2,0,1]=4 2132 B11R0.140 CCCCC[C@H](C)NCCSC c78c43026640a050f9c91afae13393f5 [0,1,0,0,0,0|2,0,1]=4 2133 B11R0.140 CCCCC[C@H](C)NCOCC bd2629791c8cccce6b739b3ec894b67f [0,1,0,0,0,0|2,0,1]=4 2134 B11R0.140 CCCCC[C@H](C)OCCC#N 5094076653df9d16642f5a5d674f1a98 [0,1,0,0,0,0|1,0,2]=4 2135 B11R0.140 CCCCC[C@H](C)OCCC=O 5954d8323fa87a2a72c5c22be2472904 [0,1,0,0,0,0|1,0,2]=4 2136 B11R0.140 CCCCC[C@H](C)OCCCC 364f0fd5e9c64b042cb4e7a98c79d828 [0,1,0,0,0,0|1,0,1]=3 2137 B11R0.140 CCCCC[C@H](C)OCCCF 3a9219a69c14b20f09b1d58065125e23 [0,1,0,0,0,0|1,0,1]=3 2138 B11R0.140 CCCCC[C@H](C)OCCCS 9ad2cb2cfbf28b2ad6f675b606fd325a [0,1,0,0,0,0|1,0,1]=3 2139 B11R0.140 CCCCC[C@H](C)OCCOC ec21f6e9d45788a089670d7a49b9ac50 [0,1,0,0,0,0|1,0,1]=3 2140 B11R0.140 CCCCC[C@H](C)OCCSC 0111ad70432ee4950251dc7169d7e139 [0,1,0,0,0,0|1,0,1]=3 2141 B11R0.140 CCCCNC(=O)/C=C/COC 828bd306078f090afcfef68e5936d391 [0,1,0,0,0,0|2,0,1]=4 2142 B11R0.140 CCCCNC(=O)/C=C/OCC fe687fc8c5ccff6550d9001d2ae7d865 [0,1,0,0,0,0|2,0,1]=4 2143 B11R0.140 CCCCNC(=O)C#CCCO 373644af9731856667148c96182d093a [0,1,0,0,0,0|2,0,1]=4 2144 B11R0.140 CCCCNC(=O)C#CCOC ec397080cd13e94ff23e5fbbf3769aec [0,1,0,0,0,0|2,0,1]=4 2145 B11R0.140 CCCCNC(=O)C=CCOC 1c8f22bbb657d9dd76211666dbbb210b [0,1,0,0,0,0|2,0,1]=4 2146 B11R0.140 CCCCNC(=O)C=COCC 73490c74e6582964f341c9498226ee09 [0,1,0,0,0,0|2,0,1]=4 2147 B11R0.140 CCCCNC(=O)CCCC#N 2a904cf26f98ea7958a9214687a74b57 [0,1,0,0,0,0|2,0,1]=4 2148 B11R0.140 CCCCNC(=O)CCCC=O 55dbea94e2d96e29b1593c4ba52bcf0a [0,1,0,0,0,0|2,0,1]=4 2149 B11R0.140 CCCCNC(=O)CCCCF e71492931ec397f58804097c9f883b55 [0,1,0,0,0,0|2,0,0]=3 2150 B11R0.140 CCCCNC(=O)CCCCO 593f5d52babede557c322fbd8e084dab [0,1,0,0,0,0|2,0,0]=3 2151 B11R0.140 CCCCNC(=O)CCCCS bfd03e05842cd48faa780df98d501b48 [0,1,0,0,0,0|2,0,0]=3 2152 B11R0.140 CCCCNC(=O)CCCOC dc862964af79516b6ff78aca657b641f [0,1,0,0,0,0|2,0,0]=3 2153 B11R0.140 CCCCNC(=O)CCCSC 2cc4224b99b3468b35f6e9a2acdcac92 [0,1,0,0,0,0|2,0,0]=3 2154 B11R0.140 CCCCNC(=O)CCOCC c3f7e5a3b5feea58c86443dd674f7a52 [0,1,0,0,0,0|2,0,0]=3 2155 B11R0.140 CCCCNC(=O)CCSCC 7f786e36797bb7542ae7585e2d8cc4d6 [0,1,0,0,0,0|2,0,0]=3 2156 B11R0.140 CCCCNC(=O)CCSSC dac7867d36fc2aff5ad03c73c3f80260 [0,1,0,0,0,0|3,0,0]=4 2157 B11R0.140 CCCCNC(=O)CNCCBr bc02a6841cdd834e2ce56237293b6b96 [0,1,0,0,0,0|3,0,0]=4 2158 B11R0.140 CCCCNC(=O)CNCCC 7995b6d3449849e4b8d31ad7e484cdba [0,1,0,0,0,0|2,0,0]=3 2159 B11R0.140 CCCCNC(=O)CNCCF bfe66d906ebabc321c0ac8479f1de024 [0,1,0,0,0,0|3,0,0]=4 2160 B11R0.140 CCCCNC(=O)CNCCI 5ad180aecc833e84872822044b4104cc [0,1,0,0,0,0|3,0,0]=4 2161 B11R0.140 CCCCNC(=O)CNCCO 36ebe6b587730fe513b6ffa9410e01c7 [0,1,0,0,0,0|3,0,0]=4 2162 B11R0.140 CCCCNC(=O)CNCCS fd69c898b1b9a9ad2181d300d2f8bfe9 [0,1,0,0,0,0|3,0,0]=4 2163 B11R0.140 CCCCNC(=O)CNCOC b2fc41c566e62b97f5c36e978956d080 [0,1,0,0,0,0|3,0,0]=4 2164 B11R0.140 CCCCNC(=O)CNCSC c21ff59bcb1d02794a91205630fa84a2 [0,1,0,0,0,0|3,0,0]=4 2165 B11R0.140 CCCCNC(=O)COCC#N 90271ab6c82c90c41b01cca48d139e42 [0,1,0,0,0,0|2,0,1]=4 2166 B11R0.140 CCCCNC(=O)COCCC c398f7dc7ea4e90cb09c80a5ecf79cc4 [0,1,0,0,0,0|1,0,0]=2 2167 B11R0.140 CCCCNC(=O)COCCF 4d9b4cc999c7b3e34a142df3c535a108 [0,1,0,0,0,0|2,0,0]=3 2168 B11R0.140 CCCCNC(=O)COCCO efff646c53e6bc171fe260de1266376c [0,1,0,0,0,0|2,0,0]=3 2169 B11R0.140 CCCCNC(=O)COCCS 6ae35ac329be27b98e7c58792d266d98 [0,1,0,0,0,0|2,0,0]=3 2170 B11R0.140 CCCCNC(=O)COCOC 7a82bced51b7a28a3bc234cc39a08ef3 [0,1,0,0,0,0|2,0,0]=3 2171 B11R0.140 CCCCNC(=O)CSCCC 8c4cb842a084e76db7161f6eff9e53c7 [0,1,0,0,0,0|1,1,0]=3 2172 B11R0.140 CCCCNC(=O)NCCC#N c772f4e1b0575ed1c76a0db13f6a6835 [0,1,0,0,0,0|2,0,1]=4 2173 B11R0.140 CCCCNC(=O)NCCCC c719e405195b966f72024032958c65c8 [0,1,0,0,0,0|2,0,0]=3 2174 B11R0.140 CCCCNC(=O)NCCCN 15d27cf9c9a48f270109026a3c10e167 [0,1,0,0,0,0|2,0,0]=3 2175 B11R0.140 CCCCNC(=O)NCCCO 3826de59818848886774ea31dc0ac5c1 [0,1,0,0,0,0|2,0,0]=3 2176 B11R0.140 CCCCNC(=O)NCCOC 7898881a31b05dadec6f2e4cf89a87f2 [0,1,0,0,0,0|2,0,0]=3 2177 B11R0.140 CCCCNC(=O)NCCON 7a0a575a913c074e62c5e64962360797 [0,1,0,0,0,0|3,0,0]=4 2178 B11R0.140 CCCCNC(=O)NCCSC b83d78c333973a8fdbe1ab3cd070fa84 [0,1,0,0,0,0|2,0,0]=3 2179 B11R0.140 CCCCNC(=S)NCCCC 9d59d80edfd82f82f7791a34f1a1d76d [0,1,0,0,0,0|2,1,0]=4 2180 B11R0.140 CCCCNC(=S)NCCCN efa0f0d402614700140508eb7b6a8fb9 [0,1,0,0,0,0|2,1,0]=4 2181 B11R0.140 CCCCNC(=S)NCCCO 8005305f71e336b0f0436fbe77b84c95 [0,1,0,0,0,0|2,1,0]=4 2182 B11R0.140 CCCCNC(=S)NCCOC a8e99275e251d79ed9b7ba1e20581fb7 [0,1,0,0,0,0|2,1,0]=4 2183 B11R0.140 CCCCNC(=S)NCCSC e8ee78eb67e4b6272f8d7dcbb3f607b7 [0,1,0,0,0,0|2,1,0]=4 2184 B11R0.140 CCCCOC(=O)CNCC#N 5d4259741e2c37bc37f171c0789e52d4 [0,1,0,0,0,0|2,0,1]=4 2185 B11R0.140 CCCCOC(=O)CNCCBr 36567f722e288941b861f68eb7e72c21 [0,1,0,0,0,0|2,0,0]=3 2186 B11R0.140 CCCCOC(=O)CNCCC c0a0d2697546d9e4333433b4358cb6ff [0,1,0,0,0,0|1,0,0]=2 2187 B11R0.140 CCCCOC(=O)CNCCF 7f09ea68c7ee59e33de06bc5cabb0ebb [0,1,0,0,0,0|2,0,0]=3 2188 B11R0.140 CCCCOC(=O)CNCCI 03be6762c5a3f5485d914256e9664858 [0,1,0,0,0,0|2,0,0]=3 2189 B11R0.140 CCCCOC(=O)CNCCO 02ff2a9da7644ed362156d75565f3458 [0,1,0,0,0,0|2,0,0]=3 2190 B11R0.140 CCCCOC(=O)CNCCS 34a480cdb51def64117262e59eb5ddb1 [0,1,0,0,0,0|2,0,0]=3 2191 B11R0.140 CCCCOC(=O)COCC#N 708c45fb25fa90957eb04fee31f0bf4d [0,1,0,0,0,0|2,0,1]=4 2192 B11R0.140 CCCCOC(=O)COCC=O b3d23ee41c2b32185f68c762938e3c3d [0,1,0,0,0,0|2,0,1]=4 2193 B11R0.140 CCCCOC(=O)COCCC 78f0096971537abe87b7326c8a1f7ef2 [0,1,0,0,0,0|1,0,0]=2 2194 B11R0.140 CCCCOC(=O)COCCF bfd76b2e1c67f1de3a298fa43f8d355d [0,1,0,0,0,0|2,0,0]=3 2195 B11R0.140 CCCCOC(=O)COCCS c7fa547b1d62e79d158de635c9cf0c9f [0,1,0,0,0,0|2,0,0]=3 2196 B11R0.140 CCCCOC(=O)COCOC ec7fd1fb27d7e2656dbcaa664f302663 [0,1,0,0,0,0|2,0,0]=3 2197 B11R0.140 CCCCOC(=O)COCSC 73c2375e20f06e1605cbfc75c5b76b63 [0,1,0,0,0,0|2,0,0]=3 2198 B11R0.140 CCCCOC(=O)OCNC#N d9ca14502572521c76c2ae567be04be9 [0,1,0,0,0,0|2,0,1]=4 2199 B11R0.140 CCCCOC(C)COCCC 605a87a976b02b2b9e805fbdea0660ac [0,1,0,0,0,0|2,0,1]=4 2200 B11R0.140 CCCNCC(=O)NCCC#N 06b0183b7980f889790bccf3e4b46b07 [0,1,0,0,0,0|2,0,1]=4 2201 B11R0.140 CCCNCC(=O)NCCOC 661fd4be516d00f63fee1cb122d806d9 [0,1,0,0,0,0|2,0,0]=3 2202 B11R0.140 CCCNCC(=O)OCCOC 9ea377657694ddfb13c31fc24ab61832 [0,1,0,0,0,0|1,0,0]=2 2203 B11R0.140 CCCOCC(=O)NCCC#N e4f3c160437e9da9eaa6677f9e0b27d1 [0,1,0,0,0,0|2,0,1]=4 2204 B11R0.140 CCCOCC(=O)NCCCCl c858bf0551c549bb01607c1e5311c156 [0,1,0,0,0,0|2,0,0]=3 2205 B11R0.140 CCCOCC(=O)NCCCO 7f6c87c26256c61cbb8deb0b49899923 [0,1,0,0,0,0|2,0,0]=3 2206 B11R0.140 CCCOCC(=O)NCCOC efd23285e06aded6efa3ba1414715b9d [0,1,0,0,0,0|2,0,0]=3 2207 B11R0.140 CCCOCC(=O)NCCON 50516f4a053e06e07f7866f8bcfa72be [0,1,0,0,0,0|3,0,0]=4 2208 B11R0.140 CCCOCC(=O)NCCSC 21a8c57546eae42fed7d6c7b9ebfa071 [0,1,0,0,0,0|2,0,0]=3 2209 B11R0.140 CCCOCC(=O)OCCOC d7aa92aac2eeb45a791532f48e2968be [0,1,0,0,0,0|1,0,0]=2 2210 B11R0.140 CCCOCC(C)COCCC faa2af5bc7589bad6579109d39f8cdd4 [0,1,0,0,0,0|2,0,1]=4 2211 B11R0.140 CCCOCC(C)OCCCF e943be4f12580ba230a1df38adf55924 [0,1,0,0,0,0|2,0,1]=4 2212 B11R0.140 CCCOCC(C)OCCCS 60d05aff3d86ed77c047d9dc35106ebf [0,1,0,0,0,0|2,0,1]=4 2213 B11R0.140 CCCOCC(C)OCCOC db192605bcf0820f6197ff61d08916dc [0,1,0,0,0,0|2,0,1]=4 2214 B11R0.140 CCCOCC(C)OCCSC a539b49e43cb7b2b066385005edc579d [0,1,0,0,0,0|2,0,1]=4 2215 B11R0.140 CCCSCC(=O)NCCC#N df0db66b22de6ffd7272f6a07485b9a8 [0,1,0,0,0,0|2,0,1]=4 2216 B11R0.140 CCCSCC(=O)NCCCCl 1d048a9ca90f8db3d46f9346b9efae8f [0,1,0,0,0,0|2,0,0]=3 2217 B11R0.140 CCCSCC(=O)NCCCO 01b4b20a414a6ead099cdfb29817bd2d [0,1,0,0,0,0|2,0,0]=3 2218 B11R0.140 CCCSCC(=O)NCCOC f8a6a073c70eed888cfea11bb1ee986e [0,1,0,0,0,0|2,0,0]=3 2219 B11R0.140 CCCSCC(=O)NCCON 219691dff3c7d636530e1d5154c79320 [0,1,0,0,0,0|3,0,0]=4 2220 B11R0.140 CCCSCC(=O)NCCSC 7a6e1db94c65bf62418336ff192523d2 [0,1,0,0,0,0|2,0,0]=3 2221 B11R0.140 CCOCCC(=O)NCCC#N 89964d2f57bcd32af0be7d518834042d [0,1,0,0,0,0|2,0,1]=4 2222 B11R0.140 CCOCCC(=O)NCCCCl 2ec4b8b6ed81ed92b75327c9374cdd87 [0,1,0,0,0,0|2,0,0]=3 2223 B11R0.140 CCOCCC(=O)NCCCO c6230f7fd35da36eb1b4438e6b0a4256 [0,1,0,0,0,0|2,0,0]=3 2224 B11R0.140 CCOCCC(=O)NCCOC b1f90b49e5b9121c207e8c192876fcb9 [0,1,0,0,0,0|2,0,0]=3 2225 B11R0.140 CCOCCC(=O)NCCON e9b463b38141b4d225b444d65ade8a2c [0,1,0,0,0,0|3,0,0]=4 2226 B11R0.140 CCOCCC(=O)NCCSC 117da9a109e2a68e06d1bd4ae7c23a8d [0,1,0,0,0,0|2,0,0]=3 2227 B11R0.140 CCSCCC(=O)NCCC#N 267427c2f893adb827f6c432f04926da [0,1,0,0,0,0|2,0,1]=4 2228 B11R0.140 CCSCCC(=O)NCCCCl 0ec56feba53e4a911e084b80681fa524 [0,1,0,0,0,0|2,0,0]=3 2229 B11R0.140 CCSCCC(=O)NCCCO a16d7101359f5ecc2a709a69f656a088 [0,1,0,0,0,0|2,0,0]=3 2230 B11R0.140 CCSCCC(=O)NCCOC 8786fafba55b28fb0b42affa7070ac95 [0,1,0,0,0,0|2,0,0]=3 2231 B11R0.140 CCSCCC(=O)NCCON f16b9c852611d9ae622230b1b297521e [0,1,0,0,0,0|3,0,0]=4 2232 B11R0.140 CCSCCC(=O)NCCSC 90923f02b0edf1b4433c56fd1b7b9f76 [0,1,0,0,0,0|2,0,0]=3 2233 B11R0.140 COCCCC(=O)NCCC#N cbfc715f41db23fc1d29c323d3bdab55 [0,1,0,0,0,0|2,0,1]=4 2234 B11R0.140 COCCCC(=O)NCCCCl f4f7a3dc8a614db04e196bea621515ed [0,1,0,0,0,0|2,0,0]=3 2235 B11R0.140 COCCCC(=O)NCCCO 8db99a6086d4b5e2209663ba6d036fa2 [0,1,0,0,0,0|2,0,0]=3 2236 B11R0.140 COCCCC(=O)NCCOC ac26de9620b68008a243c660c5da105d [0,1,0,0,0,0|2,0,0]=3 2237 B11R0.140 COCCCC(=O)NCCON b7fbb322e02a300668c3a522f91a49e8 [0,1,0,0,0,0|3,0,0]=4 2238 B11R0.140 COCCCC(=O)NCCSC 8de330e530fb268df4a041616630923d [0,1,0,0,0,0|2,0,0]=3 2239 B11R0.140 COCCNC(=O)CCCC#N 44f7f2d78ad330b92e9cc16a43aa6b63 [0,1,0,0,0,0|2,0,1]=4 2240 B11R0.140 COCCNC(=O)CCCC=O 49977fd153294f529efb2571849dcc21 [0,1,0,0,0,0|2,0,1]=4 2241 B11R0.140 COCCNC(=O)CCCCF 074cbf8b0df5e8c532c3feba1fcffabe [0,1,0,0,0,0|2,0,0]=3 2242 B11R0.140 COCCNC(=O)CCCCO ed6b1e6b12ea8c3934082827ebd93d91 [0,1,0,0,0,0|2,0,0]=3 2243 B11R0.140 COCCNC(=O)CCCCS 2247467f0eda745166f2b91493dadd00 [0,1,0,0,0,0|2,0,0]=3 2244 B11R0.140 COCCNC(=O)CCCSC c0fb986ea5d717b3ee7b9a5dfc17db71 [0,1,0,0,0,0|2,0,0]=3 2245 B11R0.140 COCCNC(=O)CCSSC c0c01ed92ce8f2ea83441a5ff1c398dc [0,1,0,0,0,0|3,0,0]=4 2246 B11R0.140 COCCNC(=O)CNCCBr fc6b5b946c938ea837d117d59dde4f2e [0,1,0,0,0,0|3,0,0]=4 2247 B11R0.140 COCCNC(=O)CNCCF 7d55b501d0a5c3538b4b04d8316d0c9d [0,1,0,0,0,0|3,0,0]=4 2248 B11R0.140 COCCNC(=O)CNCCI 4c43c9d4aff537da6e18418fd7441698 [0,1,0,0,0,0|3,0,0]=4 2249 B11R0.140 COCCNC(=O)CNCCO 853ede615f9ee8c027ccd9c53b74712e [0,1,0,0,0,0|3,0,0]=4 2250 B11R0.140 COCCNC(=O)CNCCS e695ffbfe35f5905f69740f1eec5ca9a [0,1,0,0,0,0|3,0,0]=4 2251 B11R0.140 COCCNC(=O)COCCO 31118f88ea8e9308c84ba7eb5419aa20 [0,1,0,0,0,0|3,0,0]=4 2252 B11R0.140 COCCNC(=O)COCCS c9ee3391fefe6ce44a18cb85c4f8b55f [0,1,0,0,0,0|3,0,0]=4 2253 B11R0.140 COCCNC(=O)COCOC 520c16f04b356d016072d47f7300df53 [0,1,0,0,0,0|3,0,0]=4 2254 B11R0.140 COCCNC(=O)NCCCN d8b3f072ee4e9a9064878da6fbf4677a [0,1,0,0,0,0|3,0,0]=4 2255 B11R0.140 COCCNC(=O)NCCCO 86cab188ae06b90a5c205ad50155e437 [0,1,0,0,0,0|3,0,0]=4 2256 B11R0.140 COCCNC(=O)NCCOC 5c3cea692631735ecc5c1388cdd28bae [0,1,0,0,0,0|3,0,0]=4 2257 B11R0.140 COCCNC(=O)NCCSC 150c4a41ac35e51691ecce06cf4b7bb8 [0,1,0,0,0,0|3,0,0]=4 2258 B11R0.140 COCCOC(=O)CNCC#N b76b28614c4585978ce4aed8423e157e [0,1,0,0,0,0|2,0,1]=4 2259 B11R0.140 COCCOC(=O)CNCCBr 404ab67b99a9b71258e59fe1a5931b0a [0,1,0,0,0,0|2,0,0]=3 2260 B11R0.140 COCCOC(=O)CNCCF f67a953e0cfbb02277cd16d3c09bf921 [0,1,0,0,0,0|2,0,0]=3 2261 B11R0.140 COCCOC(=O)CNCCI 603e13dd04cc211b4102e488faa39060 [0,1,0,0,0,0|2,0,0]=3 2262 B11R0.140 COCCOC(=O)CNCCO 333b7d9a68e0f085fb61e8bfa1b7152b [0,1,0,0,0,0|2,0,0]=3 2263 B11R0.140 COCCOC(=O)CNCCS 722da5978ca756c864b5c2d54386aaa9 [0,1,0,0,0,0|2,0,0]=3 2264 B11R0.140 COCCOC(=O)COCC#N 06383c31c39db9ba6c1cb34f1754d97d [0,1,0,0,0,0|2,0,1]=4 2265 B11R0.140 COCCOC(=O)COCCF c6743c9d9706b2ffbea4cb92ea3d22c8 [0,1,0,0,0,0|2,0,0]=3 2266 B11R0.140 COCCOC(=O)COCCS 4d971cbe138adf446d2df7dba838f470 [0,1,0,0,0,0|2,0,0]=3 2267 B11R0.140 COCCOC(=O)COCOC 10ed7b2073f286042b5727785f069042 [0,1,0,0,0,0|2,0,0]=3 2268 B11R0.140 CSCCCC(=O)NCCC#N 9c16e99c9aec81e248cbd25a46ef805d [0,1,0,0,0,0|2,0,1]=4 2269 B11R0.140 CSCCCC(=O)NCCCCl 326cda13ace1616ee0325cbccf97ffaf [0,1,0,0,0,0|2,0,0]=3 2270 B11R0.140 CSCCCC(=O)NCCCO fea22d4bac90ae58cb922dc69337616a [0,1,0,0,0,0|2,0,0]=3 2271 B11R0.140 CSCCCC(=O)NCCON dd5ab5ef586431805dda9d432fb516f1 [0,1,0,0,0,0|3,0,0]=4 2272 B11R0.140 CSCCCC(=O)NCCSC 509f45395f2c6e8391469b61ea8b6341 [0,1,0,0,0,0|2,0,0]=3 2273 B11R0.140 CSCCNC(=O)CCCC#N 0b86618e0accda58a2fabea692d31559 [0,1,0,0,0,0|2,0,1]=4 2274 B11R0.140 CSCCNC(=O)CCCC=O 019fa88896b6883c938c3a47d11f26bc [0,1,0,0,0,0|2,0,1]=4 2275 B11R0.140 CSCCNC(=O)CCCCF bb6bd72b5712015eaab40e386072fbc6 [0,1,0,0,0,0|2,0,0]=3 2276 B11R0.140 CSCCNC(=O)CCCCO 34c3d704f6286de78f113d28f0593730 [0,1,0,0,0,0|2,0,0]=3 2277 B11R0.140 CSCCNC(=O)CCCCS e45bac83beee77eb22d4abd945084a02 [0,1,0,0,0,0|2,0,0]=3 2278 B11R0.140 CSCCNC(=O)CCSSC 5054dd3f76821485d58cf2fbb7245601 [0,1,0,0,0,0|3,0,0]=4 2279 B11R0.140 CSCCNC(=O)COCCO d6000daaf2c12b8330cfe8c67cab19e9 [0,1,0,0,0,0|3,0,0]=4 2280 B11R0.140 CSCCNC(=O)COCCS 7485b32c4a3e551e9f57c27d2e6e2b27 [0,1,0,0,0,0|3,0,0]=4 2281 B11R0.140 CSCCNC(=O)NCCCN efef6b38eacac6b2a5659e77d907e5a3 [0,1,0,0,0,0|3,0,0]=4 2282 B11R0.140 CSCCNC(=O)NCCCO 784a3734aec59f33b693c189933cdee6 [0,1,0,0,0,0|3,0,0]=4 2283 B11R0.140 CSCCNC(=O)NCCSC a6abeb086495e802f1b6aaa913f34c3d [0,1,0,0,0,0|3,0,0]=4 2284 B11R0.140 CSSCCC(=O)NCCCCl 8cee9de75cadacb1d8d2f597b086ea52 [0,1,0,0,0,0|3,0,0]=4 2285 B11R0.140 CSSCCC(=O)NCCCO 0e64bb9246b1c4dcb0e894b142cfba5f [0,1,0,0,0,0|3,0,0]=4 2286 B11R0.140 N#CCCCC(=O)NCCCCl a062a551e3228231c620a211a720cfda [0,1,0,0,0,0|2,0,1]=4 2287 B11R0.140 N#CCCCC(=O)NCCCO bb4193d35bc4252380ded07a1834dafa [0,1,0,0,0,0|2,0,1]=4 2288 B11R0.140 N#CCCNC(=O)CCCCF 738c22e3237ea605558a76ee9cde9cad [0,1,0,0,0,0|2,0,1]=4 2289 B11R0.140 N#CCCNC(=O)CCCCO 6eb34f4138df0d3b3d93f3b502057963 [0,1,0,0,0,0|2,0,1]=4 2290 B11R0.140 N#CCCNC(=O)CCCCS a384e0026f502aea77627cba2c4f8eef [0,1,0,0,0,0|2,0,1]=4 2291 B11R0.140 NCCCNC(=O)NCCCN 9cacbdafbd195b42771e099ce7c05c9c [0,1,0,0,0,0|3,0,0]=4 2292 B11R0.140 NCCCNC(=O)NCCCO 9be9d78c43c964fc6f41bf5652d77c46 [0,1,0,0,0,0|3,0,0]=4 2293 B11R0.140 NOCCNC(=O)CCCCF 17d7a863fab690a6f62ce049c7c8e10a [0,1,0,0,0,0|3,0,0]=4 2294 B11R0.140 NOCCNC(=O)CCCCO 332b04164d9efdf31b3e370e36fb5648 [0,1,0,0,0,0|3,0,0]=4 2295 B11R0.140 NOCCNC(=O)CCCCS 715a24ea606ca84523f7c8227a2049a8 [0,1,0,0,0,0|3,0,0]=4 2296 B11R0.140 O=C(CCCCF)NCCCCl 999d9494c97082f5c65defed49ee3006 [0,1,0,0,0,0|2,0,0]=3 2297 B11R0.140 O=C(CCCCF)NCCCO 7c96bbe0893deea212141e7838406457 [0,1,0,0,0,0|2,0,0]=3 2298 B11R0.140 O=C(CCCCO)NCCCCl 56acca4ee52c579a03acf74e6e9da558 [0,1,0,0,0,0|2,0,0]=3 2299 B11R0.140 O=C(CCCCO)NCCCO d9b13c4d23e15df074346f9e4d671136 [0,1,0,0,0,0|2,0,0]=3 2300 B11R0.140 O=C(CCCCS)NCCCCl bc9d23693f7d17cd0d310dc694a59021 [0,1,0,0,0,0|2,0,0]=3 2301 B11R0.140 O=C(CCCCS)NCCCO 8f3198ffc2dc0e432e5c008a895d33d2 [0,1,0,0,0,0|2,0,0]=3 2302 B11R0.140 O=C(COCCO)NCCCCl cad7445d2c700e68c962a6548b9b83d4 [0,1,0,0,0,0|3,0,0]=4 2303 B11R0.140 O=C(COCCO)NCCCO 8004b35ecba01cb089b88167ace12a70 [0,1,0,0,0,0|3,0,0]=4 2304 B11R0.140 O=C(COCCS)NCCCCl 7cf03f357d24ef84b363cf8b76779e6c [0,1,0,0,0,0|3,0,0]=4 2305 B11R0.140 O=C(COCCS)NCCCO d3a1c30fc2a910bdbe2a5d9ccfa91f6e [0,1,0,0,0,0|3,0,0]=4 2306 B11R0.140 O=C(NCCCO)NCCCO 1e45ea91a8af807eead34464a72614b4 [0,1,0,0,0,0|3,0,0]=4 2307 B11R0.140 O=CCCCC(=O)NCCCCl 23e21a3361f5819c5e3ec02b8b25c60d [0,1,0,0,0,0|2,0,1]=4 2308 B11R0.140 O=CCCCC(=O)NCCCO deb166614d0f3bbcebe6589a786153ac [0,1,0,0,0,0|2,0,1]=4 2309 B11R0.147 C#CCNC(=O)CCCC(C)C 17bdb30cf8a7b0dcce922f02064f33b8 [0,1,0,0,0,0|1,0,2]=4 2310 B11R0.147 C=C(Br)CNCC(=O)OCCC 10a742126ee2fdaf6b5bc72af87ceac8 [0,1,0,0,0,0|1,0,2]=4 2311 B11R0.147 C=C(Br)COCC(=O)OCCC b8c0126945ac6f749e8adee5aba7ab2e [0,1,0,0,0,0|1,0,2]=4 2312 B11R0.147 C=C(C)CCCC(=O)NCCBr f6c6ac3e49742a68eb5002ccaae775a6 [0,1,0,0,0,0|2,0,1]=4 2313 B11R0.147 C=C(C)CCCC(=O)NCCC 29fb072ff8a59f4e9c43b684e2b50a2d [0,1,0,0,0,0|1,0,1]=3 2314 B11R0.147 C=C(C)CCCC(=O)NCCF 265a82c95039e30724b44b036eef30e9 [0,1,0,0,0,0|2,0,1]=4 2315 B11R0.147 C=C(C)CCCC(=O)NCCI becc6271ce3e804c52739f5a3380b16a [0,1,0,0,0,0|2,0,1]=4 2316 B11R0.147 C=C(C)CCCC(=O)NCCO 064eb7d359fe37d9a06e12cbb7f3a26f [0,1,0,0,0,0|2,0,1]=4 2317 B11R0.147 C=C(C)CCCC(=O)NCCS 930245b34c499c878ba74a21ae9a7196 [0,1,0,0,0,0|2,0,1]=4 2318 B11R0.147 C=C(C)CCNC(=O)CCCC db1c8374a33b9f39bd7ce4d4faa0e8b3 [0,1,0,0,0,0|2,0,1]=4 2319 B11R0.147 C=C(C)CCNC(=O)NCCC f3cb81e65ccc884c9b00dde212584270 [0,1,0,0,0,0|2,0,1]=4 2320 B11R0.147 C=C(C)CNCC(=O)NCCC d1b3181f3af29b5adcdb1a0508668f31 [0,1,0,0,0,0|2,0,1]=4 2321 B11R0.147 C=C(C)CNCC(=O)OCCC 5cb9ad2ad1ae45ba30af543f23949fd9 [0,1,0,0,0,0|1,0,1]=3 2322 B11R0.147 C=C(C)COCC(=O)NCCC 5016f87574bb414b0103844ae2947840 [0,1,0,0,0,0|2,0,1]=4 2323 B11R0.147 C=C(C)COCC(=O)OCCC abf4a472c60f7b6a5e1913c76470dbb1 [0,1,0,0,0,0|1,0,1]=3 2324 B11R0.147 C=C(CNCC(C)C)OCOC 14c7da81ff52e940bd4cdc6d29556cc5 [0,1,0,0,0,0|3,0,0]=4 2325 B11R0.147 C=C(CNCC(C)O)OCOC 17c518f38868aa85b3683af74e46d0fe [0,1,0,0,0,0|3,0,0]=4 2326 B11R0.147 C=C(CNC[C@@H](C)O)OCOC abad84600d0da41a822fba1ace25d96f [0,1,0,0,0,0|3,0,0]=4 2327 B11R0.147 C=C(CNC[C@H](C)O)OCOC 3a6ed11381a581b4a86903059928e14b [0,1,0,0,0,0|3,0,0]=4 2328 B11R0.147 C=C(COCC(C)C)OCOC a28dbfaa230f6c030b31fd8ce6576a17 [0,1,0,0,0,0|3,0,0]=4 2329 B11R0.147 C=C(COCC(C)F)OCOC 3621ce0b5019a7ede1bf79d829b01188 [0,1,0,0,0,0|3,0,0]=4 2330 B11R0.147 C=C(COCC(C)S)OCOC c912f5aee122cf90497414ba138d19ca [0,1,0,0,0,0|3,0,0]=4 2331 B11R0.147 C=C(COC[C@@H](C)F)OCOC 7529c2a8af8f1cac22f63d7e423651c0 [0,1,0,0,0,0|3,0,0]=4 2332 B11R0.147 C=C(COC[C@H](C)F)OCOC e9bb7a2ea3052f1cc2a28c23f66130ea [0,1,0,0,0,0|3,0,0]=4 2333 B11R0.147 C=C(Cl)COCC(=O)OCCC 0677f5f6bd55ca6a02f6f1680087f357 [0,1,0,0,0,0|1,0,2]=4 2334 B11R0.147 C=C(F)COCC(=O)OCCC 17e833978081355de6e5e63254dbabe8 [0,1,0,0,0,0|1,0,2]=4 2335 B11R0.147 C=C(I)COCC(=O)OCCC 37f5aa7b025876ad67a77388af4d6753 [0,1,0,0,0,0|1,0,2]=4 2336 B11R0.147 C=CCOC(=O)CNCC(C)C 74ebb3ce0e44e8ce5d6940b3d3885064 [0,1,0,0,0,0|1,0,2]=4 2337 B11R0.147 C=CCOC(=O)CNCC(C)O d01b24aa18b9f451fe48802b635696dc [0,1,0,0,0,0|1,0,2]=4 2338 B11R0.147 C=CCOC(=O)CNC[C@@H](C)O 4cd52b23c3983b6566f50a6aba2852e5 [0,1,0,0,0,0|1,0,2]=4 2339 B11R0.147 C=CCOC(=O)CNC[C@H](C)O 0f8f807a60125d1e65a267ede4cb96d7 [0,1,0,0,0,0|1,0,2]=4 2340 B11R0.147 C=CCOC(=O)COCC(C)C 46d4c792eaa09198c8d70d764a4f685f [0,1,0,0,0,0|1,0,2]=4 2341 B11R0.147 C=CCOC(=O)COCC(C)F 24bd6f4dea699db7e7d22785226e0d5e [0,1,0,0,0,0|1,0,2]=4 2342 B11R0.147 C=CCOC(=O)COCC(C)S f76e83e11a1ccdc837f61757d465956b [0,1,0,0,0,0|1,0,2]=4 2343 B11R0.147 C=CCOC(=O)COC[C@@H](C)F 0e1e003ffb8d9346ff20e6f6e4188779 [0,1,0,0,0,0|1,0,2]=4 2344 B11R0.147 C=CCOC(=O)COC[C@H](C)F 3b2b0a414f9cff453b5c86877a87a9d7 [0,1,0,0,0,0|1,0,2]=4 2345 B11R0.147 CC(=O)CCCC(=O)NCCBr 69c36dbf0b1d3cbff8b3fb13ecb683dd [0,1,0,0,0,0|2,0,1]=4 2346 B11R0.147 CC(=O)CCCC(=O)NCCF f2ff71abac8f7dd60edc11e6794647bb [0,1,0,0,0,0|2,0,1]=4 2347 B11R0.147 CC(=O)CCCC(=O)NCCI 533fb18d14e3d0c1abd2501343f894ae [0,1,0,0,0,0|2,0,1]=4 2348 B11R0.147 CC(=O)CCCC(=O)NCCO e346e8996e82c91a88c89a5a06c5cb56 [0,1,0,0,0,0|2,0,1]=4 2349 B11R0.147 CC(=O)CCCC(=O)NCCS 2ba2f033242bdf12892f1371313adba3 [0,1,0,0,0,0|2,0,1]=4 2350 B11R0.147 CC(C)CCCC(=O)NCC#N 439dd9d5aa5e1f53a76aa67ec8bbdedb [0,1,0,0,0,0|2,0,1]=4 2351 B11R0.147 CC(C)CCCC(=O)NCCBr 2357aa376235027d3da817e523374be0 [0,1,0,0,0,0|2,0,0]=3 2352 B11R0.147 CC(C)CCCC(=O)NCCF 702f54c9fa75aff1a65d6db05fa003bd [0,1,0,0,0,0|2,0,0]=3 2353 B11R0.147 CC(C)CCCC(=O)NCCI 088e0c52e59f2ac17d3a6a7bb887e3de [0,1,0,0,0,0|2,0,0]=3 2354 B11R0.147 CC(C)CCCC(=O)NCCO 62b168a809c093e605280f39b615f5b0 [0,1,0,0,0,0|2,0,0]=3 2355 B11R0.147 CC(C)CCCC(=O)NCCS 647987f001b737c98c6056bf6fd1e1c0 [0,1,0,0,0,0|2,0,0]=3 2356 B11R0.147 CC(C)CCCC(C)OCCF 44d376cc381caceff04f42843bf2d5af [0,1,0,0,0,0|2,0,1]=4 2357 B11R0.147 CC(C)CCCC(C)OCCS 6fdde699ae27f07c8e8c8bf76266a879 [0,1,0,0,0,0|2,0,1]=4 2358 B11R0.147 CC(C)CCNC(=O)CCCF 551ba5c158f1277ee137c80a67ed7658 [0,1,0,0,0,0|3,0,0]=4 2359 B11R0.147 CC(C)CCNC(=O)CCCS d1a1d1c3d28b8088d28a341e1b02a503 [0,1,0,0,0,0|3,0,0]=4 2360 B11R0.147 CC(C)CCNC(=O)NCCF b571db7160c285d891f3d6b30834ec59 [0,1,0,0,0,0|3,0,0]=4 2361 B11R0.147 CC(C)CCNC(=O)NCCN cc67a794286ed06f988783d536efc47c [0,1,0,0,0,0|3,0,0]=4 2362 B11R0.147 CC(C)CCNC(=O)NCCO 88492deed7a1de274df5512b64bb11c6 [0,1,0,0,0,0|3,0,0]=4 2363 B11R0.147 CC(C)CCNC(=O)NCCS 4824ea7423a9312a00dd49d1d35862df [0,1,0,0,0,0|3,0,0]=4 2364 B11R0.147 CC(C)CNCC(=O)NCCO 468246a402b29c26a441e82d0c0137a3 [0,1,0,0,0,0|3,0,0]=4 2365 B11R0.147 CC(C)COCC(=O)NCCBr 8a5f4dcfd32d1cd226afd80c09cba19a [0,1,0,0,0,0|3,0,0]=4 2366 B11R0.147 CC(C)COCC(=O)NCCF 924e847fb0ba2afe2f9931dbfdadc9fb [0,1,0,0,0,0|3,0,0]=4 2367 B11R0.147 CC(C)COCC(=O)NCCI 8961f5a45ff2204fb291f653164a0c68 [0,1,0,0,0,0|3,0,0]=4 2368 B11R0.147 CC(C)COCC(=O)NCCO faeb8585c436d7f6a36b8bcafed9c50e [0,1,0,0,0,0|3,0,0]=4 2369 B11R0.147 CC(C)COCC(=O)NCCS 34c70b9daebb69fbc60c08d7691d5d19 [0,1,0,0,0,0|3,0,0]=4 2370 B11R0.147 CC(C)OCCC(=O)NCCBr b794b4a94530df5ae874384751c75335 [0,1,0,0,0,0|3,0,0]=4 2371 B11R0.147 CC(C)OCCC(=O)NCCF 38efd7fb4be6bfdc903af131bb473799 [0,1,0,0,0,0|3,0,0]=4 2372 B11R0.147 CC(C)OCCC(=O)NCCI 147877276603aaf668e04d3219bc2254 [0,1,0,0,0,0|3,0,0]=4 2373 B11R0.147 CC(C)OCCC(=O)NCCO 3587c2f6df17553510f7d66fda72e795 [0,1,0,0,0,0|3,0,0]=4 2374 B11R0.147 CC(C)OCCC(=O)NCCS c62e0660297abc77e76eb01b371cfd15 [0,1,0,0,0,0|3,0,0]=4 2375 B11R0.147 CC(C)SCCC(=O)NCCI e203196e0836adbf63915d25250fb27f [0,1,0,0,0,0|3,0,0]=4 2376 B11R0.147 CC(C)SCCC(=O)NCCO 7713a2a5abf69e2bd7e84626343c7ac6 [0,1,0,0,0,0|3,0,0]=4 2377 B11R0.147 CC(C)SCCC(=O)NCCS bde02c5b64a8884d06a43b6ac7d04c3d [0,1,0,0,0,0|3,0,0]=4 2378 B11R0.147 CC(O)CCNC(=O)CCCF ee4269ec6bc8e7fe80a5949ebcbfbeac [0,1,0,0,0,0|3,0,0]=4 2379 B11R0.147 CC(O)CCNC(=O)CCCS a97be48e6eeb190c1e010420379609f0 [0,1,0,0,0,0|3,0,0]=4 2380 B11R0.147 CC(O)CCNC(=O)NCCF 989f476cbba5be3c3eb82892da110b79 [0,1,0,0,0,0|3,0,0]=4 2381 B11R0.147 CC(O)CCNC(=O)NCCN fea06b7e3ae2492414b0996bc4aa5a6a [0,1,0,0,0,0|3,0,0]=4 2382 B11R0.147 CC(O)CCNC(=O)NCCO 1e496a03e5412ad1bf9727a3efb9a52d [0,1,0,0,0,0|3,0,0]=4 2383 B11R0.147 CC(O)CCNC(=O)NCCS 265c27129a0330ce1a66d79d581b5cf6 [0,1,0,0,0,0|3,0,0]=4 2384 B11R0.147 CC(O)CNCC(=O)NCCO ade960945b9282155f0761e20a974cb9 [0,1,0,0,0,0|3,0,0]=4 2385 B11R0.147 CC/C=C/C(=O)NCCC(C)C 92ef9b699a155ca12a1eb561d1a5c0de [0,1,0,0,0,0|2,0,1]=4 2386 B11R0.147 CC/C=C/C(=O)NCCC(C)O 78e189d1ad76daf5623ebbf20175ba81 [0,1,0,0,0,0|2,0,1]=4 2387 B11R0.147 CC/C=C/C(=O)NCC[C@@H](C)O a35688614dbc606d195a0517bde3f76b [0,1,0,0,0,0|2,0,1]=4 2388 B11R0.147 CC/C=C/C(=O)NCC[C@H](C)O 95334fa42d44f1a47887f3589349c5c7 [0,1,0,0,0,0|2,0,1]=4 2389 B11R0.147 CC/C=C\C(=O)NCCC(C)C 92475d3fa6576752150b3cf13ac3766e [0,1,0,0,0,0|2,0,1]=4 2390 B11R0.147 CC/C=C\C(=O)NCCC(C)O 2fe375c510ee290b943689f65a0cf396 [0,1,0,0,0,0|2,0,1]=4 2391 B11R0.147 CC/C=C\C(=O)NCC[C@@H](C)O ee5aa6b4c06a7142aae0de16b226eb0a [0,1,0,0,0,0|2,0,1]=4 2392 B11R0.147 CC/C=C\C(=O)NCC[C@H](C)O 5656c5ec0cfd158501b727cff183236b [0,1,0,0,0,0|2,0,1]=4 2393 B11R0.147 CCC#CC(=O)NCCC(C)C c93961cba54096bcf2546d0d432774f9 [0,1,0,0,0,0|2,0,1]=4 2394 B11R0.147 CCC#CC(=O)NCCC(C)O a1760363481d9a0854fd515c9d84e3e3 [0,1,0,0,0,0|2,0,1]=4 2395 B11R0.147 CCC#CC(=O)NCC[C@@H](C)O c390d794177da94812e659afc4ddd5fb [0,1,0,0,0,0|2,0,1]=4 2396 B11R0.147 CCC#CC(=O)NCC[C@H](C)O 9101e1fd00e3961615269ae3d81b2f08 [0,1,0,0,0,0|2,0,1]=4 2397 B11R0.147 CCC=CC(=O)NCCC(C)C 93e5e3dbcff7aa1e723aa20bf08f29be [0,1,0,0,0,0|2,0,1]=4 2398 B11R0.147 CCC=CC(=O)NCCC(C)O 13ac3dd4460b2a393d06cb37343b41c8 [0,1,0,0,0,0|2,0,1]=4 2399 B11R0.147 CCC=CC(=O)NCC[C@@H](C)O 5680d0ab302f1a0eec5a4d36d31e4b75 [0,1,0,0,0,0|2,0,1]=4 2400 B11R0.147 CCC=CC(=O)NCC[C@H](C)O 9bd717e4d887ead29090fe05df87c5ea [0,1,0,0,0,0|2,0,1]=4 2401 B11R0.147 CCCCC(=O)NCCC(C)C 5a478b47b8f1203204005e80f7ff412d [0,1,0,0,0,0|2,0,0]=3 2402 B11R0.147 CCCCC(=O)NCCC(C)O 7aaca4f02466a48e7b0e77dd77bcf92e [0,1,0,0,0,0|2,0,0]=3 2403 B11R0.147 CCCCC(=O)NCCC(F)F 275bc9bf8b5fbd65b35f2d2ffe2eac42 [0,1,0,0,0,0|3,0,0]=4 2404 B11R0.147 CCCCC(=O)NCCN(C)C 698484bc307647d2f61d65b42efa88f6 [0,1,0,0,0,0|3,0,0]=4 2405 B11R0.147 CCCCC(=O)NCCS(=O)C f3e5d923df128154ce783b550c263138 [0,1,0,0,0,0|3,0,0]=4 2406 B11R0.147 CCCCC(=O)NCC[C@@H](C)O 51765c4fe546002974c228bb17f8fe5f [0,1,0,0,0,0|2,0,0]=3 2407 B11R0.147 CCCCC(=O)NCC[C@H](C)O 7915b6c716e2dba7440a7863ffd54996 [0,1,0,0,0,0|2,0,0]=3 2408 B11R0.147 CCCCC(=O)OCOC(C)C 8695377532205c6785bd90c0a96a2b3c [0,1,0,0,0,0|3,0,0]=4 2409 B11R0.147 CCCCN(C)CCCC(C)C 63408163e7ea1897f163ad5c4903bcc8 [0,1,0,0,0,0|3,0,0]=4 2410 B11R0.147 CCCCN(C)CCCC(C)O 8828aaf31a48439873b0a5abdd1f9a16 [0,1,0,0,0,0|3,0,0]=4 2411 B11R0.147 CCCNC(=O)/C=C/CC(C)C 5fcf0c1c8ffa02f58b0f0fc06a8e03e5 [0,1,0,0,0,0|1,0,2]=4 2412 B11R0.147 CCCNC(=O)C/C=C/C(C)C cdaf24a83b0a1ccd64c4e8b9ee2e08ae [0,1,0,0,0,0|1,0,2]=4 2413 B11R0.147 CCCNC(=O)CC=CC(C)C 05fa581762ede96f0c0d987f47b10756 [0,1,0,0,0,0|1,0,2]=4 2414 B11R0.147 CCCNC(=O)CCC=C(C)C 8d6145ea5c674ecc023b1f9edcc9edf4 [0,1,0,0,0,0|1,0,2]=4 2415 B11R0.147 CCCNC(=O)CCCC(=O)C c5a6c1fa0c374636854f24398695434a [0,1,0,0,0,0|1,0,1]=3 2416 B11R0.147 CCCNC(=O)CCCC(=O)N 7cc2aab195c89524748d57707a5cc05b [0,1,0,0,0,0|2,0,1]=4 2417 B11R0.147 CCCNC(=O)CCCC(C)C d3c99083648aa796f29a4eb47f90bce2 [0,1,0,0,0,0|1,0,0]=2 2418 B11R0.147 CCCNC(=O)CCCN(C)C 55180a9f1b219057ff323cceb44c36d0 [0,1,0,0,0,0|2,0,0]=3 2419 B11R0.147 CCCNC(=O)CCC[N+](=O)[O-] f8209868907354d94f05fb6095034c7f [0,1,0,0,0,0|3,0,0]=4 2420 B11R0.147 CCCNC(=O)CCNC(=O)C 0eda2f9217dd73d4c191c4afbdbf1492 [0,1,0,0,0,0|2,0,1]=4 2421 B11R0.147 CCCNC(=O)CCOC(=O)C 4e92812656b57ec6c2569d8bf0fc23a6 [0,1,0,0,0,0|2,0,1]=4 2422 B11R0.147 CCCNC(=O)CCOC(C)C cc4a83a0641e2d794fa3f9fbb8be4941 [0,1,0,0,0,0|2,0,0]=3 2423 B11R0.147 CCCNC(=O)CCSC(=O)C 4135e010dd03602e9422c5342352e532 [0,1,0,0,0,0|2,0,1]=4 2424 B11R0.147 CCCNC(=O)CCSC(C)C 0defbebd2001d801842786ec29dd3428 [0,1,0,0,0,0|2,0,0]=3 2425 B11R0.147 CCCNC(=O)CNCC(=O)C 1c14ccafe77569596b7879bc7d1b9d4b [0,1,0,0,0,0|2,0,1]=4 2426 B11R0.147 CCCNC(=O)CNCC(C)C 05b1aff3c2e34fccfe9f6c081c013bbd [0,1,0,0,0,0|2,0,0]=3 2427 B11R0.147 CCCNC(=O)CNCC(C)O 8aca8fbe7fd1fdcb992b70c0b2a2734b [0,1,0,0,0,0|2,0,0]=3 2428 B11R0.147 CCCNC(=O)CNCC(F)F bf781fe2e3a67257d689c521237bdf06 [0,1,0,0,0,0|3,0,0]=4 2429 B11R0.147 CCCNC(=O)CNCN(C)C 073fbc0b0659240844f8c5b4999c4108 [0,1,0,0,0,0|3,0,0]=4 2430 B11R0.147 CCCNC(=O)CNC[C@@H](C)O c8d2b53bcecaa64882dc40884b2241dc [0,1,0,0,0,0|2,0,0]=3 2431 B11R0.147 CCCNC(=O)CNC[C@H](C)O af8e66958ca835b54397144e66ef4e81 [0,1,0,0,0,0|2,0,0]=3 2432 B11R0.147 CCCNC(=O)COCC(=O)C 2048467954e9aaf63c2859eb3f002b27 [0,1,0,0,0,0|2,0,1]=4 2433 B11R0.147 CCCNC(=O)COCC(C)C 779619f024f50340c9682178f1a40d53 [0,1,0,0,0,0|2,0,0]=3 2434 B11R0.147 CCCNC(=O)COCC(C)F 279f17a993278781a5f4097a5a79063a [0,1,0,0,0,0|2,0,0]=3 2435 B11R0.147 CCCNC(=O)COCC(C)S 7550eadeb07391b5f6e632728e9cbf34 [0,1,0,0,0,0|2,0,0]=3 2436 B11R0.147 CCCNC(=O)COCC(F)F 57a5b2fe1d8c6b76df0cd3df9f680ff4 [0,1,0,0,0,0|3,0,0]=4 2437 B11R0.147 CCCNC(=O)COC[C@@H](C)F ba2518d68120271afb7e2234dd6ea07e [0,1,0,0,0,0|2,0,0]=3 2438 B11R0.147 CCCNC(=O)COC[C@H](C)F 84df4454b5567b824624d94e0c19c286 [0,1,0,0,0,0|2,0,0]=3 2439 B11R0.147 CCCNC(=O)NCCC(C)C 4c030131efc35b9008debf998514bb4f [0,1,0,0,0,0|2,0,0]=3 2440 B11R0.147 CCCNC(=O)NCCC(C)O 681521c4cf318531f49332345f21646d [0,1,0,0,0,0|2,0,0]=3 2441 B11R0.147 CCCNC(=O)NCCC(F)F 45bcf08cd0bfa76980b6e48e68ab176f [0,1,0,0,0,0|3,0,0]=4 2442 B11R0.147 CCCNC(=O)NCCN(C)C 5de02f18393c5205d272f706090b1808 [0,1,0,0,0,0|3,0,0]=4 2443 B11R0.147 CCCNC(=O)NCCS(=O)C 9894426cff6deadd6cd4c8fa8df23abe [0,1,0,0,0,0|3,0,0]=4 2444 B11R0.147 CCCNC(=O)NCC[C@@H](C)O 9f4f6409afe00366e7ec8c041aeef6f9 [0,1,0,0,0,0|2,0,0]=3 2445 B11R0.147 CCCNC(=O)NCC[C@H](C)O 0fda91d2675b04a9344346808e7ed444 [0,1,0,0,0,0|2,0,0]=3 2446 B11R0.147 CCCNC(=S)NCCC(C)C ff65614a4e4729694f0b249f1ac01945 [0,1,0,0,0,0|2,1,0]=4 2447 B11R0.147 CCCNC(=S)NCCC(C)O ac472def3579b31fa8ef0c9bdf8b245a [0,1,0,0,0,0|2,1,0]=4 2448 B11R0.147 CCCNC(=S)NCC[C@@H](C)O 3fe320e09683a44bad46a823570d6c42 [0,1,0,0,0,0|2,1,0]=4 2449 B11R0.147 CCCNC(=S)NCC[C@H](C)O cc5a222bcae2e612a2d7a9ea65ade865 [0,1,0,0,0,0|2,1,0]=4 2450 B11R0.147 CCCNC(C)CCCC(C)C c3b9f8f3aaf123242312bc99ee26f3b5 [0,1,0,0,0,0|2,0,1]=4 2451 B11R0.147 CCCOC(=O)CCOC(C)C 5602a8fb39b83b91c60e731d1955672e [0,1,0,0,0,0|1,0,0]=2 2452 B11R0.147 CCCOC(=O)CNCC(=O)C 7a6a357128f1a74fb60666b9a268a04f [0,1,0,0,0,0|1,0,1]=3 2453 B11R0.147 CCCOC(=O)CNCC(=O)N f55005ff3fb5c84d8251fde5851025d3 [0,1,0,0,0,0|2,0,1]=4 2454 B11R0.147 CCCOC(=O)CNCC(=O)O ca38d75bfe1967e25a90ee5e2668578c [0,1,0,0,0,0|2,0,1]=4 2455 B11R0.147 CCCOC(=O)CNCC(C)C 3ed831026f97bdb686c4e7fae0567eef [0,1,0,0,0,0|1,0,0]=2 2456 B11R0.147 CCCOC(=O)CNCC(C)O 6a8d3605fa6e3fe4067c3ab4bb569329 [0,1,0,0,0,0|1,0,0]=2 2457 B11R0.147 CCCOC(=O)CNCC(F)F c0d799b804bf862ee1dd2d2ff69c7ed6 [0,1,0,0,0,0|2,0,0]=3 2458 B11R0.147 CCCOC(=O)CNC[C@@H](C)O 8d306c68550a622e248b8f5e9ae6a03e [0,1,0,0,0,0|1,0,0]=2 2459 B11R0.147 CCCOC(=O)CNC[C@H](C)O 5d5bd11a9bfcfd7a3b9eea2c2ea216d0 [0,1,0,0,0,0|1,0,0]=2 2460 B11R0.147 CCCOC(=O)COCC(=O)C 9f1bd3e5a30353242d54ebb9357f6923 [0,1,0,0,0,0|1,0,1]=3 2461 B11R0.147 CCCOC(=O)COCC(=O)N 80276a2c723d7715d7664b065f045bf6 [0,1,0,0,0,0|2,0,1]=4 2462 B11R0.147 CCCOC(=O)COCC(=O)O a9073d193a3fdd4b64080cd2591a05c4 [0,1,0,0,0,0|2,0,1]=4 2463 B11R0.147 CCCOC(=O)COCC(=S)N eb798a311d4ab77429f565f333cb2226 [0,1,0,0,0,0|2,0,1]=4 2464 B11R0.147 CCCOC(=O)COCC(C)C edc1cbc28ec16b514ffb7a18e2834c97 [0,1,0,0,0,0|1,0,0]=2 2465 B11R0.147 CCCOC(=O)COCC(C)F 45310dd2018df2d5d59994c99008b034 [0,1,0,0,0,0|1,0,0]=2 2466 B11R0.147 CCCOC(=O)COCC(C)S 6f396f1614a7c808722f7950b08e9931 [0,1,0,0,0,0|1,0,0]=2 2467 B11R0.147 CCCOC(=O)COCC(F)F 02c75dfc6fe807e8bb26a0d26371c751 [0,1,0,0,0,0|2,0,0]=3 2468 B11R0.147 CCCOC(=O)COCS(=O)O 61c184278cd803d2c437f4ceec49b8c4 [0,1,0,0,0,0|3,0,0]=4 2469 B11R0.147 CCCOC(=O)COC[C@@H](C)F f311baf237251c19b643bbde5e70b03f [0,1,0,0,0,0|1,0,0]=2 2470 B11R0.147 CCCOC(=O)COC[C@H](C)F bcd7759e6eaa8830799c07b9f984960e [0,1,0,0,0,0|1,0,0]=2 2471 B11R0.147 CCCOC(=O)OCOC(C)C dd535a633b34f045b586097a13c65bb9 [0,1,0,0,0,0|2,0,0]=3 2472 B11R0.147 CCCOC(C)CCCC(C)C 27e0039638de50cc4c3f9d16889c3880 [0,1,0,0,0,0|1,0,1]=3 2473 B11R0.147 CCOCC(=O)NCCC(C)C 24db9df6256e045963f0233ef4b10e7f [0,1,0,0,0,0|3,0,0]=4 2474 B11R0.147 CCOCC(=O)NCCC(C)O b07b825e0e4b194c3db717ac1a5ece43 [0,1,0,0,0,0|3,0,0]=4 2475 B11R0.147 CCOCC(=O)NCC[C@@H](C)O f53d31762a4cab98760f72e8c05e63cc [0,1,0,0,0,0|3,0,0]=4 2476 B11R0.147 CCOCC(=O)NCC[C@H](C)O baf1283307b1216c4642f96271e2b877 [0,1,0,0,0,0|3,0,0]=4 2477 B11R0.147 CCSCC(=O)NCCC(C)C 7181a473b23931c4806ab7d0736840d1 [0,1,0,0,0,0|3,0,0]=4 2478 B11R0.147 CCSCC(=O)NCCC(C)O f64e92125ece9a2f9829bb41c397c5f4 [0,1,0,0,0,0|3,0,0]=4 2479 B11R0.147 CCSCC(=O)NCC[C@@H](C)O 997048adb0b833a72893438e60f20dc8 [0,1,0,0,0,0|3,0,0]=4 2480 B11R0.147 CCSCC(=O)NCC[C@H](C)O 6ddc35f598237d39f28818cf847b1d51 [0,1,0,0,0,0|3,0,0]=4 2481 B11R0.147 CN(C)CCCC(=O)NCCBr 25ac9fefcc739d79e3afd57be2806698 [0,1,0,0,0,0|3,0,0]=4 2482 B11R0.147 CN(C)CCCC(=O)NCCF f8cb707857fb2599e7ebb021be96f0ac [0,1,0,0,0,0|3,0,0]=4 2483 B11R0.147 CN(C)CCCC(=O)NCCI 2b5bd06f2b0b5d35f0e367675a43fd03 [0,1,0,0,0,0|3,0,0]=4 2484 B11R0.147 CN(C)CCCC(=O)NCCO 0220662d4ca759e3048dc0d7b50eee37 [0,1,0,0,0,0|3,0,0]=4 2485 B11R0.147 CN(C)CCCC(=O)NCCS 65ad20deed4b37687903cb39b061455a [0,1,0,0,0,0|3,0,0]=4 2486 B11R0.147 COCCC(=O)NCCC(C)C ddd993306a852effca922baecdff1101 [0,1,0,0,0,0|3,0,0]=4 2487 B11R0.147 COCCC(=O)NCCC(C)O 94b2036d8e9b3a1f778db5eef2d77ed7 [0,1,0,0,0,0|3,0,0]=4 2488 B11R0.147 COCCC(=O)NCC[C@@H](C)O 301f95e6dff3d7e4e143770a66a73c18 [0,1,0,0,0,0|3,0,0]=4 2489 B11R0.147 COCCC(=O)NCC[C@H](C)O 51c25ea64de3e592edd39630f9b30878 [0,1,0,0,0,0|3,0,0]=4 2490 B11R0.147 COCOC(C)CCCC(C)C 81a7f87715fdace095caa72ef7f177e7 [0,1,0,0,0,0|2,0,1]=4 2491 B11R0.147 CSCCC(=O)CNCC(C)C 76a4238f244b7e14ad9f0c20356d56e7 [0,1,0,0,0,0|3,0,0]=4 2492 B11R0.147 CSCCC(=O)CNCC(C)O c0d8fe526051ee2f9d7feeef118ff9ce [0,1,0,0,0,0|3,0,0]=4 2493 B11R0.147 CSCCC(=O)CNC[C@@H](C)O af6287cfd17a3e41f1ab7bde6a74a834 [0,1,0,0,0,0|3,0,0]=4 2494 B11R0.147 CSCCC(=O)CNC[C@H](C)O 6500d257b9301dc765a242b7f88cf34a [0,1,0,0,0,0|3,0,0]=4 2495 B11R0.147 CSCCC(=O)COCC(C)C 7cc8ced8981e3fdadc8d892b53f7ff5a [0,1,0,0,0,0|3,0,0]=4 2496 B11R0.147 CSCCC(=O)COCC(C)F 67c74334504c282c0eac0b659cbfcf96 [0,1,0,0,0,0|3,0,0]=4 2497 B11R0.147 CSCCC(=O)COCC(C)S 261098b0616f67bf6127f15dd9ad5643 [0,1,0,0,0,0|3,0,0]=4 2498 B11R0.147 CSCCC(=O)COC[C@@H](C)F c5e5cf2736f3447270630aba1d97cfb2 [0,1,0,0,0,0|3,0,0]=4 2499 B11R0.147 CSCCC(=O)COC[C@H](C)F 181ddabe3a6abd10c93c5a9c9e7f25de [0,1,0,0,0,0|3,0,0]=4 2500 B11R0.147 CSCCC(=O)NCCC(C)C 5f0490124b891029c39d548a27b03378 [0,1,0,0,0,0|3,0,0]=4 2501 B11R0.147 CSCCC(=O)NCCC(C)O 6d52ada0342a819e2702880fcd6f9895 [0,1,0,0,0,0|3,0,0]=4 2502 B11R0.147 CSCCC(=O)NCC[C@@H](C)O b0216e4cd37b8c6b0db03c893d0b0a2a [0,1,0,0,0,0|3,0,0]=4 2503 B11R0.147 CSCCC(=O)NCC[C@H](C)O 122816f3564430135cfa21b942e1a631 [0,1,0,0,0,0|3,0,0]=4 2504 B11R0.147 CSCOC(C)CCCC(C)C 886dc41067accc58974e3af4f4c80dd2 [0,1,0,0,0,0|2,0,1]=4 2505 B11R0.147 C[C@@H](O)CCNC(=O)CCCF c38182db3d988d15a4822839c54cb635 [0,1,0,0,0,0|3,0,0]=4 2506 B11R0.147 C[C@@H](O)CCNC(=O)CCCS ec79e1ae4c9786ed64315f706a6e93da [0,1,0,0,0,0|3,0,0]=4 2507 B11R0.147 C[C@@H](O)CCNC(=O)NCCF 69b1cf251990703fe1dfa5ade07d4b73 [0,1,0,0,0,0|3,0,0]=4 2508 B11R0.147 C[C@@H](O)CCNC(=O)NCCN 69aa0c529c1290f689d00b9d9205bcc1 [0,1,0,0,0,0|3,0,0]=4 2509 B11R0.147 C[C@@H](O)CCNC(=O)NCCO 8c929d008e755ebe949f1999a4c837d6 [0,1,0,0,0,0|3,0,0]=4 2510 B11R0.147 C[C@@H](O)CCNC(=O)NCCS 8256b4cf8429be810ce410a45af27109 [0,1,0,0,0,0|3,0,0]=4 2511 B11R0.147 C[C@@H](O)CNCC(=O)NCCO 974590ced7164cf9f999aee3ee22a5f3 [0,1,0,0,0,0|3,0,0]=4 2512 B11R0.147 C[C@H](O)CCNC(=O)CCCF 0783e2e89f3461753697ee63a117d9e7 [0,1,0,0,0,0|3,0,0]=4 2513 B11R0.147 C[C@H](O)CCNC(=O)CCCS 87be5013f19a81c166146ff7a771dbcd [0,1,0,0,0,0|3,0,0]=4 2514 B11R0.147 C[C@H](O)CCNC(=O)NCCF 161a84bc530133fb19e352a2b3e4a574 [0,1,0,0,0,0|3,0,0]=4 2515 B11R0.147 C[C@H](O)CCNC(=O)NCCN 740a9d457ad91eea38a302b0a761cd7f [0,1,0,0,0,0|3,0,0]=4 2516 B11R0.147 C[C@H](O)CCNC(=O)NCCO 586f5dbbe8855e10e19eaf0ea7bbad7d [0,1,0,0,0,0|3,0,0]=4 2517 B11R0.147 C[C@H](O)CCNC(=O)NCCS b9973a12e38a309b1960758b8295296d [0,1,0,0,0,0|3,0,0]=4 2518 B11R0.147 C[C@H](O)CNCC(=O)NCCO e3556ea666c933294c18f3d7308124db [0,1,0,0,0,0|3,0,0]=4 2519 B11R0.152 C#CC(CCCCC)OCCC 0c180a1bc78e038fe589780ea4641747 [0,1,0,0,0,0|1,0,1]=3 2520 B11R0.152 C#CC(CCCCC)OCCF 1e762a9b42ed54c435b0cd33a0aa2644 [0,1,0,0,0,0|2,0,1]=4 2521 B11R0.152 C#CC(CCCCC)OCCS fd495e7287741f4dd4e20530ab00aa34 [0,1,0,0,0,0|2,0,1]=4 2522 B11R0.152 C#CC(CCCCC)OCOC c50084f1f4ba9d0d722a1aea8d5ef114 [0,1,0,0,0,0|2,0,1]=4 2523 B11R0.152 C#CC(CCCCC)OCSC e8a2e5f40ef07561d93bd2208bc0f573 [0,1,0,0,0,0|2,0,1]=4 2524 B11R0.152 C#C[C@H](CCCCC)OCCC 5bcdf538314c902ada08dce2c1c11583 [0,1,0,0,0,0|1,0,1]=3 2525 B11R0.152 C#C[C@H](CCCCC)OCCF dfdf17a9390d53b4fb0f92d1eaddac30 [0,1,0,0,0,0|2,0,1]=4 2526 B11R0.152 C#C[C@H](CCCCC)OCCS 4bd6bb027a8df15dbf6cf54de8b79160 [0,1,0,0,0,0|2,0,1]=4 2527 B11R0.152 C#C[C@H](CCCCC)OCOC 2a83cbe5321dacf6df1a87b795d42d04 [0,1,0,0,0,0|2,0,1]=4 2528 B11R0.152 C#C[C@H](CCCCC)OCSC 13ca96ec9873422f5d5107824f73fe66 [0,1,0,0,0,0|2,0,1]=4 2529 B11R0.152 C=CC(CCCCC)OCCC b8f7f4b3c36c14e7c71130b4faf5bf44 [0,1,0,0,0,0|1,0,1]=3 2530 B11R0.152 C=CC(CCCCC)OCCF 40e7a5f20b50f221ea37daf308efe482 [0,1,0,0,0,0|2,0,1]=4 2531 B11R0.152 C=CC(CCCCC)OCCS e9960052c802964c1103dcd4d979e503 [0,1,0,0,0,0|2,0,1]=4 2532 B11R0.152 C=CC(CCCCC)OCOC d2d1d71ce51aef852900612372fe089f [0,1,0,0,0,0|2,0,1]=4 2533 B11R0.152 C=CC(CCCCC)OCSC ae1974295feffdf644d8e90a8371beed [0,1,0,0,0,0|2,0,1]=4 2534 B11R0.152 C=C[C@H](CCCCC)OCCC 079a321513731a15be8a8ba6b60102d9 [0,1,0,0,0,0|1,0,1]=3 2535 B11R0.152 C=C[C@H](CCCCC)OCCF e04ee4056faa81cb0edc471a31880e94 [0,1,0,0,0,0|2,0,1]=4 2536 B11R0.152 C=C[C@H](CCCCC)OCCS a8b442d35866dc68d7c5abad1875faf6 [0,1,0,0,0,0|2,0,1]=4 2537 B11R0.152 C=C[C@H](CCCCC)OCOC b36913c192da669fde59e873d27c6520 [0,1,0,0,0,0|2,0,1]=4 2538 B11R0.152 C=C[C@H](CCCCC)OCSC 5d9f99c6d55df7e9916b9227c6eff58c [0,1,0,0,0,0|2,0,1]=4 2539 B11R0.152 CCC/C=C(\CC)/COCCC cb50a8b11ecb973069fc700f8ab9351f [0,1,0,0,0,0|3,0,0]=4 2540 B11R0.152 CCCCCC(CC)OCCC eb8abd30125ee681a13a1a1c98757d32 [0,1,0,0,0,0|1,0,1]=3 2541 B11R0.152 CCCCCC(CC)OCCF 9b27c55d73a566546a0836d2d87a6bc8 [0,1,0,0,0,0|2,0,1]=4 2542 B11R0.152 CCCCCC(CC)OCCS 99526376828de0c126fff1af2b792938 [0,1,0,0,0,0|2,0,1]=4 2543 B11R0.152 CCCCCC(CC)OCOC fae509200476092e9336974e73e85bd5 [0,1,0,0,0,0|2,0,1]=4 2544 B11R0.152 CCCCCC(CC)OCSC b890f3b4079c1837fb9f4cae78cb493e [0,1,0,0,0,0|2,0,1]=4 2545 B11R0.152 CCCCCN(C=O)CCCC da9d9018a9c5b1cea9ee60f531307452 [0,1,0,0,0,0|2,0,0]=3 2546 B11R0.152 CCCCCN(CC)CCCC bf8eb649855f132d9bfb256ba88bcd5b [0,1,0,0,0,0|3,0,0]=4 2547 B11R0.152 CCCCCN(CF)CCCC 8d81dfcc5996696554089070820f875c [0,1,0,0,0,0|3,0,0]=4 2548 B11R0.152 CCCCCN(CO)CCCC fbaf3264022e1f143f9c8652efbd996f [0,1,0,0,0,0|2,0,1]=4 2549 B11R0.152 CCCCC[C@H](CC)OCCC cd6f24cc3c62a85a2f8d47f083573856 [0,1,0,0,0,0|1,0,1]=3 2550 B11R0.152 CCCCC[C@H](CC)OCCF 3027ffd66396f4c750c5e93186305971 [0,1,0,0,0,0|2,0,1]=4 2551 B11R0.152 CCCCC[C@H](CC)OCCS 6b01f06f1d509df462bc020953c8215e [0,1,0,0,0,0|2,0,1]=4 2552 B11R0.152 CCCCC[C@H](CC)OCOC 1c6fdef56809d9ce842287e2048b4214 [0,1,0,0,0,0|2,0,1]=4 2553 B11R0.152 CCCCC[C@H](CC)OCSC 5405ccdfc1edc48363b69c7ba1e12e1b [0,1,0,0,0,0|2,0,1]=4 2554 B11R0.152 CCCCN(C=O)CCCCO b9332866f49048682d06288cea8190ea [0,1,0,0,0,0|3,0,0]=4 2555 B11R0.154 C#CC(C)NC(=O)CCCCC 694d0a471329db7d9516431ebc7cc8b0 [0,1,0,0,0,0|1,0,2]=4 2556 B11R0.154 C#CCCCC(=O)NC(C)CC 71538425fa334f8ea189d73820c6f976 [0,1,0,0,0,0|1,0,2]=4 2557 B11R0.154 C#CCCCC(=O)N[C@@H](C)CC c6d6857fed5a077b2f568f787c577f54 [0,1,0,0,0,0|1,0,2]=4 2558 B11R0.154 C#CCCCC(=O)N[C@H](C)CC f131ed168a1b8286a05fc4dd5998d614 [0,1,0,0,0,0|1,0,2]=4 2559 B11R0.154 C#C[C@@H](C)NC(=O)CCCCC cf8d4ed0c7cc7c2f77a8c1cef54d407b [0,1,0,0,0,0|1,0,2]=4 2560 B11R0.154 C#C[C@H](C)NC(=O)CCCCC 758878ca3e0c8aa09d4ca14c45c055fd [0,1,0,0,0,0|1,0,2]=4 2561 B11R0.154 C=CC(C)NC(=O)CCCCC b868782804cb2797fc7ff5fcf4d323cf [0,1,0,0,0,0|1,0,2]=4 2562 B11R0.154 C=CCCCC(=O)NC(C)CC ecba52a2da5e051dcc1d1b53d5df7a3a [0,1,0,0,0,0|1,0,2]=4 2563 B11R0.154 C=CCCCC(=O)N[C@@H](C)CC ef7eb901a9661234e74a0efdbfddf8c2 [0,1,0,0,0,0|1,0,2]=4 2564 B11R0.154 C=CCCCC(=O)N[C@H](C)CC e4b1ae4f9f20cf530661eadc13e9a4f7 [0,1,0,0,0,0|1,0,2]=4 2565 B11R0.154 CC#CCCC(=O)NC(C)CC 3249ab552dd164a402b86a3838a84c34 [0,1,0,0,0,0|1,0,2]=4 2566 B11R0.154 CC#CCCC(=O)N[C@@H](C)CC 86fc8aa7e4a9949a7c398a05354c1c24 [0,1,0,0,0,0|1,0,2]=4 2567 B11R0.154 CC#CCCC(=O)N[C@H](C)CC 1e87ef97fef357137e163e3e28e25e24 [0,1,0,0,0,0|1,0,2]=4 2568 B11R0.154 CC(CO)NC(=O)CCCCF 8f0f9e3c9afd1b3cbfcad9d453dd4591 [0,1,0,0,0,0|3,0,0]=4 2569 B11R0.154 CC(CO)NC(=O)CCCCO 204db279a7941b8bd91f24d898eea47d [0,1,0,0,0,0|3,0,0]=4 2570 B11R0.154 CC(CO)NC(=O)CCCCS c9f396dd69ccfbe9303b0571ff7f5916 [0,1,0,0,0,0|3,0,0]=4 2571 B11R0.154 CC/C=C/CC(=O)NC(C)CC eb9d58aada7db4fa626fa8406c1f793a [0,1,0,0,0,0|1,0,2]=4 2572 B11R0.154 CC/C=C/CC(=O)N[C@@H](C)CC db51b372306f83e0d5ff941526c3b771 [0,1,0,0,0,0|1,0,2]=4 2573 B11R0.154 CC/C=C/CC(=O)N[C@H](C)CC b4747ed28f31e62930404f41810a98d7 [0,1,0,0,0,0|1,0,2]=4 2574 B11R0.154 CC/C=C\CC(=O)NC(C)CC 3d17a27bf586a6ce1645e9fef76e9fef [0,1,0,0,0,0|1,0,2]=4 2575 B11R0.154 CC/C=C\CC(=O)N[C@@H](C)CC 3639ca7eb7535d651d87e51b2a967010 [0,1,0,0,0,0|1,0,2]=4 2576 B11R0.154 CC/C=C\CC(=O)N[C@H](C)CC e4b0d0ce051c2828b0fdc6d31906bc58 [0,1,0,0,0,0|1,0,2]=4 2577 B11R0.154 CC=CCCC(=O)NC(C)CC 79d49ef82e1e22732cc22b9a78316a61 [0,1,0,0,0,0|1,0,2]=4 2578 B11R0.154 CC=CCCC(=O)N[C@@H](C)CC afb930da388ef83d30a4606cd34190bb [0,1,0,0,0,0|1,0,2]=4 2579 B11R0.154 CC=CCCC(=O)N[C@H](C)CC 57fd1dba4845a0617ab1c5eea69404b9 [0,1,0,0,0,0|1,0,2]=4 2580 B11R0.154 CCC(C)CC(=O)NCCCCl f0d122afc49c4fd93f9ff351dc5d7cd4 [0,1,0,0,0,0|3,0,0]=4 2581 B11R0.154 CCC(C)CC(=O)NCCCO b6764610435ed8dadac0ea5b7d8dd758 [0,1,0,0,0,0|3,0,0]=4 2582 B11R0.154 CCC(C)CC(=O)NCCOC fe99f1bbf4f9591078c89e4ee533c080 [0,1,0,0,0,0|3,0,0]=4 2583 B11R0.154 CCC(C)CC(=O)NCCSC d814307643e69807a3fdd0897ff9138a [0,1,0,0,0,0|3,0,0]=4 2584 B11R0.154 CCC(C)NC(=O)CCCC#N 9d4480cf62936e16554a7ca5ad716108 [0,1,0,0,0,0|2,0,1]=4 2585 B11R0.154 CCC(C)NC(=O)CCCC=O 39d35d702544181e270cf17736d41db2 [0,1,0,0,0,0|2,0,1]=4 2586 B11R0.154 CCC(C)NC(=O)CCCCF 93200ab14d8346e94028c9eb7e42cf25 [0,1,0,0,0,0|2,0,0]=3 2587 B11R0.154 CCC(C)NC(=O)CCCCO f27c1d769ef86da2b96bff58091029a1 [0,1,0,0,0,0|2,0,0]=3 2588 B11R0.154 CCC(C)NC(=O)CCCCS 7a17ca638e77972d146489a99b47f18a [0,1,0,0,0,0|2,0,0]=3 2589 B11R0.154 CCC(C)NC(=O)CCCOC 07366ba2467a9b9f720e5a52663dc51b [0,1,0,0,0,0|2,0,0]=3 2590 B11R0.154 CCC(C)NC(=O)CCCSC 37bea9c0c90a79951a04e44f36595a65 [0,1,0,0,0,0|2,0,0]=3 2591 B11R0.154 CCC(C)NC(=O)CCSSC 3d5a71ac5411e36189a9d086bc7c691c [0,1,0,0,0,0|3,0,0]=4 2592 B11R0.154 CCC(C)NC(=O)CNCCBr d6f4d61bafb5a94ec90f14eeaccfa41a [0,1,0,0,0,0|3,0,0]=4 2593 B11R0.154 CCC(C)NC(=O)CNCCF 3b23a1ade2c19455c2cc3dbafd758ef4 [0,1,0,0,0,0|3,0,0]=4 2594 B11R0.154 CCC(C)NC(=O)CNCCI dbb0ff6417ed654d5511e5ef2565f60d [0,1,0,0,0,0|3,0,0]=4 2595 B11R0.154 CCC(C)NC(=O)CNCCO e6764b49da2c1dcca80c4cfa0d001971 [0,1,0,0,0,0|3,0,0]=4 2596 B11R0.154 CCC(C)NC(=O)CNCCS 27a7880d0de1fbc52c5c2056df847808 [0,1,0,0,0,0|3,0,0]=4 2597 B11R0.154 CCC(C)NC(=O)COCCF 7158a2551cdf06c6dc8737b60642944e [0,1,0,0,0,0|3,0,0]=4 2598 B11R0.154 CCC(C)NC(=O)COCCO 4d9a881612552a7875eaff57bab4ec33 [0,1,0,0,0,0|3,0,0]=4 2599 B11R0.154 CCC(C)NC(=O)COCCS 0776c6a6297d900c44326f102b31e93e [0,1,0,0,0,0|3,0,0]=4 2600 B11R0.154 CCC(C)NC(=O)COCOC e6f3ee58a2c1a4b398c29e1ead189be0 [0,1,0,0,0,0|3,0,0]=4 2601 B11R0.154 CCC(C)NC(=O)NCCCN 7f24a4d69a172b703eb47256b1d5b7b9 [0,1,0,0,0,0|3,0,0]=4 2602 B11R0.154 CCC(C)NC(=O)NCCCO 0c2e845e5256b846f617aa534398a7da [0,1,0,0,0,0|3,0,0]=4 2603 B11R0.154 CCC(C)NC(=O)NCCOC 1ff823b2c3a4712df3686c791a54f6d5 [0,1,0,0,0,0|3,0,0]=4 2604 B11R0.154 CCC(C)NC(=O)NCCSC 7acedca92f813c09f583b39598c8cd45 [0,1,0,0,0,0|3,0,0]=4 2605 B11R0.154 CCC(O)CC(=O)NCCCCl 31ed6869ecbc7311fab450946cc97f10 [0,1,0,0,0,0|3,0,0]=4 2606 B11R0.154 CCC(O)CC(=O)NCCCO 4ddf246a1501b1a2f8d3566f6d97acbd [0,1,0,0,0,0|3,0,0]=4 2607 B11R0.154 CCC(O)CC(=O)NCCOC fe0e5d6d06832fe5400a80758984d84e [0,1,0,0,0,0|3,0,0]=4 2608 B11R0.154 CCC(O)CC(=O)NCCSC aa6e938b7fcf66a7d7b8ce0dc6bcafb1 [0,1,0,0,0,0|3,0,0]=4 2609 B11R0.154 CCC/C=C/C(=O)NC(C)CC ac23f62156c5572a24fb1961800e55ea [0,1,0,0,0,0|1,0,2]=4 2610 B11R0.154 CCC/C=C/C(=O)N[C@@H](C)CC 340e314c099b2d272110e660372442d5 [0,1,0,0,0,0|1,0,2]=4 2611 B11R0.154 CCC/C=C/C(=O)N[C@H](C)CC 0d82e2b37ead327769d6451b1d88a217 [0,1,0,0,0,0|1,0,2]=4 2612 B11R0.154 CCC=CCC(=O)NC(C)CC 2984af5cfc7d0750d8d850a8ae6b4cd5 [0,1,0,0,0,0|1,0,2]=4 2613 B11R0.154 CCC=CCC(=O)N[C@@H](C)CC 48127b00c184d090b286e257dfd69d1d [0,1,0,0,0,0|1,0,2]=4 2614 B11R0.154 CCC=CCC(=O)N[C@H](C)CC 6e8e6f5775d358659454d760783cd362 [0,1,0,0,0,0|1,0,2]=4 2615 B11R0.154 CCCC#CC(=O)NC(C)CC a8adfef6b355348633c97659ff9bd391 [0,1,0,0,0,0|1,0,2]=4 2616 B11R0.154 CCCC#CC(=O)N[C@@H](C)CC c14ff3482d9721f9773412b79752c113 [0,1,0,0,0,0|1,0,2]=4 2617 B11R0.154 CCCC#CC(=O)N[C@H](C)CC d03129a70bc6077092125d6e14b13d08 [0,1,0,0,0,0|1,0,2]=4 2618 B11R0.154 CCCC=CC(=O)NC(C)CC d883c7b6baa279307fbf52b7edaf6673 [0,1,0,0,0,0|1,0,2]=4 2619 B11R0.154 CCCC=CC(=O)N[C@@H](C)CC e7f8a616058628744377330b8a1fd0aa [0,1,0,0,0,0|1,0,2]=4 2620 B11R0.154 CCCC=CC(=O)N[C@H](C)CC c10210aba895d11f32d16c846fec404b [0,1,0,0,0,0|1,0,2]=4 2621 B11R0.154 CCCCCC(=O)CN(C)CC 30366db760f80dff1900f3d8d8a8eb20 [0,1,0,0,0,0|2,0,0]=3 2622 B11R0.154 CCCCCC(=O)NC(C)C#N 8d7f6340b7d007c075c3894406659a08 [0,1,0,0,0,0|2,0,1]=4 2623 B11R0.154 CCCCCC(=O)NC(C)CC 262ef4edc9ec8245baac4f07e5e9b05f [0,1,0,0,0,0|1,0,0]=2 2624 B11R0.154 CCCCCC(=O)NC(C)CO 4fe9e4a902aeeded3b455a1e0740f5e1 [0,1,0,0,0,0|2,0,0]=3 2625 B11R0.154 CCCCCC(=O)N[C@@H](C)CC cc5954556163eddbab17d6f2286c6d5a [0,1,0,0,0,0|1,0,0]=2 2626 B11R0.154 CCCCCC(=O)N[C@@H](C)CO ef75078178c0a4c84af7ac212693362b [0,1,0,0,0,0|2,0,0]=3 2627 B11R0.154 CCCCCC(=O)N[C@H](C)CC 7da21d20a8de2d55a27316da359a6a33 [0,1,0,0,0,0|1,0,0]=2 2628 B11R0.154 CCCCCC(=O)N[C@H](C)CO 8c1d0b3a5ea3d0a6f6400cbabf6b003f [0,1,0,0,0,0|2,0,0]=3 2629 B11R0.154 CCCCCC(C)NC(C)CC 6b768cd417bf1ab4f56fb460dbbaebf9 [0,1,0,0,0,0|2,0,1]=4 2630 B11R0.154 CCCCCC(C)N[C@@H](C)CC 14258c5b71e688e7345d25ee0ab9b221 [0,1,0,0,0,0|2,0,1]=4 2631 B11R0.154 CCCCCC(C)N[C@H](C)CC e0a72263141be070ffb3316b3ed2dc4a [0,1,0,0,0,0|2,0,1]=4 2632 B11R0.154 CCCCCC(C)OC(C)CC fc643163d2b891af0c0926d7f7eb2462 [0,1,0,0,0,0|1,0,1]=3 2633 B11R0.154 CCCCCC(C)OC(C)CF cc2c35f47a7dacdabba3585b5db989f6 [0,1,0,0,0,0|2,0,1]=4 2634 B11R0.154 CCCCCC(C)O[C@@H](C)CC da1300fa38abc5a9011c506e97ae86c1 [0,1,0,0,0,0|1,0,1]=3 2635 B11R0.154 CCCCCC(C)O[C@H](C)CC 5f460a324fee5c3fec72e73bca2add32 [0,1,0,0,0,0|1,0,1]=3 2636 B11R0.154 CCCCCN(C)CC(C)CC ddc41fe6bc67fe620fae44e12c9a3c7a [0,1,0,0,0,0|3,0,0]=4 2637 B11R0.154 CCCCCN(C)CC(O)CC 7ae7d1c610d1ff44858aed3840f873ac [0,1,0,0,0,0|3,0,0]=4 2638 B11R0.154 CCCCCN(C)C[C@@H](C)CC 5bd000c5c14a440e2ff76d7a2dd21caf [0,1,0,0,0,0|3,0,0]=4 2639 B11R0.154 CCCCCN(C)C[C@H](C)CC c798021cc7f3e5f99685ffcf4bc37caf [0,1,0,0,0,0|3,0,0]=4 2640 B11R0.154 CCCCC[C@@H](C)OC(C)CC 51c578f0319615a410c0ef65ae55d4bb [0,1,0,0,0,0|1,0,1]=3 2641 B11R0.154 CCCCC[C@H](C)NC(C)CC 1e6be1469cd5bf36b9b7f65e2ba78e01 [0,1,0,0,0,0|2,0,1]=4 2642 B11R0.154 CCCCC[C@H](C)N[C@@H](C)CC f93021dcdbef5d2d95b635670b96be17 [0,1,0,0,0,0|2,0,1]=4 2643 B11R0.154 CCCCC[C@H](C)N[C@H](C)CC a900949361c71300fc11b7049b77de7b [0,1,0,0,0,0|2,0,1]=4 2644 B11R0.154 CCCCC[C@H](C)OC(C)CC d26536a90aeff68338d067622136554f [0,1,0,0,0,0|1,0,1]=3 2645 B11R0.154 CCCCC[C@H](C)OC(C)CF dde88321a5d2885a664fd97ed3a34341 [0,1,0,0,0,0|2,0,1]=4 2646 B11R0.154 CCCCC[C@H](C)OC(C)CS 25039d223d87be6a968b01992b7d308a [0,1,0,0,0,0|2,0,1]=4 2647 B11R0.154 CCCCC[C@H](C)O[C@@H](C)CC 80fa37361d22f5be457b77facfc339ed [0,1,0,0,0,0|1,0,1]=3 2648 B11R0.154 CCCCC[C@H](C)O[C@H](C)CC d0b6ca99c00ec0460fe469da71a605d9 [0,1,0,0,0,0|1,0,1]=3 2649 B11R0.154 CCCCC[C@H](C)O[C@H](C)CS 8fcfc0eed6f082e4d74dbb07a250bf55 [0,1,0,0,0,0|2,0,1]=4 2650 B11R0.154 CCCCNC(=O)/C=C(/C)\CC 0185ad8bd86769662024184fc970bdd7 [0,1,0,0,0,0|2,0,1]=4 2651 B11R0.154 CCCCNC(=O)/C=C(\C)/CC f3fcf383627067cd786dd2995da54997 [0,1,0,0,0,0|2,0,1]=4 2652 B11R0.154 CCCCNC(=O)CC(C)CC d31a01276300abdc95d24254c3ee0196 [0,1,0,0,0,0|2,0,0]=3 2653 B11R0.154 CCCCNC(=O)CC(C)OC 0461123f3953d0aa1076f215afe6258d [0,1,0,0,0,0|3,0,0]=4 2654 B11R0.154 CCCCNC(=O)CC(O)CC 92b44cbeed12a13cdd77a96626d420b8 [0,1,0,0,0,0|2,0,0]=3 2655 B11R0.154 CCCCNC(=O)CN(C)CC 11700c69641a384ea594850c32210726 [0,1,0,0,0,0|3,0,0]=4 2656 B11R0.154 CCCCNC(=O)C[C@@H](C)CC 41224ffdc5c3570f914684ae9d2252ac [0,1,0,0,0,0|2,0,0]=3 2657 B11R0.154 CCCCNC(=O)C[C@@H](O)CC 12e7048243fe1d6d308243c530eaef53 [0,1,0,0,0,0|2,0,0]=3 2658 B11R0.154 CCCCNC(=O)C[C@H](C)CC 52d1709aff4335c28250979e425dbc20 [0,1,0,0,0,0|2,0,0]=3 2659 B11R0.154 CCCCNC(=O)C[C@H](O)CC 6e0f54c9b9c4f2ae2f6516c70082aabe [0,1,0,0,0,0|2,0,0]=3 2660 B11R0.154 CCCCNC(=O)NC(C)CC 675aaeb61dd545c78539eb8ac9d322c3 [0,1,0,0,0,0|2,0,0]=3 2661 B11R0.154 CCCCNC(=O)NC(C)CO 089fc564672cfbb4791a2f0fd478693e [0,1,0,0,0,0|3,0,0]=4 2662 B11R0.154 CCCCNC(=O)N[C@@H](C)CC 4ef0b7c2d8b333a5d6e7de44f61bb2c6 [0,1,0,0,0,0|2,0,0]=3 2663 B11R0.154 CCCCNC(=O)N[C@@H](C)CO 63fe23134dd144335500e4aa7c420bcd [0,1,0,0,0,0|3,0,0]=4 2664 B11R0.154 CCCCNC(=O)N[C@H](C)CC 228bc2dffa802f525164f41b7e7b04a0 [0,1,0,0,0,0|2,0,0]=3 2665 B11R0.154 CCCCNC(=O)N[C@H](C)CO a0e4cf8b2b3beeeff3186e6d34e97833 [0,1,0,0,0,0|3,0,0]=4 2666 B11R0.154 CCCCNC(=S)NC(C)CC 7c32bd304871aa686baddbb22b86acfd [0,1,0,0,0,0|2,1,0]=4 2667 B11R0.154 CCCCNC(=S)N[C@@H](C)CC a6f71c9d2bc06c22db98eb47fa5d31bc [0,1,0,0,0,0|2,1,0]=4 2668 B11R0.154 CCCCNC(=S)N[C@H](C)CC 7116cb087596568a1fedc363f5f6f8ed [0,1,0,0,0,0|2,1,0]=4 2669 B11R0.154 CCCCOC(=O)CN(C)CC 46ec8fad816883260181673b7bfb0f84 [0,1,0,0,0,0|3,0,0]=4 2670 B11R0.154 CCCNCC(=O)NC(C)CC 38455c846cc69b4140967187d379ea91 [0,1,0,0,0,0|2,0,0]=3 2671 B11R0.154 CCCNCC(=O)NC(C)CO 289b63f69bef0d852dcc058ae345da09 [0,1,0,0,0,0|3,0,0]=4 2672 B11R0.154 CCCOCC(=O)NC(C)CC 0ebc24a9e650a176e7c94e7946f3a50f [0,1,0,0,0,0|2,0,0]=3 2673 B11R0.154 CCCOCC(=O)NC(C)CO d3e4e2a86237da18b88a30bac3844a9b [0,1,0,0,0,0|3,0,0]=4 2674 B11R0.154 CCCOCC(=O)N[C@@H](C)CC bfd38ca2df18878ff64cd290bf57d3ee [0,1,0,0,0,0|2,0,0]=3 2675 B11R0.154 CCCOCC(=O)N[C@@H](C)CO be131dfaf23e9dcb1430697534947b54 [0,1,0,0,0,0|3,0,0]=4 2676 B11R0.154 CCCOCC(=O)N[C@H](C)CC 31707dceffa07c748f36424f61985f24 [0,1,0,0,0,0|2,0,0]=3 2677 B11R0.154 CCCOCC(=O)N[C@H](C)CO e247a066d5a63e5aa4130d6b0d59f85e [0,1,0,0,0,0|3,0,0]=4 2678 B11R0.154 CCCOCC(C)OC(C)CC 6af984d8f1e6f996d0742e034d861047 [0,1,0,0,0,0|2,0,1]=4 2679 B11R0.154 CCCSCC(=O)NC(C)CC 3bf1c607c033a21b4e48233f17f75a0c [0,1,0,0,0,0|2,0,0]=3 2680 B11R0.154 CCCSCC(=O)NC(C)CO 5839a1328325965a932211b9039ea617 [0,1,0,0,0,0|3,0,0]=4 2681 B11R0.154 CCCSCC(=O)N[C@@H](C)CC 3547c7b6de1e38cfff0a7f964a27a96c [0,1,0,0,0,0|2,0,0]=3 2682 B11R0.154 CCCSCC(=O)N[C@@H](C)CO 176580e7ef99ca26cc7618aca9a2c139 [0,1,0,0,0,0|3,0,0]=4 2683 B11R0.154 CCCSCC(=O)N[C@H](C)CC 86dee1f1c26967ec43eee7397c7423a4 [0,1,0,0,0,0|2,0,0]=3 2684 B11R0.154 CCCSCC(=O)N[C@H](C)CO 35db1f932e04aee39037e5897694cdc5 [0,1,0,0,0,0|3,0,0]=4 2685 B11R0.154 CCOCCC(=O)NC(C)CC 0b03a003401f0856d0643b97d08a64c1 [0,1,0,0,0,0|2,0,0]=3 2686 B11R0.154 CCOCCC(=O)NC(C)CO a9c2735419cd8de958663f1f25562574 [0,1,0,0,0,0|3,0,0]=4 2687 B11R0.154 CCOCCC(=O)N[C@@H](C)CC 8bdadbdd464ada88ecdcb87d06820dec [0,1,0,0,0,0|2,0,0]=3 2688 B11R0.154 CCOCCC(=O)N[C@@H](C)CO 8b955547c62162122978409f5fdb526f [0,1,0,0,0,0|3,0,0]=4 2689 B11R0.154 CCOCCC(=O)N[C@H](C)CC d6c48a6af85ca7aa97b61c3c621bdab2 [0,1,0,0,0,0|2,0,0]=3 2690 B11R0.154 CCOCCC(=O)N[C@H](C)CO b4a86942deb203b08b2b6e495a02be75 [0,1,0,0,0,0|3,0,0]=4 2691 B11R0.154 CCSCCC(=O)NC(C)CC 5e8c194e9616b3d4ee1fd7f31a1de2ec [0,1,0,0,0,0|2,0,0]=3 2692 B11R0.154 CCSCCC(=O)NC(C)CO 23b0020147e1ce226130e68ff98311a6 [0,1,0,0,0,0|3,0,0]=4 2693 B11R0.154 CCSCCC(=O)N[C@@H](C)CC 97ef4130509f3dcfe58d96c99efa3cd8 [0,1,0,0,0,0|2,0,0]=3 2694 B11R0.154 CCSCCC(=O)N[C@@H](C)CO cc748af24113cbf8a16867b736965a35 [0,1,0,0,0,0|3,0,0]=4 2695 B11R0.154 CCSCCC(=O)N[C@H](C)CC 148bfba6e2601ada5140972dc1b7bb59 [0,1,0,0,0,0|2,0,0]=3 2696 B11R0.154 CCSCCC(=O)N[C@H](C)CO 007fb4d763f3caa94c5309b06362cf94 [0,1,0,0,0,0|3,0,0]=4 2697 B11R0.154 CC[C@@H](C)CC(=O)NCCCCl f437e1b7ed77ba9892523e58b516a5cc [0,1,0,0,0,0|3,0,0]=4 2698 B11R0.154 CC[C@@H](C)CC(=O)NCCCO 20f81de654df15665da5af53f180bf8f [0,1,0,0,0,0|3,0,0]=4 2699 B11R0.154 CC[C@@H](C)CC(=O)NCCOC c8dd83a1239373e484db7d75b5674528 [0,1,0,0,0,0|3,0,0]=4 2700 B11R0.154 CC[C@@H](C)CC(=O)NCCSC ed4fd05fc927870c6eb2185c3578af91 [0,1,0,0,0,0|3,0,0]=4 2701 B11R0.154 CC[C@@H](C)NC(=O)CCCC#N f0ebf6d9c24b0cc47d9d446311a3f8aa [0,1,0,0,0,0|2,0,1]=4 2702 B11R0.154 CC[C@@H](C)NC(=O)CCCC=O 54197821683375fc41187f6a15357f03 [0,1,0,0,0,0|2,0,1]=4 2703 B11R0.154 CC[C@@H](C)NC(=O)CCCCF bae4fcc15564fb4b81716dfb5a92c1f1 [0,1,0,0,0,0|2,0,0]=3 2704 B11R0.154 CC[C@@H](C)NC(=O)CCCCO 015e290a4cd8655c17176750fdad99b5 [0,1,0,0,0,0|2,0,0]=3 2705 B11R0.154 CC[C@@H](C)NC(=O)CCCCS 7430f704cd7b2d6c53086e9cba660513 [0,1,0,0,0,0|2,0,0]=3 2706 B11R0.154 CC[C@@H](C)NC(=O)CCCOC 1bcce62ef1b4dec781654b9ed6cc582c [0,1,0,0,0,0|2,0,0]=3 2707 B11R0.154 CC[C@@H](C)NC(=O)CCCSC a88fd5fe74d523b553371d7d6152656e [0,1,0,0,0,0|2,0,0]=3 2708 B11R0.154 CC[C@@H](C)NC(=O)CCSSC eb5860d26c5f3aac9d390c507964bd63 [0,1,0,0,0,0|3,0,0]=4 2709 B11R0.154 CC[C@@H](C)NC(=O)COCCO e2ea3eab24736f0f9600af2ec30bbf85 [0,1,0,0,0,0|3,0,0]=4 2710 B11R0.154 CC[C@@H](C)NC(=O)COCCS 12fe51d3f452524865ec8840ac1bac02 [0,1,0,0,0,0|3,0,0]=4 2711 B11R0.154 CC[C@@H](C)NC(=O)NCCCN 850a3f7f997d158c8761bca00861ff78 [0,1,0,0,0,0|3,0,0]=4 2712 B11R0.154 CC[C@@H](C)NC(=O)NCCCO f3302a55f8cdba227ca8d33e1dfbe647 [0,1,0,0,0,0|3,0,0]=4 2713 B11R0.154 CC[C@@H](C)NC(=O)NCCOC 586bdbb3635e12f2da8b5d6ed85db184 [0,1,0,0,0,0|3,0,0]=4 2714 B11R0.154 CC[C@@H](C)NC(=O)NCCSC 0068081042984b65843ef0d581876023 [0,1,0,0,0,0|3,0,0]=4 2715 B11R0.154 CC[C@@H](O)CC(=O)NCCCCl 629dac239894dc9b19dbd857065168f7 [0,1,0,0,0,0|3,0,0]=4 2716 B11R0.154 CC[C@@H](O)CC(=O)NCCCO fb1b61f92bfe91079372326c06a35f57 [0,1,0,0,0,0|3,0,0]=4 2717 B11R0.154 CC[C@@H](O)CC(=O)NCCOC 4c5a2b8708049fc00e67a6844939d200 [0,1,0,0,0,0|3,0,0]=4 2718 B11R0.154 CC[C@@H](O)CC(=O)NCCSC 1ed2af6653c9a223417e4c1571a2881b [0,1,0,0,0,0|3,0,0]=4 2719 B11R0.154 CC[C@H](C)CC(=O)NCCCCl cb508cf65ac2861b769f2bb1efb46eae [0,1,0,0,0,0|3,0,0]=4 2720 B11R0.154 CC[C@H](C)CC(=O)NCCCO 5cc8966de734d634a8bb1f516a54357f [0,1,0,0,0,0|3,0,0]=4 2721 B11R0.154 CC[C@H](C)CC(=O)NCCOC 91dd9c976fea51872dea724cf507c545 [0,1,0,0,0,0|3,0,0]=4 2722 B11R0.154 CC[C@H](C)CC(=O)NCCSC 875f2c0409de057960945760203a6e97 [0,1,0,0,0,0|3,0,0]=4 2723 B11R0.154 CC[C@H](C)NC(=O)CCCC#N 01528287e972ad2feecab2250103770a [0,1,0,0,0,0|2,0,1]=4 2724 B11R0.154 CC[C@H](C)NC(=O)CCCC=O deee3344bbd74ed8b5d8b1a8f86972b2 [0,1,0,0,0,0|2,0,1]=4 2725 B11R0.154 CC[C@H](C)NC(=O)CCCCF 7d80b4d49e13c25226b90ff52ba31556 [0,1,0,0,0,0|2,0,0]=3 2726 B11R0.154 CC[C@H](C)NC(=O)CCCCO 991ecf8b3cb128fa7c084c7d6f1c4685 [0,1,0,0,0,0|2,0,0]=3 2727 B11R0.154 CC[C@H](C)NC(=O)CCCCS 3929d54e10bd9c44e425c76384ae8cfe [0,1,0,0,0,0|2,0,0]=3 2728 B11R0.154 CC[C@H](C)NC(=O)CCCOC 535bfa05790a72be7805f9a2f43626cd [0,1,0,0,0,0|2,0,0]=3 2729 B11R0.154 CC[C@H](C)NC(=O)CCCSC 93252a4b74000ddfbf38f43ce243cdaf [0,1,0,0,0,0|2,0,0]=3 2730 B11R0.154 CC[C@H](C)NC(=O)CCSSC 3a01137c5e06cbe138b2d86165c033ae [0,1,0,0,0,0|3,0,0]=4 2731 B11R0.154 CC[C@H](C)NC(=O)COCCO 2aa85fa68f08e45e0516893ca0b09a1b [0,1,0,0,0,0|3,0,0]=4 2732 B11R0.154 CC[C@H](C)NC(=O)COCCS c22594fbdb91b4f0ca415221d37e2bec [0,1,0,0,0,0|3,0,0]=4 2733 B11R0.154 CC[C@H](C)NC(=O)NCCCN e335639765235f49f0e0b3ebb8d4c180 [0,1,0,0,0,0|3,0,0]=4 2734 B11R0.154 CC[C@H](C)NC(=O)NCCCO 1b122bc09fad4d66d7122eda4c6f6ab2 [0,1,0,0,0,0|3,0,0]=4 2735 B11R0.154 CC[C@H](C)NC(=O)NCCOC dd486fe5b1092ffc43a32bf574666753 [0,1,0,0,0,0|3,0,0]=4 2736 B11R0.154 CC[C@H](C)NC(=O)NCCSC edfb46d5f95ca6bed41a255def00712c [0,1,0,0,0,0|3,0,0]=4 2737 B11R0.154 CC[C@H](O)CC(=O)NCCCCl 6cfa804b43d61c96e13b3676c697fe91 [0,1,0,0,0,0|3,0,0]=4 2738 B11R0.154 CC[C@H](O)CC(=O)NCCCO baa78503a6d6c36d1aa528353e094a06 [0,1,0,0,0,0|3,0,0]=4 2739 B11R0.154 CC[C@H](O)CC(=O)NCCOC 2904797e3999abde4284cd271ab3fbcb [0,1,0,0,0,0|3,0,0]=4 2740 B11R0.154 CC[C@H](O)CC(=O)NCCSC c8a84afb94d076719b75b53b7e1ee58f [0,1,0,0,0,0|3,0,0]=4 2741 B11R0.154 COCCCC(=O)NC(C)CO 3c7ba607316e42e66e69fa35674297c8 [0,1,0,0,0,0|3,0,0]=4 2742 B11R0.154 COCCCC(=O)N[C@@H](C)CO 1ddc9ad4699990342460a7af12ece8a8 [0,1,0,0,0,0|3,0,0]=4 2743 B11R0.154 COCCCC(=O)N[C@H](C)CO 35a8bc844bc06e24b7f9ea354e60ff52 [0,1,0,0,0,0|3,0,0]=4 2744 B11R0.154 CSCCCC(=O)NC(C)CO afb5f4f449d3c1b93448a028c4d38a82 [0,1,0,0,0,0|3,0,0]=4 2745 B11R0.154 CSCCCC(=O)N[C@@H](C)CO 0ce3350dea5cbc4d5f2130093c4c2db4 [0,1,0,0,0,0|3,0,0]=4 2746 B11R0.154 CSCCCC(=O)N[C@H](C)CO c12a212d11da8644072ce8f6e008f401 [0,1,0,0,0,0|3,0,0]=4 2747 B11R0.154 C[C@@H](CO)NC(=O)CCCCF 0f9e66c6b6b60272232a861b7c9f217e [0,1,0,0,0,0|3,0,0]=4 2748 B11R0.154 C[C@@H](CO)NC(=O)CCCCO ac744197665ceabb5465329a8dad584b [0,1,0,0,0,0|3,0,0]=4 2749 B11R0.154 C[C@@H](CO)NC(=O)CCCCS a157532331231ea374da735618a4c293 [0,1,0,0,0,0|3,0,0]=4 2750 B11R0.154 C[C@H](CO)NC(=O)CCCCF e52c51247b7f89f3edb2e95ffe726174 [0,1,0,0,0,0|3,0,0]=4 2751 B11R0.154 C[C@H](CO)NC(=O)CCCCO a009ef318f1417670eb598c4b6394cf7 [0,1,0,0,0,0|3,0,0]=4 2752 B11R0.154 C[C@H](CO)NC(=O)CCCCS 96451654ace2005296b8552f67cb02ce [0,1,0,0,0,0|3,0,0]=4 2753 B11R0.155 C#CCCCC(=O)N(C)CCC f7a83456a116e1e9edcadc8195431cb7 [0,1,0,0,0,0|1,0,2]=4 2754 B11R0.155 C#CCN(C)C(=O)CCCCC b39a5cbfadc63ec9087f2930ebd6406a [0,1,0,0,0,0|1,0,2]=4 2755 B11R0.155 C=C(CCC)C(=O)NCCCC 8da78ccc70ef073710392e9ca5a4309d [0,1,0,0,0,0|2,0,0]=3 2756 B11R0.155 C=C(CCC)C(=O)NCCCCl 89656c01a9918bc23e1da4f9c8eb62e5 [0,1,0,0,0,0|3,0,0]=4 2757 B11R0.155 C=C(CCC)C(=O)NCCCO 876d29523428406eb5335a2890c7ba93 [0,1,0,0,0,0|3,0,0]=4 2758 B11R0.155 C=C(CCC)C(=O)NCCOC 95e4f4dfb47556407dc97e6e5f4df8e9 [0,1,0,0,0,0|3,0,0]=4 2759 B11R0.155 C=C(CCC)C(=O)NCCSC 76b2a829f800720ba85b4dfc435cf6f1 [0,1,0,0,0,0|3,0,0]=4 2760 B11R0.155 C=C(COC)C(=O)NCCCC f8e64de0c6ad60b2c6ac8ff47e8456c3 [0,1,0,0,0,0|3,0,0]=4 2761 B11R0.155 C=C(CSC)C(=O)NCCCC 40b32582e3c6bc6946117011b956594b [0,1,0,0,0,0|3,0,0]=4 2762 B11R0.155 C=CCCCC(=O)N(C)CCC 62b555f1decbe23a0d22d078811d4d0b [0,1,0,0,0,0|1,0,2]=4 2763 B11R0.155 C=CCN(C)C(=O)CCCCC f74fe3a819d085cc5e256dfefdd7656a [0,1,0,0,0,0|1,0,2]=4 2764 B11R0.155 CC#CCCC(=O)N(C)CCC 5a583e18c3d1f5a41adbc19472423748 [0,1,0,0,0,0|1,0,2]=4 2765 B11R0.155 CC/C=C(\C)/C(=O)NCCCC 8b4a7dbe6b7f14fc22083fa54719e177 [0,1,0,0,0,0|2,0,1]=4 2766 B11R0.155 CC/C=C/CC(=O)N(C)CCC 4d2016ecf7a4edd05d6b11ed2341156b [0,1,0,0,0,0|1,0,2]=4 2767 B11R0.155 CC/C=C\CC(=O)N(C)CCC 6575bcf13fdd98c91fca64b54aab97a7 [0,1,0,0,0,0|1,0,2]=4 2768 B11R0.155 CC=CCCC(=O)N(C)CCC afcd185e200c52c32db9580624e4f985 [0,1,0,0,0,0|1,0,2]=4 2769 B11R0.155 CCC/C=C/C(=O)N(C)CCC d2b5f74166f812962d6b54e526ca83f3 [0,1,0,0,0,0|1,0,2]=4 2770 B11R0.155 CCC=C(C)C(=O)NCCCC 365c1a54592f426d11c9023a8e25b332 [0,1,0,0,0,0|2,0,1]=4 2771 B11R0.155 CCC=CCC(=O)N(C)CCC 993ac5fa01aa013faeabf740f5e64de6 [0,1,0,0,0,0|1,0,2]=4 2772 B11R0.155 CCCC#CC(=O)N(C)CCC ec881e661188d5d50674b2eb1719ac8f [0,1,0,0,0,0|1,0,2]=4 2773 B11R0.155 CCCC(=O)C(=O)NCCCCl b016af4d4e15e11228b9c4ff89839eb7 [0,1,0,0,0,0|3,0,0]=4 2774 B11R0.155 CCCC(=O)C(=O)NCCCO 9c3585798047e2f2ec89048c6c2631d9 [0,1,0,0,0,0|3,0,0]=4 2775 B11R0.155 CCCC(=O)C(=O)NCCOC 85e7fc223b6131cff677c485da205e60 [0,1,0,0,0,0|3,0,0]=4 2776 B11R0.155 CCCC(=O)C(=O)NCCSC feb9935e371abe7f656cc359838d7894 [0,1,0,0,0,0|3,0,0]=4 2777 B11R0.155 CCCC(O)C(=O)NCCCCl 54ce495ef6f91813466d6d3dc3302eed [0,1,0,0,0,0|3,0,0]=4 2778 B11R0.155 CCCC(O)C(=O)NCCCO d7b3cbe1f10a4dd8693b69f783ab4a87 [0,1,0,0,0,0|3,0,0]=4 2779 B11R0.155 CCCC(O)C(=O)NCCOC f35165c8e91cacd996de9489752a6888 [0,1,0,0,0,0|3,0,0]=4 2780 B11R0.155 CCCC(O)C(=O)NCCSC d5659afb1c22317f9652c7e2bfde4fea [0,1,0,0,0,0|3,0,0]=4 2781 B11R0.155 CCCC=CC(=O)N(C)CCC 5134950ab923f7249d33200043007f85 [0,1,0,0,0,0|1,0,2]=4 2782 B11R0.155 CCCCCC(=O)N(C)CC#N a8cf1fa6cb9db6abe42cd6171b3b2fd7 [0,1,0,0,0,0|2,0,1]=4 2783 B11R0.155 CCCCCC(=O)N(C)CCC 7b3a4a8d0f7eb6e69d5ef5ae6144192e [0,1,0,0,0,0|1,0,0]=2 2784 B11R0.155 CCCCCC(=O)N(C)CCF 67cf27e06db7a3be6faa3c51d37a9466 [0,1,0,0,0,0|2,0,0]=3 2785 B11R0.155 CCCCCC(=O)N(C)CCO 2df9c6a41964bdde7ff1df48b3c48386 [0,1,0,0,0,0|2,0,0]=3 2786 B11R0.155 CCCCCC(C)N(C)CCC 25324ed71c87513310a1cd3237e9798e [0,1,0,0,0,0|2,0,1]=4 2787 B11R0.155 CCCCCN(C)C(=O)CCC f69c208eb29980023e139971dcc14c2a [0,1,0,0,0,0|3,0,0]=4 2788 B11R0.155 CCCCCN(C)C(C)CCC 970ae3d5f048fc4c68dd55f1f817d726 [0,1,0,0,0,0|3,0,0]=4 2789 B11R0.155 CCCCC[C@H](C)N(C)CCC b092f8147c516893fab842fcd121d6eb [0,1,0,0,0,0|2,0,1]=4 2790 B11R0.155 CCCCNC(=O)C(=O)CCC e6c5a3b9f2b52c40c8aa3aeabed5b416 [0,1,0,0,0,0|2,0,0]=3 2791 B11R0.155 CCCCNC(=O)C(=O)NCC 8a89c12f27f995e788bac24d6142e14d [0,1,0,0,0,0|3,0,0]=4 2792 B11R0.155 CCCCNC(=O)C(=O)OCC bdfded043e796bb568818197108f941f [0,1,0,0,0,0|3,0,0]=4 2793 B11R0.155 CCCCNC(=O)C(C)NCC b3341205f4a315a91b2dcfe2cd9ac4e9 [0,1,0,0,0,0|3,0,0]=4 2794 B11R0.155 CCCCNC(=O)C(C)OCC 9542a2319011d3e402e507ffb8d23a18 [0,1,0,0,0,0|3,0,0]=4 2795 B11R0.155 CCCCNC(=O)C(C)SCC b3f9b23b1d7c41d26db00e57ec4380e3 [0,1,0,0,0,0|3,0,0]=4 2796 B11R0.155 CCCCNC(=O)C(O)CCC b9d76d00e049f73e65856aca4d1320b1 [0,1,0,0,0,0|2,0,0]=3 2797 B11R0.155 CCCCNC(=O)C(O)CSC 6034b91998891a01e418df859e898aeb [0,1,0,0,0,0|3,0,0]=4 2798 B11R0.155 CCCCNC(=O)N(C)CCC e3da8091ef452ec50f8b52a36a299541 [0,1,0,0,0,0|2,0,0]=3 2799 B11R0.155 CCCCNC(=O)N(C)CCF fb16406dba413ecce806554ddbdbd448 [0,1,0,0,0,0|3,0,0]=4 2800 B11R0.155 CCCCNC(=O)N(C)CCO fa084589fcc6e6cb969bb2adc010c20e [0,1,0,0,0,0|3,0,0]=4 2801 B11R0.155 CCCCNC(=O)[C@@H](O)CCC 292e279519b3c81403f95db1afc0d7dc [0,1,0,0,0,0|2,0,0]=3 2802 B11R0.155 CCCCNC(=O)[C@H](O)CCC c49de6f212a5a493258f182200ef6a2d [0,1,0,0,0,0|2,0,0]=3 2803 B11R0.155 CCCCNC(=S)N(C)CCC 92316c24e0fd39b2d516056e9c2fb2d9 [0,1,0,0,0,0|2,1,0]=4 2804 B11R0.155 CCCCOC(=O)C(C)OCC 27155e1ed43f541a504e02b173f00a3b [0,1,0,0,0,0|3,0,0]=4 2805 B11R0.155 CCCCOC(=O)[C@H](C)NCC 7fbea0a857f37b140821280e76d310a4 [0,1,0,0,0,0|3,0,0]=4 2806 B11R0.155 CCCCOC(=O)[C@H](C)OCC 56fa363abf1d7b957e9fc08fae5bab2b [0,1,0,0,0,0|3,0,0]=4 2807 B11R0.155 CCCN(C)C(=O)CCCC#N a7efa1df443663c83f78d14d4b7991b1 [0,1,0,0,0,0|2,0,1]=4 2808 B11R0.155 CCCN(C)C(=O)CCCC=O f1f7b0f2591e30a158698d04ddaa7a70 [0,1,0,0,0,0|2,0,1]=4 2809 B11R0.155 CCCN(C)C(=O)CCCCF b1e32e698ce4802b47d0fcc51e7c3804 [0,1,0,0,0,0|2,0,0]=3 2810 B11R0.155 CCCN(C)C(=O)CCCCO 2dcdc6415872aa48691dd2ac56c5fa73 [0,1,0,0,0,0|2,0,0]=3 2811 B11R0.155 CCCN(C)C(=O)CCCCS 485289b3790e54cbfb52541851ae40e1 [0,1,0,0,0,0|2,0,0]=3 2812 B11R0.155 CCCN(C)C(=O)CCCOC 1f4513de10a357f26e3ec9d7c4a9f57e [0,1,0,0,0,0|2,0,0]=3 2813 B11R0.155 CCCN(C)C(=O)CCCSC daa8033f342da7987ca96700c11c79bb [0,1,0,0,0,0|2,0,0]=3 2814 B11R0.155 CCCN(C)C(=O)CCOCC 97cc64917bdea963d184695b6ee00910 [0,1,0,0,0,0|2,0,0]=3 2815 B11R0.155 CCCN(C)C(=O)CCSCC 477dea9f138bdaf9f900f87dce8e3b56 [0,1,0,0,0,0|2,0,0]=3 2816 B11R0.155 CCCN(C)C(=O)CCSSC 825f57afb68e252f5a0787c4c2041c2f [0,1,0,0,0,0|3,0,0]=4 2817 B11R0.155 CCCN(C)C(=O)COCCO 86a477f65657d67a0b71e1eebfc82a8b [0,1,0,0,0,0|3,0,0]=4 2818 B11R0.155 CCCN(C)C(=O)COCCS 3b414ec1bdf934970214aa4538be5f04 [0,1,0,0,0,0|3,0,0]=4 2819 B11R0.155 CCCN(C)C(=O)NCCCN 270df8346e62ec89bd37abea6b82b0e4 [0,1,0,0,0,0|3,0,0]=4 2820 B11R0.155 CCCN(C)C(=O)NCCCO 3c6af76ef3447d60a92002718182f285 [0,1,0,0,0,0|3,0,0]=4 2821 B11R0.155 CCCN(C)C(=O)NCCOC c10f704bb72b08e476e6effc5cbab5eb [0,1,0,0,0,0|3,0,0]=4 2822 B11R0.155 CCCN(C)C(=O)NCCSC 14a5ef4907ce2b85a823a6b8ebea4a73 [0,1,0,0,0,0|3,0,0]=4 2823 B11R0.155 CCCOCC(=O)N(C)CCC 05f65b2297411e4da43fdb2a90ee58cb [0,1,0,0,0,0|2,0,0]=3 2824 B11R0.155 CCCOCC(=O)N(C)CCF 671d524e5e29c3fe7be0ebd03aabfda6 [0,1,0,0,0,0|3,0,0]=4 2825 B11R0.155 CCCOCC(=O)N(C)CCO 8441e1dff0dd26b7a8083faecac45087 [0,1,0,0,0,0|3,0,0]=4 2826 B11R0.155 CCCSCC(=O)N(C)CCC cf4b4321c8dbc9705456585faebbd34e [0,1,0,0,0,0|2,0,0]=3 2827 B11R0.155 CCCSCC(=O)N(C)CCF 19b9729c716e53a55fad18bc8e3c1083 [0,1,0,0,0,0|3,0,0]=4 2828 B11R0.155 CCCSCC(=O)N(C)CCO 28c613ce5ac776dcb01211afba77b8cd [0,1,0,0,0,0|3,0,0]=4 2829 B11R0.155 CCC[C@@H](O)C(=O)NCCCCl c155664f75048cda3207903971c4c46b [0,1,0,0,0,0|3,0,0]=4 2830 B11R0.155 CCC[C@@H](O)C(=O)NCCCO 05fc34ad487dbdd72bf5e94c54db8410 [0,1,0,0,0,0|3,0,0]=4 2831 B11R0.155 CCC[C@@H](O)C(=O)NCCOC 1af00c9ebf8b5b342ca14bd39011407c [0,1,0,0,0,0|3,0,0]=4 2832 B11R0.155 CCC[C@@H](O)C(=O)NCCSC 17c7df8d6bf7b4e10bbb34a81211808d [0,1,0,0,0,0|3,0,0]=4 2833 B11R0.155 CCC[C@H](O)C(=O)NCCCCl 863de3bf2deb451068d4e65c60c64eff [0,1,0,0,0,0|3,0,0]=4 2834 B11R0.155 CCC[C@H](O)C(=O)NCCCO c281c8e21638b7f63160a505b5a4bcfa [0,1,0,0,0,0|3,0,0]=4 2835 B11R0.155 CCC[C@H](O)C(=O)NCCOC 790dad4019570dd99b1f8fd9664a4804 [0,1,0,0,0,0|3,0,0]=4 2836 B11R0.155 CCC[C@H](O)C(=O)NCCSC a897d36c01205149994b5f8481754698 [0,1,0,0,0,0|3,0,0]=4 2837 B11R0.155 CCOCCC(=O)N(C)CCF 97f4ceabb59abce7a22925812d0f2a4d [0,1,0,0,0,0|3,0,0]=4 2838 B11R0.155 CCOCCC(=O)N(C)CCO 94e441eac36d3c10c7ffe434229dce4d [0,1,0,0,0,0|3,0,0]=4 2839 B11R0.155 CCSCCC(=O)N(C)CCF ce28252450a425342077a170057cbd92 [0,1,0,0,0,0|3,0,0]=4 2840 B11R0.155 CCSCCC(=O)N(C)CCO 5223a90595f1109c323a601b351d9766 [0,1,0,0,0,0|3,0,0]=4 2841 B11R0.155 CN(CCF)C(=O)CCCCF cb372f36d4719ff97faa353c511b3a78 [0,1,0,0,0,0|3,0,0]=4 2842 B11R0.155 CN(CCF)C(=O)CCCCO 055791b49f28c5005af74ebe283ad997 [0,1,0,0,0,0|3,0,0]=4 2843 B11R0.155 CN(CCF)C(=O)CCCCS 5d0c7d670a3da3bd12deb0938fc624bf [0,1,0,0,0,0|3,0,0]=4 2844 B11R0.155 CN(CCO)C(=O)CCCCF 213167e25b5b8309a9b183dc8deec226 [0,1,0,0,0,0|3,0,0]=4 2845 B11R0.155 CN(CCO)C(=O)CCCCO 496474665cc7e362c82542d350778a55 [0,1,0,0,0,0|3,0,0]=4 2846 B11R0.155 CN(CCO)C(=O)CCCCS 9570f9c94dc25955ee29370b268b3834 [0,1,0,0,0,0|3,0,0]=4 2847 B11R0.155 COCCCC(=O)N(C)CCF c9bae8d1c071ad102fea9797af7b9c3f [0,1,0,0,0,0|3,0,0]=4 2848 B11R0.155 COCCCC(=O)N(C)CCO 110858776263944a44e3eeb9decf8d91 [0,1,0,0,0,0|3,0,0]=4 2849 B11R0.155 CSCCCC(=O)N(C)CCF fc0e7c46a84d710ab49ce7177f28f2e9 [0,1,0,0,0,0|3,0,0]=4 2850 B11R0.155 CSCCCC(=O)N(C)CCO c196c5e40ff7664a3b54115250b07481 [0,1,0,0,0,0|3,0,0]=4 2851 B11R1.5 CCCN1CCCCCC1C 29918e7d6c2ed7cbd3b8be71c6bc41c1 [0,0,0,1,0,0|2,0,1]=4 2852 B11R1.5 CCNC1CCCCNC1=O 098d09f495a66ed384979d824580bfa2 [0,0,0,1,0,0|3,0,0]=4 2853 B11R1.5 CCN[C@@H]1CCCCNC1=O 7a7dafe68975c76ed141e35a2aec69d7 [0,0,0,1,0,0|3,0,0]=4 2854 B11R1.5 CCN[C@H]1CCCCNC1=O 2a68e47f98077e779c5902456b420aa5 [0,0,0,1,0,0|3,0,0]=4 2855 B11R1.5 CCOC1CCCCCC1=O 6f512a9e711095b873eeb84a2a48b1a3 [0,0,0,1,0,0|2,0,0]=3 2856 B11R1.5 O=C1CCCCCC1OCF 1d4dd4103e923ca865993bfbc40b6a96 [0,0,0,1,0,0|3,0,0]=4 2857 B11R1.17 C#CCOC1CCCOC1=O 6e4d1451eaa8f6dc237d1419a381dde6 [0,0,0,1,0,0|1,0,2]=4 2858 B11R1.17 C=CCOC1CCCOC1=O 81bfa0a6ffb92c604e94fa17ffd03406 [0,0,0,1,0,0|1,0,2]=4 2859 B11R1.17 CCCNC1CCCCC1=O 0cb59e2cec2f653dc474888b981af37e [0,0,0,1,0,0|2,0,0]=3 2860 B11R1.17 CCCNC1CCCNC1=O 55abc9603bc8ad72c941140f99c710d8 [0,0,0,1,0,0|2,0,0]=3 2861 B11R1.17 CCCNC1COCCC1=O cc1336d3470e5f929ba83ad086081887 [0,0,0,1,0,0|3,0,0]=4 2862 B11R1.17 CCCNC1SCCCC1=O 8381da6070669fe6af4b89cf8bbf52f5 [0,0,0,1,0,0|3,0,0]=4 2863 B11R1.17 CCCN[C@@H]1CCCNC1=O 7d1db2f72e530a6681cc97b5e4db3ee2 [0,0,0,1,0,0|2,0,0]=3 2864 B11R1.17 CCCN[C@H]1CCCNC1=O 4916f2a94ebc0e2edb168ccc952724f1 [0,0,0,1,0,0|2,0,0]=3 2865 B11R1.17 CCCOC1CCCC=C1Br 4b592f5b2b05c930ea5eb16acb9a11e3 [0,0,0,1,0,0|3,0,0]=4 2866 B11R1.17 CCCOC1CCCCC1=O e4c34c8c4ab210cd57a1a2afd505d7df [0,0,0,1,0,0|2,0,0]=3 2867 B11R1.17 CCCOC1CCCNC1=O 0dd79fe7c8234340f8d36a3aacd0c241 [0,0,0,1,0,0|2,0,0]=3 2868 B11R1.17 CCCOC1CCCOC1=O bae7db991e4e9db8da62f6e44703e2f5 [0,0,0,1,0,0|1,0,0]=2 2869 B11R1.17 CCCOC1COCCC1=O 6e0c021772ee4b507917c743135eb078 [0,0,0,1,0,0|3,0,0]=4 2870 B11R1.17 CCCOC1SCCCC1=O 912f5c29d1c59e0444ed4666cb57956d [0,0,0,1,0,0|3,0,0]=4 2871 B11R1.17 CCCO[C@@H]1CCCNC1=O 63647725328b6ac5901edd510d2ccbd4 [0,0,0,1,0,0|2,0,0]=3 2872 B11R1.17 CCCO[C@H]1CCCNC1=O bce532d3fac664ccc027a489bde355a9 [0,0,0,1,0,0|2,0,0]=3 2873 B11R1.17 CCOCC1CCCCC1=O 1418121428d59b49fd9e78a21f140e3d [0,0,0,1,0,0|2,0,0]=3 2874 B11R1.17 CCOCC1CCCNC1=O 8a41dbb5963950aeecb814af715ca666 [0,0,0,1,0,0|2,0,0]=3 2875 B11R1.17 COCNC1CCCNC1=O 68c991ddb51195679e7efbe35d50d455 [0,0,0,1,0,0|3,0,0]=4 2876 B11R1.17 COCN[C@@H]1CCCNC1=O f0b249091d8bdc6b34af909d6287cf6e [0,0,0,1,0,0|3,0,0]=4 2877 B11R1.17 COCN[C@H]1CCCNC1=O 7694fa3ff5f0d0b3a03d1647bc918a71 [0,0,0,1,0,0|3,0,0]=4 2878 B11R1.17 COCOC1CCCCC1=O 40c2ae16d1ea2c8c8ac779ae86b8465e [0,0,0,1,0,0|3,0,0]=4 2879 B11R1.17 COCOC1CCCNC1=O 81df45c8a0b4bea64707d71f9626af67 [0,0,0,1,0,0|3,0,0]=4 2880 B11R1.17 COCOC1CCCOC1=O 08d61923b975b41062abff82fa122ee8 [0,0,0,1,0,0|2,0,0]=3 2881 B11R1.17 COCO[C@@H]1CCCNC1=O 53c9c6b3feb831f4018d66d103ddca52 [0,0,0,1,0,0|3,0,0]=4 2882 B11R1.17 COCO[C@H]1CCCNC1=O 1fa4ee374558e3fd63a91dfc505a6b4b [0,0,0,1,0,0|3,0,0]=4 2883 B11R1.17 CSCNC1CCCNC1=O 7b65a5412f37e4e60263f317f6f77611 [0,0,0,1,0,0|3,0,0]=4 2884 B11R1.17 CSCN[C@@H]1CCCNC1=O d89576883b4d455b567980e82d53da9a [0,0,0,1,0,0|3,0,0]=4 2885 B11R1.17 CSCN[C@H]1CCCNC1=O 75334433e002a7313c04589f96f76c69 [0,0,0,1,0,0|3,0,0]=4 2886 B11R1.17 CSCOC1CCCCC1=O 02fecc013f186d2622128bee88943975 [0,0,0,1,0,0|3,0,0]=4 2887 B11R1.17 CSCOC1CCCNC1=O 03328cb230ee24c6e17ca65c676c9977 [0,0,0,1,0,0|3,0,0]=4 2888 B11R1.17 CSCOC1CCCOC1=O e670188ee651b11f79096e508bad6d6b [0,0,0,1,0,0|2,0,0]=3 2889 B11R1.17 CSCO[C@@H]1CCCNC1=O 7baa911a388459b92cf0737a22f68076 [0,0,0,1,0,0|3,0,0]=4 2890 B11R1.17 CSCO[C@H]1CCCNC1=O b44fcc670fe88048c050c3bc9ecbb1a5 [0,0,0,1,0,0|3,0,0]=4 2891 B11R1.17 N#CCOC1CCCOC1=O eb3b7030c2028d6b759687e5e54a47e0 [0,0,0,1,0,0|2,0,1]=4 2892 B11R1.17 O=C1CCCCC1COCF 25bbebcaccf0bfdc324c1d3648883a2d [0,0,0,1,0,0|3,0,0]=4 2893 B11R1.17 O=C1CCCCC1NCCI 43b317d86a6ed052fc4b71621ecfbed5 [0,0,0,1,0,0|3,0,0]=4 2894 B11R1.17 O=C1CCCCC1NCCO 90ee47ccf7f96346a67869b80f393421 [0,0,0,1,0,0|3,0,0]=4 2895 B11R1.17 O=C1CCCCC1NCCS 0d61179f00a6f609c429a53f8c5546d2 [0,0,0,1,0,0|3,0,0]=4 2896 B11R1.17 O=C1CCCCC1OCCF 752b273070ae9004da396d378d62e3a0 [0,0,0,1,0,0|3,0,0]=4 2897 B11R1.17 O=C1CCCCC1OCCS 11cd2cf2fe159c6c52530f28d1e1ce33 [0,0,0,1,0,0|3,0,0]=4 2898 B11R1.17 O=C1NCCCC1COCF 5062422dc03b6a7860d63d5234e66043 [0,0,0,1,0,0|3,0,0]=4 2899 B11R1.17 O=C1NCCCC1NCCF 01463875fbe8db99da4052d7b409401c [0,0,0,1,0,0|3,0,0]=4 2900 B11R1.17 O=C1NCCCC1NCCI ea177f0ee970a7b919e1065bbd2b6ff6 [0,0,0,1,0,0|3,0,0]=4 2901 B11R1.17 O=C1NCCCC1NCCO 158a0e1e942fc585d5a5db7721dd18c9 [0,0,0,1,0,0|3,0,0]=4 2902 B11R1.17 O=C1NCCCC1NCCS a316205e81cc1a34556f92bb93267322 [0,0,0,1,0,0|3,0,0]=4 2903 B11R1.17 O=C1NCCCC1OCCF c60a70911ea81c8e401aca9f8b8e3235 [0,0,0,1,0,0|3,0,0]=4 2904 B11R1.17 O=C1NCCCC1OCCS 0767951149d9d79ecdf8a62b1ab7bfc7 [0,0,0,1,0,0|3,0,0]=4 2905 B11R1.17 O=C1NCCC[C@@H]1NCCF 921bcf2e160a1bc47c6b8db171c347fb [0,0,0,1,0,0|3,0,0]=4 2906 B11R1.17 O=C1NCCC[C@@H]1NCCO 00e44fa47e2c777f3532b171331b4734 [0,0,0,1,0,0|3,0,0]=4 2907 B11R1.17 O=C1NCCC[C@@H]1NCCS 44ecc116410bfbe64e3af0a45d0083da [0,0,0,1,0,0|3,0,0]=4 2908 B11R1.17 O=C1NCCC[C@@H]1OCCF 6fbee89c2b75334c4ff88d28a9d72f20 [0,0,0,1,0,0|3,0,0]=4 2909 B11R1.17 O=C1NCCC[C@@H]1OCCS 3350d7a22cbc9d65ae0f039fb9cd53ba [0,0,0,1,0,0|3,0,0]=4 2910 B11R1.17 O=C1NCCC[C@H]1NCCF 7435a95b09b121725da38dfdbd0f3ee1 [0,0,0,1,0,0|3,0,0]=4 2911 B11R1.17 O=C1NCCC[C@H]1NCCO 4a81e6f030a7cccd02aa03931650e97f [0,0,0,1,0,0|3,0,0]=4 2912 B11R1.17 O=C1NCCC[C@H]1NCCS 8588eb2a8304e4f393efbdfef9904046 [0,0,0,1,0,0|3,0,0]=4 2913 B11R1.17 O=C1NCCC[C@H]1OCCF ef52a26a2e6afbba4f85556857ea68c5 [0,0,0,1,0,0|3,0,0]=4 2914 B11R1.17 O=C1NCCC[C@H]1OCCS eb674de704fb2083412720c51a1f54e6 [0,0,0,1,0,0|3,0,0]=4 2915 B11R1.17 O=C1OCCCC1OCCF a1dcf2c0aa2e72a8184b870390d26de0 [0,0,0,1,0,0|2,0,0]=3 2916 B11R1.17 O=C1OCCCC1OCCS c494101fa45a5e51ea26cdf362c8fddd [0,0,0,1,0,0|2,0,0]=3 2917 B11R1.17 O=CCOC1CCCOC1=O 81d31c362e0a7c70e40b0ea10c4c7da2 [0,0,0,1,0,0|2,0,1]=4 2918 B11R1.24 CC1CCCC(C1)OCCF 34dc8ec9e7b5680e6c337d9cecabba36 [0,0,0,1,0,0|2,0,1]=4 2919 B11R1.24 CC1CCCC(C1)OCCS b73b708ea9daec77ee15353be5a399f5 [0,0,0,1,0,0|2,0,1]=4 2920 B11R1.24 CCCCN1CCCC(C1)C 816b5f6bdf97ab4163163811a8f399aa [0,0,0,1,0,0|3,0,0]=4 2921 B11R1.24 CCCCN1CCC[C@@H](C1)C c9eebf929a5dd2d06c8edaec1bbb5a4f [0,0,0,1,0,0|3,0,0]=4 2922 B11R1.24 CCCCN1CCC[C@H](C1)C 7b4578eae2af0c53b6409850286b2da7 [0,0,0,1,0,0|3,0,0]=4 2923 B11R1.24 CCCNC1CCCC(C1)C a81125382d678ebc8e9ba0cefc93cb8c [0,0,0,1,0,0|2,0,1]=4 2924 B11R1.24 CCCN[C@@H]1CCC[C@H](C1)C bffb35be013df57e1b8e8d70e8190332 [0,0,0,1,0,0|2,0,1]=4 2925 B11R1.24 CCCOC1C=C(CCC1)C 6dce11d0f49296f7fa9063d6a455adc2 [0,0,0,1,0,0|1,0,2]=4 2926 B11R1.24 CCCOC1CCCC(C1)C 51405fdb3ff3cc2adf7c96653b9e85c4 [0,0,0,1,0,0|1,0,1]=3 2927 B11R1.24 CCCOC1CCCN(C1)C 269bfb157505d0dfd723a4d9015bc14d [0,0,0,1,0,0|2,0,1]=4 2928 B11R1.24 CCCOC1CCOC(C1)C 136c6a27b250a4f0369c8143bb4b552e [0,0,0,1,0,0|2,0,1]=4 2929 B11R1.24 CCCO[C@@H]1CCCN(C1)C 75b8f3561a07b3f4beeac98f2b66f776 [0,0,0,1,0,0|2,0,1]=4 2930 B11R1.24 CCCO[C@@H]1CCC[C@@H](C1)C 6ab0223803e6a8aacec5c5bacc8264c3 [0,0,0,1,0,0|1,0,1]=3 2931 B11R1.24 CCCO[C@@H]1CCO[C@@H](C1)C 007cf4c786d12d43b9d5de06db1b1cfe [0,0,0,1,0,0|2,0,1]=4 2932 B11R1.24 CCCO[C@@H]1CCO[C@H](C1)C b1c6c9e34adb7fa4231f1baf2287a054 [0,0,0,1,0,0|2,0,1]=4 2933 B11R1.24 CCCO[C@H]1CCCN(C1)C a380a34005ceb5cc64de5fd862c7dfd0 [0,0,0,1,0,0|2,0,1]=4 2934 B11R1.24 CCCO[C@H]1CCC[C@@H](C1)C 6ac94074d08177dad0794af8039ca22e [0,0,0,1,0,0|1,0,1]=3 2935 B11R1.24 CCCO[C@H]1CCC[C@H](C1)C a9a57dcfebcc6debd037c1cce2e8fd54 [0,0,0,1,0,0|1,0,1]=3 2936 B11R1.24 CCCO[C@H]1CCO[C@@H](C1)C dead0e4bdddf01b8919b9bb558a70199 [0,0,0,1,0,0|2,0,1]=4 2937 B11R1.24 CCCO[C@H]1CCO[C@H](C1)C 8f734c4dde5f8b376b9be1db9715e773 [0,0,0,1,0,0|2,0,1]=4 2938 B11R1.24 COCOC1CCCC(C1)C e99ecad30ef89f93b298fb272e3d29af [0,0,0,1,0,0|2,0,1]=4 2939 B11R1.24 COCO[C@@H]1CCC[C@@H](C1)C 23117f2ee0fd41bc40b5f1d8ca4da895 [0,0,0,1,0,0|2,0,1]=4 2940 B11R1.24 COCO[C@H]1CCC[C@@H](C1)C b798f9eec577e4b7e9c9be7771c96892 [0,0,0,1,0,0|2,0,1]=4 2941 B11R1.24 COCO[C@H]1CCC[C@H](C1)C 2a1195e71d7ff1409a4a6fce008b83cb [0,0,0,1,0,0|2,0,1]=4 2942 B11R1.24 CSCOC1CCCC(C1)C 95e224fa882ebc32a4d8230616995fb4 [0,0,0,1,0,0|2,0,1]=4 2943 B11R1.24 CSCO[C@@H]1CCC[C@@H](C1)C 8664cf1d84dfe36ae785090fe122a220 [0,0,0,1,0,0|2,0,1]=4 2944 B11R1.24 CSCO[C@H]1CCC[C@@H](C1)C f75fa12fded282e9c870eb751eed1e50 [0,0,0,1,0,0|2,0,1]=4 2945 B11R1.24 CSCO[C@H]1CCC[C@H](C1)C 120ab20889f1a1ad3945a510297d7354 [0,0,0,1,0,0|2,0,1]=4 2946 B11R1.24 C[C@@H]1CCC[C@@H](C1)OCCF f6cbd4c084efb91702d18b89fe430660 [0,0,0,1,0,0|2,0,1]=4 2947 B11R1.24 C[C@@H]1CCC[C@@H](C1)OCCS 5177be2b454c47f1b61f4b12470943dd [0,0,0,1,0,0|2,0,1]=4 2948 B11R1.24 C[C@H]1CCC[C@@H](C1)OCCF 7cb2f11d7a8c495f3414341611661be3 [0,0,0,1,0,0|2,0,1]=4 2949 B11R1.24 C[C@H]1CCC[C@@H](C1)OCCS a384c2206a18515c37b01ac8ef0c9a0d [0,0,0,1,0,0|2,0,1]=4 2950 B11R1.24 C[C@H]1CCC[C@H](C1)OCCF 61a02d11d288aa3dd2f2a493e65d9567 [0,0,0,1,0,0|2,0,1]=4 2951 B11R1.24 C[C@H]1CCC[C@H](C1)OCCS 3f7648b2ed5dadea24b4de53bd369844 [0,0,0,1,0,0|2,0,1]=4 2952 B11R1.27 CCCCCN1CCC(C1)C fb2c748fd271d5b579dbb78daa840a82 [0,0,0,1,0,0|3,0,0]=4 2953 B11R1.28 CCCCNC1CCCCO1 3bd035030ae808d12bab4c5cba6dcb1f [0,0,0,1,0,0|2,0,1]=4 2954 B11R1.28 CCCCOC1CCCCO1 876a79fef12cc68fcbedfbd209aaa824 [0,0,0,1,0,0|2,0,1]=4 2955 B11R1.28 CCCNCC1=CCCCC1 6d8d5e2e616fa115caf3395893b142f2 [0,0,0,1,0,0|3,0,0]=4 2956 B11R1.28 CCCNCC1CCCCO1 fe32d4ffbdc5749c38e47cf869213fa5 [0,0,0,1,0,0|2,0,1]=4 2957 B11R1.28 CCCOCC1=CCCCO1 fd0a4208366709896cb1e56da0f533fc [0,0,0,1,0,0|2,0,0]=3 2958 B11R1.28 CCCOCC1CCCCO1 90f98ba9e9eadc1d9df337afb14e5eef [0,0,0,1,0,0|2,0,1]=4 2959 B11R1.28 CCCOC[C@@H]1CCCCO1 20a5d3e0feb8c992886908978ec6f96d [0,0,0,1,0,0|2,0,1]=4 2960 B11R1.28 CCCOC[C@H]1CCCCO1 6cb49fd295b71bf392a373607d504cfc [0,0,0,1,0,0|2,0,1]=4 2961 B11R1.28 CCNCCC1=CCCCC1 ab5a37ea6e07b1f74ecd0412b642a299 [0,0,0,1,0,0|3,0,0]=4 2962 B11R1.28 CCNCCC1CCCCO1 0514cc2009abea27205eb2d4527ea2a3 [0,0,0,1,0,0|2,0,1]=4 2963 B11R1.28 CCOCCC1CCCCO1 0eb2e7b6ffe2601ad6e04d63bcdae13d [0,0,0,1,0,0|2,0,1]=4 2964 B11R1.28 CSCOCC1=CCCCO1 51650021c836555064d9d3285513379d [0,0,0,1,0,0|3,0,0]=4 2965 B11R1.28 FCCOCC1=CCCCO1 d5bdc040cd96a1184f68bbc50e3eed40 [0,0,0,1,0,0|3,0,0]=4 2966 B11R1.28 SCCOCC1=CCCCO1 61b106915c9576719e1d30851df9e5ed [0,0,0,1,0,0|3,0,0]=4 2967 B11R1.29 CC(OCCF)C1CCCC1 e3e25a36059ad8e613817b92d1d9277f [0,0,0,1,0,0|2,0,1]=4 2968 B11R1.29 CC(OCCS)C1CCCC1 56b6d9e99b186048e034f3954a96186b [0,0,0,1,0,0|2,0,1]=4 2969 B11R1.29 CCCCC(=O)N1CCSC1 b3db6183cf6034a8416f50097103d1e5 [0,0,0,1,0,0|3,0,0]=4 2970 B11R1.29 CCCCN(C)C1CCCC1 15cf7419e836ec5868587a976662f5ec [0,0,0,1,0,0|3,0,0]=4 2971 B11R1.29 CCCNC(=O)C1=CCCC1 581b7e80fde64cc894f2aa1fbed86279 [0,0,0,1,0,0|1,0,2]=4 2972 B11R1.29 CCCNC(=O)C1CCCO1 fa46017997c7e2870594c079a3f5227b [0,0,0,1,0,0|2,0,0]=3 2973 B11R1.29 CCCNC(=O)C1CCCS1 3214105d740cfe28a12a92d12f7b5128 [0,0,0,1,0,0|2,0,0]=3 2974 B11R1.29 CCCNC(=O)N1CCNC1 563cb4445f8c198dee65b854653bca6a [0,0,0,1,0,0|3,0,0]=4 2975 B11R1.29 CCCNC(=O)N1CCSC1 9429dd5a6e412e0e13233aa2896fa132 [0,0,0,1,0,0|3,0,0]=4 2976 B11R1.29 CCCNC(=O)[C@@H]1CCCO1 c781c8b232840a467776f8078f94f2dc [0,0,0,1,0,0|2,0,0]=3 2977 B11R1.29 CCCNC(=O)[C@H]1CCCO1 836bd4f46d97daf7d36c92475767a03c [0,0,0,1,0,0|2,0,0]=3 2978 B11R1.29 CCCNC(C)C1CCCC1 0ef9b851a96e67a02e9991d070bb82c7 [0,0,0,1,0,0|2,0,1]=4 2979 B11R1.29 CCCOC(C)C1CCCC1 f54ecb6e7152619579e8912e760516aa [0,0,0,1,0,0|1,0,1]=3 2980 B11R1.29 CCCOC(C)C1CCOC1 07fbcfa1f0d5ad81c34a140f875aa61d [0,0,0,1,0,0|2,0,1]=4 2981 B11R1.29 CCCO[C@H](C)[C@H]1CCCO1 70091228d1070c2012e2367279973562 [0,0,0,1,0,0|2,0,1]=4 2982 B11R1.29 CCNCC(=O)N1CCCC1 913db141ee2e4d3d3d4ac750ad90696a [0,0,0,1,0,0|3,0,0]=4 2983 B11R1.29 CCOCC(=O)C1CCCC1 3771d762631c3384326f41a908d590cc [0,0,0,1,0,0|2,0,0]=3 2984 B11R1.29 CCOCC(=O)N1CCCC1 2a86678128096e579d6691f6f91a0397 [0,0,0,1,0,0|3,0,0]=4 2985 B11R1.29 COCOC(C)C1CCCC1 2b2883cdcebeeafe8179b40fbab267e5 [0,0,0,1,0,0|2,0,1]=4 2986 B11R1.29 CSCOC(C)C1CCCC1 7d14f279aa29a8bb9e5c870c534ec558 [0,0,0,1,0,0|2,0,1]=4 2987 B11R1.29 O=C(COCF)C1CCCC1 bb3ad3470bd98e8ffbe07670bbd84b20 [0,0,0,1,0,0|3,0,0]=4 2988 B11R1.29 O=C(NCCBr)C1CCCO1 f6e9b62b00827f43ff537695bf23a3ef [0,0,0,1,0,0|3,0,0]=4 2989 B11R1.29 O=C(NCCBr)[C@@H]1CCCO1 f76813b0687ee395a5656186b33c6722 [0,0,0,1,0,0|3,0,0]=4 2990 B11R1.29 O=C(NCCBr)[C@H]1CCCO1 e5537b50d9da8652d6acdb348d9c2021 [0,0,0,1,0,0|3,0,0]=4 2991 B11R1.29 O=C(NCCF)C1CCCO1 9cc985840f719b89bf83c35f63da0058 [0,0,0,1,0,0|3,0,0]=4 2992 B11R1.29 O=C(NCCF)[C@@H]1CCCO1 ebf4e4385e801ecd482bac597364b7b3 [0,0,0,1,0,0|3,0,0]=4 2993 B11R1.29 O=C(NCCF)[C@H]1CCCO1 9e91c1cffec7fae2729875947f9e9619 [0,0,0,1,0,0|3,0,0]=4 2994 B11R1.29 O=C(NCCI)C1CCCO1 bdd31f8eb593dd716bdb4884df577049 [0,0,0,1,0,0|3,0,0]=4 2995 B11R1.29 O=C(NCCI)C1CCCS1 17cc3c1f7bb0eec2c65b572e47fe4389 [0,0,0,1,0,0|3,0,0]=4 2996 B11R1.29 O=C(NCCI)[C@@H]1CCCO1 db1da7fa9bf7970b537e18a5daac8b9f [0,0,0,1,0,0|3,0,0]=4 2997 B11R1.29 O=C(NCCI)[C@H]1CCCO1 e3cbb7438957dc6f8b9edf43c1086eaf [0,0,0,1,0,0|3,0,0]=4 2998 B11R1.29 O=C(NCCO)C1CCCO1 7f7a0e443362f9b9d375725423004281 [0,0,0,1,0,0|3,0,0]=4 2999 B11R1.29 O=C(NCCO)C1CCCS1 170da989a3ab279c0bf98b956a278eda [0,0,0,1,0,0|3,0,0]=4 3000 B11R1.29 O=C(NCCO)[C@@H]1CCCO1 b942ff07b7d2a9147913c1ac7ac85301 [0,0,0,1,0,0|3,0,0]=4 3001 B11R1.29 O=C(NCCO)[C@H]1CCCO1 0c08c111b3c822f0a7e98581261611be [0,0,0,1,0,0|3,0,0]=4 3002 B11R1.29 O=C(NCCS)C1CCCO1 36068448bd99f1329540d9ae4e7895f2 [0,0,0,1,0,0|3,0,0]=4 3003 B11R1.29 O=C(NCCS)[C@@H]1CCCO1 09bba412a4e51b356f9698f6d11f756d [0,0,0,1,0,0|3,0,0]=4 3004 B11R1.29 O=C(NCCS)[C@H]1CCCO1 880b280794f2b4da0572e1f430b57ac4 [0,0,0,1,0,0|3,0,0]=4 3005 B11R1.37 CCN1CCC(=O)CC1CO 0786a8d9abcdc0c70516c47e8a90b6d8 [0,0,0,1,0,0|3,0,0]=4 3006 B11R1.110 CCCN1CCCNC(=O)C1 f406ce3053c9c608ac4e8ba7b28a00e2 [0,0,0,1,0,0|2,0,0]=3 3007 B11R1.110 CCCN1CCCOC(C1)C f3ae23ccef9c67c08a63673ea08acc04 [0,0,0,1,0,0|2,0,1]=4 3008 B11R1.110 CCOC1CCCNC(=O)C1 826321f04ddcae70bc5b8b57f6c60b43 [0,0,0,1,0,0|2,0,0]=3 3009 B11R1.110 COCN1CCCNC(=O)C1 58a8ba267be13aee382cf6e2b88e5dab [0,0,0,1,0,0|3,0,0]=4 3010 B11R1.110 CSCN1CCCNC(=O)C1 03fbb989aa2eb67b95ff988895964557 [0,0,0,1,0,0|3,0,0]=4 3011 B11R1.110 O=C1CC(CCCN1)OCF 01817bb7f90cfaffe8da05120bb2bd1f [0,0,0,1,0,0|3,0,0]=4 3012 B11R1.110 O=C1CN(CCCN1)CCF 49f794e3794d44d81cad42e589a21142 [0,0,0,1,0,0|3,0,0]=4 3013 B11R1.110 O=C1CN(CCCN1)CCO 24c9c90b6328e6d80e0d930f9f29604c [0,0,0,1,0,0|3,0,0]=4 3014 B11R1.110 O=C1CN(CCCN1)CCS b8813ea9a3da52aee36bde7aa80b01a8 [0,0,0,1,0,0|3,0,0]=4 3015 B11R1.182 CC1CNC(=O)CN1CCF d79800b080268b70db825123d4a9c59b [0,0,0,1,0,0|3,0,0]=4 3016 B11R1.182 CC1CNC(=O)CN1CCO 3cb642a5bb323cada4228ba48240e468 [0,0,0,1,0,0|3,0,0]=4 3017 B11R1.182 CC1CNC(=O)CN1CCS d5c6c4e9e0d525ba580223c34c47432c [0,0,0,1,0,0|3,0,0]=4 3018 B11R1.182 CCCN1CC(=O)NCC1C b462abbdf6d5a6c1f5e9e8775cd0be53 [0,0,0,1,0,0|2,0,0]=3 3019 B11R1.182 CCCN1CC(=O)NC[C@@H]1C 53c032fe10ca5a010afe3f2b114dc54c [0,0,0,1,0,0|2,0,0]=3 3020 B11R1.182 CCCN1CC(=O)NC[C@H]1C 27333b459116688cc1134ab44bbc7082 [0,0,0,1,0,0|2,0,0]=3 3021 B11R1.182 CCCN1CC(OCC1C)C 2d1411e0beaf7d329cfab92562443baf [0,0,0,1,0,0|2,0,1]=4 3022 B11R1.182 CCCN1C[C@@H](OC[C@@H]1C)C c4d4615ad660752a643b8586876c0cf5 [0,0,0,1,0,0|2,0,1]=4 3023 B11R1.182 CCCN1C[C@@H](OC[C@H]1C)C eaaf5902ad18c42cd85fc324e1f8b452 [0,0,0,1,0,0|2,0,1]=4 3024 B11R1.182 CCCN1C[C@H](OC[C@@H]1C)C 20891654117a7314bb8c7728cdf45583 [0,0,0,1,0,0|2,0,1]=4 3025 B11R1.182 CCCN1C[C@H](OC[C@H]1C)C ad6cf022ceed2975fb38487234e96af6 [0,0,0,1,0,0|2,0,1]=4 3026 B11R1.182 COCN1CC(=O)NCC1C 9d24a6248c265e47c390153325d593fd [0,0,0,1,0,0|3,0,0]=4 3027 B11R1.182 COCN1CC(=O)NC[C@@H]1C 64b9fd42e391e64d73a70eef0e23b5c7 [0,0,0,1,0,0|3,0,0]=4 3028 B11R1.182 COCN1CC(=O)NC[C@H]1C 2a9a1725a4c2c4a405fa9dddb7794f39 [0,0,0,1,0,0|3,0,0]=4 3029 B11R1.182 CSCN1CC(=O)NCC1C 919cb38ec5de946b9f55843082814439 [0,0,0,1,0,0|3,0,0]=4 3030 B11R1.182 CSCN1CC(=O)NC[C@@H]1C 7c54e032f4a33f9c6cfb434d3dc2e940 [0,0,0,1,0,0|3,0,0]=4 3031 B11R1.182 CSCN1CC(=O)NC[C@H]1C c0968d5d9432c6a8a40eb55bb1df0505 [0,0,0,1,0,0|3,0,0]=4 3032 B11R1.182 C[C@@H]1CNC(=O)CN1CCF beb117520d54bf32b20a2ce17000672f [0,0,0,1,0,0|3,0,0]=4 3033 B11R1.182 C[C@@H]1CNC(=O)CN1CCO e0b1a61653abdc558939e59566515143 [0,0,0,1,0,0|3,0,0]=4 3034 B11R1.182 C[C@@H]1CNC(=O)CN1CCS a8319a51a9ca73514dbb175e0b824421 [0,0,0,1,0,0|3,0,0]=4 3035 B11R1.182 C[C@H]1CNC(=O)CN1CCF cc007f8a2df0ca6d959c189260916f5c [0,0,0,1,0,0|3,0,0]=4 3036 B11R1.182 C[C@H]1CNC(=O)CN1CCO 67e41ca41564594515c18ce5248a8ad9 [0,0,0,1,0,0|3,0,0]=4 3037 B11R1.182 C[C@H]1CNC(=O)CN1CCS fa9cf5f1b218ad6606a3befb2d5065fa [0,0,0,1,0,0|3,0,0]=4 3038 B11R1.203 CCCCN1CCCCCC1 efa7754fb7e0af662a839d9bbcf60db4 [0,0,0,1,0,0|3,0,0]=4 3039 B11R1.203 CCCNC1CCCCCC1 be3afd6091ac207b6cf40b281273c757 [0,0,0,1,0,0|2,0,1]=4 3040 B11R1.203 CCCOC1CCCCCC1 a0d3b974b653d57eb78c12eb297baa1e [0,0,0,1,0,0|1,0,1]=3 3041 B11R1.203 CCCOC1CCCOCC1 e6ba70a1eee68a270651209b5c88918d [0,0,0,1,0,0|2,0,1]=4 3042 B11R1.203 COCOC1CCCCCC1 c669f7add16d44cc1d0541c9bd6617f7 [0,0,0,1,0,0|2,0,1]=4 3043 B11R1.203 CSCOC1CCCCCC1 90eec6a2a8287bbaa85dcf4e8ba247e3 [0,0,0,1,0,0|2,0,1]=4 3044 B11R1.203 FCCOC1CCCCCC1 7a234923a4de254fa31b1ac546f7c56f [0,0,0,1,0,0|2,0,1]=4 3045 B11R1.203 SCCOC1CCCCCC1 75478865fa94ff788ac8d34e86861fcf [0,0,0,1,0,0|2,0,1]=4 3046 B11R1.210 CCCCN1CC(C1)CCC 4780f078bbbe1284cb22556f16787e61 [0,0,0,1,0,0|3,0,0]=4 3047 B11R1.210 CCCOC1CN(C1)CCC 481bd66777263ef10a83b8ea9e71709a [0,0,0,1,0,0|2,0,1]=4 3048 B11R1.210 CCCO[C@H]1C[C@@H](C1)COC 260676d68666ddba9ccfc92d9233ae1a [0,0,0,1,0,0|2,0,1]=4 3049 B11R1.210 CCCO[C@H]1C[C@@H](C1)OCC e8efc09860368638534aa1d798b4d7e1 [0,0,0,1,0,0|2,0,1]=4 3050 B11R1.210 CCCO[C@H]1C[C@H](C1)COC ac3b7406bf23ce24fa6c7401b2dbaa3e [0,0,0,1,0,0|2,0,1]=4 3051 B11R1.210 CCCO[C@H]1C[C@H](C1)OCC 33ddeb9e5cb5c43462ccd6848b07fb42 [0,0,0,1,0,0|2,0,1]=4 3052 B11R1.214 CCCCN1CCC(C1)CC 578ab0cb5a2ed6c5f24d7124e85bd7c8 [0,0,0,1,0,0|3,0,0]=4 3053 B11R1.214 CCCOC1CCC(C1)OC 17ff0a92448113db37aeaaac3691ff94 [0,0,0,1,0,0|2,0,1]=4 3054 B11R1.214 CCCOC1CCN(C1)CC 1e54aa33c239425a51c86be93a0a7214 [0,0,0,1,0,0|2,0,1]=4 3055 B11R1.214 CCCO[C@@H]1CCN(C1)CC 76cb5015fc6385d9c243f6caf63d5447 [0,0,0,1,0,0|2,0,1]=4 3056 B11R1.214 CCCO[C@@H]1CC[C@H](C1)OC b33bdd852f2015bd0d9c6d6c57b5c6dd [0,0,0,1,0,0|2,0,1]=4 3057 B11R1.214 CCCO[C@H]1CCN(C1)CC 4539a66ce633eb3c9d4e470c54da7d70 [0,0,0,1,0,0|2,0,1]=4 3058 B11R1.214 CCCO[C@H]1CC[C@H](C1)OC eb85ca4a30bd8b00fcd9bfbc25411987 [0,0,0,1,0,0|2,0,1]=4 3059 B11R1.283 CC/C=C/C(=O)NC1CC1C 432c6b8b567e3405fb20aa1277a7a2b6 [0,0,0,1,0,0|2,0,1]=4 3060 B11R1.283 CC/C=C\C(=O)NC1CC1C e76a22f8605881e1b15c79c0c1e7d29d [0,0,0,1,0,0|2,0,1]=4 3061 B11R1.283 CC1CC1NC(=O)CCCF 9d7793243a68b8f453165abc7cc921f7 [0,0,0,1,0,0|3,0,0]=4 3062 B11R1.283 CC1CC1NC(=O)CCCS bfb1f614897dbc6fae8f8c76bccd445e [0,0,0,1,0,0|3,0,0]=4 3063 B11R1.283 CC1CC1NC(=O)NCCF 290efcfb088c437904d1564d98f71b5e [0,0,0,1,0,0|3,0,0]=4 3064 B11R1.283 CC1CC1NC(=O)NCCN d8f89ba855b67fbe65bdb8b950199776 [0,0,0,1,0,0|3,0,0]=4 3065 B11R1.283 CC1CC1NC(=O)NCCO 09b2c7764256c386edea3793e4652164 [0,0,0,1,0,0|3,0,0]=4 3066 B11R1.283 CC1CC1NC(=O)NCCS 847eb8a5d878b8d0908b6e73ea90d4f6 [0,0,0,1,0,0|3,0,0]=4 3067 B11R1.283 CCC#CC(=O)NC1CC1C e0f026154d796c3fb8e449fc5af88b5f [0,0,0,1,0,0|2,0,1]=4 3068 B11R1.283 CCC=CC(=O)NC1CC1C 52c7af44e3d0bd53c0d0028c6d44b1a8 [0,0,0,1,0,0|2,0,1]=4 3069 B11R1.283 CCCCC(=O)NC1CC1C b0fcf2942a211577d69302de270bf55e [0,0,0,1,0,0|2,0,0]=3 3070 B11R1.283 CCCCC(=O)N[C@@H]1C[C@H]1F 69c7ca261424c6d0df87d5e10a1b5867 [0,0,0,1,0,0|3,0,0]=4 3071 B11R1.283 CCCCC(=O)N[C@H]1C[C@@H]1F c3dada1a3015f5c74c4c769e4c94956e [0,0,0,1,0,0|3,0,0]=4 3072 B11R1.283 CCCCC(=O)N[C@H]1C[C@H]1F 50ba5c6c8798a62d2a89b2d5750a01ed [0,0,0,1,0,0|3,0,0]=4 3073 B11R1.283 CCCNC(=O)NC1CC1C 4c58e36bc6d50aba0a2c9ceb7282437d [0,0,0,1,0,0|2,0,0]=3 3074 B11R1.283 CCCNC(=O)NC1CC1N c1854468c098959ee1ba92dd438177c6 [0,0,0,1,0,0|3,0,0]=4 3075 B11R1.283 CCCNC(=O)N[C@@H]1C[C@H]1F a799f1c3242537f1ada28a1cef6077cc [0,0,0,1,0,0|3,0,0]=4 3076 B11R1.283 CCCNC(=O)N[C@H]1C[C@@H]1F 1cc411e0ddf8d5e0bcff360d90abeaea [0,0,0,1,0,0|3,0,0]=4 3077 B11R1.283 CCCNC(=O)N[C@H]1C[C@H]1F 7c81959d9d9183e8f5fd3991dee08762 [0,0,0,1,0,0|3,0,0]=4 3078 B11R1.283 CCCNC(=O)N[C@H]1C[C@H]1N 3e7f1d65370caa7c3bbf609157aca269 [0,0,0,1,0,0|3,0,0]=4 3079 B11R1.283 CCCNC(=S)NC1CC1C d1fe95863c2e94e7b7d5742705971170 [0,0,0,1,0,0|2,1,0]=4 3080 B11R1.283 CCOCC(=O)NC1CC1C df2790d268a75c056ec61e7997476616 [0,0,0,1,0,0|3,0,0]=4 3081 B11R1.283 CCSCC(=O)NC1CC1C d093421051ec77dd37a7d582c035b4c6 [0,0,0,1,0,0|3,0,0]=4 3082 B11R1.283 COCCC(=O)NC1CC1C ab2d4c10e944a591eccd8e2791ca97cf [0,0,0,1,0,0|3,0,0]=4 3083 B11R1.283 CSCCC(=O)NC1CC1C b61fd2c7a752b7e2abe7095524be8b7f [0,0,0,1,0,0|3,0,0]=4 3084 B11R1.284 C#CCNC(=O)CC1CCC1 6fec540ea3b1becc2f5cbee3d7e1fa33 [0,0,0,1,0,0|1,0,2]=4 3085 B11R1.284 C=C(CN1CCC1)OCOC ffe4e6cb8dea8814385877fa22d4186b [0,0,0,1,0,0|3,0,0]=4 3086 B11R1.284 C=CCOC(=O)CN1CCC1 be3c27b4e95611effbd24513b9e2295b [0,0,0,1,0,0|1,0,2]=4 3087 B11R1.284 CC/C=C/C(=O)NC1CCC1 c5daee5b8a9a0688e5c6ee3d0074f571 [0,0,0,1,0,0|2,0,1]=4 3088 B11R1.284 CC/C=C\C(=O)NC1CCC1 c7f23a9a031afdb971ede0ace56ca410 [0,0,0,1,0,0|2,0,1]=4 3089 B11R1.284 CCC#CC(=O)NC1CCC1 0c64dfa000a8263e2a7f36795056e2b1 [0,0,0,1,0,0|2,0,1]=4 3090 B11R1.284 CCC=CC(=O)NC1CCC1 79d56a70080cb0aa42a1e89991458e9c [0,0,0,1,0,0|2,0,1]=4 3091 B11R1.284 CCCCC(=O)NC1CCC1 03a15290c11274174058b1f2389a0fb6 [0,0,0,1,0,0|2,0,0]=3 3092 B11R1.284 CCCCC(=O)NC1COC1 056a26aa5d624bbb6fb2236a16523c16 [0,0,0,1,0,0|3,0,0]=4 3093 B11R1.284 CCCCN(C)CC1CCC1 037529b6d2d1ee765730b614f8d6b2e4 [0,0,0,1,0,0|3,0,0]=4 3094 B11R1.284 CCCNC(=O)C=C1CCC1 73f8c4973ef4824129008f44abbb2e36 [0,0,0,1,0,0|1,0,2]=4 3095 B11R1.284 CCCNC(=O)CC1CCC1 e6da0d2bc72e959c075386f1a447ff43 [0,0,0,1,0,0|1,0,0]=2 3096 B11R1.284 CCCNC(=O)CC1CCO1 3d6b616156415869a8b671e5216014e1 [0,0,0,1,0,0|2,0,0]=3 3097 B11R1.284 CCCNC(=O)CC1COC1 79e199d4e4203bf23b1f2186d4556191 [0,0,0,1,0,0|2,0,0]=3 3098 B11R1.284 CCCNC(=O)CC1CSC1 0d9415eaa32fe5a87ade6e274824465f [0,0,0,1,0,0|2,0,0]=3 3099 B11R1.284 CCCNC(=O)CN1CCC1 f53a1640c9167d6425da8e578ae8051e [0,0,0,1,0,0|2,0,0]=3 3100 B11R1.284 CCCNC(=O)NC1CCC1 e6d2d078d3ada872c072e7fe118456df [0,0,0,1,0,0|2,0,0]=3 3101 B11R1.284 CCCNC(=O)NC1COC1 4cf766ec38efda7de06d10f94240e9c5 [0,0,0,1,0,0|3,0,0]=4 3102 B11R1.284 CCCNC(=S)NC1CCC1 c0c90c906b8bd33dd6f7a1d5806b8079 [0,0,0,1,0,0|2,1,0]=4 3103 B11R1.284 CCCOC(=O)CN1CCC1 7a13e9e76a8348b67592385655f4956f [0,0,0,1,0,0|1,0,0]=2 3104 B11R1.284 CCNCC(=O)NC1CCC1 4f984455c11e40ca99d127e88d86f6f5 [0,0,0,1,0,0|3,0,0]=4 3105 B11R1.284 CCOCC(=O)NC1CCC1 051ac1f2c4190c2fb1330a44ea74a980 [0,0,0,1,0,0|3,0,0]=4 3106 B11R1.284 CCSCC(=O)NC1CCC1 cf927ebf2d756bd7cbd874892449357e [0,0,0,1,0,0|3,0,0]=4 3107 B11R1.284 COCCC(=O)NC1CCC1 d460164dfcadaf000179e7d655f713a5 [0,0,0,1,0,0|3,0,0]=4 3108 B11R1.284 CSCCC(=O)CN1CCC1 e1da823a8e3afd0d2d7776fea216c264 [0,0,0,1,0,0|3,0,0]=4 3109 B11R1.284 CSCCC(=O)NC1CCC1 b907fdfe5b013aefb7c584bc133c3a81 [0,0,0,1,0,0|3,0,0]=4 3110 B11R1.284 N#CCNC(=O)CC1CCC1 2d8fb81fe108bddca24f1aa11ba33b20 [0,0,0,1,0,0|2,0,1]=4 3111 B11R1.284 NCCNC(=O)NC1CCC1 18209e29d3eb7f78c8eee24848440b49 [0,0,0,1,0,0|3,0,0]=4 3112 B11R1.284 O=C(CC1CCC1)NCCBr 7e4c4511b174cf5ca137e6fee839839a [0,0,0,1,0,0|2,0,0]=3 3113 B11R1.284 O=C(CC1CCC1)NCCF cf3545ee18a9c788a036c7e6bb6d2ac9 [0,0,0,1,0,0|2,0,0]=3 3114 B11R1.284 O=C(CC1CCC1)NCCI 5c3d4bcd22a7939d0459b586242ca3fd [0,0,0,1,0,0|2,0,0]=3 3115 B11R1.284 O=C(CC1CCC1)NCCO 9379e0fec8b74acb9b7b670f3484eca7 [0,0,0,1,0,0|2,0,0]=3 3116 B11R1.284 O=C(CC1CCC1)NCCS 51c0f5aa5100cde3b66cb1a9189a9afd [0,0,0,1,0,0|2,0,0]=3 3117 B11R1.284 O=C(CC1CCO1)NCCBr 34addb5f4718e5c93b11b2886b56f8e7 [0,0,0,1,0,0|3,0,0]=4 3118 B11R1.284 O=C(CC1CCO1)NCCF 039a0d54d9208733dd4a2614e4490a1f [0,0,0,1,0,0|3,0,0]=4 3119 B11R1.284 O=C(CC1CCO1)NCCI 608494a60983bc671f171cdf52ba7bfc [0,0,0,1,0,0|3,0,0]=4 3120 B11R1.284 O=C(CC1CCO1)NCCO a3531e7138ac441187956513d04c1dff [0,0,0,1,0,0|3,0,0]=4 3121 B11R1.284 O=C(CC1CCO1)NCCS 9dc1aef17095c61a8a6eabe47eee513a [0,0,0,1,0,0|3,0,0]=4 3122 B11R1.284 O=C(CC1COC1)NCCBr 19e794fca1c129cd69f6af78994ff79b [0,0,0,1,0,0|3,0,0]=4 3123 B11R1.284 O=C(CC1COC1)NCCF 0656030aa5360c4d211261cfb0dedc85 [0,0,0,1,0,0|3,0,0]=4 3124 B11R1.284 O=C(CC1COC1)NCCI 76372d79c508eedde58126b7e03dd72b [0,0,0,1,0,0|3,0,0]=4 3125 B11R1.284 O=C(CC1COC1)NCCO 67402f7d764aba6bebf52dea408aa0de [0,0,0,1,0,0|3,0,0]=4 3126 B11R1.284 O=C(CC1COC1)NCCS bf87db94250d06eadc4a4b2d1d5289d3 [0,0,0,1,0,0|3,0,0]=4 3127 B11R1.284 O=C(CC1CSC1)NCCBr f28f6c5fd917573216a1637ae7c50210 [0,0,0,1,0,0|3,0,0]=4 3128 B11R1.284 O=C(CC1CSC1)NCCF 551769c1b8cf79989ec3281519b7bb28 [0,0,0,1,0,0|3,0,0]=4 3129 B11R1.284 O=C(CC1CSC1)NCCI 3189454cbf533121f4d6e9cc20a11864 [0,0,0,1,0,0|3,0,0]=4 3130 B11R1.284 O=C(CC1CSC1)NCCO a7fc7d9be2e3ef000226a0e56e17af39 [0,0,0,1,0,0|3,0,0]=4 3131 B11R1.284 O=C(CC1CSC1)NCCS 19aa37ad0110b10d3a6410458d4251b7 [0,0,0,1,0,0|3,0,0]=4 3132 B11R1.284 O=C(CCCF)NC1CCC1 72b3c4993aaa0d98c4f390f6bdabdcf9 [0,0,0,1,0,0|3,0,0]=4 3133 B11R1.284 O=C(CCCS)NC1CCC1 73e88593338436d544505256c4eaba60 [0,0,0,1,0,0|3,0,0]=4 3134 B11R1.284 O=C(CN1CCC1)NCCBr 44dec7de32fceb7363dc8ef928ff0e3b [0,0,0,1,0,0|3,0,0]=4 3135 B11R1.284 O=C(CN1CCC1)NCCF ff7c291f0ca854bc81dc943289f93274 [0,0,0,1,0,0|3,0,0]=4 3136 B11R1.284 O=C(CN1CCC1)NCCI 86e0bde588c7179facd7a64f701d7496 [0,0,0,1,0,0|3,0,0]=4 3137 B11R1.284 O=C(CN1CCC1)NCCO 1c271a25a8e3dbf6e8161d9f71c23db0 [0,0,0,1,0,0|3,0,0]=4 3138 B11R1.284 O=C(CN1CCC1)NCCS 0a3cdc458199cebbf1d0aebb8f0b9244 [0,0,0,1,0,0|3,0,0]=4 3139 B11R1.284 O=C(NCCF)NC1CCC1 3f0ff9f4bad4ff9cd8c797a45d8b011f [0,0,0,1,0,0|3,0,0]=4 3140 B11R1.284 O=C(NCCO)NC1CCC1 5183957ff2ac5948c9f03dd207f40f66 [0,0,0,1,0,0|3,0,0]=4 3141 B11R1.284 O=C(NCCS)NC1CCC1 2968bd0970a3b56f4501ceed1cfbc913 [0,0,0,1,0,0|3,0,0]=4 3142 B11R1.285 C#CCNC(=O)CCC1CC1 6747d439acdf34d05564577641a2bd67 [0,0,0,1,0,0|1,0,2]=4 3143 B11R1.285 C=C(CNC1CC1)OCOC 111a5552ebce99cd0a214d03c4da3c97 [0,0,0,1,0,0|3,0,0]=4 3144 B11R1.285 C=C(COC1CC1)OCOC 642bad49964367c609752f7b869fb0d3 [0,0,0,1,0,0|3,0,0]=4 3145 B11R1.285 C=CCOC(=O)CNC1CC1 10cfb17361a2e78efcebde0bb454ebb2 [0,0,0,1,0,0|1,0,2]=4 3146 B11R1.285 C=CCOC(=O)COC1CC1 e9d874b1928075778c7eef0bed2c862c [0,0,0,1,0,0|1,0,2]=4 3147 B11R1.285 CC/C=C/C(=O)NCC1CC1 95044f4074faa330507ac26332685fba [0,0,0,1,0,0|2,0,1]=4 3148 B11R1.285 CC/C=C\C(=O)NCC1CC1 210adada93d641d36ebcf2b8ba212e17 [0,0,0,1,0,0|2,0,1]=4 3149 B11R1.285 CCC#CC(=O)NCC1CC1 df4ea47ed9adde846132ef4185cf8c30 [0,0,0,1,0,0|2,0,1]=4 3150 B11R1.285 CCC=CC(=O)NCC1CC1 e03b61cb6ce2d4cf7bdf005edbdb0186 [0,0,0,1,0,0|2,0,1]=4 3151 B11R1.285 CCCCC(=O)NCC1CC1 488f9ad91fd5119acc4eb21efd20d02b [0,0,0,1,0,0|2,0,0]=3 3152 B11R1.285 CCCCN(C)CCC1CC1 afd56bbd7545b82993f0b33860c22fad [0,0,0,1,0,0|3,0,0]=4 3153 B11R1.285 CCCNC(=O)/C=C/C1CC1 ccd3d648edfb6d20f03fc64a1ce48298 [0,0,0,1,0,0|1,0,2]=4 3154 B11R1.285 CCCNC(=O)C#CC1CC1 18511ec0758d1ef8a48340fbaf3e7681 [0,0,0,1,0,0|1,0,2]=4 3155 B11R1.285 CCCNC(=O)C=CC1CC1 7f157438c594eeaa128f5831c5cdbe00 [0,0,0,1,0,0|1,0,2]=4 3156 B11R1.285 CCCNC(=O)CCC1CC1 5ef93a11288ca07c865318ec3237bb97 [0,0,0,1,0,0|1,0,0]=2 3157 B11R1.285 CCCNC(=O)CNC1CC1 71f698bd40dc9322d6dea66fd21d362e [0,0,0,1,0,0|2,0,0]=3 3158 B11R1.285 CCCNC(=O)COC1CC1 36ec3aa3769094bab56a5bec450853d1 [0,0,0,1,0,0|2,0,0]=3 3159 B11R1.285 CCCNC(=O)NCC1CC1 ec6ecd7ec0147ab057b75be88cd49b6d [0,0,0,1,0,0|2,0,0]=3 3160 B11R1.285 CCCNC(=S)NCC1CC1 d7172f6e6dc0df8a1f55a4de8475842f [0,0,0,1,0,0|2,1,0]=4 3161 B11R1.285 CCCOC(=O)CNC1CC1 bdb3d6c8a7bf39a6dc9595ce838c7bb0 [0,0,0,1,0,0|1,0,0]=2 3162 B11R1.285 CCCOC(=O)COC1CC1 78161b82b2f54ac96d0d39e935153ca6 [0,0,0,1,0,0|1,0,0]=2 3163 B11R1.285 CCOCC(=O)NCC1CC1 1a573250a87f35adeea6a0ab5a49d1a8 [0,0,0,1,0,0|3,0,0]=4 3164 B11R1.285 CCSCC(=O)NCC1CC1 c578fda066ca81b63c4fc5f9c0064410 [0,0,0,1,0,0|3,0,0]=4 3165 B11R1.285 COCCC(=O)NCC1CC1 df1f68875e785ad49a7107484a1288b4 [0,0,0,1,0,0|3,0,0]=4 3166 B11R1.285 CSCCC(=O)CNC1CC1 00073ba82786c86b820b1374a013be51 [0,0,0,1,0,0|3,0,0]=4 3167 B11R1.285 CSCCC(=O)COC1CC1 b292f74c964d6fb71e92b9cee3d044e3 [0,0,0,1,0,0|3,0,0]=4 3168 B11R1.285 CSCCC(=O)NCC1CC1 25ce60d0205a1a04e16cd3c20d41a02b [0,0,0,1,0,0|3,0,0]=4 3169 B11R1.285 N#CCNC(=O)CCC1CC1 e53bf36da990370281ba460cc34ca90e [0,0,0,1,0,0|2,0,1]=4 3170 B11R1.285 NCCNC(=O)NCC1CC1 de54a547415e46d155911373230c71f4 [0,0,0,1,0,0|3,0,0]=4 3171 B11R1.285 O=C(CCC1CC1)NCCBr 504f411608f14d572d3e202f3c6808bc [0,0,0,1,0,0|2,0,0]=3 3172 B11R1.285 O=C(CCC1CC1)NCCF 952f196548d0c9868b560e650358a4fc [0,0,0,1,0,0|2,0,0]=3 3173 B11R1.285 O=C(CCC1CC1)NCCI b90494aea6ed834429cf23247d28c594 [0,0,0,1,0,0|2,0,0]=3 3174 B11R1.285 O=C(CCC1CC1)NCCO d01431f0afd27b90e23ced922df4eb41 [0,0,0,1,0,0|2,0,0]=3 3175 B11R1.285 O=C(CCC1CC1)NCCS 997a78074330507349ca3fa369f6c441 [0,0,0,1,0,0|2,0,0]=3 3176 B11R1.285 O=C(CCCF)NCC1CC1 26d71298bdc38a8293f8b5044283e7ad [0,0,0,1,0,0|3,0,0]=4 3177 B11R1.285 O=C(CCCS)NCC1CC1 7fc841dcbddc905e446a50205f3f8861 [0,0,0,1,0,0|3,0,0]=4 3178 B11R1.285 O=C(CNC1CC1)NCCO 8e8cff436024606d8bedd135dddaad66 [0,0,0,1,0,0|3,0,0]=4 3179 B11R1.285 O=C(COC1CC1)NCCBr a95e5b773456a80ed21899017075d154 [0,0,0,1,0,0|3,0,0]=4 3180 B11R1.285 O=C(COC1CC1)NCCF 90f98d3c9413448091770829ee327b32 [0,0,0,1,0,0|3,0,0]=4 3181 B11R1.285 O=C(COC1CC1)NCCI b707a13d8b58af859f9283d7aac9aa17 [0,0,0,1,0,0|3,0,0]=4 3182 B11R1.285 O=C(COC1CC1)NCCO e8ae7a4e159d62710f49719cb19f1b42 [0,0,0,1,0,0|3,0,0]=4 3183 B11R1.285 O=C(COC1CC1)NCCS efe9e74e1926ea94f194a982226fec5c [0,0,0,1,0,0|3,0,0]=4 3184 B11R1.285 O=C(NCCF)NCC1CC1 d87575d447d7819533854a70a62489fa [0,0,0,1,0,0|3,0,0]=4 3185 B11R1.285 O=C(NCCO)NCC1CC1 46c73a1c18986a868a357369f6d9b376 [0,0,0,1,0,0|3,0,0]=4 3186 B11R1.285 O=C(NCCS)NCC1CC1 5b0515d4ca55f741b69438c72279424b [0,0,0,1,0,0|3,0,0]=4 3187 B11R1.286 CCCNC(=O)C1CCN1C 808448658715945bb489f29fc3186aa1 [0,0,0,1,0,0|2,0,0]=3 3188 B11R1.286 CCCNC(=O)[C@@H]1CCN1C 06fd69d680541fbe270e6695b79c0214 [0,0,0,1,0,0|2,0,0]=3 3189 B11R1.286 CCCNC(=O)[C@H]1CCN1C d24a9e2450505c97db5efc1624f15efd [0,0,0,1,0,0|2,0,0]=3 3190 B11R1.286 CN1CCC1C(=O)NCCF 9a2ab2e15ec43176792922336b042801 [0,0,0,1,0,0|3,0,0]=4 3191 B11R1.286 CN1CCC1C(=O)NCCI 70bf8eb43f5a5979581181a13093be04 [0,0,0,1,0,0|3,0,0]=4 3192 B11R1.286 CN1CCC1C(=O)NCCO 40e178f740e1938df1290239d48c7f01 [0,0,0,1,0,0|3,0,0]=4 3193 B11R1.286 CN1CCC1C(=O)NCCS f832870f028891837b1539d42e875171 [0,0,0,1,0,0|3,0,0]=4 3194 B11R1.286 CN1CC[C@@H]1C(=O)NCCF 453c9c282581ee1095fe50cb33841b61 [0,0,0,1,0,0|3,0,0]=4 3195 B11R1.286 CN1CC[C@@H]1C(=O)NCCI 813e2257ca8a8af3c517c7751fc2e023 [0,0,0,1,0,0|3,0,0]=4 3196 B11R1.286 CN1CC[C@@H]1C(=O)NCCO 5533589cd154aca6d37353b6b7442425 [0,0,0,1,0,0|3,0,0]=4 3197 B11R1.286 CN1CC[C@@H]1C(=O)NCCS 594f3ce8606cc3ff47219f0b5a30bbe8 [0,0,0,1,0,0|3,0,0]=4 3198 B11R1.286 CN1CC[C@H]1C(=O)NCCF c66ba81626a7fe960be07c8ca99516ce [0,0,0,1,0,0|3,0,0]=4 3199 B11R1.286 CN1CC[C@H]1C(=O)NCCI 3374b8363f860db7520720818e4e3989 [0,0,0,1,0,0|3,0,0]=4 3200 B11R1.286 CN1CC[C@H]1C(=O)NCCO 3f5e18841789ffd538888626addc63c5 [0,0,0,1,0,0|3,0,0]=4 3201 B11R1.286 CN1CC[C@H]1C(=O)NCCS 377fd12551c5d1517a8758f74352e509 [0,0,0,1,0,0|3,0,0]=4 3202 B11R1.299 C#CCCCC(=O)N1CCC1 fe4c3cd2450aba2661a47118944425eb [0,0,0,1,0,0|1,0,2]=4 3203 B11R1.299 C=CCCCC(=O)N1CCC1 72af870d665d151da3e98685c789ba3b [0,0,0,1,0,0|1,0,2]=4 3204 B11R1.299 CC#CCCC(=O)N1CCC1 f4f854e9b93f59684ecebaf9cd85c38a [0,0,0,1,0,0|1,0,2]=4 3205 B11R1.299 CC/C=C/CC(=O)N1CCC1 2b5758050efac63d497bd3c6394f21cb [0,0,0,1,0,0|1,0,2]=4 3206 B11R1.299 CC/C=C\CC(=O)N1CCC1 2cee7701d79aed570c6db7c5e5511bd1 [0,0,0,1,0,0|1,0,2]=4 3207 B11R1.299 CC=CCCC(=O)N1CCC1 2382d2a18d625bbe78163cef2b002315 [0,0,0,1,0,0|1,0,2]=4 3208 B11R1.299 CCC/C=C/C(=O)N1CCC1 9c94ffed3b74f4c0bfbf51414c810c9c [0,0,0,1,0,0|1,0,2]=4 3209 B11R1.299 CCC=CCC(=O)N1CCC1 c1b42e21e07441d36cc26d76573f4710 [0,0,0,1,0,0|1,0,2]=4 3210 B11R1.299 CCCC#CC(=O)N1CCC1 93467f5b8a65577b3b301f2387d5fadf [0,0,0,1,0,0|1,0,2]=4 3211 B11R1.299 CCCC=CC(=O)N1CCC1 b546b813cff9dabf463e2a0eba3ef24e [0,0,0,1,0,0|1,0,2]=4 3212 B11R1.299 CCCCCC(=O)N1CCC1 8d6c0846d448d2b87069863c4bda5b3f [0,0,0,1,0,0|1,0,0]=2 3213 B11R1.299 CCCCCC(C)N1CCC1 011f008539052aa470bf877b7bc798e5 [0,0,0,1,0,0|2,0,1]=4 3214 B11R1.299 CCCCCN(C)C1CCC1 2deb918601988401629b23a7ed3278f8 [0,0,0,1,0,0|3,0,0]=4 3215 B11R1.299 CCCCC[C@H](C)N1CCC1 adc37931243a7d94b6f0a6ae5d21c184 [0,0,0,1,0,0|2,0,1]=4 3216 B11R1.299 CCCCNC(=O)C1=CCC1 4e990555a9832402130a708dbbc2d2f7 [0,0,0,1,0,0|2,0,1]=4 3217 B11R1.299 CCCCNC(=O)C1CCO1 5d0184f9965f6e1d12eedb7d56a432bc [0,0,0,1,0,0|3,0,0]=4 3218 B11R1.299 CCCCNC(=O)N1CCC1 9b1db031f847a68b5c99b2555e316ecc [0,0,0,1,0,0|2,0,0]=3 3219 B11R1.299 CCCCNC(=O)[C@@H]1CCO1 b44acec168423fe8924de9b365e51e44 [0,0,0,1,0,0|3,0,0]=4 3220 B11R1.299 CCCCNC(=O)[C@H]1CCO1 c375dbc2854ca5d8531bb40dd8f57281 [0,0,0,1,0,0|3,0,0]=4 3221 B11R1.299 CCCCNC(=S)N1CCC1 7a3ef099f6630d0325d8b909ea1e4d20 [0,0,0,1,0,0|2,1,0]=4 3222 B11R1.299 CCCNCC(=O)C1CCC1 d42d0cea915d9e675eef56f337c454c3 [0,0,0,1,0,0|2,0,0]=3 3223 B11R1.299 CCCNCC(=O)N1CCC1 bca7e7d74932f99bdcb4268f0bc41325 [0,0,0,1,0,0|2,0,0]=3 3224 B11R1.299 CCCOCC(=O)C1CCC1 c02b97b8abe184f4ddad90df8883ba45 [0,0,0,1,0,0|2,0,0]=3 3225 B11R1.299 CCCOCC(=O)N1CCC1 9842cc916368c43c704ac6922e056926 [0,0,0,1,0,0|2,0,0]=3 3226 B11R1.299 CCCSCC(=O)N1CCC1 e1a98efea39683a80b4601da32c1fc42 [0,0,0,1,0,0|2,0,0]=3 3227 B11R1.299 CCOCCC(=O)N1CCC1 c6250e506058a9c3bafd9648d1f4d6f4 [0,0,0,1,0,0|2,0,0]=3 3228 B11R1.299 CCSCCC(=O)N1CCC1 16e873b7f6a5b895dcaa019030ddf29c [0,0,0,1,0,0|2,0,0]=3 3229 B11R1.299 COCCCC(=O)N1CCC1 a9f95988f0b5627eb734d79168c5fc0d [0,0,0,1,0,0|2,0,0]=3 3230 B11R1.299 COCCNC(=O)N1CCC1 6e4443d2826ca03245e55adce032d8dd [0,0,0,1,0,0|3,0,0]=4 3231 B11R1.299 COCOCC(=O)C1CCC1 ce29525f88778b6532e0e92842c79204 [0,0,0,1,0,0|3,0,0]=4 3232 B11R1.299 COCOCC(=O)N1CCC1 f6c303b1140467d5d3f80a7001dd2c04 [0,0,0,1,0,0|3,0,0]=4 3233 B11R1.299 CSCCCC(=O)N1CCC1 043be41e762f8fbca7c7df3b60cc784b [0,0,0,1,0,0|2,0,0]=3 3234 B11R1.299 CSCCNC(=O)N1CCC1 97f580c31124a0847479751e4c892f49 [0,0,0,1,0,0|3,0,0]=4 3235 B11R1.299 CSSCCC(=O)N1CCC1 882131e314f6811c9ee9df8d2071daef [0,0,0,1,0,0|3,0,0]=4 3236 B11R1.299 N#CCCCC(=O)N1CCC1 09ae18f1bc2c8993fe74020f31d75d97 [0,0,0,1,0,0|2,0,1]=4 3237 B11R1.299 NCCCNC(=O)N1CCC1 0376e92b6c9ec4dcadf9e6f358300a59 [0,0,0,1,0,0|3,0,0]=4 3238 B11R1.299 O=C(CCCCF)N1CCC1 a379b999574893eacf729ad3996d7f6c [0,0,0,1,0,0|2,0,0]=3 3239 B11R1.299 O=C(CCCCO)N1CCC1 e0114c6328d9254d5ee73ef5b6550f38 [0,0,0,1,0,0|2,0,0]=3 3240 B11R1.299 O=C(CCCCS)N1CCC1 d9712ed50aca930bba88dcdc511ebeff [0,0,0,1,0,0|2,0,0]=3 3241 B11R1.299 O=C(CNCCBr)C1CCC1 98d35409e1263001a62bd6ad35023389 [0,0,0,1,0,0|3,0,0]=4 3242 B11R1.299 O=C(CNCCBr)N1CCC1 4a8b5df3611a7b16335ddefe4d2f5558 [0,0,0,1,0,0|3,0,0]=4 3243 B11R1.299 O=C(CNCCF)C1CCC1 7aa7e36d98e0507eacea77d974f138d4 [0,0,0,1,0,0|3,0,0]=4 3244 B11R1.299 O=C(CNCCF)N1CCC1 3598c5129ea4f810b43565ead69b146f [0,0,0,1,0,0|3,0,0]=4 3245 B11R1.299 O=C(CNCCI)C1CCC1 86c06937d2586c36365d884a92320bbf [0,0,0,1,0,0|3,0,0]=4 3246 B11R1.299 O=C(CNCCI)N1CCC1 64a487ba1920f9e2ae03e32b7d641ea8 [0,0,0,1,0,0|3,0,0]=4 3247 B11R1.299 O=C(CNCCO)C1CCC1 45a4321a08b6627ea3016468d6e89579 [0,0,0,1,0,0|3,0,0]=4 3248 B11R1.299 O=C(CNCCO)N1CCC1 36365149e02171ceeedb2240f6084772 [0,0,0,1,0,0|3,0,0]=4 3249 B11R1.299 O=C(CNCCS)C1CCC1 c274aa015fdabf44cb6a1d0fa2e3f4d9 [0,0,0,1,0,0|3,0,0]=4 3250 B11R1.299 O=C(CNCCS)N1CCC1 14ad66582c523b1674cf492db89e3f28 [0,0,0,1,0,0|3,0,0]=4 3251 B11R1.299 O=C(COCCF)C1CCC1 c1706dd59d38adb5aea525c6575c6668 [0,0,0,1,0,0|3,0,0]=4 3252 B11R1.299 O=C(COCCF)N1CCC1 cb8f41acacbee4b36fe100e3b39f7dbc [0,0,0,1,0,0|3,0,0]=4 3253 B11R1.299 O=C(COCCO)N1CCC1 dda79c8aa047560a56045e18a65720cf [0,0,0,1,0,0|3,0,0]=4 3254 B11R1.299 O=C(COCCS)C1CCC1 39865cc0bb40819a9f987a79c6c26428 [0,0,0,1,0,0|3,0,0]=4 3255 B11R1.299 O=C(COCCS)N1CCC1 718bb59d0e632af6c9ff99c5185f8ffd [0,0,0,1,0,0|3,0,0]=4 3256 B11R1.299 O=C(NCCCO)N1CCC1 741ba44b9ce8914bd576e73c62f7a176 [0,0,0,1,0,0|3,0,0]=4 3257 B11R1.299 O=CCCCC(=O)N1CCC1 5647b001f37fb7504d6ffc036b5d35da [0,0,0,1,0,0|2,0,1]=4 3258 B11R1.301 C#CCCCC(=O)NC1CC1 72662273b6887c7b770d0dde1381b25f [0,0,0,1,0,0|1,0,2]=4 3259 B11R1.301 C=CCCCC(=O)NC1CC1 c3fa03d41d30a6bf7258f6c93011e942 [0,0,0,1,0,0|1,0,2]=4 3260 B11R1.301 CC#CCCC(=O)NC1CC1 3f76f18b24fae6d38504bf173f914ccb [0,0,0,1,0,0|1,0,2]=4 3261 B11R1.301 CC/C=C/CC(=O)NC1CC1 0636f1a0abc96e414f3d45aa6c4185a6 [0,0,0,1,0,0|1,0,2]=4 3262 B11R1.301 CC/C=C\CC(=O)NC1CC1 8eec5a0e3d81f6b7cb71a2f27dd92193 [0,0,0,1,0,0|1,0,2]=4 3263 B11R1.301 CC=CCCC(=O)NC1CC1 f1d2a439473fd12fd256e7faebbef93e [0,0,0,1,0,0|1,0,2]=4 3264 B11R1.301 CCC/C=C/C(=O)NC1CC1 7f119ba2b3ef5661ac16249a2a2946a0 [0,0,0,1,0,0|1,0,2]=4 3265 B11R1.301 CCC=CCC(=O)NC1CC1 37b7499a3b7ee44ca32f69cda62ac39f [0,0,0,1,0,0|1,0,2]=4 3266 B11R1.301 CCCC#CC(=O)NC1CC1 d2131bfe96492a0a4a79ca3e986f736f [0,0,0,1,0,0|1,0,2]=4 3267 B11R1.301 CCCC=CC(=O)NC1CC1 3989756d9d13dd7f622e1ebc73abb666 [0,0,0,1,0,0|1,0,2]=4 3268 B11R1.301 CCCCCC(=O)NC1CC1 70dd38d610268ef3c26e12b23ff440ab [0,0,0,1,0,0|1,0,0]=2 3269 B11R1.301 CCCCCC(C)NC1CC1 845ba0669e10a58288570128efdbfdb2 [0,0,0,1,0,0|2,0,1]=4 3270 B11R1.301 CCCCCC(C)OC1CC1 ea23e4a35307d314848e3b830ac4a6d7 [0,0,0,1,0,0|1,0,1]=3 3271 B11R1.301 CCCCCN(C)CC1CC1 7d1dfcf06f05ff6a50fa12b1d92e2018 [0,0,0,1,0,0|3,0,0]=4 3272 B11R1.301 CCCCC[C@@H](C)OC1CC1 8332cd60325a67ec25b12cb104d25829 [0,0,0,1,0,0|1,0,1]=3 3273 B11R1.301 CCCCC[C@H](C)NC1CC1 c6727d9c6b3f04bddedfc7c1c5729095 [0,0,0,1,0,0|2,0,1]=4 3274 B11R1.301 CCCCC[C@H](C)OC1CC1 1363655c37fd0dffecc54ba2a3286e78 [0,0,0,1,0,0|1,0,1]=3 3275 B11R1.301 CCCCNC(=O)CC1CC1 e2f8f7520accb7d7daf3a5d25d7ba01f [0,0,0,1,0,0|2,0,0]=3 3276 B11R1.301 CCCCNC(=O)NC1CC1 599f02630df824c501468dbca97796c6 [0,0,0,1,0,0|2,0,0]=3 3277 B11R1.301 CCCCNC(=S)NC1CC1 7da004b57eee5aa593bedd9d9c57afe2 [0,0,0,1,0,0|2,1,0]=4 3278 B11R1.301 CCCNCC(=O)NC1CC1 be9c9c2a7202d4182957b5c449e41812 [0,0,0,1,0,0|2,0,0]=3 3279 B11R1.301 CCCOCC(=O)NC1CC1 b2573f17ff22fcf5a12d7563ad2c2c8e [0,0,0,1,0,0|2,0,0]=3 3280 B11R1.301 CCCOCC(C)OC1CC1 f17cc38382a1696716671b8da18321af [0,0,0,1,0,0|2,0,1]=4 3281 B11R1.301 CCCSCC(=O)NC1CC1 88183c9e98d6f2498cd8f6d2e50c6f60 [0,0,0,1,0,0|2,0,0]=3 3282 B11R1.301 CCSCCC(=O)NC1CC1 0c17370b2e651d9cb435068dc2a87f53 [0,0,0,1,0,0|2,0,0]=3 3283 B11R1.301 COCCCC(=O)NC1CC1 18c481c4212edfd91ee25381b1f063cb [0,0,0,1,0,0|2,0,0]=3 3284 B11R1.301 COCCNC(=O)CC1CC1 f89e1a7d4319c8f2d3f62e0000759246 [0,0,0,1,0,0|3,0,0]=4 3285 B11R1.301 COCCNC(=O)NC1CC1 d4caacb646b3c086b373f45d0126f40e [0,0,0,1,0,0|3,0,0]=4 3286 B11R1.301 COCNCC(=O)NC1CC1 370efdc2554ceb3a8013069cb8bb0fad [0,0,0,1,0,0|3,0,0]=4 3287 B11R1.301 COCOCC(=O)NC1CC1 e2364b8c93fc0c13a8c933d290d46fcb [0,0,0,1,0,0|3,0,0]=4 3288 B11R1.301 CSCCCC(=O)NC1CC1 6420ed3d41930de5d2453943d0c8483c [0,0,0,1,0,0|2,0,0]=3 3289 B11R1.301 CSCCNC(=O)CC1CC1 13baf32b54fabfc59be5a3bf463d2c10 [0,0,0,1,0,0|3,0,0]=4 3290 B11R1.301 CSCCNC(=O)NC1CC1 ef8c1a2e5c1cd4e40d97a91dd0eac551 [0,0,0,1,0,0|3,0,0]=4 3291 B11R1.301 CSCNCC(=O)NC1CC1 3343d18516215acf3e406c3fb332337b [0,0,0,1,0,0|3,0,0]=4 3292 B11R1.301 CSSCCC(=O)NC1CC1 e34a39eb4ff8e71f41b33cc7010bf3b4 [0,0,0,1,0,0|3,0,0]=4 3293 B11R1.301 N#CCCCC(=O)NC1CC1 95ee7e1f73e0bcfde3d825ed23e2691d [0,0,0,1,0,0|2,0,1]=4 3294 B11R1.301 NCCCNC(=O)NC1CC1 1978c59eb27c105d745efa8603358dec [0,0,0,1,0,0|3,0,0]=4 3295 B11R1.301 O=C(CC1CC1)NCCCCl 0d6619a79eb84b09a695d67838ff9372 [0,0,0,1,0,0|3,0,0]=4 3296 B11R1.301 O=C(CC1CC1)NCCCO 404c6ee499058da383752bed20fda862 [0,0,0,1,0,0|3,0,0]=4 3297 B11R1.301 O=C(CCCCF)NC1CC1 0826b8f671bed8cbad49521a6ee6b5e0 [0,0,0,1,0,0|2,0,0]=3 3298 B11R1.301 O=C(CCCCO)NC1CC1 ccb1c6a08ad90868197a1b638c4aac59 [0,0,0,1,0,0|2,0,0]=3 3299 B11R1.301 O=C(CCCCS)NC1CC1 e0c8d72ae110205ddb7dc5e83372228b [0,0,0,1,0,0|2,0,0]=3 3300 B11R1.301 O=C(CNCCBr)NC1CC1 13f880d4190412a92e895cd4ca3ae228 [0,0,0,1,0,0|3,0,0]=4 3301 B11R1.301 O=C(CNCCF)NC1CC1 081a37a3b27ae967b854caa8d52dec9f [0,0,0,1,0,0|3,0,0]=4 3302 B11R1.301 O=C(CNCCI)NC1CC1 ffb77a730a09feeb1e845c478e6d8315 [0,0,0,1,0,0|3,0,0]=4 3303 B11R1.301 O=C(CNCCO)NC1CC1 090a66f90f54ac7c5624dfaada0cdc50 [0,0,0,1,0,0|3,0,0]=4 3304 B11R1.301 O=C(CNCCS)NC1CC1 b13ec8feaaec917c5a796d777e9eed2c [0,0,0,1,0,0|3,0,0]=4 3305 B11R1.301 O=C(COCCF)NC1CC1 0aebc9472bb08eb80c33d25af0023c69 [0,0,0,1,0,0|3,0,0]=4 3306 B11R1.301 O=C(COCCO)NC1CC1 1f0a1c0c6d7af0e533a90a26be5e7b7c [0,0,0,1,0,0|3,0,0]=4 3307 B11R1.301 O=C(COCCS)NC1CC1 1c865fbadd7e37ce869985d19de7ab0d [0,0,0,1,0,0|3,0,0]=4 3308 B11R1.301 O=C(NCCCO)NC1CC1 77381f66669735ffa13885a98f82dbf1 [0,0,0,1,0,0|3,0,0]=4 3309 B11R1.301 O=CCCCC(=O)NC1CC1 e5f33fc04635f705b71dcec414e75d8c [0,0,0,1,0,0|2,0,1]=4 3310 B11R1.303 CCOC1=C(CCC1=O)CC 49a73b3978529d74140bb64934f75395 [0,0,0,1,0,0|2,0,1]=4 3311 B11R1.465 CCCN[C@@H]1C(=O)NC[C@H]1O 6d0d285a558de3f269e480a3a9628d54 [0,0,0,1,0,0|3,0,0]=4 3312 B11R1.465 CCCOC1=C(COC1=O)C f168f1c97da0e398a09606a2464dbb9b [0,0,0,1,0,0|1,0,2]=4 3313 B11R1.465 O=C1OC[C@@H]([C@@H]1NCCO)O 9ffac6c9875dc82da0cc6cc5b2dbd9b2 [0,0,0,1,0,0|3,0,0]=4 3314 B11R1.605 CCCN1C(CCCC1C)C 305e7968253a52aab9f3fde8da0c3e48 [0,0,0,1,0,0|2,0,1]=4 3315 B11R1.605 CCCN1[C@@H](CCC[C@@H]1C)C a82fe994b481b8ca04b4a9c350842b96 [0,0,0,1,0,0|2,0,1]=4 3316 B11R1.605 CCCN1[C@@H](CCC[C@H]1C)C 83b3595356ded754f9d091511af89168 [0,0,0,1,0,0|2,0,1]=4 3317 B11R1.605 CCCN1[C@H](CCC[C@@H]1C)C 1530cd2f3bf9c9cafda64d939072943d [0,0,0,1,0,0|2,0,1]=4 3318 B11R1.756 CCCNCC1(CCCO1)C df049434889ef2af7afe1f2986951d62 [0,0,0,1,0,0|2,0,1]=4 3319 B11R1.756 CCCOCC1(CCCO1)C c9db85dc12fe3f43dca5c29908cc8e6f [0,0,0,1,0,0|2,0,1]=4 3320 B11R1.759 CCCCCN1CC(C1)CC 2a26d55ed23e500362e95766ae8bdf93 [0,0,0,1,0,0|3,0,0]=4 3321 B11R1.900 CCCNC1(CCCCC1)C 55a443218bf0085f3aa4c1476dfafb50 [0,0,0,1,0,0|2,0,1]=4 3322 B8R0.1 CCCC(=O)NCCBr e3424ddfe0e4582b4445faadedeca9f3 [2,0,0,0,0,0|2,0,0]=4 3323 B8R0.1 CCCC(=O)NCCF abd86ad1a4854f306fa4ec91802cd24f [2,0,0,0,0,0|2,0,0]=4 3324 B8R0.1 CCCC(=O)NCCI effb943f4ec1dba1ee2232662d0cb367 [2,0,0,0,0,0|2,0,0]=4 3325 B8R0.1 CCCC(=O)NCCO d2bc78e5bd2f73aa8619f010857f1926 [2,0,0,0,0,0|2,0,0]=4 3326 B8R0.1 CCCC(=O)NCCS c2ef67720d0b2ef54134f82538ee13fd [2,0,0,0,0,0|2,0,0]=4 3327 B8R0.1 CCCC(=S)OCCF 4a3f66968fafe65a13eab591dccc8c9f [2,0,0,0,0,0|1,1,0]=4 3328 B8R0.1 CCCC(=S)OCCS 7161c28940ff0dc6e0b2d32d8bc2d5dc [2,0,0,0,0,0|1,1,0]=4 3329 B8R0.1 CCCC(=S)OCOC d7c66aa0be93e71a0e10702c93e66ce1 [2,0,0,0,0,0|1,1,0]=4 3330 B8R0.1 CCCC(=S)OCSC aaf32ff7376d2185d5b81bb017266ecd [2,0,0,0,0,0|1,1,0]=4 3331 B8R0.1 CCCCC(C)OCC e43df0ae121ab44cb6194c6546aa1e41 [2,0,0,0,0,0|1,0,1]=4 3332 B8R0.1 CCCCN(C)CCC 598958f1bf27154d8760346aca3fc1c7 [2,0,0,0,0,0|2,0,0]=4 3333 B8R0.1 CCCC[C@@H](C)OCC d38acbfc54d47c4bbd565f1b434e5e73 [2,0,0,0,0,0|1,0,1]=4 3334 B8R0.1 CCCC[C@H](C)OCC f8165a8926a10ebcbdb8675cf31f0cb1 [2,0,0,0,0,0|1,0,1]=4 3335 B8R0.1 CCCNC(=O)CCC 3a4ef615081398a2acfdf5d3349655c4 [2,0,0,0,0,0|1,0,0]=3 3336 B8R0.1 CCCNC(=O)CCF 80cac466548133e31f593852e3638107 [2,0,0,0,0,0|2,0,0]=4 3337 B8R0.1 CCCNC(=O)CCO 1e17d6cf040450a0042d7883a84b4d20 [2,0,0,0,0,0|2,0,0]=4 3338 B8R0.1 CCCNC(=O)CCS 5ca47d6ccf33cee73df146cfd5794783 [2,0,0,0,0,0|2,0,0]=4 3339 B8R0.1 CCCNC(=O)COC d992f0c3466a56e61d0974e6b6e8669f [2,0,0,0,0,0|2,0,0]=4 3340 B8R0.1 CCCNC(=O)CSC 6ae58cb75ea789964eebc3d4df556317 [2,0,0,0,0,0|2,0,0]=4 3341 B8R0.1 CCCOC(=S)CCC 553859e26557f67ca84075cb05814f3e [2,0,0,0,0,0|0,1,0]=3 3342 B8R0.1 CCCOC(C)CCC 5072af5c5b154601df0153ecc4f9a62c [2,0,0,0,0,0|1,0,1]=4 3343 B8R0.1 CCCO[C@@H](C)CCC 3768650ef68ec2d5f66e51478eb2c0cf [2,0,0,0,0,0|1,0,1]=4 3344 B8R0.1 CCCO[C@H](C)CCC d9937f3512bcf6b6a2b04993e218c5dc [2,0,0,0,0,0|1,0,1]=4 3345 B8R0.1 CCNC(=O)COCC c84e7c49da6c2baea65be933f5b80bea [2,0,0,0,0,0|2,0,0]=4 3346 B8R0.1 CCNCC(=O)NCC 85e3c6c463358c2ceb6c3f3c07ea189c [2,0,0,0,0,0|2,0,0]=4 3347 B8R0.1 CCNCC(=O)OCC 13e479e123264c7bc2cd9986b04b4c24 [2,0,0,0,0,0|1,0,0]=3 3348 B8R0.1 CCOC(=O)CNCF 7d02e761e530b1a2e8b4937d75024162 [2,0,0,0,0,0|2,0,0]=4 3349 B8R0.1 CCOC(=O)CNCO be258da79336855a99e7f18427102b1b [2,0,0,0,0,0|2,0,0]=4 3350 B8R0.1 CCOC(=O)COCF e0f65d48f1d596b5b0dcd0c878bc5d05 [2,0,0,0,0,0|2,0,0]=4 3351 B8R0.1 CCOCC(=O)OCC a71429e2784f27b770f80be9d4ceb826 [2,0,0,0,0,0|1,0,0]=3 3352 B8R0.4 C#CCCCOCCC f6e548e043c266c18f3f2bc45e2b26e7 [2,0,0,0,0,0|0,0,2]=4 3353 B8R0.4 C#CCOCCCCC b060b391600b8a6b8af1e059657888e9 [2,0,0,0,0,0|0,0,2]=4 3354 B8R0.4 C/C=C/CCOCCC f366940c9b8e42845e1a3a54e7e58d66 [2,0,0,0,0,0|0,0,2]=4 3355 B8R0.4 C=CCCCOCCC 5f646296a8d9f451f6f7524888b9f8ed [2,0,0,0,0,0|0,0,2]=4 3356 B8R0.4 C=CCOCCCCC fcddc90e6084facec8d1d12eaaa08ee7 [2,0,0,0,0,0|0,0,2]=4 3357 B8R0.4 CC#CCCOCCC 387cb960b2fced33dd26ab6a4fb5ee8c [2,0,0,0,0,0|0,0,2]=4 3358 B8R0.4 CC/C=C/CCOCC 4aff7b2c30c18c7ed71e09741dd9cd03 [2,0,0,0,0,0|1,0,1]=4 3359 B8R0.4 CC/C=C/CNCCC 7b76f5221e9f8d321a930b2cc78f0465 [2,0,0,0,0,0|1,0,1]=4 3360 B8R0.4 CC/C=C/COCCC 7c99577e2748989634a614f6f829f70a [2,0,0,0,0,0|0,0,2]=4 3361 B8R0.4 CC/C=C\CCOCC a415407c2a3f74060244fd9fe72f26f2 [2,0,0,0,0,0|1,0,1]=4 3362 B8R0.4 CC/C=C\COCCC bfdbd41336075fd3cb4c9e9e3471925b [2,0,0,0,0,0|0,0,2]=4 3363 B8R0.4 CCC#CCOCCC 4e180024a47b40b4debdbd4f1d487e6a [2,0,0,0,0,0|0,0,2]=4 3364 B8R0.4 CCC/C=C/COCC 194c2fe9a034aa9429bf8b431746f7e5 [2,0,0,0,0,0|1,0,1]=4 3365 B8R0.4 CCC/C=C\COCC 6a1508b69f1117002ddef7a5ce847c5e [2,0,0,0,0,0|1,0,1]=4 3366 B8R0.4 CCCCCCNCC 007e02c518c21b960782cd7d67a6f9d7 [2,0,0,0,0,0|1,0,1]=4 3367 B8R0.4 CCCCCCOCC 9345e14939c0037a8cd7124fa95af69b [2,0,0,0,0,0|0,0,1]=3 3368 B8R0.4 CCCCCCOCF 5545a0a4abb65fe9a326f72bb8454219 [2,0,0,0,0,0|1,0,1]=4 3369 B8R0.4 CCCCCNCCBr 089f5434d612eac8e3264fb2af68de09 [2,0,0,0,0,0|2,0,0]=4 3370 B8R0.4 CCCCCNCCC e1899f21e9e3263889e806dca2898495 [2,0,0,0,0,0|1,0,0]=3 3371 B8R0.4 CCCCCNCCF 08736e9d031b962149008af4dbbae1ec [2,0,0,0,0,0|2,0,0]=4 3372 B8R0.4 CCCCCNCCI 451535c8d9a592fc4903d9a80bb5e070 [2,0,0,0,0,0|2,0,0]=4 3373 B8R0.4 CCCCCNCCO f9b71f37f65a5dd4fd3f51e1e821c5a0 [2,0,0,0,0,0|2,0,0]=4 3374 B8R0.4 CCCCCNCCS 8d24f5c417bfd50b34a0c81d07c624ad [2,0,0,0,0,0|2,0,0]=4 3375 B8R0.4 CCCCCNCOC 39758a02c0fddd5394c0093195bca6be [2,0,0,0,0,0|2,0,0]=4 3376 B8R0.4 CCCCCNCSC a12f2c65341920caab6c80b675bb648f [2,0,0,0,0,0|2,0,0]=4 3377 B8R0.4 CCCCCOCC#N 000a9d63180c20d434c83376e668a582 [2,0,0,0,0,0|1,0,1]=4 3378 B8R0.4 CCCCCOCC=O 95ddace22ad0ae385e1b30e1a33c697f [2,0,0,0,0,0|1,0,1]=4 3379 B8R0.4 CCCCCOCCC c08adbc8512009f4d669d9cfc0c3fe67 [2,0,0,0,0,0|0,0,0]=2 3380 B8R0.4 CCCCCOCCF b565148eef0c482ff0e6a7dc3e323e46 [2,0,0,0,0,0|1,0,0]=3 3381 B8R0.4 CCCCCOCCS c4cd0a419631483dc8c725004b7f7323 [2,0,0,0,0,0|1,0,0]=3 3382 B8R0.4 CCCCCOCOC b5b3100512c55f3430f83e20b695c569 [2,0,0,0,0,0|1,0,0]=3 3383 B8R0.4 CCCCCOCSC a7f8dc7f97f2742c2c3f78a6bcb15d4b [2,0,0,0,0,0|1,0,0]=3 3384 B8R0.4 CCCCNCCCC 83f5cde9216aaf13647a8beda79dab35 [2,0,0,0,0,0|1,0,1]=4 3385 B8R0.4 CCCCNCOCC 6270590fe71f8e7cfb7887c503e7cb19 [2,0,0,0,0,0|1,0,1]=4 3386 B8R0.4 CCCCOCCCC a5b0ef99667fb81b30d5c592594cbe40 [2,0,0,0,0,0|1,0,1]=4 3387 B8R0.4 CCCCOCOCC cfd273cfcd393094625c8ef6899069be [2,0,0,0,0,0|1,0,1]=4 3388 B8R0.4 CCCNCCCCCl 86d3fabc966fee554ec309bcdb6a6f42 [2,0,0,0,0,0|2,0,0]=4 3389 B8R0.4 CCCNCCCCF f801e13fe9947adffb3521a5945c4de9 [2,0,0,0,0,0|2,0,0]=4 3390 B8R0.4 CCCNCCCCO 101d8adf768a1371279ab06c67e1a854 [2,0,0,0,0,0|2,0,0]=4 3391 B8R0.4 CCCNCCCCS e81cbea71a1d34af60d6fe3b38b1645e [2,0,0,0,0,0|2,0,0]=4 3392 B8R0.4 CCCNCCCOC 97e272a50a3dc43fab42b265af642693 [2,0,0,0,0,0|2,0,0]=4 3393 B8R0.4 CCCNCCCSC a1fb4fe81d031e7dcffdf0d0cda484e8 [2,0,0,0,0,0|2,0,0]=4 3394 B8R0.4 CCCNCCOCC 788b5a303fd5463369b362f7c1e82c05 [2,0,0,0,0,0|1,0,1]=4 3395 B8R0.4 CCCNCCSCC 145c32b87daf4b90eafd0f3078816379 [2,0,0,0,0,0|2,0,0]=4 3396 B8R0.4 CCCOCCCC#N b3a2f594f5ca80ef3759bc59478543ea [2,0,0,0,0,0|1,0,1]=4 3397 B8R0.4 CCCOCCCC=O 36a3d4a82e0ed496435ff747ce5facc5 [2,0,0,0,0,0|1,0,1]=4 3398 B8R0.4 CCCOCCCCF 4b4695bfbe072018bc890c8e6fdbfb83 [2,0,0,0,0,0|1,0,0]=3 3399 B8R0.4 CCCOCCCCS 0885ae66405cbad0900445dfe2d6de97 [2,0,0,0,0,0|1,0,0]=3 3400 B8R0.4 CCCOCCCOC 8f84ed15eeef50c54bbb8786899dacf1 [2,0,0,0,0,0|1,0,0]=3 3401 B8R0.4 CCCOCCCSC 8c60126d0675ea04220b398e82d839b9 [2,0,0,0,0,0|1,0,0]=3 3402 B8R0.4 CCCOCCNCC 3ad8014459df89d50716c0dd5d41fb69 [2,0,0,0,0,0|1,0,0]=3 3403 B8R0.4 CCCOCCNCF a9319f07478697381a5dccdb718d2320 [2,0,0,0,0,0|2,0,0]=4 3404 B8R0.4 CCCOCCNCO 8595bcbbbf5fd075137f627b7ec6b8b8 [2,0,0,0,0,0|2,0,0]=4 3405 B8R0.4 CCCOCCOCC 329b2bcd6f865f8651c78dbc452ecac4 [2,0,0,0,0,0|1,0,0]=3 3406 B8R0.4 CCCOCCOCF 6893c8c2de2661d9cf2e52b0c6eaabcf [2,0,0,0,0,0|2,0,0]=4 3407 B8R0.4 CCCOCCSCC 64da344c31f9c5888d0de5ce68aa3904 [2,0,0,0,0,0|1,0,0]=3 3408 B8R0.4 CCCSCCOCC c76e8fe318a52d32927def1b7ebdffa7 [2,0,0,0,0,0|1,0,1]=4 3409 B8R0.4 CCNCCCOCC f2ffbe155d0d4a2462785a082836f9b5 [2,0,0,0,0,0|1,0,1]=4 3410 B8R0.4 CCNCCOCCO ab40f68d3f552d1a5970b56d1caa576b [2,0,0,0,0,0|2,0,0]=4 3411 B8R0.4 CCNCCOCCS c3388bd6ae086c9b8dbf3a86d3508eb7 [2,0,0,0,0,0|2,0,0]=4 3412 B8R0.4 CCOCCCCOC 884278e30d78a09f4fe2f7feb30d0d3f [2,0,0,0,0,0|1,0,1]=4 3413 B8R0.4 CCOCCCCSC c32f6fe4365f04c7fe23f7790fb72a1b [2,0,0,0,0,0|1,0,1]=4 3414 B8R0.4 CCOCCCOCC 1ce53fcb477dcf09005ceecf2916bb17 [2,0,0,0,0,0|1,0,1]=4 3415 B8R0.4 CCOCCCSCC 93ac6b931fc33d114d8490d7cf350c9c [2,0,0,0,0,0|1,0,1]=4 3416 B8R0.4 CCOCCOCCF de5dbf96542777ab66f236cc8c494a50 [2,0,0,0,0,0|2,0,0]=4 3417 B8R0.4 CCOCCOCCS 5aba6681f29eaa409e556a8d2831c051 [2,0,0,0,0,0|2,0,0]=4 3418 B8R0.4 CCOCCOCOC e6334ba77bd51e3629560bf63da6c369 [2,0,0,0,0,0|2,0,0]=4 3419 B8R0.4 CCOCCOCSC 7ad27a18099c3a18c7e8e4cf515a46f8 [2,0,0,0,0,0|2,0,0]=4 3420 B8R0.4 CCSCCOCCF 3152acc3bf34398cc3029a904de2d9cf [2,0,0,0,0,0|2,0,0]=4 3421 B8R0.4 CCSCCOCCS b961b22c97ebb3dca7d6d173dec4f531 [2,0,0,0,0,0|2,0,0]=4 3422 B8R0.4 CCSCCOCOC 82ae2d32858c1bccbdb00354afa21801 [2,0,0,0,0,0|2,0,0]=4 3423 B8R0.4 CCSCCOCSC c28324caa69bb59277d280a61ae231b9 [2,0,0,0,0,0|2,0,0]=4 3424 B8R0.4 COCCCOCCF 4ffb019798fea01253e3983e39a3b217 [2,0,0,0,0,0|2,0,0]=4 3425 B8R0.4 COCCCOCCS 034151073721ed7fced30d5c7d96809d [2,0,0,0,0,0|2,0,0]=4 3426 B8R0.4 COCCCOCOC 92047848dd3f717a8d9bb57dfbd960e0 [2,0,0,0,0,0|2,0,0]=4 3427 B8R0.4 COCCCOCSC 2202eb2dedd91ff1a10fe1f6f7568624 [2,0,0,0,0,0|2,0,0]=4 3428 B8R0.4 COCOCCCCF 439027e7cee7c83bc2a5d7479ed3ff0e [2,0,0,0,0,0|2,0,0]=4 3429 B8R0.4 COCOCCCCS 6711c3ede78b89314526970b63403a62 [2,0,0,0,0,0|2,0,0]=4 3430 B8R0.4 COCOCCCSC 06d84955d844cdd7598946b8ec70b891 [2,0,0,0,0,0|2,0,0]=4 3431 B8R0.4 CSCCCOCCF 05935ee408f5ed062eac02bc9adf2239 [2,0,0,0,0,0|2,0,0]=4 3432 B8R0.4 CSCCCOCCS 65d497f29e41e59af616450de8429e8f [2,0,0,0,0,0|2,0,0]=4 3433 B8R0.4 CSCCCOCSC 2c634a852737da83c464a5d2f75b1867 [2,0,0,0,0,0|2,0,0]=4 3434 B8R0.4 CSCOCCCCF 02a4eb12d2b76c8014e2d98697a6f3b3 [2,0,0,0,0,0|2,0,0]=4 3435 B8R0.4 CSCOCCCCS 973c96e0004f71ffadd877ed13fe3fbf [2,0,0,0,0,0|2,0,0]=4 3436 B8R0.4 FCCCCOCCF 17e41dc14ab54f79884ac156b3d1ba74 [2,0,0,0,0,0|2,0,0]=4 3437 B8R0.4 FCCCCOCCS e510e523279ca95973ccf48144b1bca7 [2,0,0,0,0,0|2,0,0]=4 3438 B8R0.4 FCCOCCCCS bc8da81f510b1c1aea4df0919b9f364c [2,0,0,0,0,0|2,0,0]=4 3439 B8R0.4 SCCCCOCCS 99ee8ef0ab9592fe877786d3b31651be [2,0,0,0,0,0|2,0,0]=4 3440 B8R0.6 C=C(CC)CNCCC 13f11be9634d172790672a2fd9a9840c [2,0,0,0,0,0|2,0,0]=4 3441 B8R0.6 C=C(CC)COCCC 9a03753bc1b5bbc7ba706f1688ccd4c0 [2,0,0,0,0,0|2,0,0]=4 3442 B8R0.6 C=C(CNCCC)OC 087b8e9db7c5cf69f544a95d2e04b5df [2,0,0,0,0,0|2,0,0]=4 3443 B8R0.6 C=C(COCCC)OC 35a576a479e84b27dbf4c71b4925086f [2,0,0,0,0,0|2,0,0]=4 3444 B8R0.6 CCC(=O)CNCCBr 4ae86c97534187fa67e366dfd1eebd3b [2,0,0,0,0,0|2,0,0]=4 3445 B8R0.6 CCC(=O)CNCCF 0bc469d08994cf5b5fbc36250b4ccf28 [2,0,0,0,0,0|2,0,0]=4 3446 B8R0.6 CCC(=O)CNCCI 652e280753f4ad7ee550469669c66e91 [2,0,0,0,0,0|2,0,0]=4 3447 B8R0.6 CCC(=O)CNCCO c42e5d5f257b37e8ba7acbbae4993f31 [2,0,0,0,0,0|2,0,0]=4 3448 B8R0.6 CCC(=O)CNCCS 5d6e1d449d9df5ddcd81a9e54a1f9bcc [2,0,0,0,0,0|2,0,0]=4 3449 B8R0.6 CCC(=O)COCCF 42452841604a6e08503574a608b88150 [2,0,0,0,0,0|2,0,0]=4 3450 B8R0.6 CCC(=O)COCCS 361d7f9395122f7ce5b0a13a0b0a8b7e [2,0,0,0,0,0|2,0,0]=4 3451 B8R0.6 CCC(=O)COCOC 2080604d4fba0b9d8e850f3f84775a84 [2,0,0,0,0,0|2,0,0]=4 3452 B8R0.6 CCC(=O)COCSC 20ce94165e7ab9ceae1e7c23a6d6840a [2,0,0,0,0,0|2,0,0]=4 3453 B8R0.6 CCC(=O)NCCCCl 8c01153ec31ae9cc62389708147e768e [2,0,0,0,0,0|2,0,0]=4 3454 B8R0.6 CCC(=O)NCCCO f98fa75986b7788f9e80577d0f4b70ab [2,0,0,0,0,0|2,0,0]=4 3455 B8R0.6 CCC(=O)NCCOC 23e877e020a2c5b2736fc6a95b7c4f02 [2,0,0,0,0,0|2,0,0]=4 3456 B8R0.6 CCC(=O)NCCSC c0f9bf4f85b22a82daaa8b7807daec1c [2,0,0,0,0,0|2,0,0]=4 3457 B8R0.6 CCCCCN(C)CC 9518c2300d9243488291f90365ee6acc [2,0,0,0,0,0|2,0,0]=4 3458 B8R0.6 CCCCNC(=O)CC 285e0c69f0d3b13983c95eed26c8d721 [2,0,0,0,0,0|1,0,0]=3 3459 B8R0.6 CCCCNC(=O)CF ccc4967a8e0a27400c7d0139924f7409 [2,0,0,0,0,0|2,0,0]=4 3460 B8R0.6 CCCCNC(=O)CO a7ebdf854bf2900347fbb690e8e35978 [2,0,0,0,0,0|2,0,0]=4 3461 B8R0.6 CCCCNC(=O)CS c89622d02eae8eb9fb1a47fc8bb6fb10 [2,0,0,0,0,0|2,0,0]=4 3462 B8R0.6 CCCNCC(=O)CC 5f434fb49a11666bfc9ba500f0cbcfca [2,0,0,0,0,0|1,0,0]=3 3463 B8R0.6 CCCNCC(=O)CO c0d2ea34a02dfba5aebbad6447271711 [2,0,0,0,0,0|2,0,0]=4 3464 B8R0.6 CCCNCC(=O)NC eb0d012f1c9ad7dec4f4287f037196b3 [2,0,0,0,0,0|2,0,0]=4 3465 B8R0.6 CCCNCC(=O)OC 3b0745436e6aac5047a752faa3629f9d [2,0,0,0,0,0|1,0,0]=3 3466 B8R0.6 CCCOCC(=O)CC 3f397a74b90866b03f1163a524097d68 [2,0,0,0,0,0|1,0,0]=3 3467 B8R0.6 CCCOCC(=O)NC 58f4813a2cc9a1be45793f06ebe468ea [2,0,0,0,0,0|2,0,0]=4 3468 B8R0.6 CCCOCC(=O)OC c6e77fb768013ea608698b73991c1be0 [2,0,0,0,0,0|1,0,0]=3 3469 B8R0.6 CCNCCC(=O)NC 1e9b17ee02ba0e5b6aaaa347b3dcbe57 [2,0,0,0,0,0|2,0,0]=4 3470 B8R0.6 CCNCCC(=O)OC bbd99f235af5ec44deb263c1fbced8c5 [2,0,0,0,0,0|1,0,0]=3 3471 B8R0.6 CCOCCC(=O)NC 04f56cfd8d6885a7e2cb20782e900533 [2,0,0,0,0,0|2,0,0]=4 3472 B8R0.6 CCOCCC(=O)OC 6c8ac8346f4b448f7b384f7ba30dc419 [2,0,0,0,0,0|1,0,0]=3 3473 B8R0.6 COC(=O)CCNCF c9ea88c8e4da792c48ff261f6679c953 [2,0,0,0,0,0|2,0,0]=4 3474 B8R0.6 COC(=O)CCNCO 9bc4822c35c94c877fc0ddc05b282774 [2,0,0,0,0,0|2,0,0]=4 3475 B8R0.6 COC(=O)CCOCF 2f015a84e5a71939cec0c0c38276031f [2,0,0,0,0,0|2,0,0]=4 3476 B8R0.6 COC(=O)CNCCBr e28aeca94e61f0de9c0ea2f9b9e87e88 [2,0,0,0,0,0|2,0,0]=4 3477 B8R0.6 COC(=O)CNCCF d4a8c2b68347ac06f3cf07a0af263386 [2,0,0,0,0,0|2,0,0]=4 3478 B8R0.6 COC(=O)CNCCI 45efb0e66cb53512c5450123a0571534 [2,0,0,0,0,0|2,0,0]=4 3479 B8R0.6 COC(=O)CNCCO 9abf03e13c5594ade083b34dd22b9514 [2,0,0,0,0,0|2,0,0]=4 3480 B8R0.6 COC(=O)CNCCS dafa382862b39c74b9bcdca9e45699c9 [2,0,0,0,0,0|2,0,0]=4 3481 B8R0.6 COC(=O)CNCSC 8f9e6be1c8a25920663107a786d297b6 [2,0,0,0,0,0|2,0,0]=4 3482 B8R0.6 COC(=O)COCCF 5fd538a27028a3025713a820ebe3ece9 [2,0,0,0,0,0|2,0,0]=4 3483 B8R0.6 COC(=O)COCCS 8cf490d3a85a4d72de5bf7120c96cf93 [2,0,0,0,0,0|2,0,0]=4 3484 B8R0.6 COC(=O)COCSC 0a7a5ae46e24085ed1063ee9467aa6ec [2,0,0,0,0,0|2,0,0]=4 3485 B8R0.6 COCNCC(=O)OC 418d993c7f5c594cafa954c9550f79e1 [2,0,0,0,0,0|2,0,0]=4 3486 B8R0.6 COCOCC(=O)OC 2b399bb8cae6f66d03fa8086bd2ee628 [2,0,0,0,0,0|2,0,0]=4 3487 B10R0.1 C#CCC(=O)NCCCCC 04dc362110f47aa68005f8f27e9f123f [1,1,0,0,0,0|0,0,2]=4 3488 B10R0.1 C#CCCCNC(=O)CCC 1e5aba94a15dbf62ea93232b53804dde [1,1,0,0,0,0|0,0,2]=4 3489 B10R0.1 C#CCCNCC(=O)CCC b89d15c3e2290d8fcd49f987532af107 [1,1,0,0,0,0|0,0,2]=4 3490 B10R0.1 C#CCCNCC(=O)OCC 660feaed428b78d4d9889f724ba89e6d [1,1,0,0,0,0|0,0,2]=4 3491 B10R0.1 C#CCCOCC(=O)CCC 4b16cb2cf69aa46b6e6a8c9c82f2cec9 [1,1,0,0,0,0|0,0,2]=4 3492 B10R0.1 C#CCCOCC(=O)OCC 8863e8ba2856bb97b173e3548b548c23 [1,1,0,0,0,0|0,0,2]=4 3493 B10R0.1 C#CCNCCC(=O)OCC e27d398c3827ebca8e68e815e8936e5d [1,1,0,0,0,0|0,0,2]=4 3494 B10R0.1 C#CCOCCC(=O)OCC 9c4ab5e11e2962f2970d8dc88491ff59 [1,1,0,0,0,0|0,0,2]=4 3495 B10R0.1 C/C=C/C(=O)NCCCCC 2f321928cc740d5db12c914a5b6ab6d1 [1,1,0,0,0,0|0,0,2]=4 3496 B10R0.1 C/C=C/CNCC(=O)OCC 3971c1466964639190b06b77f21694e6 [1,1,0,0,0,0|0,0,2]=4 3497 B10R0.1 C/C=C/COCC(=O)CCC e705dd41e10e42b7866df48e1ca92157 [1,1,0,0,0,0|0,0,2]=4 3498 B10R0.1 C/C=C/COCC(=O)OCC c4a5c491f257cf2590570911846cd739 [1,1,0,0,0,0|0,0,2]=4 3499 B10R0.1 C/C=C\CNCC(=O)OCC 81a2937d3e1606796de18eacc70c2e46 [1,1,0,0,0,0|0,0,2]=4 3500 B10R0.1 C/C=C\COCC(=O)CCC 8bf6bfccd0bb73cc8d5f50cefcee622b [1,1,0,0,0,0|0,0,2]=4 3501 B10R0.1 C/C=C\COCC(=O)OCC 9ac79a3ef898c8e8f64d66a3f23e6f21 [1,1,0,0,0,0|0,0,2]=4 3502 B10R0.1 C=CCC(=O)NCCCCC 60936a96866426d775857d450c7aa644 [1,1,0,0,0,0|0,0,2]=4 3503 B10R0.1 C=CCCCNC(=O)CCC 36add1eb0b637534ddbc7b909527399d [1,1,0,0,0,0|0,0,2]=4 3504 B10R0.1 C=CCCNCC(=O)CCC ec695e02d29ced9756cce2a57165ab66 [1,1,0,0,0,0|0,0,2]=4 3505 B10R0.1 C=CCCNCC(=O)OCC 3a60ac770644bf8bec6c57beac87737b [1,1,0,0,0,0|0,0,2]=4 3506 B10R0.1 C=CCCOCC(=O)CCC 5fa19dac02f4734efaaffc6177d1b445 [1,1,0,0,0,0|0,0,2]=4 3507 B10R0.1 C=CCCOCC(=O)OCC ca2a012c9c19ec05860d3b7f4ff94511 [1,1,0,0,0,0|0,0,2]=4 3508 B10R0.1 C=CCNCCC(=O)OCC b27ea27ad794acb73774bcb886627aa9 [1,1,0,0,0,0|0,0,2]=4 3509 B10R0.1 C=CCOCCC(=O)OCC 3ac4b62ca23069a0ea5e50f1a30c29b0 [1,1,0,0,0,0|0,0,2]=4 3510 B10R0.1 C=COC(=O)CNCCCC dae1382989b40ea758400263a4cea49d [1,1,0,0,0,0|0,0,2]=4 3511 B10R0.1 C=COC(=O)COCCCC b0f56a6903bffaeb0bb0ceeee20fb975 [1,1,0,0,0,0|0,0,2]=4 3512 B10R0.1 CC#CC(=O)NCCCCC 2e0c3a2c2b59180c16266b5fc6ade442 [1,1,0,0,0,0|0,0,2]=4 3513 B10R0.1 CC#CCNCC(=O)CCC d5c90d6368945fb250c673b2cec0c49f [1,1,0,0,0,0|0,0,2]=4 3514 B10R0.1 CC#CCNCC(=O)OCC 480c6e31167bd0137981aeddc5911464 [1,1,0,0,0,0|0,0,2]=4 3515 B10R0.1 CC#CCOCC(=O)CCC b631437fcbe06f5bf58285241b38365a [1,1,0,0,0,0|0,0,2]=4 3516 B10R0.1 CC#CCOCC(=O)OCC 818491b4253c8cf44b6fb0df5828001c [1,1,0,0,0,0|0,0,2]=4 3517 B10R0.1 CC=CCNCC(=O)CCC 82640ac2c5fa5f7a65f6439c940d2283 [1,1,0,0,0,0|0,0,2]=4 3518 B10R0.1 CC=CCNCC(=O)OCC 6ee97b5c39a02117843fc083e4a99768 [1,1,0,0,0,0|0,0,2]=4 3519 B10R0.1 CC=CCOCC(=O)CCC 8f6ba979a3d95982df241a72b750c80a [1,1,0,0,0,0|0,0,2]=4 3520 B10R0.1 CC=CCOCC(=O)OCC 519288c260291b5ecd988148a2e2aaa1 [1,1,0,0,0,0|0,0,2]=4 3521 B10R0.1 CCCC(=O)CNCCC#N c906abeb0acd59261d6b48e3a839571c [1,1,0,0,0,0|1,0,1]=4 3522 B10R0.1 CCCC(=O)CNCCCCl c0f1363d0e8689562363b48372f1c1fb [1,1,0,0,0,0|1,0,0]=3 3523 B10R0.1 CCCC(=O)CNCCCO af23909a43cb4df58e0bd24d961ffff2 [1,1,0,0,0,0|1,0,0]=3 3524 B10R0.1 CCCC(=O)CNCCOC 317e67aceabfbe7a232fb2e03d7a50fc [1,1,0,0,0,0|1,0,0]=3 3525 B10R0.1 CCCC(=O)CNCCON ec45a05a1a39129911970a8874e7fab4 [1,1,0,0,0,0|2,0,0]=4 3526 B10R0.1 CCCC(=O)CNCCSC 3695c07515b783531beb51fbbf72d8bd [1,1,0,0,0,0|1,0,0]=3 3527 B10R0.1 CCCC(=O)COCCC#N de2911d958dfedb1968ade1bc892e1fd [1,1,0,0,0,0|1,0,1]=4 3528 B10R0.1 CCCC(=O)COCCC=O a3f44f7038af8e0629e44e7280315658 [1,1,0,0,0,0|1,0,1]=4 3529 B10R0.1 CCCC(=O)COCCCF 62bf1ed7b351b58b6ed0990794725915 [1,1,0,0,0,0|1,0,0]=3 3530 B10R0.1 CCCC(=O)COCCCS 019fcf2db5438ee1091d1c151725150a [1,1,0,0,0,0|1,0,0]=3 3531 B10R0.1 CCCC(=O)COCCOC a601e67880a5e9a5fc70d75a9a8aab5b [1,1,0,0,0,0|1,0,0]=3 3532 B10R0.1 CCCC(=O)COCCSC bb4a6374ae7cadeee3ba62422eca67c7 [1,1,0,0,0,0|1,0,0]=3 3533 B10R0.1 CCCC(=O)NCCCC#N cf2eb2b08ac770f0ecc60b81767531c8 [1,1,0,0,0,0|1,0,1]=4 3534 B10R0.1 CCCC(=O)NCCCCCl f671a3330fe2c47b146f725c22547753 [1,1,0,0,0,0|1,0,0]=3 3535 B10R0.1 CCCC(=O)NCCCCO 5dcc5934786fd672ded2e88e6ca59c07 [1,1,0,0,0,0|1,0,0]=3 3536 B10R0.1 CCCC(=O)NCCCCS 4ffd987e848f5ce52a73d93f5062b35c [1,1,0,0,0,0|1,0,0]=3 3537 B10R0.1 CCCC(=O)NCCCOC 7712654c76c69518ffc7db7f1c70c47f [1,1,0,0,0,0|1,0,0]=3 3538 B10R0.1 CCCC(=O)NCCCSC 0162770f8d54f07949cd04a73d25d9ee [1,1,0,0,0,0|1,0,0]=3 3539 B10R0.1 CCCC(=O)NCCOCC 79d9b92616c769d2cdcd747927c60328 [1,1,0,0,0,0|1,0,0]=3 3540 B10R0.1 CCCC(=O)NCCSCC 80b0e19972a11cccc458980ea52b2299 [1,1,0,0,0,0|1,0,0]=3 3541 B10R0.1 CCCC(=O)OCCOCC 9a285a2c378d3b3e5e911c97d35a22b7 [1,1,0,0,0,0|1,0,0]=3 3542 B10R0.1 CCCC(=O)OCCOCF 3c9e2aeba7aac381e328973102e6b518 [1,1,0,0,0,0|2,0,0]=4 3543 B10R0.1 CCCC(=O)OCNCCBr 30734e62ea61515bfcd7b9963185a180 [1,1,0,0,0,0|2,0,0]=4 3544 B10R0.1 CCCC(=O)OCNCCF 9461371387da09d32e1a124fabb3128d [1,1,0,0,0,0|2,0,0]=4 3545 B10R0.1 CCCC(=O)OCNCCI 10e5dfc9291f4d6a52bef8bfbd46ea72 [1,1,0,0,0,0|2,0,0]=4 3546 B10R0.1 CCCC(=O)OCNCCO a51bae12876ca95add56b81db6ac58f9 [1,1,0,0,0,0|2,0,0]=4 3547 B10R0.1 CCCC(=O)OCNCCS e8f339d65a1c2e70198227e13ce11765 [1,1,0,0,0,0|2,0,0]=4 3548 B10R0.1 CCCC(=O)OCOCCS fc6fc7ed68bb3d8ebc4097c031c4d7b2 [1,1,0,0,0,0|2,0,0]=4 3549 B10R0.1 CCCC(=O)OCOCOC fbb7c8e9294a5d705a5a9e62492b2491 [1,1,0,0,0,0|2,0,0]=4 3550 B10R0.1 CCCC(=S)OCCCCF a87f2db53eb48cbc176427ca92313c59 [1,1,0,0,0,0|1,1,0]=4 3551 B10R0.1 CCCC(=S)OCCCOC 0f4db520c0f579ec24c237eea823c892 [1,1,0,0,0,0|1,1,0]=4 3552 B10R0.1 CCCC(=S)OCCCSC 12882614c3d678eebfd0f7f1164a7738 [1,1,0,0,0,0|1,1,0]=4 3553 B10R0.1 CCCC(=S)OCCOCC a1bd1ecdf3a74bbe1c29303e11aeb9ee [1,1,0,0,0,0|1,1,0]=4 3554 B10R0.1 CCCC(=S)OCCSCC 57566a2b28663af6eed39d2cf1b8b53f [1,1,0,0,0,0|1,1,0]=4 3555 B10R0.1 CCCC(C)CCCOCC b730bf7a00ffbf0ead7383036ed439dc [1,1,0,0,0,0|1,0,1]=4 3556 B10R0.1 CCCCCCC(C)OCC d985d856010a7b8ef992ad40f7161b3e [1,1,0,0,0,0|1,0,1]=4 3557 B10R0.1 CCCCCCN(C)CCC d9be85fa1ca3cb2603bb497abfd54e2f [1,1,0,0,0,0|2,0,0]=4 3558 B10R0.1 CCCCCC[C@@H](C)OCC af575d78eb64c4272362170d1037dd2d [1,1,0,0,0,0|1,0,1]=4 3559 B10R0.1 CCCCCC[C@H](C)OCC 2bb6b456a8080df3ef2c68e70ba1062c [1,1,0,0,0,0|1,0,1]=4 3560 B10R0.1 CCCCCNC(=O)CC#N 2c6db1124ce6a3f337f9bf4b0c262cef [1,1,0,0,0,0|1,0,1]=4 3561 B10R0.1 CCCCCNC(=O)CC=O 36f9b6b1d9882210ce52718d5f372ace [1,1,0,0,0,0|1,0,1]=4 3562 B10R0.1 CCCCCNC(=O)CCC cd3617b761f054cae655d3c214537a01 [1,1,0,0,0,0|0,0,0]=2 3563 B10R0.1 CCCCCNC(=O)CCF 8f55dcb051c9e4fa4d8e7353d886739d [1,1,0,0,0,0|1,0,0]=3 3564 B10R0.1 CCCCCNC(=O)CCO e4a8972fa724b6f0f9b4d6b3c835d2fb [1,1,0,0,0,0|1,0,0]=3 3565 B10R0.1 CCCCCNC(=O)CCS 3733c740ac8be76287971250e938eadf [1,1,0,0,0,0|1,0,0]=3 3566 B10R0.1 CCCCCNC(=O)COC 3c827a5b8568a226ab9d7a96910886e4 [1,1,0,0,0,0|1,0,0]=3 3567 B10R0.1 CCCCCNC(=O)CON d7cee1de03fd51e11ccb46eda36a2cba [1,1,0,0,0,0|2,0,0]=4 3568 B10R0.1 CCCCCNC(=O)CSC a633d95815fa33f04c44be165a312304 [1,1,0,0,0,0|1,0,0]=3 3569 B10R0.1 CCCCCNC(C)CCC 26d51ec122f46d71a5a747b600912d97 [1,1,0,0,0,0|1,0,1]=4 3570 B10R0.1 CCCCCN[C@@H](C)CCC e8a554d0748c7efb659626f73b094a1c [1,1,0,0,0,0|1,0,1]=4 3571 B10R0.1 CCCCCOC(=S)CCC e70fcd071a998201c96ff7af83897208 [1,1,0,0,0,0|0,1,0]=3 3572 B10R0.1 CCCCCOC(C)CCC 95598e4482fa2acf5532e4fa9a6ad6e3 [1,1,0,0,0,0|1,0,1]=4 3573 B10R0.1 CCCCCO[C@@H](C)CCC d796f1fbb42029d496f1afefad90a0c9 [1,1,0,0,0,0|1,0,1]=4 3574 B10R0.1 CCCCCO[C@H](C)CCC 8ec1919c97beba8a5a1b87817d43e6ed [1,1,0,0,0,0|1,0,1]=4 3575 B10R0.1 CCCCNCC(=O)CCC 453fddd4efd403580a47150fb6a1b943 [1,1,0,0,0,0|0,0,0]=2 3576 B10R0.1 CCCCNCC(=O)COC c8c6b69bbcb048c0297d4859878c7a37 [1,1,0,0,0,0|1,0,0]=3 3577 B10R0.1 CCCCNCC(=O)NCC a218683c63b1bb6bc4fada805a19d3fa [1,1,0,0,0,0|1,0,0]=3 3578 B10R0.1 CCCCNCC(=O)NCO b25b38657c9f4e44ec96d205ddf4ac94 [1,1,0,0,0,0|2,0,0]=4 3579 B10R0.1 CCCCNCC(=O)OCC b97c56bc755b41308bd27845c7930d51 [1,1,0,0,0,0|0,0,0]=2 3580 B10R0.1 CCCCNCC(C)CCC 4f59e86f407e5a8df9a836ce6955135c [1,1,0,0,0,0|1,0,1]=4 3581 B10R0.1 CCCCNCC(C)OCC 4de8c7dc25725cb634524f80ed919150 [1,1,0,0,0,0|1,0,1]=4 3582 B10R0.1 CCCCNCC(O)CCC 6bd7c0c81aa28ae46438b3751e240977 [1,1,0,0,0,0|0,0,2]=4 3583 B10R0.1 CCCCOCC(=O)CCC 3c18382cf685be3b48662cc000c9f11f [1,1,0,0,0,0|0,0,0]=2 3584 B10R0.1 CCCCOCC(=O)COC 5492555264028ec97fd6f9a9065a58cf [1,1,0,0,0,0|1,0,0]=3 3585 B10R0.1 CCCCOCC(=O)NCC 1a816a8692edc4d39f6404d2712f2a39 [1,1,0,0,0,0|1,0,0]=3 3586 B10R0.1 CCCCOCC(=O)OCC b9d8b0969b606fca5e0d886f04b1b9a2 [1,1,0,0,0,0|0,0,0]=2 3587 B10R0.1 CCCCOCC(C)CCC 2a98bf460dddd7a4e9e45b8087a55eec [1,1,0,0,0,0|1,0,1]=4 3588 B10R0.1 CCCCOCC(C)OCC 3ab5d2e9e6f4b5b74f864cb73992a7a5 [1,1,0,0,0,0|1,0,1]=4 3589 B10R0.1 CCCCOCN(C)CCC 7f0f02d15a6378bca5e117d267dfb251 [1,1,0,0,0,0|2,0,0]=4 3590 B10R0.1 CCCN(C)CCCCCF e27148d9b567bda8627914ddddba069e [1,1,0,0,0,0|2,0,0]=4 3591 B10R0.1 CCCN(C)CCCCCO 4305d20a6b59bd375a5c9f2aff4c3e85 [1,1,0,0,0,0|2,0,0]=4 3592 B10R0.1 CCCN(C)CCCCOC 52b72a006a739a10a24b19f85b688dc4 [1,1,0,0,0,0|2,0,0]=4 3593 B10R0.1 CCCN(C)CCCOCC 20c3397d24eae637873a4f5d643c09c9 [1,1,0,0,0,0|2,0,0]=4 3594 B10R0.1 CCCN(C)CCCSCC 593a584b9c4c03f38d1af6272b329652 [1,1,0,0,0,0|2,0,0]=4 3595 B10R0.1 CCCNCCC(=O)NCC fed5cf7995e8bcb3cb088a7324683334 [1,1,0,0,0,0|1,0,0]=3 3596 B10R0.1 CCCNCCC(=O)OCC a5eca5b369834181d5c681e73bc5df58 [1,1,0,0,0,0|0,0,0]=2 3597 B10R0.1 CCCNCOC(=O)CCC 38cbf3506e155a3e433f65aa13f4e89b [1,1,0,0,0,0|1,0,0]=3 3598 B10R0.1 CCCNCOC(=O)OCC dd5fb1e82de8f1385da13ffd886652b3 [1,1,0,0,0,0|1,0,0]=3 3599 B10R0.1 CCCNCOC(=O)SCC afe6d13e5e63696216df6a5e42e8e018 [1,1,0,0,0,0|1,1,0]=4 3600 B10R0.1 CCCOCCC(=O)NCC 716a0638bd662663b8cdb9317f882e86 [1,1,0,0,0,0|1,0,0]=3 3601 B10R0.1 CCCOCCC(=O)OCC 7807b520106a1db433af53f99cc9cebe [1,1,0,0,0,0|0,0,0]=2 3602 B10R0.1 CCCOCCC(C)CCC 812492a8a2e3acbfb23fcbf69f497277 [1,1,0,0,0,0|1,0,1]=4 3603 B10R0.1 CCCOCCC(S)CCC 34887f963efbb0e38cbd0aa64aac796a [1,1,0,0,0,0|0,1,1]=4 3604 B10R0.1 CCCOCCN(C)CCC 5eb3e46db7d815edc5f72115f2c5c89a [1,1,0,0,0,0|2,0,0]=4 3605 B10R0.1 CCCOCOC(=O)CCC ae34f309fddde79fb1b78768c738001e [1,1,0,0,0,0|1,0,0]=3 3606 B10R0.1 CCCOCOC(=O)OCC 00ffc636bc87edde518c508ef349454a [1,1,0,0,0,0|1,0,0]=3 3607 B10R0.1 CCCOCOC(=O)SCC db970673b3d242e11b09ecfcd7404053 [1,1,0,0,0,0|1,1,0]=4 3608 B10R0.1 CCNC(=O)CCNCCBr 1f9f558ea0de59ec698c5b67ba5623ce [1,1,0,0,0,0|2,0,0]=4 3609 B10R0.1 CCNC(=O)CCNCCF 82959926fc183ffc716d32c678e2c23d [1,1,0,0,0,0|2,0,0]=4 3610 B10R0.1 CCNC(=O)CCNCCI 101df6ecad4367a58835c04b1c924da9 [1,1,0,0,0,0|2,0,0]=4 3611 B10R0.1 CCNC(=O)CCNCCO 95ddb3d67ac0bdfce705a73f9d453a8e [1,1,0,0,0,0|2,0,0]=4 3612 B10R0.1 CCNC(=O)CCNCCS 0d4fd3cb336aa80e1aad1db2b5bf3e2d [1,1,0,0,0,0|2,0,0]=4 3613 B10R0.1 CCNC(=O)CCOCCF 7addcb151c86a7c713faa772efeaa04d [1,1,0,0,0,0|2,0,0]=4 3614 B10R0.1 CCNC(=O)CCOCCS 0808f4844e9a005d537d9ac8fa1c8dfc [1,1,0,0,0,0|2,0,0]=4 3615 B10R0.1 CCNC(=O)CCOCOC b6e45b946a4bf02c749b7fac80392b93 [1,1,0,0,0,0|2,0,0]=4 3616 B10R0.1 CCNC(=O)CNCCCCl 9c6ff97864b49d8396431c4ce76be751 [1,1,0,0,0,0|2,0,0]=4 3617 B10R0.1 CCNC(=O)CNCCCF c615c71e5423fe3e8cbc404021a795fd [1,1,0,0,0,0|2,0,0]=4 3618 B10R0.1 CCNC(=O)CNCCCO 2aa5f1a756a42010184170770de4d7d0 [1,1,0,0,0,0|2,0,0]=4 3619 B10R0.1 CCNC(=O)CNCCCS 14189159b6b162ee43ca614708d9c1f8 [1,1,0,0,0,0|2,0,0]=4 3620 B10R0.1 CCNC(=O)CNCCOC 4e9254754734005634aa080be5064dfa [1,1,0,0,0,0|2,0,0]=4 3621 B10R0.1 CCNC(=O)CNCCSC 921582e620bc9744c65977bc790d2e82 [1,1,0,0,0,0|2,0,0]=4 3622 B10R0.1 CCNC(=O)CNCOCC 49effb3200ea90688c3d30f56a60cc04 [1,1,0,0,0,0|2,0,0]=4 3623 B10R0.1 CCNC(=O)COCCCF 6879e55a53a664dbfdf20f5ed4986686 [1,1,0,0,0,0|2,0,0]=4 3624 B10R0.1 CCNC(=O)COCCCS 09f971483aba30f1c8cfc0f9bb6ee313 [1,1,0,0,0,0|2,0,0]=4 3625 B10R0.1 CCNC(=O)COCCOC 126af58aa417d53e2decba7593c648a0 [1,1,0,0,0,0|2,0,0]=4 3626 B10R0.1 CCNC(=O)COCCSC deaff2a084443a15847ffbe142fafa63 [1,1,0,0,0,0|2,0,0]=4 3627 B10R0.1 CCNC(=O)COCOCC 10ced6eb548f01ba9d4a8f1cb1adaad1 [1,1,0,0,0,0|2,0,0]=4 3628 B10R0.1 CCNCCCC(=O)OCC ec7ea6af2e873221783738c3262f1017 [1,1,0,0,0,0|0,0,0]=2 3629 B10R0.1 CCOC(=O)CCCNC#N d6e7b2fae15ad2a6cffad306ff78c620 [1,1,0,0,0,0|1,0,1]=4 3630 B10R0.1 CCOC(=O)CCCNC=O 86a05c2160bc257b0fc4adb3a0dc4189 [1,1,0,0,0,0|1,0,1]=4 3631 B10R0.1 CCOC(=O)CCCNCF d252d1ad95be1be46de00f0a62c87a26 [1,1,0,0,0,0|1,0,0]=3 3632 B10R0.1 CCOC(=O)CCCNCO 6ad8e394886b5bbcf235085ec2778bb5 [1,1,0,0,0,0|1,0,0]=3 3633 B10R0.1 CCOC(=O)CCCOCF ec36e0805bbb2fa958b8522cdcebce6e [1,1,0,0,0,0|1,0,0]=3 3634 B10R0.1 CCOC(=O)CCNCC#N d4f83c196bb5cc36b4e50a4068f62934 [1,1,0,0,0,0|1,0,1]=4 3635 B10R0.1 CCOC(=O)CCNCC=O f69e364b5cadae09b04a32eac9d6dbc6 [1,1,0,0,0,0|1,0,1]=4 3636 B10R0.1 CCOC(=O)CCNCCBr dc62d6e6989f38d8a1c9086df109dd58 [1,1,0,0,0,0|1,0,0]=3 3637 B10R0.1 CCOC(=O)CCNCCF a126fe35bf21d7af24142127a9d7b487 [1,1,0,0,0,0|1,0,0]=3 3638 B10R0.1 CCOC(=O)CCNCCI ebee6740df89e11a56f6ab71aafb9dee [1,1,0,0,0,0|1,0,0]=3 3639 B10R0.1 CCOC(=O)CCNCCO c103a6e0970c0aff3c29210fe93324f0 [1,1,0,0,0,0|1,0,0]=3 3640 B10R0.1 CCOC(=O)CCNCCS aec7d2f9c68c53cea47927e128d7b562 [1,1,0,0,0,0|1,0,0]=3 3641 B10R0.1 CCOC(=O)CCNCOC ddf32b15df8cba89ca9d021c4d1d593d [1,1,0,0,0,0|1,0,0]=3 3642 B10R0.1 CCOC(=O)CCNCSC 84d439c9c270311224f102ed64d933ea [1,1,0,0,0,0|1,0,0]=3 3643 B10R0.1 CCOC(=O)CCOCC#N c3ec52627dbb213144b8c8f498da6529 [1,1,0,0,0,0|1,0,1]=4 3644 B10R0.1 CCOC(=O)CCOCC=O 6d15dd620e80b8f0e6d73840ed17e4b9 [1,1,0,0,0,0|1,0,1]=4 3645 B10R0.1 CCOC(=O)CCOCCF 925e99a249fc8f5a48f8ddf51d1e6a35 [1,1,0,0,0,0|1,0,0]=3 3646 B10R0.1 CCOC(=O)CCOCCS c7efa8542dc4c5340c321502afe56ef8 [1,1,0,0,0,0|1,0,0]=3 3647 B10R0.1 CCOC(=O)CCOCOC e943a6c684e4e08ca5cc5bedbbbf4d1e [1,1,0,0,0,0|1,0,0]=3 3648 B10R0.1 CCOC(=O)CCOCSC 688997c505935e69c875e06b92c7ccc8 [1,1,0,0,0,0|1,0,0]=3 3649 B10R0.1 CCOC(=O)CNCCC#N c13950e951453850d17910e30815e667 [1,1,0,0,0,0|1,0,1]=4 3650 B10R0.1 CCOC(=O)CNCCC=O fc68b9ee2ea09eabacf0c854c56ee901 [1,1,0,0,0,0|1,0,1]=4 3651 B10R0.1 CCOC(=O)CNCCCCl 2a7d72348462cab84c46344b34c99ac2 [1,1,0,0,0,0|1,0,0]=3 3652 B10R0.1 CCOC(=O)CNCCCF 2b17c80de5b67443357ab9181868ea7a [1,1,0,0,0,0|1,0,0]=3 3653 B10R0.1 CCOC(=O)CNCCCO e6ca78830304e337859e0c6e5fd7adb3 [1,1,0,0,0,0|1,0,0]=3 3654 B10R0.1 CCOC(=O)CNCCCS be6e7e8ea1ad129a71f56a17397bacd9 [1,1,0,0,0,0|1,0,0]=3 3655 B10R0.1 CCOC(=O)CNCCOC 193cf4f6f69e813ac1a6ad1d465b4cf0 [1,1,0,0,0,0|1,0,0]=3 3656 B10R0.1 CCOC(=O)CNCCON 2e72187cf373a1557b567cd873bfac00 [1,1,0,0,0,0|2,0,0]=4 3657 B10R0.1 CCOC(=O)CNCCSC 97cf95347670bdca8ae7f4a58822476d [1,1,0,0,0,0|1,0,0]=3 3658 B10R0.1 CCOC(=O)COCCC#N 04950e5c4cb812c9b61f39b34be451f0 [1,1,0,0,0,0|1,0,1]=4 3659 B10R0.1 CCOC(=O)COCCC=O 325f694203bab272759ae406db84a6be [1,1,0,0,0,0|1,0,1]=4 3660 B10R0.1 CCOC(=O)COCCCF 9db06f731f4e085bb967620bc40e73c5 [1,1,0,0,0,0|1,0,0]=3 3661 B10R0.1 CCOC(=O)COCCCS 910154b5a69cb476fce331dfd79628e5 [1,1,0,0,0,0|1,0,0]=3 3662 B10R0.1 CCOC(=O)COCCOC 8d9669626e8f41a69132fe558212487f [1,1,0,0,0,0|1,0,0]=3 3663 B10R0.1 CCOC(=O)COCCSC 68d82d823b73c14bf81455b24058a7e8 [1,1,0,0,0,0|1,0,0]=3 3664 B10R0.1 CCOC(=O)OCNCCBr a61ffdc0f93223afd6057dc21cb45d66 [1,1,0,0,0,0|2,0,0]=4 3665 B10R0.1 CCOC(=O)OCNCCF 2c7106c293115ac97d34a3ad49a8a2f3 [1,1,0,0,0,0|2,0,0]=4 3666 B10R0.1 CCOC(=O)OCNCCI 5c08bb8871acb4665eefbedb8465a7af [1,1,0,0,0,0|2,0,0]=4 3667 B10R0.1 CCOC(=O)OCNCCO 41ff48df0b0b1bb9ae91f5c7f14f3eb2 [1,1,0,0,0,0|2,0,0]=4 3668 B10R0.1 CCOC(=O)OCNCCS 4284da6d1820be51ec95046775df3a83 [1,1,0,0,0,0|2,0,0]=4 3669 B10R0.1 CCOC(=O)OCOCCS 837640ad7e95b1ea09b0e9bd60b58cce [1,1,0,0,0,0|2,0,0]=4 3670 B10R0.1 CCOC(=O)OCOCOC 980e31dc6b923991b3b50a858a6c660c [1,1,0,0,0,0|2,0,0]=4 3671 B10R0.1 CCOC/C=C/C(=O)OCC 235a92a77305524a7cdb188642fea70a [1,1,0,0,0,0|0,0,2]=4 3672 B10R0.1 CCOCC#CC(=O)OCC fa98a4ed6bedc855f202954d918a08cd [1,1,0,0,0,0|0,0,2]=4 3673 B10R0.1 CCOCCCC(=O)OCC 065e688430f5956cbb53aefa5e1e9a90 [1,1,0,0,0,0|0,0,0]=2 3674 B10R0.1 CCOCCNC(=O)CCF 30ff3d1e0d42d88b890503467a1d0faf [1,1,0,0,0,0|2,0,0]=4 3675 B10R0.1 CCOCCNC(=O)CCO 07fe0269889c2bb3a011a39b226f32c2 [1,1,0,0,0,0|2,0,0]=4 3676 B10R0.1 CCOCCNC(=O)CCS ba9fc205a8abbd5100b90e72fc8022c0 [1,1,0,0,0,0|2,0,0]=4 3677 B10R0.1 CCOCCNC(=O)COC 78fcea0c24a356c716c115100dc7a09f [1,1,0,0,0,0|2,0,0]=4 3678 B10R0.1 CCOCCNC(=O)CSC cc96c76b4bd9e83a7fed71cad246cb3d [1,1,0,0,0,0|2,0,0]=4 3679 B10R0.1 CCOCNCC(=O)OCC 2155e3c18af0c68bcd17bcd5f7780a07 [1,1,0,0,0,0|1,0,0]=3 3680 B10R0.1 CCOCOCC(=O)OCC 91dce8a6e34fa8cace96e79585b8811b [1,1,0,0,0,0|1,0,0]=3 3681 B10R0.1 CCSCCNC(=O)CCF 546f28f99d32729a57edd07a91f6d52b [1,1,0,0,0,0|2,0,0]=4 3682 B10R0.1 CCSCCNC(=O)CCO cdd7f8211b4e390617f39925d56f3718 [1,1,0,0,0,0|2,0,0]=4 3683 B10R0.1 CCSCCNC(=O)CCS 7c9b93abf3ea2c2a2c588739c4cb7bac [1,1,0,0,0,0|2,0,0]=4 3684 B10R0.1 CCSCCNC(=O)COC a19b0a93f49032c26f16e852a9c205d9 [1,1,0,0,0,0|2,0,0]=4 3685 B10R0.1 CCSCCNC(=O)CSC b409c0a5f6b4d3adf33fab235d1c16f6 [1,1,0,0,0,0|2,0,0]=4 3686 B10R0.1 COCC(=O)CNCCCCl e476564fc0a2f95dcef903ebdce2f326 [1,1,0,0,0,0|2,0,0]=4 3687 B10R0.1 COCC(=O)CNCCCO 181e49546b4568ff81ba4a23379b051f [1,1,0,0,0,0|2,0,0]=4 3688 B10R0.1 COCC(=O)CNCCSC 6d8487c66282ea54445d91293acf57db [1,1,0,0,0,0|2,0,0]=4 3689 B10R0.1 COCC(=O)COCCCF 1efac76f6d965af83427c8cd3db40039 [1,1,0,0,0,0|2,0,0]=4 3690 B10R0.1 COCC(=O)COCCSC c326bd99d2ec3dca71ebad02c9717b24 [1,1,0,0,0,0|2,0,0]=4 3691 B10R0.1 COCC(=O)NCCCCCl bf98da29268c6c731a21be48ca575909 [1,1,0,0,0,0|2,0,0]=4 3692 B10R0.1 COCC(=O)NCCCCO 9788392c77d4b9388dfcec5602286f1d [1,1,0,0,0,0|2,0,0]=4 3693 B10R0.1 COCC(=O)NCCCCS 575c3c3b4fc3fe0df2c117d292232b27 [1,1,0,0,0,0|2,0,0]=4 3694 B10R0.1 COCC(=O)NCCCSC 484918eb6915e305a98942cd577ff66d [1,1,0,0,0,0|2,0,0]=4 3695 B10R0.1 COCCCNC(=O)CCF 07ad89282b12d855b19aea54b65f7037 [1,1,0,0,0,0|2,0,0]=4 3696 B10R0.1 COCCCNC(=O)CCO 82a3671f6ca25e1924fb0d12d2c00443 [1,1,0,0,0,0|2,0,0]=4 3697 B10R0.1 COCCCNC(=O)CCS eb8f8b417a7b6ca67973a0cb951e1903 [1,1,0,0,0,0|2,0,0]=4 3698 B10R0.1 COCCCNC(=O)COC a95f3d1c56fc9699b3e78feef59d36ec [1,1,0,0,0,0|2,0,0]=4 3699 B10R0.1 COCCCNC(=O)CSC c5cb8f5af4ec02bc1896a3f0c0a40533 [1,1,0,0,0,0|2,0,0]=4 3700 B10R0.1 COCCNCC(=O)COC b30201e812a2f048184ce17922389d36 [1,1,0,0,0,0|2,0,0]=4 3701 B10R0.1 COCCOCC(=O)COC 8482545c4e53647501dc212160973072 [1,1,0,0,0,0|2,0,0]=4 3702 B10R0.1 CSCC(=O)NCCCCCl d28cebc86c70f68b723b95fa8a51740d [1,1,0,0,0,0|2,0,0]=4 3703 B10R0.1 CSCC(=O)NCCCCO b5716720caa9ef6737a301802ba2bb6d [1,1,0,0,0,0|2,0,0]=4 3704 B10R0.1 CSCC(=O)NCCCCS 0946012f9eefb75ee640ee74283678f3 [1,1,0,0,0,0|2,0,0]=4 3705 B10R0.1 CSCCCNC(=O)CCF 836c8274edab8263bfb65d176ae9a745 [1,1,0,0,0,0|2,0,0]=4 3706 B10R0.1 CSCCCNC(=O)CCO b1a9b2a734ea204292bf17a713e67108 [1,1,0,0,0,0|2,0,0]=4 3707 B10R0.1 CSCCCNC(=O)CCS ec915c99e64127ae48269170511ca292 [1,1,0,0,0,0|2,0,0]=4 3708 B10R0.1 CSCCCNC(=O)CSC df4e66fa8a1d90beb12e79e61332cd13 [1,1,0,0,0,0|2,0,0]=4 3709 B10R0.1 O=C(CCF)NCCCCCl da4326635e79533dd9f88241957bd62b [1,1,0,0,0,0|2,0,0]=4 3710 B10R0.1 O=C(CCF)NCCCCO 7ca3d07f8aa6c3791730aa748f304038 [1,1,0,0,0,0|2,0,0]=4 3711 B10R0.1 O=C(CCF)NCCCCS dc9c03eef229da864a0075977eb454f4 [1,1,0,0,0,0|2,0,0]=4 3712 B10R0.1 O=C(CCO)NCCCCCl feeb571388f6c0dca819e020bdd3b7aa [1,1,0,0,0,0|2,0,0]=4 3713 B10R0.1 O=C(CCO)NCCCCO eb8190f503184dce54f6503361fba3c2 [1,1,0,0,0,0|2,0,0]=4 3714 B10R0.1 O=C(CCO)NCCCCS fcdf16f99c7b22054491ea7f6b6ffbaa [1,1,0,0,0,0|2,0,0]=4 3715 B10R0.1 O=C(CCS)NCCCCCl 7848a4967d9fe44f8a74667860e19313 [1,1,0,0,0,0|2,0,0]=4 3716 B10R0.1 O=C(CCS)NCCCCO b8d3238d1c88465a91908b8a194ebaf3 [1,1,0,0,0,0|2,0,0]=4 3717 B10R0.1 O=C(CCS)NCCCCS 52d8805717368edb54f0ed297ea0dde5 [1,1,0,0,0,0|2,0,0]=4 3718 B10R0.2 CCCC(=O)CN(C)CCC ed9faa47710b4c8cbd4da864234d5bf1 [1,1,0,0,0,0|1,0,0]=3 3719 B10R0.2 CCCC(=O)CN(C)CCF 1ab4b1ae72c6b5ea5e90bd5dde4627ec [1,1,0,0,0,0|2,0,0]=4 3720 B10R0.2 CCCC(=O)CN(C)CCO 81b8fff8b10e42c28336d0547302e36f [1,1,0,0,0,0|2,0,0]=4 3721 B10R0.2 CCCC(=O)NC(C)CCC 56490631c48f2aca072c23f49ee9d058 [1,1,0,0,0,0|1,0,0]=3 3722 B10R0.2 CCCC(=O)NC(C)CCO 5919b60c107cc1ebaf9d386a0f33a7c3 [1,1,0,0,0,0|2,0,0]=4 3723 B10R0.2 CCCC(=O)NC(C)COC 03f2d6c28fcaf9c50b1441eb116940a4 [1,1,0,0,0,0|2,0,0]=4 3724 B10R0.2 CCCC(=O)N[C@@H](C)CCC 8e5c769688371942cde58e588e37dc9d [1,1,0,0,0,0|1,0,0]=3 3725 B10R0.2 CCCC(=O)N[C@@H](C)CCO 932b928501cefed5a897b0c541a84c74 [1,1,0,0,0,0|2,0,0]=4 3726 B10R0.2 CCCC(=O)N[C@@H](C)COC 32d1fede2fae362d50263839bfd066c4 [1,1,0,0,0,0|2,0,0]=4 3727 B10R0.2 CCCC(=O)N[C@H](C)CCO 194b81205d9e7b862e31fe13833f72fe [1,1,0,0,0,0|2,0,0]=4 3728 B10R0.2 CCCC(=O)N[C@H](C)COC 33c5d1f5df178ec4598f4c705fc15027 [1,1,0,0,0,0|2,0,0]=4 3729 B10R0.2 CCCC(=S)OC(C)CCC a1e27c222b99617f74081c2514499359 [1,1,0,0,0,0|1,1,0]=4 3730 B10R0.2 CCCC(C)CC(C)OCC 1f4dcda5991606b58ae0cdcd9a219476 [1,1,0,0,0,0|1,0,1]=4 3731 B10R0.2 CCCC(C)CN(C)CCC 203d548ebbc3c00597efaf2ef0ec012f [1,1,0,0,0,0|2,0,0]=4 3732 B10R0.2 CCCC(C)NC(=O)CCF c75651a0446867fa721b8be04398f841 [1,1,0,0,0,0|2,0,0]=4 3733 B10R0.2 CCCC(C)NC(=O)CCO a6465449ef301530ae7d40e780707a33 [1,1,0,0,0,0|2,0,0]=4 3734 B10R0.2 CCCC(C)NC(=O)CCS 37888992e4b4c91d972f05d2146acb68 [1,1,0,0,0,0|2,0,0]=4 3735 B10R0.2 CCCC(C)NC(=O)COC 80d5b2db690d4b3a34721723600b0eae [1,1,0,0,0,0|2,0,0]=4 3736 B10R0.2 CCCC(C)NC(=O)CSC 60a0dde5f0fb97ce04784b7dd4042df4 [1,1,0,0,0,0|2,0,0]=4 3737 B10R0.2 CCCN(C)CC(=O)COC 447919a6b503bb85e0648077d498f4fa [1,1,0,0,0,0|2,0,0]=4 3738 B10R0.2 CCCN(C)CC(=O)NCC e2cb8b8c354023ec13a0233080e3401f [1,1,0,0,0,0|2,0,0]=4 3739 B10R0.2 CCCN(C)CC(=O)OCC 6d6f653dbba79c33476d433e8e3e5947 [1,1,0,0,0,0|1,0,0]=3 3740 B10R0.2 CCC[C@H](C)NC(=O)CCF e475e4a781571e55175c590b3ea9f9cd [1,1,0,0,0,0|2,0,0]=4 3741 B10R0.2 CCC[C@H](C)NC(=O)CCO 2fe417e155c60a2b404a8aadb741f290 [1,1,0,0,0,0|2,0,0]=4 3742 B10R0.2 CCC[C@H](C)NC(=O)CCS d03b67e7e4e3e5fedfdca048be8e7b00 [1,1,0,0,0,0|2,0,0]=4 3743 B10R0.2 CCC[C@H](C)NC(=O)COC 98cc4d38fdc7658d5f12c1a8f33cae62 [1,1,0,0,0,0|2,0,0]=4 3744 B10R0.2 CCC[C@H](C)NC(=O)CSC a10a8f758c4607dca24c6c6481884f31 [1,1,0,0,0,0|2,0,0]=4 3745 B10R0.2 CCNC(C)CC(=O)OCC 7705f9df12f8bf9df9877f6b146d95df [1,1,0,0,0,0|1,0,0]=3 3746 B10R0.2 CCOC(=O)CC(C)NCF d86d3e1f98189aed0cc0431093a5cacd [1,1,0,0,0,0|2,0,0]=4 3747 B10R0.2 CCOC(=O)CC(C)NCO 738f16f031645e7baba1b65ac213bee4 [1,1,0,0,0,0|2,0,0]=4 3748 B10R0.2 CCOC(=O)CC(C)OCC e868558c556c7c64bd1a79763f1f0c41 [1,1,0,0,0,0|1,0,0]=3 3749 B10R0.2 CCOC(=O)CC(C)OCF 50c18b03d6a75aca0ef8169c579ff6ad [1,1,0,0,0,0|2,0,0]=4 3750 B10R0.2 CCOC(=O)CN(C)CCF dedc6219d8ea8c13957a6fda7b422ec2 [1,1,0,0,0,0|2,0,0]=4 3751 B10R0.2 CCOC(=O)CN(C)CCO 7843d8f9d23c61dd461bddc1275723ac [1,1,0,0,0,0|2,0,0]=4 3752 B10R0.2 CCOC(=O)C[C@@H](C)OCC 658a64fd32faf34a2272bfe8b1820efa [1,1,0,0,0,0|1,0,0]=3 3753 B10R0.2 CCOC(=O)C[C@@H](C)OCF b5e302860c4001cace47e2577b895faf [1,1,0,0,0,0|2,0,0]=4 3754 B10R0.2 CCOC(=O)C[C@H](C)OCC 935bdffa769b2a9ffd1e721b074907b4 [1,1,0,0,0,0|1,0,0]=3 3755 B10R0.2 CCOC(=O)C[C@H](C)OCF 97dd5d59b070decff3526ceccb9afaf9 [1,1,0,0,0,0|2,0,0]=4 3756 B10R0.3 C=C(C)CCNC(=O)CCC afb7ac740c90404e17c253e5c073997c [1,1,0,0,0,0|1,0,1]=4 3757 B10R0.3 C=C(C)CNCC(=O)CCC 068d9335d15f0a9692a8aa0a8b49b1c4 [1,1,0,0,0,0|1,0,1]=4 3758 B10R0.3 C=C(C)CNCC(=O)OCC 92642587a4bd71eae0ff8adb7bd32cc2 [1,1,0,0,0,0|1,0,1]=4 3759 B10R0.3 C=C(C)COCC(=O)CCC 003d5185bb33c292b7a4e452aacb00fa [1,1,0,0,0,0|1,0,1]=4 3760 B10R0.3 C=C(C)COCC(=O)OCC 935fee7e21827ff3e855551827c663c0 [1,1,0,0,0,0|1,0,1]=4 3761 B10R0.3 CC(C)CCNC(=O)CCF 63d8ff119e1bbfa8e62d4b4ca693f78c [1,1,0,0,0,0|2,0,0]=4 3762 B10R0.3 CC(C)CCNC(=O)CCO b7fa76776ce04caba125cc1d990df8fd [1,1,0,0,0,0|2,0,0]=4 3763 B10R0.3 CC(C)CCNC(=O)CCS ea27dd796f9b2c569ef1d32e32cd0231 [1,1,0,0,0,0|2,0,0]=4 3764 B10R0.3 CC(O)CCNC(=O)CCF 44bf75219d3cae25246ba854c8b89b04 [1,1,0,0,0,0|2,0,0]=4 3765 B10R0.3 CC(O)CCNC(=O)CCO 83f62a25cf6917fe3ca02610219dabc1 [1,1,0,0,0,0|2,0,0]=4 3766 B10R0.3 CC(O)CCNC(=O)CCS f4f5ca1eade9289110564107510579f8 [1,1,0,0,0,0|2,0,0]=4 3767 B10R0.3 CCCC(=O)CNCC(=O)C 2f2bca955c317c66027ee57e4b8faaa3 [1,1,0,0,0,0|1,0,1]=4 3768 B10R0.3 CCCC(=O)CNCC(C)C d6dbda926415cfa91fe09dacaed5a50b [1,1,0,0,0,0|1,0,0]=3 3769 B10R0.3 CCCC(=O)CNCC(C)O 8caf9004f6887c9f4fde44237fb38f37 [1,1,0,0,0,0|1,0,0]=3 3770 B10R0.3 CCCC(=O)CNCC(F)F 00412f49566b57c6220ec1287a2cfa5e [1,1,0,0,0,0|2,0,0]=4 3771 B10R0.3 CCCC(=O)CNC[C@@H](C)O 427570fe3164dc21a4ae2b59c46b65c3 [1,1,0,0,0,0|1,0,0]=3 3772 B10R0.3 CCCC(=O)CNC[C@H](C)O a58bca160ef266fd5766bbca5a179402 [1,1,0,0,0,0|1,0,0]=3 3773 B10R0.3 CCCC(=O)COCC(=O)C d084d6d5aefe17d20bd2d81df30cc1b6 [1,1,0,0,0,0|1,0,1]=4 3774 B10R0.3 CCCC(=O)COCC(C)C 2326b3f3fe2ad2caa1b98fc82b274e2b [1,1,0,0,0,0|1,0,0]=3 3775 B10R0.3 CCCC(=O)COCC(C)F c7a44fc7e123c35b89a8f946d579750e [1,1,0,0,0,0|1,0,0]=3 3776 B10R0.3 CCCC(=O)COCC(C)S 01de9397df788eae604c7442ce4404f0 [1,1,0,0,0,0|1,0,0]=3 3777 B10R0.3 CCCC(=O)COCC(F)F c8a36323cad4b55b882b7eae6ac315ed [1,1,0,0,0,0|2,0,0]=4 3778 B10R0.3 CCCC(=O)COC[C@@H](C)F 0224b09aea7b2e5f9cbe6dec30326650 [1,1,0,0,0,0|1,0,0]=3 3779 B10R0.3 CCCC(=O)COC[C@H](C)F fea9b07c67754b0d917921c012826a06 [1,1,0,0,0,0|1,0,0]=3 3780 B10R0.3 CCCC(=O)NCCC(C)C e171303c24d98f11696cb7898188a053 [1,1,0,0,0,0|1,0,0]=3 3781 B10R0.3 CCCC(=O)NCCC(C)O 435d9016502776865e9e7740d06dc2b2 [1,1,0,0,0,0|1,0,0]=3 3782 B10R0.3 CCCC(=O)NCCC(F)F 90766d09c0575f4ece910f5bbd8ce4e1 [1,1,0,0,0,0|2,0,0]=4 3783 B10R0.3 CCCC(=O)NCCN(C)C b879d7317da648cb08676edd66824f73 [1,1,0,0,0,0|2,0,0]=4 3784 B10R0.3 CCCC(=O)NCCS(=O)C f139ea336f1ef8ebfffc4e993a1ede56 [1,1,0,0,0,0|2,0,0]=4 3785 B10R0.3 CCCC(=O)NCC[C@@H](C)O fc63587775c8491198cda2d65c27060a [1,1,0,0,0,0|1,0,0]=3 3786 B10R0.3 CCCC(=O)NCC[C@H](C)O cac8a742c35c278f106b0c5e309642e0 [1,1,0,0,0,0|1,0,0]=3 3787 B10R0.3 CCCC(=O)OCOC(C)C b74821bfd7761e206a8fbeb9480f4296 [1,1,0,0,0,0|2,0,0]=4 3788 B10R0.3 CCCC(=S)OCCC(C)C f87a8472ce883931995adcfbbae92853 [1,1,0,0,0,0|1,1,0]=4 3789 B10R0.3 CCCN(C)CCCC(C)C 231f713b6c52f6022e12909a8f96d55f [1,1,0,0,0,0|2,0,0]=4 3790 B10R0.3 CCCN(C)CCCC(C)O bcb8921018679fc023b0f411f18b9d7c [1,1,0,0,0,0|2,0,0]=4 3791 B10R0.3 CCNC(=O)CCOC(C)C 821bc8f07bf1880dd7da04556bcfbaf2 [1,1,0,0,0,0|2,0,0]=4 3792 B10R0.3 CCNC(=O)CNCC(C)C 236a1dc2f39f6d2f2711bee31bfb3249 [1,1,0,0,0,0|2,0,0]=4 3793 B10R0.3 CCNC(=O)CNCC(C)O e21af5259da2cfb7fc72229a4c4516b5 [1,1,0,0,0,0|2,0,0]=4 3794 B10R0.3 CCNC(=O)CNC[C@@H](C)O 04653aa517250896ac8cf6b868382bcb [1,1,0,0,0,0|2,0,0]=4 3795 B10R0.3 CCNC(=O)CNC[C@H](C)O 7853dfa602206c37a162c6e10909c3d8 [1,1,0,0,0,0|2,0,0]=4 3796 B10R0.3 CCNC(=O)COCC(C)C 477acbeb8cc8b25b59d08131b680a641 [1,1,0,0,0,0|2,0,0]=4 3797 B10R0.3 CCNC(=O)COCC(C)F 374d7c352cb50b30398c39442f2e4485 [1,1,0,0,0,0|2,0,0]=4 3798 B10R0.3 CCNC(=O)COCC(C)S 964e1b380e75a15b4fb448fe2f72c881 [1,1,0,0,0,0|2,0,0]=4 3799 B10R0.3 CCNC(=O)COC[C@@H](C)F 06000575131b5913a91d77797270508c [1,1,0,0,0,0|2,0,0]=4 3800 B10R0.3 CCNC(=O)COC[C@H](C)F e737da41a92e48fcf0ae5a5998cfbb86 [1,1,0,0,0,0|2,0,0]=4 3801 B10R0.3 CCOC(=O)CCNC(=O)C 2bf0e8c535336d39c394f92a0ff1db48 [1,1,0,0,0,0|1,0,1]=4 3802 B10R0.3 CCOC(=O)CCNC(C)C 1d850d9280acf3b63ac9aff043863c28 [1,1,0,0,0,0|1,0,0]=3 3803 B10R0.3 CCOC(=O)CCOC(C)C 2b191ccd2baac7216cc229f4f29030fe [1,1,0,0,0,0|1,0,0]=3 3804 B10R0.3 CCOC(=O)CNCC(=O)C 4cf4dd2df9859a0051dc28742d628c83 [1,1,0,0,0,0|1,0,1]=4 3805 B10R0.3 CCOC(=O)CNCC(C)C b3e6ebe933852f5ff64fb6764f5e0b0a [1,1,0,0,0,0|1,0,0]=3 3806 B10R0.3 CCOC(=O)CNCC(C)O 9fb464870826f03da21f2b03117e6ea6 [1,1,0,0,0,0|1,0,0]=3 3807 B10R0.3 CCOC(=O)CNCC(F)F e2a5424b47c5f45737cebf2f42b38f72 [1,1,0,0,0,0|2,0,0]=4 3808 B10R0.3 CCOC(=O)CNCN(C)C 70d4db0b6fd541cf328544778c9ed7d4 [1,1,0,0,0,0|2,0,0]=4 3809 B10R0.3 CCOC(=O)CNC[C@@H](C)O f1686031fb481639b214e11b7e59fc49 [1,1,0,0,0,0|1,0,0]=3 3810 B10R0.3 CCOC(=O)CNC[C@H](C)O 8877edba6d3b750453ee21c862c72a31 [1,1,0,0,0,0|1,0,0]=3 3811 B10R0.3 CCOC(=O)COCC(=O)C 582b9711c7edac48bd3c8a33f0d73ee9 [1,1,0,0,0,0|1,0,1]=4 3812 B10R0.3 CCOC(=O)COCC(C)C 107ada615e2926e4792d3104d122bddb [1,1,0,0,0,0|1,0,0]=3 3813 B10R0.3 CCOC(=O)COCC(C)F 5ed2e95b94e9a779093703e03d9a6995 [1,1,0,0,0,0|1,0,0]=3 3814 B10R0.3 CCOC(=O)COCC(C)S b43c926d0d65539341d97aea5337a82a [1,1,0,0,0,0|1,0,0]=3 3815 B10R0.3 CCOC(=O)COCC(F)F 4ddbfc8303897fbb0b86882d84fa8bd3 [1,1,0,0,0,0|2,0,0]=4 3816 B10R0.3 CCOC(=O)COCN(C)C fd53339e450d234746c5917ef2c13672 [1,1,0,0,0,0|2,0,0]=4 3817 B10R0.3 CCOC(=O)COC[C@@H](C)F e3bcac717ebd1cdcd458dd7c47e8be4a [1,1,0,0,0,0|1,0,0]=3 3818 B10R0.3 CCOC(=O)COC[C@H](C)F db542cc9892663143317b7ff73e1bc20 [1,1,0,0,0,0|1,0,0]=3 3819 B10R0.3 CCOC(=O)OCOC(C)C cf559709abb36b61b754d78ec81f484d [1,1,0,0,0,0|2,0,0]=4 3820 B10R0.3 CCOC(C)CCCC(C)C 04034ba2b012fb4877b465e2ae762835 [1,1,0,0,0,0|1,0,1]=4 3821 B10R0.3 COCC(=O)CNCC(C)C 197236dd43253f73404bfab544bd5cd9 [1,1,0,0,0,0|2,0,0]=4 3822 B10R0.3 COCC(=O)CNCC(C)O 45080df13267181826130b917be2a3f7 [1,1,0,0,0,0|2,0,0]=4 3823 B10R0.3 COCC(=O)CNC[C@@H](C)O a19e0807690ae09c22a333c276cc8b94 [1,1,0,0,0,0|2,0,0]=4 3824 B10R0.3 COCC(=O)CNC[C@H](C)O ebe61a0d6ea6cb249920f9d969a8d411 [1,1,0,0,0,0|2,0,0]=4 3825 B10R0.3 COCC(=O)COCC(C)C 46c04f2b8f129ac2acccbf29c3a4329a [1,1,0,0,0,0|2,0,0]=4 3826 B10R0.3 COCC(=O)COCC(C)F 331fb6e8b87b2db9846d84afc3bdabe9 [1,1,0,0,0,0|2,0,0]=4 3827 B10R0.3 COCC(=O)COC[C@@H](C)F 66f7961651f292835cafb5356d970d6c [1,1,0,0,0,0|2,0,0]=4 3828 B10R0.3 COCC(=O)COC[C@H](C)F 21f281fbb0cbb53e38724020ef1a2e7f [1,1,0,0,0,0|2,0,0]=4 3829 B10R0.3 COCC(=O)NCCC(C)C f4260d1dd94d88e060424321231d91ad [1,1,0,0,0,0|2,0,0]=4 3830 B10R0.3 COCC(=O)NCCC(C)O a7603ac2f49528f66b46aa75e701367c [1,1,0,0,0,0|2,0,0]=4 3831 B10R0.3 COCC(=O)NCC[C@@H](C)O 32fb036af975bd24cad7b2895f27d80d [1,1,0,0,0,0|2,0,0]=4 3832 B10R0.3 COCC(=O)NCC[C@H](C)O 0a4b90d567bfabc800daa236691eccaa [1,1,0,0,0,0|2,0,0]=4 3833 B10R0.3 CSCC(=O)NCCC(C)C db8eb9c0e0e6d2707b3ffa978d5f5b83 [1,1,0,0,0,0|2,0,0]=4 3834 B10R0.3 CSCC(=O)NCCC(C)O 7848e46ae3808e0ac9d1efe18cbfd4dd [1,1,0,0,0,0|2,0,0]=4 3835 B10R0.3 CSCC(=O)NCC[C@@H](C)O d57c31401e2b1b463900225e10802c2e [1,1,0,0,0,0|2,0,0]=4 3836 B10R0.3 CSCC(=O)NCC[C@H](C)O a77f0322c4a11e039227a28e2626e4e3 [1,1,0,0,0,0|2,0,0]=4 3837 B10R0.3 C[C@@H](O)CCNC(=O)CCF 5d942b71f30ee5bb5b506a8e530c16a6 [1,1,0,0,0,0|2,0,0]=4 3838 B10R0.3 C[C@@H](O)CCNC(=O)CCO 2ae5cb4a4c415b6bf6da4a8ef184c522 [1,1,0,0,0,0|2,0,0]=4 3839 B10R0.3 C[C@@H](O)CCNC(=O)CCS 432196bb14ac1402e33ec9699dd4e236 [1,1,0,0,0,0|2,0,0]=4 3840 B10R0.3 C[C@H](O)CCNC(=O)CCF 64b04acb93a1730976c7d1257fe03e5e [1,1,0,0,0,0|2,0,0]=4 3841 B10R0.3 C[C@H](O)CCNC(=O)CCO d233aaf5f171aeb9d874c61ed6e4d942 [1,1,0,0,0,0|2,0,0]=4 3842 B10R0.3 C[C@H](O)CCNC(=O)CCS c40466dd1c4f545a251381c498a9e210 [1,1,0,0,0,0|2,0,0]=4 3843 B10R0.6 C=C(C)CC(=O)NCCCC 8755696ec9cf3464dac3064a60dd6b8a [1,1,0,0,0,0|1,0,1]=4 3844 B10R0.6 CC(C)CC(=O)CNCCBr 5e50b194db21003f6657fd9283f45f22 [1,1,0,0,0,0|2,0,0]=4 3845 B10R0.6 CC(C)CC(=O)CNCCF b03813d1619c61aec3d6db6da44bfa6d [1,1,0,0,0,0|2,0,0]=4 3846 B10R0.6 CC(C)CC(=O)CNCCI 79e03cc4f8c6b10e221bbf5f76f6935c [1,1,0,0,0,0|2,0,0]=4 3847 B10R0.6 CC(C)CC(=O)CNCCO 77d47800be2288e08c1f88770ee8d092 [1,1,0,0,0,0|2,0,0]=4 3848 B10R0.6 CC(C)CC(=O)CNCCS c69e4b64e88b78d74c71c8fcde527623 [1,1,0,0,0,0|2,0,0]=4 3849 B10R0.6 CC(C)CC(=O)COCCF 4ec54aeebcae8a32953028dd7679397c [1,1,0,0,0,0|2,0,0]=4 3850 B10R0.6 CC(C)CC(=O)COCCS cf7d1d26e3c4613629441336248dad72 [1,1,0,0,0,0|2,0,0]=4 3851 B10R0.6 CC(C)CC(=O)NCCCCl 472c1f3ca12d44d3050cca2e68c43859 [1,1,0,0,0,0|2,0,0]=4 3852 B10R0.6 CC(C)CC(=O)NCCCO 8c99f9ce536c5b44a8f0bad5107132ff [1,1,0,0,0,0|2,0,0]=4 3853 B10R0.6 CC(C)OC(=O)CNCCBr 5826d474401c05f26210b4bcdc84d1b5 [1,1,0,0,0,0|2,0,0]=4 3854 B10R0.6 CC(C)OC(=O)CNCCF 22a814fd59be1a9eda58c0970c6ccd92 [1,1,0,0,0,0|2,0,0]=4 3855 B10R0.6 CC(C)OC(=O)CNCCI 73cf8b4b52a46afd851f2d22e0a43f4d [1,1,0,0,0,0|2,0,0]=4 3856 B10R0.6 CC(C)OC(=O)CNCCO be874c64fd56a9d3d71ceaac51634fa8 [1,1,0,0,0,0|2,0,0]=4 3857 B10R0.6 CC(C)OC(=O)CNCCS 5cd001d1dd84e45cce7a1d615d851422 [1,1,0,0,0,0|2,0,0]=4 3858 B10R0.6 CC(C)OC(=O)COCCF c0ff94fabeac5e8bb97944fcebe94a83 [1,1,0,0,0,0|2,0,0]=4 3859 B10R0.6 CC(C)OC(=O)COCCS f01f00a0bc536b5c52e32aa6facc62c7 [1,1,0,0,0,0|2,0,0]=4 3860 B10R0.6 CC(O)CC(=O)NCCCCl 58b0dcf744b816482a1124b01d1c1cee [1,1,0,0,0,0|2,0,0]=4 3861 B10R0.6 CC(O)CC(=O)NCCCO 9ff3a00bd271b36fca97f5d8eb67854d [1,1,0,0,0,0|2,0,0]=4 3862 B10R0.6 CCCCCC(C)OC(C)C 95b0f06e4023c661a347d1a359881d00 [1,1,0,0,0,0|1,0,1]=4 3863 B10R0.6 CCCCCN(C)CC(C)C f9fc3472d400d85b2a46f0c906024916 [1,1,0,0,0,0|2,0,0]=4 3864 B10R0.6 CCCCCN(C)CC(C)O 901fef81c3595ff2c01b25c0d15a49c8 [1,1,0,0,0,0|2,0,0]=4 3865 B10R0.6 CCCCCN(C)C[C@@H](C)O afc2448e222a7091f88ee19e4f713057 [1,1,0,0,0,0|2,0,0]=4 3866 B10R0.6 CCCCCN(C)C[C@H](C)O d10accc63c31e841e5b492aed9733d0f [1,1,0,0,0,0|2,0,0]=4 3867 B10R0.6 CCCCC[C@@H](C)OC(C)C c949db6949068bbc1ac83e262232b3a5 [1,1,0,0,0,0|1,0,1]=4 3868 B10R0.6 CCCCC[C@H](C)OC(C)C 4424b843f9aca94dfe1bca2a6a34affd [1,1,0,0,0,0|1,0,1]=4 3869 B10R0.6 CCCCNC(=O)CC(=O)C 00bd35636d398cf3ada227296de4129c [1,1,0,0,0,0|1,0,1]=4 3870 B10R0.6 CCCCNC(=O)CC(C)C 3363a95f899c4d1d2797ab0d53e6e066 [1,1,0,0,0,0|1,0,0]=3 3871 B10R0.6 CCCCNC(=O)CC(C)O 69d342c86e5eab398563e6e8e09634d6 [1,1,0,0,0,0|1,0,0]=3 3872 B10R0.6 CCCCNC(=O)CC(F)F 0f5fdd0f80cc18417b0625935966f63d [1,1,0,0,0,0|2,0,0]=4 3873 B10R0.6 CCCCNC(=O)CN(C)C 2277b0f8e5e27160757d71da573d4afe [1,1,0,0,0,0|2,0,0]=4 3874 B10R0.6 CCCCNC(=O)C[C@@H](C)O ab8e83b515ef0d7fc7a0f54f23eff3b8 [1,1,0,0,0,0|1,0,0]=3 3875 B10R0.6 CCCCNC(=O)C[C@H](C)O 29a1309b76801dcb4b96a6e826d2ece6 [1,1,0,0,0,0|1,0,0]=3 3876 B10R0.6 CCCNCC(=O)CC(C)C 1ddb5bc8b60625117230ea69d77ad9af [1,1,0,0,0,0|1,0,0]=3 3877 B10R0.6 CCCNCC(=O)NC(C)C 0a23f6bba2ebfc76bacf01e286c2b8a2 [1,1,0,0,0,0|2,0,0]=4 3878 B10R0.6 CCCNCC(=O)OC(C)C 2fb375c8333c868a0ae70970623d321e [1,1,0,0,0,0|1,0,0]=3 3879 B10R0.6 CCCOCC(=O)CC(C)C b189f7aa06f5e5eb201f826b495694cc [1,1,0,0,0,0|1,0,0]=3 3880 B10R0.6 CCCOCC(=O)NC(C)C d5892aa65d4bcf34da58bd32a941fca8 [1,1,0,0,0,0|2,0,0]=4 3881 B10R0.6 CCCOCC(=O)OC(C)C 48ce383eaec39bd480e02f6e063a2e1a [1,1,0,0,0,0|1,0,0]=3 3882 B10R0.6 COCCNC(=O)CC(C)C 4e68289a447c9dde539173d014fab9db [1,1,0,0,0,0|2,0,0]=4 3883 B10R0.6 COCCNC(=O)CC(C)O dd56df07fb33cc4a2d4fce0a58c6545a [1,1,0,0,0,0|2,0,0]=4 3884 B10R0.6 COCCNC(=O)C[C@@H](C)O ade9627ac280384bb5c15e35b38ef4d8 [1,1,0,0,0,0|2,0,0]=4 3885 B10R0.6 COCCNC(=O)C[C@H](C)O b5ce220a0bdc8baeb6e545d76477f4ca [1,1,0,0,0,0|2,0,0]=4 3886 B10R0.6 COCOCC(=O)CC(C)C 77c5d33e8fd7066d7d9aaedaa224bf1d [1,1,0,0,0,0|2,0,0]=4 3887 B10R0.6 COCOCC(=O)OC(C)C 3f0bef6f546b5c23f235fce0c9abd7ae [1,1,0,0,0,0|2,0,0]=4 3888 B10R0.6 CSCCNC(=O)CC(C)C b6ff69a7c17d8938b8b4acdd7e6222f5 [1,1,0,0,0,0|2,0,0]=4 3889 B10R0.6 CSCCNC(=O)CC(C)O c3146d3179ffaafbf935dfb512b50e9d [1,1,0,0,0,0|2,0,0]=4 3890 B10R0.6 CSCCNC(=O)C[C@@H](C)O c2ab799ecb5248b0b6c104ef999755bd [1,1,0,0,0,0|2,0,0]=4 3891 B10R0.6 CSCCNC(=O)C[C@H](C)O 82d927f26bcda51e345da129148631ff [1,1,0,0,0,0|2,0,0]=4 3892 B10R0.6 CSCOCC(=O)OC(C)C c67f4ec1d787490468d921c1f7ffb04e [1,1,0,0,0,0|2,0,0]=4 3893 B10R0.6 C[C@@H](O)CC(=O)NCCCCl 83dca3c2718000aad897ec32c332da2c [1,1,0,0,0,0|2,0,0]=4 3894 B10R0.6 C[C@@H](O)CC(=O)NCCCO 3c856bec81de28e743120ca1d0ac12bb [1,1,0,0,0,0|2,0,0]=4 3895 B10R0.6 C[C@H](O)CC(=O)NCCCCl cca23ff2a4093b8579be812fdb0611a5 [1,1,0,0,0,0|2,0,0]=4 3896 B10R0.6 C[C@H](O)CC(=O)NCCCO 69358177a94b5e43426f63ef4c1c67a2 [1,1,0,0,0,0|2,0,0]=4 3897 B10R0.19 C=C(COCC)C(=O)OCC 6f10787a53e9e179e98980ece827ebe3 [1,1,0,0,0,0|1,0,1]=4 3898 B10R0.19 CCCC(=O)N(C)CCCO aa526b2cb34561ea37f14fc606f15b54 [1,1,0,0,0,0|2,0,0]=4 3899 B10R0.19 CCCC(=O)N(C)CCOC 5fee7231bfc5953066c981c54b1ddc91 [1,1,0,0,0,0|2,0,0]=4 3900 B10R0.19 CCCC(=O)N(C)CCSC 61727274333cc9fb15271abbb1d84beb [1,1,0,0,0,0|2,0,0]=4 3901 B10R0.19 CCCCC(C)N(C)CCC 3dd555de828073303328b989478847b5 [1,1,0,0,0,0|2,0,0]=4 3902 B10R0.19 CCCCN(C)C(=O)CCC 2b7b784470b8b7ff831c528c223e6a34 [1,1,0,0,0,0|1,0,0]=3 3903 B10R0.19 CCCCN(C)C(=O)CCF 391e477ab1fb6a69251f8957ca28e495 [1,1,0,0,0,0|2,0,0]=4 3904 B10R0.19 CCCCN(C)C(=O)CCO 38d92cdad79d05905c316479ef7e8763 [1,1,0,0,0,0|2,0,0]=4 3905 B10R0.19 CCCCN(C)C(=O)CCS afb13be8e05a3692f482a3be73f1fe23 [1,1,0,0,0,0|2,0,0]=4 3906 B10R0.19 CCCCN(C)C(=O)COC 2577def73493edeac0c4ed538d627414 [1,1,0,0,0,0|2,0,0]=4 3907 B10R0.19 CCCCN(C)C(=O)CSC 68573d7f429ecb339090cdbe2bbbc786 [1,1,0,0,0,0|2,0,0]=4 3908 B10R0.19 CCCNC(=O)C(=O)CCC 5f1ca2ad77e4e87193cbe96fbe565f08 [1,1,0,0,0,0|1,0,1]=4 3909 B10R0.19 CCCNC(=O)C(=O)OCC 126270ea1ba4e767f191773567423bc3 [1,1,0,0,0,0|1,0,1]=4 3910 B10R0.19 CCCNC(C)C(=O)NCC 4d8a751697c0aafd9a4a6523aa2d78a0 [1,1,0,0,0,0|2,0,0]=4 3911 B10R0.19 CCCNC(C)C(=O)OCC a5bc76108a07c2d666e42f51eaeeddad [1,1,0,0,0,0|1,0,0]=3 3912 B10R0.19 CCCNC(F)C(=O)OCC 5b25cec6bdd3ca76df5dbdfb7f6f2cee [1,1,0,0,0,0|1,0,0]=3 3913 B10R0.19 CCCN[C@@H](C)C(=O)NCC a00c96ce6051441db2313a4ef1a99527 [1,1,0,0,0,0|2,0,0]=4 3914 B10R0.19 CCCN[C@@H](C)C(=O)OCC 8307fc251a428f5e5cd7764df108d7f4 [1,1,0,0,0,0|1,0,0]=3 3915 B10R0.19 CCCN[C@H](C)C(=O)OCC e3baecfd69e367b3a0331595e9b279fc [1,1,0,0,0,0|1,0,0]=3 3916 B10R0.19 CCCOC(C)C(=O)NCC 663a3ae454ef80b37fef1892bf90e0da [1,1,0,0,0,0|2,0,0]=4 3917 B10R0.19 CCCOC(C)C(=O)OCC ab8ff289244dec834ca22da0f5d8b6d4 [1,1,0,0,0,0|1,0,0]=3 3918 B10R0.19 CCCOC(F)C(=O)OCC a0370e8810575cf9bdcdb7d5afcd7c6f [1,1,0,0,0,0|1,0,0]=3 3919 B10R0.19 CCCO[C@@H](C)C(=O)OCC d090f23ed408baa128a37269f58d1c53 [1,1,0,0,0,0|1,0,0]=3 3920 B10R0.19 CCCO[C@H](C)C(=O)OCC dcab65047931043055d0bc5167530869 [1,1,0,0,0,0|1,0,0]=3 3921 B10R0.19 CCNCC(C)C(=O)OCC bed894143b65f72480fec39bc03493cb [1,1,0,0,0,0|1,0,0]=3 3922 B10R0.19 CCOC(=O)C(C)CNCF 65b75c44499b15f5420832089f2adf0e [1,1,0,0,0,0|2,0,0]=4 3923 B10R0.19 CCOC(=O)C(C)CNCO 1f1750a2c4f819bc91715968f9192e85 [1,1,0,0,0,0|2,0,0]=4 3924 B10R0.19 CCOC(=O)C(C)COCF c5820983f330cf6b193a3557b26a6ebb [1,1,0,0,0,0|2,0,0]=4 3925 B10R0.19 CCOC(=O)C(C)NCCBr 0cb64ee6d40c775f652c0f1ed4d70014 [1,1,0,0,0,0|2,0,0]=4 3926 B10R0.19 CCOC(=O)C(C)NCCF 3e674721f9ca0de01d6018656ac1e53f [1,1,0,0,0,0|2,0,0]=4 3927 B10R0.19 CCOC(=O)C(C)NCCI 55e62beeb294e545a76ab3053ddfb073 [1,1,0,0,0,0|2,0,0]=4 3928 B10R0.19 CCOC(=O)C(C)NCCO 98c9648ddf7fb40bfeef5c796786de98 [1,1,0,0,0,0|2,0,0]=4 3929 B10R0.19 CCOC(=O)C(C)NCCS 65da2a38f995f40d39f707e54203408c [1,1,0,0,0,0|2,0,0]=4 3930 B10R0.19 CCOC(=O)C(C)OCCF 8d33ec125dcfde79d3c39b701ed510aa [1,1,0,0,0,0|2,0,0]=4 3931 B10R0.19 CCOC(=O)C(C)OCCS 678639ffc4291db2dbdeb8e121892a25 [1,1,0,0,0,0|2,0,0]=4 3932 B10R0.19 CCOC(=O)C(C)OCOC 45b535ba590e906f0e2f4a938e1f9641 [1,1,0,0,0,0|2,0,0]=4 3933 B10R0.19 CCOC(=O)C(C)OCSC cd91fd18a612d8c5c10fbf2ba48318b3 [1,1,0,0,0,0|2,0,0]=4 3934 B10R0.19 CCOC(=O)C(F)NCCBr c502d56bb21a329e75a4cf87fe854b1b [1,1,0,0,0,0|2,0,0]=4 3935 B10R0.19 CCOC(=O)C(F)NCCF 0ef17089aa08c9f3a130311a7db0ac82 [1,1,0,0,0,0|2,0,0]=4 3936 B10R0.19 CCOC(=O)C(F)NCCI 3d310d605a07f3fa002a80d4a6c3e3a2 [1,1,0,0,0,0|2,0,0]=4 3937 B10R0.19 CCOC(=O)C(F)NCCO 12d98e39721837c854962eaf22066fee [1,1,0,0,0,0|2,0,0]=4 3938 B10R0.19 CCOC(=O)C(F)NCCS 3e6a3c7139ac9811230674e453a045de [1,1,0,0,0,0|2,0,0]=4 3939 B10R0.19 CCOC(=O)C(F)OCCF cdfc8b1ed6e9271c3833a5df53b2d241 [1,1,0,0,0,0|2,0,0]=4 3940 B10R0.19 CCOC(=O)C(F)OCCS dd9db70d453889e0010adfa217c779c9 [1,1,0,0,0,0|2,0,0]=4 3941 B10R0.19 CCOC(=O)C(F)OCOC 661b3a15b4790ac19fe7144a75f3c85b [1,1,0,0,0,0|2,0,0]=4 3942 B10R0.19 CCOC(=O)[C@@H](C)NCCBr a4736d092bcbb74d11f55219d2897228 [1,1,0,0,0,0|2,0,0]=4 3943 B10R0.19 CCOC(=O)[C@@H](C)NCCF 74cfd0f122c169ccf9b6b621f20b549a [1,1,0,0,0,0|2,0,0]=4 3944 B10R0.19 CCOC(=O)[C@@H](C)NCCI 18aa06b3a7d7be0ac9906415cc40b82b [1,1,0,0,0,0|2,0,0]=4 3945 B10R0.19 CCOC(=O)[C@@H](C)NCCO 08be691523ceeab57d04dc6f7a075a2d [1,1,0,0,0,0|2,0,0]=4 3946 B10R0.19 CCOC(=O)[C@@H](C)NCCS ae4d5e48f6e61befa3bb39020df1cd80 [1,1,0,0,0,0|2,0,0]=4 3947 B10R0.19 CCOC(=O)[C@@H](C)NCOC eafdb504bf06787408e52bffc60497c2 [1,1,0,0,0,0|2,0,0]=4 3948 B10R0.19 CCOC(=O)[C@@H](C)NCSC dbc28556b9a8bc59336f0af509aa4836 [1,1,0,0,0,0|2,0,0]=4 3949 B10R0.19 CCOC(=O)[C@@H](C)OCCF 2b98e3a0780235a1ab49d0fbd769cbb9 [1,1,0,0,0,0|2,0,0]=4 3950 B10R0.19 CCOC(=O)[C@@H](C)OCCS 54ec4dd0d44697b6d0f71910611b4787 [1,1,0,0,0,0|2,0,0]=4 3951 B10R0.19 CCOC(=O)[C@@H](C)OCOC 6d10ddf4d83787d87e4c56e629f34599 [1,1,0,0,0,0|2,0,0]=4 3952 B10R0.19 CCOC(=O)[C@@H](C)OCSC b356af9367a0d09fe45fe2ecf2a2739c [1,1,0,0,0,0|2,0,0]=4 3953 B10R0.19 CCOC(=O)[C@H](C)NCCBr 9f347487137125f70c0bb9513dfc54a5 [1,1,0,0,0,0|2,0,0]=4 3954 B10R0.19 CCOC(=O)[C@H](C)NCCF 3d30530e1f846694e4b0c842723df9a7 [1,1,0,0,0,0|2,0,0]=4 3955 B10R0.19 CCOC(=O)[C@H](C)NCCI 776bdf0f095d7a7840333d374bd2156b [1,1,0,0,0,0|2,0,0]=4 3956 B10R0.19 CCOC(=O)[C@H](C)NCCO f7b2e715928240e2797f31972a8afb06 [1,1,0,0,0,0|2,0,0]=4 3957 B10R0.19 CCOC(=O)[C@H](C)NCCS 71303de23b18ac2977d5420a4e8bc5d2 [1,1,0,0,0,0|2,0,0]=4 3958 B10R0.19 CCOC(=O)[C@H](C)OCCF 8b3dd1eaac08d97cfee9ac1b8cad2069 [1,1,0,0,0,0|2,0,0]=4 3959 B10R0.19 CCOC(=O)[C@H](C)OCCS a2fb7a9524546fdcaa3c8036beec55ee [1,1,0,0,0,0|2,0,0]=4 3960 B10R0.19 CCOC(=O)[C@H](C)OCOC fa68e3132ada730f1da09bc5267e2344 [1,1,0,0,0,0|2,0,0]=4 3961 B10R0.19 CCOC(=O)[C@H](C)OCSC 83fc4e59b76985b825fcf4c9a31c6b4b [1,1,0,0,0,0|2,0,0]=4 3962 B10R0.19 CCOCC(C)C(=O)OCC 0f2424f972bf92769c6abc269b3fc887 [1,1,0,0,0,0|1,0,0]=3 3963 B10R0.24 C#CC(CCCCC)OCC 90058fe546fc9404f4e240cfaf3f05cf [1,1,0,0,0,0|1,0,1]=4 3964 B10R0.24 C#C[C@H](CCCCC)OCC cd21c033028f0cdb6396d49acdb07a59 [1,1,0,0,0,0|1,0,1]=4 3965 B10R0.24 C=CC(CCCCC)OCC 6d5704efc3b1195bb916339612770471 [1,1,0,0,0,0|1,0,1]=4 3966 B10R0.24 C=C[C@H](CCCCC)OCC 3a4d862c38cdc003a94c27a4e7b8df7f [1,1,0,0,0,0|1,0,1]=4 3967 B10R0.24 CCCCCC(CC)OCC f1e5ecf57e6b559d8bd03908dd3f1294 [1,1,0,0,0,0|1,0,1]=4 3968 B10R0.24 CCCCCN(C=O)CCC 8646abf1faa254eafc312659290c903a [1,1,0,0,0,0|1,0,0]=3 3969 B10R0.24 CCCCCN(C=O)CCO 96121951b82ae2714360bd22f86e4e05 [1,1,0,0,0,0|2,0,0]=4 3970 B10R0.24 CCCCCN(CC)CCC f4575dfb52731309a5e57b12315cb064 [1,1,0,0,0,0|2,0,0]=4 3971 B10R0.24 CCCCCN(CF)CCC c591c1c332e83e44ca21bca58f9fd128 [1,1,0,0,0,0|2,0,0]=4 3972 B10R0.24 CCCCCN(CO)CCC 3a4cd50340d217539e7062bbb02c7f9a [1,1,0,0,0,0|1,0,1]=4 3973 B10R0.24 CCCCC[C@H](CC)OCC 40180de9fd9da42585f0165bff867107 [1,1,0,0,0,0|1,0,1]=4 3974 B10R0.83 C=C(CC)C(=O)NCCCC 9ecf90067c139255ad96e608ea3e7b91 [1,1,0,0,0,0|1,0,1]=4 3975 B10R0.83 CCC(C)C(=O)CNCCBr e4196cdca5c8ecdd474d643feddcf662 [1,1,0,0,0,0|2,0,0]=4 3976 B10R0.83 CCC(C)C(=O)CNCCF 2f25701d89edfb14175851176ccfd002 [1,1,0,0,0,0|2,0,0]=4 3977 B10R0.83 CCC(C)C(=O)CNCCI e3d712a0cb5312ca21a5828aca39735b [1,1,0,0,0,0|2,0,0]=4 3978 B10R0.83 CCC(C)C(=O)CNCCO 71b4810267726a0beba1c5c849506a5b [1,1,0,0,0,0|2,0,0]=4 3979 B10R0.83 CCC(C)C(=O)CNCCS 9ea924ed853e09b67371ee1128544e9f [1,1,0,0,0,0|2,0,0]=4 3980 B10R0.83 CCC(C)C(=O)COCCF aa3cd62fbe1a0e02255aa462b897d758 [1,1,0,0,0,0|2,0,0]=4 3981 B10R0.83 CCC(C)C(=O)COCCS ee079db34842c2bc16ebfdaad7fb90f0 [1,1,0,0,0,0|2,0,0]=4 3982 B10R0.83 CCC(C)C(=O)COCOC 691a68790a7c82e63da080573420a20f [1,1,0,0,0,0|2,0,0]=4 3983 B10R0.83 CCC(O)C(=O)NCCCCl 9ce76e2e16255cf45719b1b759f04822 [1,1,0,0,0,0|2,0,0]=4 3984 B10R0.83 CCC(O)C(=O)NCCCO 2406374cdf2c85dcb9e6f87639fd940b [1,1,0,0,0,0|2,0,0]=4 3985 B10R0.83 CCC(O)C(=O)NCCOC 76bd8e622cea127c938fdfa28035f1cc [1,1,0,0,0,0|2,0,0]=4 3986 B10R0.83 CCC(O)C(=O)NCCSC 0688f327066619e2c7e150d42feb589c [1,1,0,0,0,0|2,0,0]=4 3987 B10R0.83 CCCCCC(=O)N(C)CC 5faccaab2625fd396450487f4aa68930 [1,1,0,0,0,0|1,0,0]=3 3988 B10R0.83 CCCCCN(C)C(C)CC 7a2678ea826902adc6ed5ab4c6ffe7be [1,1,0,0,0,0|2,0,0]=4 3989 B10R0.83 CCCCNC(=O)C(=O)CC f70364b47518d044d4168c14edef081c [1,1,0,0,0,0|1,0,1]=4 3990 B10R0.83 CCCCNC(=O)C(C)OC b55068bf7a4db16e7cedc99e858c4871 [1,1,0,0,0,0|2,0,0]=4 3991 B10R0.83 CCCCNC(=O)C(C)SC 70fdddc2c637497f84b3a6ab01d732d6 [1,1,0,0,0,0|2,0,0]=4 3992 B10R0.83 CCCCNC(=O)C(O)CC 0bb7cae020f8d9a6f1ab0021bf8a298d [1,1,0,0,0,0|1,0,0]=3 3993 B10R0.83 CCCCNC(=O)C(O)CO d98d9133743f731cf08495d863edb929 [1,1,0,0,0,0|2,0,0]=4 3994 B10R0.83 CCCCNC(=O)N(C)CC 281153b38e5b0720f98fb991dbfaf202 [1,1,0,0,0,0|2,0,0]=4 3995 B10R0.83 CCCCNC(=O)[C@@H](C)OC e789ae086f9ed633afca669e35f42777 [1,1,0,0,0,0|2,0,0]=4 3996 B10R0.83 CCCCNC(=O)[C@@H](O)CC ce320a80fc74e2960ab5c1b56d0c1177 [1,1,0,0,0,0|1,0,0]=3 3997 B10R0.83 CCCCNC(=O)[C@@H](O)CO 8320f21a23ab3c4834e9f96d8866433e [1,1,0,0,0,0|2,0,0]=4 3998 B10R0.83 CCCCNC(=O)[C@@H](S)CC 86e97a222f204fadccdea11157c8e72f [1,1,0,0,0,0|1,0,0]=3 3999 B10R0.83 CCCCNC(=O)[C@H](C)OC ac821403e6615ab5c9463a45ef84f512 [1,1,0,0,0,0|2,0,0]=4 4000 B10R0.83 CCCCNC(=O)[C@H](O)CC ccbdd8cd94855236f2a70575c312a593 [1,1,0,0,0,0|1,0,0]=3 4001 B10R0.83 CCCCNC(=O)[C@H](O)CF 2c27eb611eb186e3e9278ea9236ea1e0 [1,1,0,0,0,0|2,0,0]=4 4002 B10R0.83 CCCNCC(=O)C(C)CC 421f60228013d880568584f5c10554a9 [1,1,0,0,0,0|1,0,0]=3 4003 B10R0.83 CCCNCC(=O)N(C)CC 08c814e45b22c77f25830d1554a003c2 [1,1,0,0,0,0|2,0,0]=4 4004 B10R0.83 CCCOCC(=O)C(C)CC be769a4148e4c3e25a48685acf6e03de [1,1,0,0,0,0|1,0,0]=3 4005 B10R0.83 CCCOCC(=O)N(C)CC fba66d9a26ef78111ecea3ac55d52b9c [1,1,0,0,0,0|2,0,0]=4 4006 B10R0.83 CCCSCC(=O)N(C)CC 657abe031aca5e49f408b4008ac5cca1 [1,1,0,0,0,0|2,0,0]=4 4007 B10R0.83 CCN(C)C(=O)CCCCF 8347edb5410cec08d11260ec9777165b [1,1,0,0,0,0|2,0,0]=4 4008 B10R0.83 CCN(C)C(=O)CCCCO 622ab477291ad551178150267858eda6 [1,1,0,0,0,0|2,0,0]=4 4009 B10R0.83 CCN(C)C(=O)CCCCS cd15be06df481bd0d2643b2c228d1289 [1,1,0,0,0,0|2,0,0]=4 4010 B10R0.83 CCN(C)C(=O)CCCOC 10f1ffa083d67261b48a4f0a95b9d007 [1,1,0,0,0,0|2,0,0]=4 4011 B10R0.83 CCN(C)C(=O)CCCSC 9aeabc5921997e9989927d01ed2ab9b2 [1,1,0,0,0,0|2,0,0]=4 4012 B10R0.83 CCOCCC(=O)N(C)CC 63ff32ab9e4178cf7e8288d7912ad643 [1,1,0,0,0,0|2,0,0]=4 4013 B10R0.83 CCSCCC(=O)N(C)CC 91d2f2b3adaca40666dd9be2071845cc [1,1,0,0,0,0|2,0,0]=4 4014 B10R0.83 CC[C@@H](O)C(=O)NCCCCl 1782330c8fc34e5e44373a9ccaeab0a2 [1,1,0,0,0,0|2,0,0]=4 4015 B10R0.83 CC[C@@H](O)C(=O)NCCCO ac6d552f2281f6fb11c74acdef51635d [1,1,0,0,0,0|2,0,0]=4 4016 B10R0.83 CC[C@@H](O)C(=O)NCCOC b923ff692a7553fe2bf7f5b93eae0dbf [1,1,0,0,0,0|2,0,0]=4 4017 B10R0.83 CC[C@@H](O)C(=O)NCCSC 0d5a3b831bd7ab7706b9d337df6267cd [1,1,0,0,0,0|2,0,0]=4 4018 B10R0.83 CC[C@H](O)C(=O)NCCCCl b61a2770e12c607a7c4c13079fe0da29 [1,1,0,0,0,0|2,0,0]=4 4019 B10R0.83 CC[C@H](O)C(=O)NCCCO 07e1ec970f418d460b98f9ea6d72bd3d [1,1,0,0,0,0|2,0,0]=4 4020 B10R0.83 CC[C@H](O)C(=O)NCCOC 12508f6e5ce78129e40dd490fd606d8b [1,1,0,0,0,0|2,0,0]=4 4021 B10R0.83 CC[C@H](O)C(=O)NCCSC 97369a1526f485b8e388718769cc5b54 [1,1,0,0,0,0|2,0,0]=4 4022 B10R0.83 CC[C@H](S)C(=O)NCCCCl 7a3054e875c4c61801bec677db59c13b [1,1,0,0,0,0|2,0,0]=4 4023 B10R0.83 CC[C@H](S)C(=O)NCCCO 306b56de5184e53997df2309b774e8e5 [1,1,0,0,0,0|2,0,0]=4 4024 B10R0.83 CC[C@H](S)C(=O)NCCOC df2bb1c0694eb9dfa23f664b32ee4b1d [1,1,0,0,0,0|2,0,0]=4 4025 B10R0.83 CC[C@H](S)C(=O)NCCSC 5ef56f1262bff7cdb07bd76d7eb1d7ec [1,1,0,0,0,0|2,0,0]=4 4026 B10R0.108 CCC(C)CNC(=O)CCF 90b38ea11e2854365f1896ee9544b73d [1,1,0,0,0,0|2,0,0]=4 4027 B10R0.108 CCC(C)CNC(=O)CCO 5f206f039df278a75b56b0edae95b828 [1,1,0,0,0,0|2,0,0]=4 4028 B10R0.108 CCC(C)CNC(=O)CCS de5977d5673b4c0680bdffdb9b8ab0a7 [1,1,0,0,0,0|2,0,0]=4 4029 B10R0.108 CCC(C)CNC(=O)COC 78e2c0ce9040fe760a4cd8f80bf92bee [1,1,0,0,0,0|2,0,0]=4 4030 B10R0.108 CCC(C)CNC(=O)CSC 0d636f102a10f14e93ff6aff78c1a81a [1,1,0,0,0,0|2,0,0]=4 4031 B10R0.108 CCC(C)OCC(=O)COC 7cb3d83083307a492a74b6446043376d [1,1,0,0,0,0|2,0,0]=4 4032 B10R0.108 CCC(O)CNC(=O)CCF 3866eb9117ae829aeda688427bd4a86c [1,1,0,0,0,0|2,0,0]=4 4033 B10R0.108 CCC(O)CNC(=O)CCO bde11ebc6991f24eaea387ae244053c1 [1,1,0,0,0,0|2,0,0]=4 4034 B10R0.108 CCC(O)CNC(=O)CCS 4c6f2a1cde2251899f8ff0130fb68fb3 [1,1,0,0,0,0|2,0,0]=4 4035 B10R0.108 CCC(O)CNC(=O)COC 38158b49d948454e666fc21da10af1ab [1,1,0,0,0,0|2,0,0]=4 4036 B10R0.108 CCC(O)CNC(=O)CSC d1ea3886a493afdb60d22c58d9d5466e [1,1,0,0,0,0|2,0,0]=4 4037 B10R0.108 CCCC(=O)CNC(C)CC a628358924cf0b79502e0c17fcc59c4d [1,1,0,0,0,0|1,0,0]=3 4038 B10R0.108 CCCC(=O)CNC(C)CO 623d83aaa974eb29f1a3cccef65393c2 [1,1,0,0,0,0|2,0,0]=4 4039 B10R0.108 CCCC(=O)CN[C@@H](C)CC e2297104809933b73fd319df0c337fbc [1,1,0,0,0,0|1,0,0]=3 4040 B10R0.108 CCCC(=O)CN[C@@H](C)CO 0a0036253e336698c95c398c99a22178 [1,1,0,0,0,0|2,0,0]=4 4041 B10R0.108 CCCC(=O)CN[C@H](C)CC c3c6970e7c9f8cda9a95ac382a74d40d [1,1,0,0,0,0|1,0,0]=3 4042 B10R0.108 CCCC(=O)CN[C@H](C)CO 0e13f354d9bfaba0b0ec904cccc3572b [1,1,0,0,0,0|2,0,0]=4 4043 B10R0.108 CCCC(=O)COC(C)CC 1256581baab2cd6985d50630ae332d34 [1,1,0,0,0,0|1,0,0]=3 4044 B10R0.108 CCCC(=O)COC(C)CF ca44e2b5533cf51d62822ebc75b6206a [1,1,0,0,0,0|2,0,0]=4 4045 B10R0.108 CCCC(=O)CO[C@@H](C)CC d5dc5c90cafeede78ef651f2739a6258 [1,1,0,0,0,0|1,0,0]=3 4046 B10R0.108 CCCC(=O)CO[C@H](C)CC 1bd012501e9168658d73d06f9bb542ff [1,1,0,0,0,0|1,0,0]=3 4047 B10R0.108 CCCC(=O)NCC(Br)CBr eadbb2e43f5ff4980ce187bf00337279 [1,1,0,0,0,0|2,0,0]=4 4048 B10R0.108 CCCC(=O)NCC(C)CC 11a7d7b226318edbbf3f3676dccd97fc [1,1,0,0,0,0|1,0,0]=3 4049 B10R0.108 CCCC(=O)NCC(C)CO b78a36e813fb23c724929b442391aec1 [1,1,0,0,0,0|2,0,0]=4 4050 B10R0.108 CCCC(=O)NCC(F)CO e82acb7919e86cb5e0430b08f0a89d08 [1,1,0,0,0,0|2,0,0]=4 4051 B10R0.108 CCCC(=O)NCC(O)CC e1547e4df4f917bb79a24b5c3077c899 [1,1,0,0,0,0|1,0,0]=3 4052 B10R0.108 CCCC(=O)NCC(O)CO 0483b411667cc5f0ad96ba6bcc7a68b9 [1,1,0,0,0,0|2,0,0]=4 4053 B10R0.108 CCCC(=O)NC[C@@H](C)CC 0afec490b93d1eb381bf8bfbe16e3fea [1,1,0,0,0,0|1,0,0]=3 4054 B10R0.108 CCCC(=O)NC[C@@H](C)OC 152380dbc49127e78f4033824ad2fd2a [1,1,0,0,0,0|2,0,0]=4 4055 B10R0.108 CCCC(=O)NC[C@@H](F)CO 427c86ec144f8ddfb9dc1df40d352bb8 [1,1,0,0,0,0|2,0,0]=4 4056 B10R0.108 CCCC(=O)NC[C@@H](O)CO 2071a3b63cf42cc1bf372b50a34963e5 [1,1,0,0,0,0|2,0,0]=4 4057 B10R0.108 CCCC(=O)NC[C@H](C)CO 3235276eaa49b26ed831c09e835790df [1,1,0,0,0,0|2,0,0]=4 4058 B10R0.108 CCCC(=O)NC[C@H](C)OC b4e591d9ea7bf4fac674c5273fa02220 [1,1,0,0,0,0|2,0,0]=4 4059 B10R0.108 CCCC(=O)NC[C@H](F)CO 74319261c7010cdf44ff3073deca455f [1,1,0,0,0,0|2,0,0]=4 4060 B10R0.108 CCCC(=O)NC[C@H](O)CC 338b06d510eaf7035158174f3623662e [1,1,0,0,0,0|1,0,0]=3 4061 B10R0.108 CCCC(=O)NC[C@H](O)CO 89e3bf4751a24a33f5741b26663eb5f9 [1,1,0,0,0,0|2,0,0]=4 4062 B10R0.108 CCCC(=O)OCN(C)CC 6c76f8de0dd33f11a103f253719132f6 [1,1,0,0,0,0|2,0,0]=4 4063 B10R0.108 CCCC(=S)OCC(C)CC e16cb751e3d09d9ad5b0df3db569de2c [1,1,0,0,0,0|1,1,0]=4 4064 B10R0.108 CCCC(=S)OC[C@@H](C)CC 19d37b226cb00bbdb75e432dcb10b8d2 [1,1,0,0,0,0|1,1,0]=4 4065 B10R0.108 CCCC(=S)OC[C@H](C)CC 44ca62e53a524d9067426b0ec06152ea [1,1,0,0,0,0|1,1,0]=4 4066 B10R0.108 CCCN(C)CCC(C)CC f5a96392838671fbcb0194b339187ea6 [1,1,0,0,0,0|2,0,0]=4 4067 B10R0.108 CCNC(=O)CCN(C)CC a5bb2c57effa5ff8abaac5c3b07945f1 [1,1,0,0,0,0|2,0,0]=4 4068 B10R0.108 CCNC(=O)CNC(C)CC 17118d0fc8c21ce320c29a0775647418 [1,1,0,0,0,0|2,0,0]=4 4069 B10R0.108 CCNC(=O)CN[C@@H](C)CC 96afd7b44f2f9e39911c9362dec121ae [1,1,0,0,0,0|2,0,0]=4 4070 B10R0.108 CCNC(=O)CN[C@H](C)CC 0eaafcf5afe7452521f2447b767356c5 [1,1,0,0,0,0|2,0,0]=4 4071 B10R0.108 CCNC(=O)COC(C)CC 1273c9479a94ab11fcb2900bc057da5d [1,1,0,0,0,0|2,0,0]=4 4072 B10R0.108 CCNC(=O)CO[C@@H](C)CC 43e4e9b57571e5b2268183b4612762a9 [1,1,0,0,0,0|2,0,0]=4 4073 B10R0.108 CCNC(=O)CO[C@H](C)CC 89402afd0315626028c4b3ac0e1c32b1 [1,1,0,0,0,0|2,0,0]=4 4074 B10R0.108 CCOC(=O)CCN(C)CC bc7fbb16102d873e6f0f2d3df2a1f365 [1,1,0,0,0,0|1,0,0]=3 4075 B10R0.108 CCOC(=O)CCN(C)CF dfd4e454d5d3cf51d8ada576c16da418 [1,1,0,0,0,0|2,0,0]=4 4076 B10R0.108 CCOC(=O)CCN(C)CO fbc4a189fc943b22d0d169d127b13ebb [1,1,0,0,0,0|2,0,0]=4 4077 B10R0.108 CCOC(=O)CNC(=O)CC d3d7341838c871ad43be6029bfd75589 [1,1,0,0,0,0|1,0,1]=4 4078 B10R0.108 CCOC(=O)CNC(C)CC d46fa60bd0ff368638f159a500d0ab11 [1,1,0,0,0,0|1,0,0]=3 4079 B10R0.108 CCOC(=O)CNC(C)CO 797728f95efc118b42238406da5c1565 [1,1,0,0,0,0|2,0,0]=4 4080 B10R0.108 CCOC(=O)CN[C@@H](C)CC 1307e59106bd58042bdd5ff77d08a18f [1,1,0,0,0,0|1,0,0]=3 4081 B10R0.108 CCOC(=O)CN[C@@H](C)CO f1d62278484a18849dd1f6bb7080c9c3 [1,1,0,0,0,0|2,0,0]=4 4082 B10R0.108 CCOC(=O)CN[C@H](C)CC 86d61570b7e1983cda87ef92f9f90921 [1,1,0,0,0,0|1,0,0]=3 4083 B10R0.108 CCOC(=O)CN[C@H](C)CO 6870e0561b349ce5a72be9b2e4234caf [1,1,0,0,0,0|2,0,0]=4 4084 B10R0.108 CCOC(=O)COC(C)CC 2306425ab51f4660a9ac8b49e518bd60 [1,1,0,0,0,0|1,0,0]=3 4085 B10R0.108 CCOC(=O)COC(C)CF 12de0f551ca2fc09618ecc3bb1190e9a [1,1,0,0,0,0|2,0,0]=4 4086 B10R0.108 CCOC(=O)COC(C)CS 8fe114c2b82894cff4c27e70f862f5b0 [1,1,0,0,0,0|2,0,0]=4 4087 B10R0.108 CCOC(=O)CO[C@@H](C)CC dddb522505023f177838e88edb68a848 [1,1,0,0,0,0|1,0,0]=3 4088 B10R0.108 CCOC(=O)CO[C@H](C)CC 6020ee214a85fd789131c5f0983729c0 [1,1,0,0,0,0|1,0,0]=3 4089 B10R0.108 CCOC(=O)CO[C@H](C)CS 13003fd025b5ea4081cf86ec3978d3ea [1,1,0,0,0,0|2,0,0]=4 4090 B10R0.108 CCOC(=O)OCN(C)CC e5cf37d77f8b082fb54d39684c51e485 [1,1,0,0,0,0|2,0,0]=4 4091 B10R0.108 CCOC(C)CCC(C)CC a022098aac07521ba0782f55f38c17af [1,1,0,0,0,0|1,0,1]=4 4092 B10R0.108 CC[C@@H](C)OCC(=O)COC 5ee417c56b1d43e4d70950221532da0e [1,1,0,0,0,0|2,0,0]=4 4093 B10R0.108 CC[C@@H](O)CNC(=O)CCF aaa219a27914bf1d172c54faa3b1e32c [1,1,0,0,0,0|2,0,0]=4 4094 B10R0.108 CC[C@@H](O)CNC(=O)CCO 2e59938b3b6729fe54a07275f5b02997 [1,1,0,0,0,0|2,0,0]=4 4095 B10R0.108 CC[C@@H](O)CNC(=O)CCS 0c3f2f0e6882f8a32156060583b021ff [1,1,0,0,0,0|2,0,0]=4 4096 B10R0.108 CC[C@@H](O)CNC(=O)COC 465ca9adc182a4642396e91f1e782fe8 [1,1,0,0,0,0|2,0,0]=4 4097 B10R0.108 CC[C@@H](O)CNC(=O)CSC 6bdab830640b58d515dc82df2ee50bc1 [1,1,0,0,0,0|2,0,0]=4 4098 B10R0.108 CC[C@H](C)CNC(=O)CCF 1dcb43a6ca27cb1bc9584064523665da [1,1,0,0,0,0|2,0,0]=4 4099 B10R0.108 CC[C@H](C)CNC(=O)CCO f198519df6a38780e5fb42bdf436c71b [1,1,0,0,0,0|2,0,0]=4 4100 B10R0.108 CC[C@H](C)CNC(=O)CCS 810c3a432f8028f2ac0f341ac42d13ea [1,1,0,0,0,0|2,0,0]=4 4101 B10R0.108 CC[C@H](C)CNC(=O)COC 3c99596929b796c1d0fa161c28f4680c [1,1,0,0,0,0|2,0,0]=4 4102 B10R0.108 CC[C@H](C)CNC(=O)CSC 95051d8afb14b977f4244a15a44b6fe0 [1,1,0,0,0,0|2,0,0]=4 4103 B10R0.108 CC[C@H](C)OCC(=O)COC 418c7b4e1977d92054479c59cef7f81b [1,1,0,0,0,0|2,0,0]=4 4104 B10R0.156 CCOCCS(=O)(=O)OCC 5ba4c021ad23f884621b84540e5211d3 [1,1,0,0,0,0|2,0,0]=4 4105 B10R0.16 C#CC(CCCC)OCCC 85b4e43a5d58cb71e6f759987b99c0c0 [1,1,0,0,0,0|1,0,1]=4 4106 B10R0.16 C=CC(CCCC)OCCC 0441f9cfc81e0c1f5e5544f7766b442c [1,1,0,0,0,0|1,0,1]=4 4107 B10R0.16 CCCCC(CC)OCCC b3bc95738f3642c32c67c66055eecfb0 [1,1,0,0,0,0|1,0,1]=4 4108 B10R0.16 CCCCN(C=O)CCCC ea96c0b4503c73e427961c44193cc2a3 [1,1,0,0,0,0|2,0,0]=4 4109 B10R0.18 CCC(C)CC(=O)NCCBr e275dea69b759e83210823a34d3ef56f [1,1,0,0,0,0|2,0,0]=4 4110 B10R0.18 CCC(C)CC(=O)NCCF daab483ee66f18c82ea07cf6701f96da [1,1,0,0,0,0|2,0,0]=4 4111 B10R0.18 CCC(C)CC(=O)NCCI 56a239ffe0ec18f41c6330117453fa87 [1,1,0,0,0,0|2,0,0]=4 4112 B10R0.18 CCC(C)CC(=O)NCCO 8e189b9ea75e5f8c9db30ca67d60d027 [1,1,0,0,0,0|2,0,0]=4 4113 B10R0.18 CCC(C)CC(=O)NCCS 42452ef2a80fed35c554383abca6256b [1,1,0,0,0,0|2,0,0]=4 4114 B10R0.18 CCC(C)NC(=O)CCCF 8bdd73463bccfd7cb4cbb134b8d5c853 [1,1,0,0,0,0|2,0,0]=4 4115 B10R0.18 CCC(C)NC(=O)CCCS d561582ec432507a485ab8fc13d773dc [1,1,0,0,0,0|2,0,0]=4 4116 B10R0.18 CCC(C)NC(=O)CCOC 641cfbdf5d982fe249468a3a4a6297d9 [1,1,0,0,0,0|2,0,0]=4 4117 B10R0.18 CCC(C)NC(=O)CCSC 1620e7c852a3cdd4c9ffa53282a49cb9 [1,1,0,0,0,0|2,0,0]=4 4118 B10R0.18 CCC(O)CC(=O)NCCBr 2fad4b5b6ddf8d967ded143a2700c807 [1,1,0,0,0,0|2,0,0]=4 4119 B10R0.18 CCC(O)CC(=O)NCCF 4b119b6b547bf473bf75226f888ec4a8 [1,1,0,0,0,0|2,0,0]=4 4120 B10R0.18 CCC(O)CC(=O)NCCI 0d6427bab3afe870a476f77d1a85d02a [1,1,0,0,0,0|2,0,0]=4 4121 B10R0.18 CCC(O)CC(=O)NCCO 878f8c4bb1f0bd1a588a6f8354f630f2 [1,1,0,0,0,0|2,0,0]=4 4122 B10R0.18 CCC(O)CC(=O)NCCS d74566de518a8e7b8ec3fb1444cf3899 [1,1,0,0,0,0|2,0,0]=4 4123 B10R0.18 CCCCC(=O)NC(C)CC 66126c31817673513d98b81982cf5c54 [1,1,0,0,0,0|1,0,0]=3 4124 B10R0.18 CCCCC(=O)NC(C)CO 3a6b1d0f8d6a7c276d99923dd52f097d [1,1,0,0,0,0|2,0,0]=4 4125 B10R0.18 CCCCC(=O)N[C@@H](C)CC a8093d37d1e960af43829239eda7d35d [1,1,0,0,0,0|1,0,0]=3 4126 B10R0.18 CCCCC(=O)N[C@@H](C)CO e96f9ccffcf44845a37410d8736ebaaa [1,1,0,0,0,0|2,0,0]=4 4127 B10R0.18 CCCCC(=O)N[C@H](C)CC 600d18adc05fbe11c2db7063e3618b34 [1,1,0,0,0,0|1,0,0]=3 4128 B10R0.18 CCCCC(=O)N[C@H](C)CO b8dbff3e6fafa369cd399df98150e9b6 [1,1,0,0,0,0|2,0,0]=4 4129 B10R0.18 CCCCC(C)OC(C)CC 52fd5692cca2410ff5de3d647587d79f [1,1,0,0,0,0|1,0,1]=4 4130 B10R0.18 CCCCC(C)O[C@@H](C)CC b672df34058a2af6caf19c03bd3eaf83 [1,1,0,0,0,0|1,0,1]=4 4131 B10R0.18 CCCCC(C)O[C@H](C)CC 702732c470493776839d713a357bb8f4 [1,1,0,0,0,0|1,0,1]=4 4132 B10R0.18 CCCC[C@@H](C)OC(C)CC 720108f7d255cb2777492d9c3eb216ba [1,1,0,0,0,0|1,0,1]=4 4133 B10R0.18 CCCC[C@H](C)OC(C)CC 051a29645f9a60a791889505d35d2b86 [1,1,0,0,0,0|1,0,1]=4 4134 B10R0.18 CCCNC(=O)CC(C)CC 4c4f8fe261881851b62ab55c2740ab1a [1,1,0,0,0,0|1,0,0]=3 4135 B10R0.18 CCCNC(=O)CC(C)OC 87a5e50d60dfda50644564ed455ee634 [1,1,0,0,0,0|2,0,0]=4 4136 B10R0.18 CCCNC(=O)CC(O)CC e2661de1468831a1cb5be0cc9960be70 [1,1,0,0,0,0|1,0,0]=3 4137 B10R0.18 CCCNC(=O)CN(C)CC f85640f21c36b4932fdd712c45fd1f41 [1,1,0,0,0,0|2,0,0]=4 4138 B10R0.18 CCCNC(=O)C[C@@H](C)CC a12fb7ae49d87e68463480fe3b1f957a [1,1,0,0,0,0|1,0,0]=3 4139 B10R0.18 CCCNC(=O)C[C@@H](O)CC b319bf22901f30ddb87f9b02d3b82853 [1,1,0,0,0,0|1,0,0]=3 4140 B10R0.18 CCCNC(=O)C[C@H](C)CC b32afbc6813ea3db814c356e80dd4c0f [1,1,0,0,0,0|1,0,0]=3 4141 B10R0.18 CCCNC(=O)C[C@H](O)CC 01d0070347df3672246380ebb226191f [1,1,0,0,0,0|1,0,0]=3 4142 B10R0.18 CCCNC(=O)NC(C)CC e9f0bcd327cbfa03bbecfb84206fadba [1,1,0,0,0,0|2,0,0]=4 4143 B10R0.18 CCCNC(=O)N[C@@H](C)CC 57ef32d64cea32f01839aad9c14d364b [1,1,0,0,0,0|2,0,0]=4 4144 B10R0.18 CCCNC(=O)N[C@H](C)CC 09cdaab2d1e464161e150dd284c13b39 [1,1,0,0,0,0|2,0,0]=4 4145 B10R0.18 CCCOC(=O)CN(C)CC 1436269e2cab00cc446280e33b4f8d3e [1,1,0,0,0,0|1,0,0]=3 4146 B10R0.18 CCOCC(=O)NC(C)CC a87ed24a35103178e2eddb240f6e200c [1,1,0,0,0,0|2,0,0]=4 4147 B10R0.18 CCOCC(=O)N[C@@H](C)CC c634cf2ad1ca94802b3b4ddbda0425ef [1,1,0,0,0,0|2,0,0]=4 4148 B10R0.18 CCOCC(=O)N[C@H](C)CC 96c7fa82852cd37bf1b9f17ddad1738e [1,1,0,0,0,0|2,0,0]=4 4149 B10R0.18 CCSCC(=O)NC(C)CC 7b839e8fd5dea7645d9edc265b5213fd [1,1,0,0,0,0|2,0,0]=4 4150 B10R0.18 CCSCC(=O)N[C@@H](C)CC eff0cdae6ce13d9a5dc00889ad83e9dd [1,1,0,0,0,0|2,0,0]=4 4151 B10R0.18 CCSCC(=O)N[C@H](C)CC 26765a0dd464cf51a66ed1e82c309b2d [1,1,0,0,0,0|2,0,0]=4 4152 B10R0.18 CC[C@@H](C)CC(=O)NCCBr e546415f0bca959dec661fbd526fbcde [1,1,0,0,0,0|2,0,0]=4 4153 B10R0.18 CC[C@@H](C)CC(=O)NCCF cedacdc2018697d061dbdde245cc257e [1,1,0,0,0,0|2,0,0]=4 4154 B10R0.18 CC[C@@H](C)CC(=O)NCCI 63da44c8b222945b7c5605003fe38f3f [1,1,0,0,0,0|2,0,0]=4 4155 B10R0.18 CC[C@@H](C)CC(=O)NCCO 62b90f8f5a57b6b59a75a5038df934b8 [1,1,0,0,0,0|2,0,0]=4 4156 B10R0.18 CC[C@@H](C)CC(=O)NCCS 067f759a4dae25bb7f5adbbbd0ced713 [1,1,0,0,0,0|2,0,0]=4 4157 B10R0.18 CC[C@@H](C)NC(=O)CCCF 5c124eaab9df5a13a669e63122c6c046 [1,1,0,0,0,0|2,0,0]=4 4158 B10R0.18 CC[C@@H](C)NC(=O)CCCS 073def5d135d1c92871fc119f9a4305f [1,1,0,0,0,0|2,0,0]=4 4159 B10R0.18 CC[C@@H](C)NC(=O)CCOC 857a4d1059b5abdc579b7a7bd137f50d [1,1,0,0,0,0|2,0,0]=4 4160 B10R0.18 CC[C@@H](C)NC(=O)CCSC 2507ccc0a2663314249c1aebb46ab9e2 [1,1,0,0,0,0|2,0,0]=4 4161 B10R0.18 CC[C@@H](O)CC(=O)NCCBr 2e2d3cf45da46be1b65fc51c6175bec9 [1,1,0,0,0,0|2,0,0]=4 4162 B10R0.18 CC[C@@H](O)CC(=O)NCCF f35c753b552c62bcd52d0652d9244ac0 [1,1,0,0,0,0|2,0,0]=4 4163 B10R0.18 CC[C@@H](O)CC(=O)NCCI 83f85fe8cb0dfbce62138a365bc85316 [1,1,0,0,0,0|2,0,0]=4 4164 B10R0.18 CC[C@@H](O)CC(=O)NCCO 66a0a03dadc8cd59094771af013edfcd [1,1,0,0,0,0|2,0,0]=4 4165 B10R0.18 CC[C@@H](O)CC(=O)NCCS 85cda7ed57e20a9acfa6cc672b677b44 [1,1,0,0,0,0|2,0,0]=4 4166 B10R0.18 CC[C@H](C)CC(=O)NCCBr 88ff757f236a53cdc0f1fe577370f191 [1,1,0,0,0,0|2,0,0]=4 4167 B10R0.18 CC[C@H](C)CC(=O)NCCF 54764ae4b47b8ab21dad0c20e096fbe5 [1,1,0,0,0,0|2,0,0]=4 4168 B10R0.18 CC[C@H](C)CC(=O)NCCI 22843df0583993e4a865d2d871115f75 [1,1,0,0,0,0|2,0,0]=4 4169 B10R0.18 CC[C@H](C)CC(=O)NCCO 2ef684186ffa6a07fb0aa46088b5f332 [1,1,0,0,0,0|2,0,0]=4 4170 B10R0.18 CC[C@H](C)CC(=O)NCCS 1c4f66b6f6c2c362b579b17fdefe33a5 [1,1,0,0,0,0|2,0,0]=4 4171 B10R0.18 CC[C@H](C)NC(=O)CCCF d517bb9824cbc32713f7b63143cef213 [1,1,0,0,0,0|2,0,0]=4 4172 B10R0.18 CC[C@H](C)NC(=O)CCCS 4d8ee186a8ce4b7fc0191d27cfb929a2 [1,1,0,0,0,0|2,0,0]=4 4173 B10R0.18 CC[C@H](C)NC(=O)CCOC 5952a4058e67da9e2f06ca784072badf [1,1,0,0,0,0|2,0,0]=4 4174 B10R0.18 CC[C@H](C)NC(=O)CCSC 78d9f26c0b72ad6250a47e9f0ec86466 [1,1,0,0,0,0|2,0,0]=4 4175 B10R0.18 CC[C@H](O)CC(=O)NCCBr fcea9cebb929883080ae557fda3bd4c7 [1,1,0,0,0,0|2,0,0]=4 4176 B10R0.18 CC[C@H](O)CC(=O)NCCF 39963ba3b6fa350f6f7ba94f86a9d532 [1,1,0,0,0,0|2,0,0]=4 4177 B10R0.18 CC[C@H](O)CC(=O)NCCI 8134439d8855e81c84dc48fb158ce902 [1,1,0,0,0,0|2,0,0]=4 4178 B10R0.18 CC[C@H](O)CC(=O)NCCO 059bf11d40a8eee659952ce5bd589705 [1,1,0,0,0,0|2,0,0]=4 4179 B10R0.18 CC[C@H](O)CC(=O)NCCS 864cd8ee95790033321cafd2a516f7f2 [1,1,0,0,0,0|2,0,0]=4 4180 B10R0.78 C=C(C)CCC(=O)NCCC 4f60a39f997ebb603154ef8d9736f96b [1,1,0,0,0,0|1,0,1]=4 4181 B10R0.78 C=C(C)CNC(=O)CCCC 424bb16b413498fd8a8b6f752d411919 [1,1,0,0,0,0|1,0,1]=4 4182 B10R0.78 CC(C)CCC(=O)NCCBr f457bbdd2b68ba0b145eb08ace7d87a2 [1,1,0,0,0,0|2,0,0]=4 4183 B10R0.78 CC(C)CCC(=O)NCCF b5ee0540008152cacc38981b290eab45 [1,1,0,0,0,0|2,0,0]=4 4184 B10R0.78 CC(C)CCC(=O)NCCI 26f90be714e3cbae31b66fb8977f93d7 [1,1,0,0,0,0|2,0,0]=4 4185 B10R0.78 CC(C)CCC(=O)NCCO 8a516e827806e151953bc2972daabbad [1,1,0,0,0,0|2,0,0]=4 4186 B10R0.78 CC(C)CCC(=O)NCCS b5fae44e74a28f4b11f69611bdc76bbb [1,1,0,0,0,0|2,0,0]=4 4187 B10R0.78 CC(C)CNC(=O)CCCF 6ef65b426473afe223a093a5e0d719bc [1,1,0,0,0,0|2,0,0]=4 4188 B10R0.78 CC(C)CNC(=O)CCCS e105d43fb88356a913b64e09d73dd501 [1,1,0,0,0,0|2,0,0]=4 4189 B10R0.78 CC(O)CCC(=O)NCCBr 8572e5242711455ba0221cfd53332ff3 [1,1,0,0,0,0|2,0,0]=4 4190 B10R0.78 CC(O)CCC(=O)NCCF b52b8d7e812a187916b9321abf6cbb94 [1,1,0,0,0,0|2,0,0]=4 4191 B10R0.78 CC(O)CCC(=O)NCCI a2577ab7aaac3517c75c7d3426f0d8f4 [1,1,0,0,0,0|2,0,0]=4 4192 B10R0.78 CC(O)CCC(=O)NCCO 5b598a52abfe774030d4d4d373d9f913 [1,1,0,0,0,0|2,0,0]=4 4193 B10R0.78 CC(O)CCC(=O)NCCS 0c8b4029f34c14a4c79de194843bcaf2 [1,1,0,0,0,0|2,0,0]=4 4194 B10R0.78 CC(O)CNC(=O)CCCF e126759b5380137394ea5b3d4fb80835 [1,1,0,0,0,0|2,0,0]=4 4195 B10R0.78 CC(O)CNC(=O)CCCS aef99d223b78c83869d8c786e80091a4 [1,1,0,0,0,0|2,0,0]=4 4196 B10R0.78 CC(S)CCC(=O)NCCBr aac46c1532e123bae54929c13b78cfd1 [1,1,0,0,0,0|2,0,0]=4 4197 B10R0.78 CC(S)CCC(=O)NCCF 607081ada410f2ce45bad89c0f49cde6 [1,1,0,0,0,0|2,0,0]=4 4198 B10R0.78 CC(S)CCC(=O)NCCI ff9395dda8a3547b69ce86ed8fdd5829 [1,1,0,0,0,0|2,0,0]=4 4199 B10R0.78 CC(S)CCC(=O)NCCO 3ac0adc080ef65fc80059759bf21062b [1,1,0,0,0,0|2,0,0]=4 4200 B10R0.78 CC(S)CCC(=O)NCCS 0d7504bd4ee8c2f7b993f2deeaa6e7e5 [1,1,0,0,0,0|2,0,0]=4 4201 B10R0.78 CCCCC(=O)NCC(=O)C 9bab1a410a486ddb153f70cacac7f1be [1,1,0,0,0,0|1,0,1]=4 4202 B10R0.78 CCCCC(=O)NCC(C)C c290f9d1e0639c9d561da0f8031a443b [1,1,0,0,0,0|1,0,0]=3 4203 B10R0.78 CCCCC(=O)NCC(C)O 568b237fd2b370f9546f2e305fabda24 [1,1,0,0,0,0|1,0,0]=3 4204 B10R0.78 CCCCC(=O)NCC(F)F ced3f8ae58d4b6ccaa4de9e68206b6dc [1,1,0,0,0,0|2,0,0]=4 4205 B10R0.78 CCCCC(=O)NC[C@@H](C)O 93ec06cc628212a108704ef43ff8f5ea [1,1,0,0,0,0|1,0,0]=3 4206 B10R0.78 CCCCC(=O)NC[C@H](C)O 3b9f4bfbbb42750ee94d3804e1fbaeb9 [1,1,0,0,0,0|1,0,0]=3 4207 B10R0.78 CCCCC(C)OCC(C)C 424a9ec68821a73c9abd043a56d36755 [1,1,0,0,0,0|1,0,1]=4 4208 B10R0.78 CCCCC(C)OCC(C)F ca810602a7bdba0b2b278dea4244cb73 [1,1,0,0,0,0|1,0,1]=4 4209 B10R0.78 CCCCC(C)OCC(C)S d1716fbaa66d92a54984b674eb4ea54d [1,1,0,0,0,0|1,0,1]=4 4210 B10R0.78 CCCCC(C)OC[C@@H](C)F 7ac2eeef51d26016295b9c17ad8407b9 [1,1,0,0,0,0|1,0,1]=4 4211 B10R0.78 CCCCC(C)OC[C@H](C)F ac7320502310b7fc2314b5fbe4095a83 [1,1,0,0,0,0|1,0,1]=4 4212 B10R0.78 CCCC[C@@H](C)OCC(C)C 69854bf27cf9a7ee910ab3ea5de8aafa [1,1,0,0,0,0|1,0,1]=4 4213 B10R0.78 CCCC[C@H](C)OCC(C)C 12b19b39acbd6ea3571522d462876754 [1,1,0,0,0,0|1,0,1]=4 4214 B10R0.78 CCCNC(=O)CCC(=O)C 3cf255f5f8f0e0f3ac79a021f8aeb248 [1,1,0,0,0,0|1,0,1]=4 4215 B10R0.78 CCCNC(=O)CCC(C)C 5d8d223c4f6b9b70f6b36cfef34364aa [1,1,0,0,0,0|1,0,0]=3 4216 B10R0.78 CCCNC(=O)CCC(C)O 105f846634ac67225d75f12a50b44aa8 [1,1,0,0,0,0|1,0,0]=3 4217 B10R0.78 CCCNC(=O)CCC(C)S 2f628d3069432db32841bdeeee8c8a63 [1,1,0,0,0,0|1,0,0]=3 4218 B10R0.78 CCCNC(=O)CCC(F)F e39fe080405576cb472ec5fcef942230 [1,1,0,0,0,0|2,0,0]=4 4219 B10R0.78 CCCNC(=O)CCN(C)C f0056bcb8ad1ea1c67ca37fd46f7ff39 [1,1,0,0,0,0|2,0,0]=4 4220 B10R0.78 CCCNC(=O)CCS(=O)C 0ea545ed679e40922c5a738cf0a3ab54 [1,1,0,0,0,0|2,0,0]=4 4221 B10R0.78 CCCNC(=O)CC[C@H](C)S 523e40bdbfb48e63a34ea9bfdb7223ef [1,1,0,0,0,0|1,0,0]=3 4222 B10R0.78 CCCNC(=O)CNC(C)C 2b629bcacb560562c52ef87439cc3dc4 [1,1,0,0,0,0|2,0,0]=4 4223 B10R0.78 CCCNC(=O)COC(C)C 46558cbbc61a2d91255bcd9d018e50e9 [1,1,0,0,0,0|2,0,0]=4 4224 B10R0.78 CCCNC(=O)CSC(C)C b15a562c7b0c99302f3e4eceda91dd3f [1,1,0,0,0,0|2,0,0]=4 4225 B10R0.78 CCCNC(=O)NCC(C)C 816d0ba9cc2f17932b73f49434060a5a [1,1,0,0,0,0|2,0,0]=4 4226 B10R0.78 CCCNC(=O)NCC(C)O d5ef9f61001064bda1cdeed06c0a8cdc [1,1,0,0,0,0|2,0,0]=4 4227 B10R0.78 CCCNC(=O)NC[C@@H](C)O 9f48fb3cef42d99e8fd9378686ab41f0 [1,1,0,0,0,0|2,0,0]=4 4228 B10R0.78 CCCNC(=O)NC[C@H](C)O 4480e9e12f291e6d6d5a6fd983030742 [1,1,0,0,0,0|2,0,0]=4 4229 B10R0.78 CCCOC(=O)COC(C)C ed3bd2f90c01a7e884ddf910a52664da [1,1,0,0,0,0|1,0,0]=3 4230 B10R0.78 CCCOC(C)CCC(C)C 92fbf3922e6291cdd2053138c92ceec3 [1,1,0,0,0,0|1,0,1]=4 4231 B10R0.78 CCOCC(=O)NCC(C)C df9f63771681f3c12f00451c8ca2267f [1,1,0,0,0,0|2,0,0]=4 4232 B10R0.78 CCOCC(=O)NCC(C)O 6299aca6fb74b63f35640b208702097c [1,1,0,0,0,0|2,0,0]=4 4233 B10R0.78 CCOCC(=O)NC[C@@H](C)O cd76e1cbb15343c84f6fdaecae471501 [1,1,0,0,0,0|2,0,0]=4 4234 B10R0.78 CCOCC(=O)NC[C@H](C)O c7f943461d4382c1e44ffb241ee22088 [1,1,0,0,0,0|2,0,0]=4 4235 B10R0.78 CCSCC(=O)NCC(C)C ca8168484b019fac81a12be8a2e18b34 [1,1,0,0,0,0|2,0,0]=4 4236 B10R0.78 CCSCC(=O)NCC(C)O 490b2cc1f9d46803fead95638d3fb72a [1,1,0,0,0,0|2,0,0]=4 4237 B10R0.78 CCSCC(=O)NC[C@@H](C)O 50be0d23c34fc9efa161e0e4a5af70cd [1,1,0,0,0,0|2,0,0]=4 4238 B10R0.78 CCSCC(=O)NC[C@H](C)O 9965c492d3691b61b18e243bedc8f5dd [1,1,0,0,0,0|2,0,0]=4 4239 B10R0.78 COCCC(=O)NCC(C)C 4bb2ef4f141bf11a31d5bfc57a02caff [1,1,0,0,0,0|2,0,0]=4 4240 B10R0.78 COCCC(=O)NCC(C)O 304f8f926fb14ca451fdd180c3bccb53 [1,1,0,0,0,0|2,0,0]=4 4241 B10R0.78 COCCC(=O)NC[C@@H](C)O 2cbff31703c3f013f3902d531049a24a [1,1,0,0,0,0|2,0,0]=4 4242 B10R0.78 COCCC(=O)NC[C@H](C)O 8fb7941fdcb653ae4e5e322366e77240 [1,1,0,0,0,0|2,0,0]=4 4243 B10R0.78 CSCCC(=O)NCC(C)C 389fd7062d53632d80e05c444fce57d3 [1,1,0,0,0,0|2,0,0]=4 4244 B10R0.78 CSCCC(=O)NCC(C)O 02090a87dc0bd243190c161fe3176ea3 [1,1,0,0,0,0|2,0,0]=4 4245 B10R0.78 CSCCC(=O)NC[C@@H](C)O 1043d586e6b4bbbf2154d195c0d00de4 [1,1,0,0,0,0|2,0,0]=4 4246 B10R0.78 CSCCC(=O)NC[C@H](C)O 7d6c80084532af99f909790fed64b027 [1,1,0,0,0,0|2,0,0]=4 4247 B10R0.78 C[C@@H](O)CNC(=O)CCCF b2389b508c5c79b6efe20d63a3ae18ef [1,1,0,0,0,0|2,0,0]=4 4248 B10R0.78 C[C@@H](O)CNC(=O)CCCS 6343ad359accbafba1d3d01a37ac2034 [1,1,0,0,0,0|2,0,0]=4 4249 B10R0.78 C[C@H](O)CNC(=O)CCCF 0733e6db6e45e11d8d7d9219487a3ad2 [1,1,0,0,0,0|2,0,0]=4 4250 B10R0.78 C[C@H](O)CNC(=O)CCCS 4f10a37730c8c234bfa3f08a33eb5c9e [1,1,0,0,0,0|2,0,0]=4 4251 B10R0.78 C[C@H](S)CCC(=O)NCCBr 82f70bacf485a6bd436687589bac8815 [1,1,0,0,0,0|2,0,0]=4 4252 B10R0.78 C[C@H](S)CCC(=O)NCCF 6187fd889741d186873247a3b3b5ae97 [1,1,0,0,0,0|2,0,0]=4 4253 B10R0.78 C[C@H](S)CCC(=O)NCCI 632d76c2f5190b975e18c42abb8427e4 [1,1,0,0,0,0|2,0,0]=4 4254 B10R0.78 C[C@H](S)CCC(=O)NCCO 4db89437043681762fc45430f4e8f770 [1,1,0,0,0,0|2,0,0]=4 4255 B10R0.78 C[C@H](S)CCC(=O)NCCS b0d080993cbef2252955d8c1041fc71f [1,1,0,0,0,0|2,0,0]=4 4256 B10R0.4 C=C(C)COCCCCCC 18580082a3e432d96826bd208c01f2c4 [1,1,0,0,0,0|0,0,2]=4 4257 B10R0.4 CC(C)CCCCOCCF 3784da788f95a661a44c6c3924a92089 [1,1,0,0,0,0|1,0,1]=4 4258 B10R0.4 CC(C)CCCCOCCS 92b82fb2c2bed3da0c1b8153f711adbf [1,1,0,0,0,0|1,0,1]=4 4259 B10R0.4 CC(C)COCCCCCF eb745bae9696944320ec2014e01d309a [1,1,0,0,0,0|1,0,1]=4 4260 B10R0.4 CC(F)COCCCCCF df62180cf6e58bb955511b8b02e85d33 [1,1,0,0,0,0|1,0,1]=4 4261 B10R0.4 CC(S)COCCCCCF 12cc684406b8652f26ec730a9d08d8c0 [1,1,0,0,0,0|1,0,1]=4 4262 B10R0.4 CCC/C=C/CNCC(C)C bf33c18b32fc4f099004cfa5dc97b5dc [1,1,0,0,0,0|2,0,0]=4 4263 B10R0.4 CCC/C=C/CNCC(C)O 88f4b9025d580f29c24456f15851a0eb [1,1,0,0,0,0|2,0,0]=4 4264 B10R0.4 CCC/C=C/CNC[C@@H](C)O 90fe731cc95a1bb87094f7ebc8d7568b [1,1,0,0,0,0|2,0,0]=4 4265 B10R0.4 CCC/C=C/CNC[C@H](C)O e0cd0f48aaec74442b1334061bd158b2 [1,1,0,0,0,0|2,0,0]=4 4266 B10R0.4 CCC/C=C/COCC(C)C 6aee71388aa393a00f90feabc9db34d1 [1,1,0,0,0,0|2,0,0]=4 4267 B10R0.4 CCC/C=C/COCC(C)F aa78cce1831b7a69d0dfafcfacf38862 [1,1,0,0,0,0|2,0,0]=4 4268 B10R0.4 CCC/C=C/COCC(C)S 58fe6b7b04b1178d6321b697f5da9208 [1,1,0,0,0,0|2,0,0]=4 4269 B10R0.4 CCC/C=C/COC[C@@H](C)F 37fb6827cd1dd490e069c28b40ee7de3 [1,1,0,0,0,0|2,0,0]=4 4270 B10R0.4 CCC/C=C/COC[C@H](C)F ff53ba64e19414cdcf7bef969f6c1e96 [1,1,0,0,0,0|2,0,0]=4 4271 B10R0.4 CCC/C=C\CCOC(C)C 6439288e8c74ee1a7d86b821ddbd6d80 [1,1,0,0,0,0|2,0,0]=4 4272 B10R0.4 CCC/C=C\CNCC(C)C 26df2bb6b4cc9569a34d081650155c19 [1,1,0,0,0,0|2,0,0]=4 4273 B10R0.4 CCC/C=C\CNCC(C)O 96b16a03c90d480780a847b4ffde19d9 [1,1,0,0,0,0|2,0,0]=4 4274 B10R0.4 CCC/C=C\CNC[C@@H](C)O 375a19b3c5843ff281c17a4b98513e64 [1,1,0,0,0,0|2,0,0]=4 4275 B10R0.4 CCC/C=C\CNC[C@H](C)O 969752c5358585189315eeb63e6fb388 [1,1,0,0,0,0|2,0,0]=4 4276 B10R0.4 CCC/C=C\COCC(C)C 8260a1bdecaedee6a7bc007730d26119 [1,1,0,0,0,0|2,0,0]=4 4277 B10R0.4 CCC/C=C\COCC(C)F aa1d690e84801e639ab5ae28f6cb5391 [1,1,0,0,0,0|2,0,0]=4 4278 B10R0.4 CCC/C=C\COCC(C)S 3ffd71efe386dc2fb2d0ba39881da682 [1,1,0,0,0,0|2,0,0]=4 4279 B10R0.4 CCC/C=C\COC[C@@H](C)F 3c47a45dbaed974ece92989d2cd02162 [1,1,0,0,0,0|2,0,0]=4 4280 B10R0.4 CCC/C=C\COC[C@H](C)F 8421d12e8670db35ffce37dd95322fc7 [1,1,0,0,0,0|2,0,0]=4 4281 B10R0.4 CCCCCCNCC(C)C 1a2401845907eef233dd59227daa3a68 [1,1,0,0,0,0|1,0,1]=4 4282 B10R0.4 CCCCCCNCC(C)O ecfd31bbb27d5c1b28261e6fc506454e [1,1,0,0,0,0|1,0,1]=4 4283 B10R0.4 CCCCCCNC[C@@H](C)O a3e47df10174193eaf313b4168d20a56 [1,1,0,0,0,0|1,0,1]=4 4284 B10R0.4 CCCCCCNC[C@H](C)O 2eab26b642fa93ab5109cc9827db8367 [1,1,0,0,0,0|1,0,1]=4 4285 B10R0.4 CCCCCCOCC(=O)C c622979e72a3edd318802db3f6123eee [1,1,0,0,0,0|0,0,2]=4 4286 B10R0.4 CCCCCCOCC(C)C b37c8621ec273a7e26019a803a340e20 [1,1,0,0,0,0|0,0,1]=3 4287 B10R0.4 CCCCCCOCC(C)F dd97ca256682a6fda25577541eecbd12 [1,1,0,0,0,0|0,0,1]=3 4288 B10R0.4 CCCCCCOCC(C)S acb8c91dce03e86d867592ce1fe72f17 [1,1,0,0,0,0|0,0,1]=3 4289 B10R0.4 CCCCCCOCC(F)F a26442e14ba2eb739a794efc864e9e28 [1,1,0,0,0,0|1,0,1]=4 4290 B10R0.4 CCCCCCOCN(C)C fae992de96d645d231407619a49196c0 [1,1,0,0,0,0|1,0,1]=4 4291 B10R0.4 CCCCCCOC[C@@H](C)F 1f30b59f94e8f4e91c0bf18fdb80d473 [1,1,0,0,0,0|0,0,1]=3 4292 B10R0.4 CCCCCCOC[C@H](C)F 3be682a709018eb770bbeb667cf57929 [1,1,0,0,0,0|0,0,1]=3 4293 B10R0.4 CCCCCNCCC(C)C 2083eb70c05c1741486a9f522b36bddf [1,1,0,0,0,0|2,0,0]=4 4294 B10R0.4 CCCCCNCCC(C)O 4e6a420569190052d94ccc1ca80cf85c [1,1,0,0,0,0|2,0,0]=4 4295 B10R0.4 CCCCCNCC[C@@H](C)O 3f00e28351ebf7b139dd29392d26fe0f [1,1,0,0,0,0|2,0,0]=4 4296 B10R0.4 CCCCCNCC[C@H](C)O 38a781c8f9bc47db57981751900f43d6 [1,1,0,0,0,0|2,0,0]=4 4297 B10R0.4 CCCCCOCCC(C)C 1aa9f5e40c826e008fbbf8f79c7f1fea [1,1,0,0,0,0|2,0,0]=4 4298 B10R0.4 CCCCNCCCC(C)C 1e31d9dbabf6be9187dab46866ffb34e [1,1,0,0,0,0|2,0,0]=4 4299 B10R0.4 CCCCNCCCC(C)O e267dad3accc230faa3bc9e16d970474 [1,1,0,0,0,0|2,0,0]=4 4300 B10R0.4 CCCCOCCCC(C)C eabf9177db773ec6de5ecc0edcb5d082 [1,1,0,0,0,0|2,0,0]=4 4301 B10R0.4 CCCCOCOCC(C)C f76cb4f3e2df2a6ccb3df0291b6aa825 [1,1,0,0,0,0|1,0,1]=4 4302 B10R0.4 CCCCOCOCC(C)F cd34d4b694e2051b6a8d4e0268bbc610 [1,1,0,0,0,0|1,0,1]=4 4303 B10R0.4 CCCCOCOCC(C)S f3aaffcd03310a3e20b7d2fe1264264b [1,1,0,0,0,0|1,0,1]=4 4304 B10R0.4 CCCCOCOC[C@@H](C)F ee6e73d719ed609d566c2bfe17d34d6e [1,1,0,0,0,0|1,0,1]=4 4305 B10R0.4 CCCCOCOC[C@H](C)F be928def4baac0f42dbb5257ad9f3746 [1,1,0,0,0,0|1,0,1]=4 4306 B10R0.4 CCCNCCCCC(C)C f22e74f3c92982d86e30c1bb0f3509d3 [1,1,0,0,0,0|1,0,1]=4 4307 B10R0.4 CCCNCCCCC(C)O 2f69e7bc2a7ca500502a3e5f1c138b9b [1,1,0,0,0,0|1,0,1]=4 4308 B10R0.4 CCCNCCCC[C@@H](C)O 6ce0e83e6e0d1b17039df927d769e87a [1,1,0,0,0,0|1,0,1]=4 4309 B10R0.4 CCCNCCOCC(C)C 938166f9aa8fdbc9fe303167e2e6357b [1,1,0,0,0,0|1,0,1]=4 4310 B10R0.4 CCCOCCCCC(=O)C fd3e516a01dea40bc28ef8e85abe7b9e [1,1,0,0,0,0|0,0,2]=4 4311 B10R0.4 CCCOCCCCC(C)C f86f1fee85db6c4439132050b4d45955 [1,1,0,0,0,0|0,0,1]=3 4312 B10R0.4 CCCOCCCCN(C)C f4bdce3025f9c0207403b9cfca0595af [1,1,0,0,0,0|1,0,1]=4 4313 B10R0.4 CCCOCCCNC(C)C 97e56004124f9f1be06a97e18672fb78 [1,1,0,0,0,0|1,0,1]=4 4314 B10R0.4 CCCOCCCOC(C)C 2860ba23bdd84f5d06b46ebf59935d79 [1,1,0,0,0,0|1,0,1]=4 4315 B10R0.4 CCCOCCCSC(C)C 45346ea51d981b2ef27e08d1180f96de [1,1,0,0,0,0|1,0,1]=4 4316 B10R0.4 CCCOCCNCC(C)C 5cd8f594d4236b2933fb695322356b2b [1,1,0,0,0,0|1,0,1]=4 4317 B10R0.4 CCCOCCNCC(C)O 883d1c984751dd118682e5292e4351b5 [1,1,0,0,0,0|1,0,1]=4 4318 B10R0.4 CCCOCCNC[C@@H](C)O 7e13fb025234b05ec2b8676f9c175057 [1,1,0,0,0,0|1,0,1]=4 4319 B10R0.4 CCCOCCNC[C@H](C)O c006c7951defa00f65e2f537374c008d [1,1,0,0,0,0|1,0,1]=4 4320 B10R0.4 CCCOCCOCC(C)C 67c7770602d90fbcb32b20089a953d09 [1,1,0,0,0,0|1,0,1]=4 4321 B10R0.4 CCCOCCOCC(C)F cfc2983fd18123640a563bc92095b11d [1,1,0,0,0,0|1,0,1]=4 4322 B10R0.4 CCCOCCOCC(C)S d255ac834fb3a033a043452b1e619ed0 [1,1,0,0,0,0|1,0,1]=4 4323 B10R0.4 CCCOCCOC[C@@H](C)F a517ceaea4e9109b99bd2e289a3b2e71 [1,1,0,0,0,0|1,0,1]=4 4324 B10R0.4 CCCOCCOC[C@H](C)F 6f3499fb7fa388136022b24ac53a6afd [1,1,0,0,0,0|1,0,1]=4 4325 B10R0.4 CCCOCCSCC(C)C 6cc0266074462b6f0c3a9145b885dd2e [1,1,0,0,0,0|1,0,1]=4 4326 B10R0.4 CCCSCCOCC(C)C 9f141e56f84160364ae0d8e664cb2e31 [1,1,0,0,0,0|1,0,1]=4 4327 B10R0.4 CCNCCCOCC(C)C 6c8467724d7ecadfe1405a3ac9f7a881 [1,1,0,0,0,0|1,0,1]=4 4328 B10R0.4 CCOCCCOCC(C)C 56e31891ef7e15ae36db42adbc2077be [1,1,0,0,0,0|1,0,1]=4 4329 B10R0.4 CCOCCCOCC(C)F cd32349fe9f84c11ac6301a75c07df26 [1,1,0,0,0,0|1,0,1]=4 4330 B10R0.4 CCOCCCOCC(C)S 79443915a3e4768d20a4312454101e5a [1,1,0,0,0,0|1,0,1]=4 4331 B10R0.4 CCOCCCOC[C@@H](C)F 6279e74916573b81c5247ec843fe4cc3 [1,1,0,0,0,0|1,0,1]=4 4332 B10R0.4 CCOCCCOC[C@H](C)F b2cf87d4b642b0d91f36a57096268de1 [1,1,0,0,0,0|1,0,1]=4 4333 B10R0.4 CCSCCCOCC(C)C c0db432965e6890593632b0efe05af39 [1,1,0,0,0,0|1,0,1]=4 4334 B10R0.4 CCSCCCOCC(C)F fafb7da3a94dbe4c492c6db9fc235251 [1,1,0,0,0,0|1,0,1]=4 4335 B10R0.4 CCSCCCOCC(C)S 36a88913b0cab40cd5908dbbe0b7763a [1,1,0,0,0,0|1,0,1]=4 4336 B10R0.4 CCSCCCOC[C@@H](C)F 60e1a8cab0f601a797d3012c0e10cd5f [1,1,0,0,0,0|1,0,1]=4 4337 B10R0.4 CCSCCCOC[C@H](C)F dce8a1d4b438e48958f6e707558d2643 [1,1,0,0,0,0|1,0,1]=4 4338 B10R0.4 COCCCCOCC(C)C ad3e80d1de064622463e513eddb48a26 [1,1,0,0,0,0|1,0,1]=4 4339 B10R0.4 COCCCCOCC(C)F 713753f7a6230c0bd0f60ff71ea383fe [1,1,0,0,0,0|1,0,1]=4 4340 B10R0.4 COCCCCOCC(C)S d091e2baee47124e0f0060765f3393a4 [1,1,0,0,0,0|1,0,1]=4 4341 B10R0.4 COCCCCOC[C@@H](C)F 63bd4b4a19a2d43f3b516101bd7efb22 [1,1,0,0,0,0|1,0,1]=4 4342 B10R0.4 COCCCCOC[C@H](C)F 8bd81dcb53b09cb232a51232163ccbb2 [1,1,0,0,0,0|1,0,1]=4 4343 B10R0.4 COCOCCCCC(C)C 5c60f7e2698c3ed5789c783d5048dedf [1,1,0,0,0,0|1,0,1]=4 4344 B10R0.4 CSCCCCOCC(C)C 2c14243237662a1853b61a37b4200032 [1,1,0,0,0,0|1,0,1]=4 4345 B10R0.4 CSCOCCCCC(C)C 0ae05e8910b5dc8ad503c7b9aaf32d2f [1,1,0,0,0,0|1,0,1]=4 4346 B10R0.4 C[C@@H](F)COCCCCCF 5b62782740e940fd707092b5f73abd66 [1,1,0,0,0,0|1,0,1]=4 4347 B10R0.4 C[C@H](F)COCCCCCF 1e67efe1f385db604f44c0115f658daa [1,1,0,0,0,0|1,0,1]=4 4348 B10R0.71 C#CCCCCCOCCC 2ca86650ff94084696655d61570ec525 [1,1,0,0,0,0|0,0,2]=4 4349 B10R0.71 C#CCCOCCCCCC abc6fbb8106126804619f331a30d4f48 [1,1,0,0,0,0|0,0,2]=4 4350 B10R0.71 C/C=C/COCCCCCC 2cc86534d43c03349a69990f00a712f1 [1,1,0,0,0,0|0,0,2]=4 4351 B10R0.71 C/C=C\COCCCCCC c3215f168781748ebc00617e7f23375f [1,1,0,0,0,0|0,0,2]=4 4352 B10R0.71 C=CCCCCCOCCC c368b69977ea0df80586838beccded89 [1,1,0,0,0,0|0,0,2]=4 4353 B10R0.71 C=CCCOCCCCCC 8814dfd80f4d64b7d70e638ca2c0b882 [1,1,0,0,0,0|0,0,2]=4 4354 B10R0.71 CC#CCOCCCCCC ca5f1de5554f737f5c88d67d2baa3847 [1,1,0,0,0,0|0,0,2]=4 4355 B10R0.71 CC/C=C\CCCOCCC 7fa768d31f02c71335efb28537f1ed87 [1,1,0,0,0,0|0,0,2]=4 4356 B10R0.71 CC=CCOCCCCCC a58ad78e13367fd9a0795b0d0efdc386 [1,1,0,0,0,0|0,0,2]=4 4357 B10R0.71 CCC/C=C/CCCOCC 96c575cc0a2c58edec4b18e8b3051827 [1,1,0,0,0,0|1,0,0]=3 4358 B10R0.71 CCC/C=C/CCCOCF 98b0df28fed8e58ca594810e577c0b52 [1,1,0,0,0,0|2,0,0]=4 4359 B10R0.71 CCC/C=C/CNCCCC eb6f385e07ebf81c43b715a8e6898101 [1,1,0,0,0,0|1,0,0]=3 4360 B10R0.71 CCC/C=C/CNCCCCl 2a631264018e960a882a9c7d88e35448 [1,1,0,0,0,0|2,0,0]=4 4361 B10R0.71 CCC/C=C/CNCCCO 7b5b1f32f3ba47219ba367ef60e6a076 [1,1,0,0,0,0|2,0,0]=4 4362 B10R0.71 CCC/C=C/CNCCOC 1834877b3a02f74dd66b3368c830d003 [1,1,0,0,0,0|2,0,0]=4 4363 B10R0.71 CCC/C=C/CNCCSC cff9b66e330f122d2cb2e38a8625314a [1,1,0,0,0,0|2,0,0]=4 4364 B10R0.71 CCC/C=C/COCCCC 5cb7fad967976b46414fd1e0981df754 [1,1,0,0,0,0|1,0,0]=3 4365 B10R0.71 CCC/C=C/COCCCF fd38a60d8b4b3155ce3d8bd9b5a36fe0 [1,1,0,0,0,0|2,0,0]=4 4366 B10R0.71 CCC/C=C/COCCCS a3127fea6f7de2c2c1cc75ec845273ca [1,1,0,0,0,0|2,0,0]=4 4367 B10R0.71 CCC/C=C/COCCOC 8b48098d1b42b8217b38413e44362209 [1,1,0,0,0,0|2,0,0]=4 4368 B10R0.71 CCC/C=C/COCCSC a935db1c7efc6d83d03e08a390a1d1ce [1,1,0,0,0,0|2,0,0]=4 4369 B10R0.71 CCC/C=C/COCOCC d280135abd2c33aad6c1f6ebc51a0a61 [1,1,0,0,0,0|2,0,0]=4 4370 B10R0.71 CCC/C=C\CCCOCC 1c8765980afe95de3eca026e03130832 [1,1,0,0,0,0|1,0,0]=3 4371 B10R0.71 CCC/C=C\CCCOCF 50493cf0adac96e55ae6ed8db7b67534 [1,1,0,0,0,0|2,0,0]=4 4372 B10R0.71 CCC/C=C\CCOCCC affe8f34b74549b94b8274cb3a319479 [1,1,0,0,0,0|1,0,0]=3 4373 B10R0.71 CCC/C=C\CCOCCF 83ffd82ab19f1fef104785fb89831535 [1,1,0,0,0,0|2,0,0]=4 4374 B10R0.71 CCC/C=C\CCOCCS 205082f7fa7fb9e497dba53835e648e3 [1,1,0,0,0,0|2,0,0]=4 4375 B10R0.71 CCC/C=C\CCOCOC 4c902c7028d4a6b2ae5784ead2ad9e7f [1,1,0,0,0,0|2,0,0]=4 4376 B10R0.71 CCC/C=C\CCOCSC 9f821fff258192e14e0436b337398bed [1,1,0,0,0,0|2,0,0]=4 4377 B10R0.71 CCC/C=C\CNCCCC bec0667c6be34c83c909fc9cd36559c3 [1,1,0,0,0,0|1,0,0]=3 4378 B10R0.71 CCC/C=C\CNCCCCl dc7e58b4cb44aa8c77c570a0a7e547fa [1,1,0,0,0,0|2,0,0]=4 4379 B10R0.71 CCC/C=C\CNCCCO 0c1e5eb36810f8e1091abebdee101c49 [1,1,0,0,0,0|2,0,0]=4 4380 B10R0.71 CCC/C=C\CNCCOC 9b69ed27e484cd80c0b145d2676e3a75 [1,1,0,0,0,0|2,0,0]=4 4381 B10R0.71 CCC/C=C\CNCCSC ab8c372b9a872750ad9eecb39daab022 [1,1,0,0,0,0|2,0,0]=4 4382 B10R0.71 CCC/C=C\COCCCC 12552b98ae2ab17ee7aaf14497e6f771 [1,1,0,0,0,0|1,0,0]=3 4383 B10R0.71 CCC/C=C\COCCCF 8fd0bd7bf500cf190978432f91f83224 [1,1,0,0,0,0|2,0,0]=4 4384 B10R0.71 CCC/C=C\COCCCS 448e1ad6e452602c6124aecd9c2d58a7 [1,1,0,0,0,0|2,0,0]=4 4385 B10R0.71 CCC/C=C\COCCOC 07d68c8f2b746de5b5301333d471291c [1,1,0,0,0,0|2,0,0]=4 4386 B10R0.71 CCC/C=C\COCCSC 384ee6f65c09c5fab77e23a50b68f611 [1,1,0,0,0,0|2,0,0]=4 4387 B10R0.71 CCC/C=C\COCOCC c143e8b3ae3a1dcfbf1ffe3b381d116c [1,1,0,0,0,0|2,0,0]=4 4388 B10R0.71 CCCC#CCCOCCC 9d371ccc704f01f8e34c17fed94acae5 [1,1,0,0,0,0|0,0,2]=4 4389 B10R0.71 CCCC#CCOCCCC 3a9b7ab043d317d55165792d5b31d2df [1,1,0,0,0,0|1,0,1]=4 4390 B10R0.71 CCCC/C=C/CNCCC b5846262769f4576898e24ec596816c8 [1,1,0,0,0,0|1,0,1]=4 4391 B10R0.71 CCCC/C=C/COCCC 07c08b56120c97240fcfc821b0cfaf7e [1,1,0,0,0,0|0,0,1]=3 4392 B10R0.71 CCCC/C=C/COCCF b3ba68c521676a423b6cca99f7dde52e [1,1,0,0,0,0|1,0,1]=4 4393 B10R0.71 CCCC/C=C/COCCS 7675b998c00101775745681e87c8b9a1 [1,1,0,0,0,0|1,0,1]=4 4394 B10R0.71 CCCC/C=C/COCOC 5abb34db6ff07a93b4633b12130e634f [1,1,0,0,0,0|1,0,1]=4 4395 B10R0.71 CCCC/C=C/COCSC 213f51c646a3a9635a4d9796c3110bc4 [1,1,0,0,0,0|1,0,1]=4 4396 B10R0.71 CCCC/C=C\CCOCC c0b86be5a318325f35923a807a0da0e5 [1,1,0,0,0,0|1,0,1]=4 4397 B10R0.71 CCCC/C=C\CNCCC 1ebafcf76c30e339500b071d8b77b007 [1,1,0,0,0,0|1,0,1]=4 4398 B10R0.71 CCCC/C=C\COCCC cacd342e00bdd06408172e2c8226f9fe [1,1,0,0,0,0|0,0,1]=3 4399 B10R0.71 CCCC/C=C\COCCF 902bc78a8fc2037f243a196aa9891798 [1,1,0,0,0,0|1,0,1]=4 4400 B10R0.71 CCCC/C=C\COCCS 11a9e56a6786b04ccb56a4976b6eabba [1,1,0,0,0,0|1,0,1]=4 4401 B10R0.71 CCCC/C=C\COCOC ba5d89fa33380be890c5974c58b24dc3 [1,1,0,0,0,0|1,0,1]=4 4402 B10R0.71 CCCC=C=CCCOCC ecd2330b3e2fc365c563b385894a4c95 [1,1,0,0,0,0|2,0,0]=4 4403 B10R0.71 CCCCC#CCOCCC b3f55348ac0050523e523ba559b53553 [1,1,0,0,0,0|0,0,2]=4 4404 B10R0.71 CCCCC/C=C/COCC d869a9967b36862cc7ff5868403bb25d [1,1,0,0,0,0|1,0,0]=3 4405 B10R0.71 CCCCC/C=C/COCF 173aafd765549e06cbff3bd6ae6fc78e [1,1,0,0,0,0|2,0,0]=4 4406 B10R0.71 CCCCCC#CCOCC caa22122c2b20cb5fe4be222e5ff2f55 [1,1,0,0,0,0|1,0,1]=4 4407 B10R0.71 CCCCCCCCNCC f45798325e076f51813ed9475990e935 [1,1,0,0,0,0|1,0,1]=4 4408 B10R0.71 CCCCCCCCOCC fdf9c57b26dc59eebf4df9f9dff7ab11 [1,1,0,0,0,0|1,0,1]=4 4409 B10R0.71 CCCCCCCNCCC 8f428c22239379f79b42eeff6f848027 [1,1,0,0,0,0|1,0,1]=4 4410 B10R0.71 CCCCCCCOCCC 2dbba9d2fa88b26583f5d2ac3d741b24 [1,1,0,0,0,0|0,0,1]=3 4411 B10R0.71 CCCCCCCOCCF 2e8dd6a0af3d2b30f6f325a750e2f8e8 [1,1,0,0,0,0|1,0,1]=4 4412 B10R0.71 CCCCCCCOCCS d905d762a9b7d322c87213c7c56ba37f [1,1,0,0,0,0|1,0,1]=4 4413 B10R0.71 CCCCCCCOCOC 5ce19ed9c6e4108e173e3dc063eaeb4e [1,1,0,0,0,0|1,0,1]=4 4414 B10R0.71 CCCCCCCOCSC 08ad92cc4f51e014a7301f82e1b9552e [1,1,0,0,0,0|1,0,1]=4 4415 B10R0.71 CCCCCCNCCCC 20be2e0525a624157bc2fad46d2186d5 [1,1,0,0,0,0|1,0,1]=4 4416 B10R0.71 CCCCCCNCCCCl 798c3b78fda1b44bfc2a5866fd849b4a [1,1,0,0,0,0|1,0,1]=4 4417 B10R0.71 CCCCCCNCCCF ec8ad93e9495e1afdc7ceb0355e5c789 [1,1,0,0,0,0|1,0,1]=4 4418 B10R0.71 CCCCCCNCCCO 5bc4d9addd0075b9ea454b7e30b2b20c [1,1,0,0,0,0|1,0,1]=4 4419 B10R0.71 CCCCCCNCCCS 8c1aea017c53a004a3a57f13df4016f5 [1,1,0,0,0,0|1,0,1]=4 4420 B10R0.71 CCCCCCNCCOC d8a9b2ae4f4d1a2408c43a2120d332fc [1,1,0,0,0,0|1,0,1]=4 4421 B10R0.71 CCCCCCNCCSC 03f05656133e75b7ef05cf7e7a9686cd [1,1,0,0,0,0|1,0,1]=4 4422 B10R0.71 CCCCCCNCOCC 0b2dadfdd556d2bf502aa4112d950603 [1,1,0,0,0,0|1,0,1]=4 4423 B10R0.71 CCCCCCOCCC#N df918a6bf56055cc68eaa0febc6250f6 [1,1,0,0,0,0|0,0,2]=4 4424 B10R0.71 CCCCCCOCCC=O 52e11fbfda6e705332503dbf6ca57c21 [1,1,0,0,0,0|0,0,2]=4 4425 B10R0.71 CCCCCCOCCCC 938d0ec0b6adc0f1b39dbfc036e22e02 [1,1,0,0,0,0|0,0,1]=3 4426 B10R0.71 CCCCCCOCCCF 96181b976d7354be2077b197619bb942 [1,1,0,0,0,0|0,0,1]=3 4427 B10R0.71 CCCCCCOCCCS 5fa58b5367e16182182d2f61e5d955a0 [1,1,0,0,0,0|0,0,1]=3 4428 B10R0.71 CCCCCCOCCOC 498c1d974b36c5798a5345f99389e8d2 [1,1,0,0,0,0|0,0,1]=3 4429 B10R0.71 CCCCCCOCCSC a2fa5d10e923435988e5eb6eaf926cde [1,1,0,0,0,0|0,0,1]=3 4430 B10R0.71 CCCCCCOCOCC de7091207636fc19f355a981992b8eb3 [1,1,0,0,0,0|0,0,1]=3 4431 B10R0.71 CCCCCNCCCCC fc6b1fbee2ae20e668586a93426dce7b [1,1,0,0,0,0|1,0,1]=4 4432 B10R0.71 CCCCCNCCCCCl c701e49df4eef1470e682606de3ca8f1 [1,1,0,0,0,0|2,0,0]=4 4433 B10R0.71 CCCCCNCCCCF d279fc520ee48aeaa07407924d2d74d7 [1,1,0,0,0,0|2,0,0]=4 4434 B10R0.71 CCCCCNCCCCO 379ab0235e165758d05e13f64b0667e2 [1,1,0,0,0,0|2,0,0]=4 4435 B10R0.71 CCCCCNCCCCS d84e183bdfafbaad537c0d200ed48999 [1,1,0,0,0,0|2,0,0]=4 4436 B10R0.71 CCCCCNCCCOC 59c794b1fdced6fe10e73b7eec0b61f4 [1,1,0,0,0,0|2,0,0]=4 4437 B10R0.71 CCCCCNCCCSC 1a943155b12e5db9b108db3f8ef5622d [1,1,0,0,0,0|2,0,0]=4 4438 B10R0.71 CCCCCNCCOCC b302026487b9f6fc9da1041bec3b940f [1,1,0,0,0,0|2,0,0]=4 4439 B10R0.71 CCCCCNCCSCC d4e4b88649a7d41376228d32433581ea [1,1,0,0,0,0|2,0,0]=4 4440 B10R0.71 CCCCCOCCCCC 6be65cbda65609b70fc256077c9081b0 [1,1,0,0,0,0|1,0,1]=4 4441 B10R0.71 CCCCCOCCCCF 1e52934387d4e6196e1ae9a21a139f63 [1,1,0,0,0,0|2,0,0]=4 4442 B10R0.71 CCCCCOCCCCS 0279225295d1c82256f6e5c11abe7674 [1,1,0,0,0,0|2,0,0]=4 4443 B10R0.71 CCCCCOCCCOC 35a4ac119007b84148d4ce463e8bfcd6 [1,1,0,0,0,0|2,0,0]=4 4444 B10R0.71 CCCCCOCCCSC 83f486b530f56d8364c21230e353c7ad [1,1,0,0,0,0|2,0,0]=4 4445 B10R0.71 CCCCCOCCOCC c8f98ba5fde1bc4c3459e40764f14618 [1,1,0,0,0,0|2,0,0]=4 4446 B10R0.71 CCCCCOCCSCC 8e2ce49f0c9b939f61ef427ccb831b7d [1,1,0,0,0,0|2,0,0]=4 4447 B10R0.71 CCCCNCCCCCCl 17907e10bc8ae216fc19d4f50e0355d8 [1,1,0,0,0,0|2,0,0]=4 4448 B10R0.71 CCCCNCCCCCF ecb524fdab50cb363fd9220f41e81b56 [1,1,0,0,0,0|2,0,0]=4 4449 B10R0.71 CCCCNCCCCCO a568cb73440f8b5eb1a832482c6c8aa1 [1,1,0,0,0,0|2,0,0]=4 4450 B10R0.71 CCCCNCCCCOC 8a51345137a99f78ee92600b49d2fddb [1,1,0,0,0,0|2,0,0]=4 4451 B10R0.71 CCCCNCCCCSC 834064ffffe2ca860260d790d8b507c6 [1,1,0,0,0,0|2,0,0]=4 4452 B10R0.71 CCCCNCCCOCC 4567bf18693d1425b182776ab5d89ce7 [1,1,0,0,0,0|2,0,0]=4 4453 B10R0.71 CCCCNCCCSCC 63db814ee76aaab4513ac3ae6b0470e2 [1,1,0,0,0,0|2,0,0]=4 4454 B10R0.71 CCCCNCCOCCC 3fcdc0cfe48703f2a83af0169c62729d [1,1,0,0,0,0|0,0,1]=3 4455 B10R0.71 CCCCNCCOCCO 80115239ef9f78352b2ee441d10a1b65 [1,1,0,0,0,0|1,0,1]=4 4456 B10R0.71 CCCCNCCOCCS 57cba1cb49bedd31f203422953e08db7 [1,1,0,0,0,0|1,0,1]=4 4457 B10R0.71 CCCCNCCOCOC bd8b266c1908f8ed7d554480840547fa [1,1,0,0,0,0|1,0,1]=4 4458 B10R0.71 CCCCNCOCCCC 545e6748e00cac4bfa4dcccf944d1023 [1,1,0,0,0,0|1,0,1]=4 4459 B10R0.71 CCCCNCOCCOC 1dd2d7a790540a31a6570455a64e2044 [1,1,0,0,0,0|1,0,1]=4 4460 B10R0.71 CCCCOCCCCCF aead05b2f46a954a77fb9b0d46a831a1 [1,1,0,0,0,0|1,0,1]=4 4461 B10R0.71 CCCCOCCCCOC 1c665f9a80dbcc19a2506b93b11eeab3 [1,1,0,0,0,0|1,0,1]=4 4462 B10R0.71 CCCCOCCCCSC 7e846181e45c3a440b01cd8ef8df47c8 [1,1,0,0,0,0|1,0,1]=4 4463 B10R0.71 CCCCOCCCNCC 010734c4fdc877ac094389f744441162 [1,1,0,0,0,0|1,0,1]=4 4464 B10R0.71 CCCCOCCCOCC 1158a02552cfd2177bf76faa90c6df77 [1,1,0,0,0,0|1,0,1]=4 4465 B10R0.71 CCCCOCCCSCC e04cab22dc6501876d38fc7fb5563829 [1,1,0,0,0,0|1,0,1]=4 4466 B10R0.71 CCCCOCCNCCC c10c126aa77fae6dee2817c49229712d [1,1,0,0,0,0|1,0,1]=4 4467 B10R0.71 CCCCOCCOCCC 62aa1933f9f6285673b3ff78d496fc74 [1,1,0,0,0,0|0,0,1]=3 4468 B10R0.71 CCCCOCCOCCF 0e3907704345f6840513dbb7fe33a55b [1,1,0,0,0,0|1,0,1]=4 4469 B10R0.71 CCCCOCCOCCS e527e16f2881ce18e3da73bad0736851 [1,1,0,0,0,0|1,0,1]=4 4470 B10R0.71 CCCCOCCOCOC ac988a5aed77ca629caaf4c7819a46c6 [1,1,0,0,0,0|1,0,1]=4 4471 B10R0.71 CCCCOCCOCSC a25829e4f34115af6afb1e4b0b83c031 [1,1,0,0,0,0|1,0,1]=4 4472 B10R0.71 CCCCOCCSCCC dd7dd42c58efb56d123dfdb4ec52bdfa [1,1,0,0,0,0|0,1,1]=4 4473 B10R0.71 CCCCOCOCCCC cab95224f5094c3b71980434e538b501 [1,1,0,0,0,0|1,0,1]=4 4474 B10R0.71 CCCCOCOCCCF b24952fd54551c34fc7a3582b4f4b10f [1,1,0,0,0,0|1,0,1]=4 4475 B10R0.71 CCCCOCOCCCS 93f4c58804d15cdcdbc12a98bf6cbca4 [1,1,0,0,0,0|1,0,1]=4 4476 B10R0.71 CCCCOCOCCOC e1e6d52bf675f052f70a55e34a94bebd [1,1,0,0,0,0|1,0,1]=4 4477 B10R0.71 CCCCOCOCCSC d930608e2de8d8b600f7619079ad5307 [1,1,0,0,0,0|1,0,1]=4 4478 B10R0.71 CCCCSCCOCCC 042c613074bc2dcac09e3dbf40c6fdea [1,1,0,0,0,0|0,0,1]=3 4479 B10R0.71 CCCCSCCOCCF 69525a32d302cf42d8a360988f118d89 [1,1,0,0,0,0|1,0,1]=4 4480 B10R0.71 CCCCSCCOCCS 4a8371f19fa6c732bc7415f178bae3dd [1,1,0,0,0,0|1,0,1]=4 4481 B10R0.71 CCCCSCCOCOC 25abdf23fb9b1c0e8b52c413fa068913 [1,1,0,0,0,0|1,0,1]=4 4482 B10R0.71 CCCCSCCOCSC 67fb4de2d405c1ef1e2ca06ab44950a3 [1,1,0,0,0,0|1,0,1]=4 4483 B10R0.71 CCCNCCCCCCCl d9d02325ceabb1236feca69f9d260e06 [1,1,0,0,0,0|1,0,1]=4 4484 B10R0.71 CCCNCCCCCCF 47bd30d6c6ebb4154ccfd3d84e3dd907 [1,1,0,0,0,0|1,0,1]=4 4485 B10R0.71 CCCNCCCCCCO 957198384cd9904d687345e1f1a839fe [1,1,0,0,0,0|1,0,1]=4 4486 B10R0.71 CCCNCCCCCOC fbe0af6a29e7bb390546dc0f24f036df [1,1,0,0,0,0|1,0,1]=4 4487 B10R0.71 CCCNCCCCSCC 4fbccce5329f8a22f7d198bd04134133 [1,1,0,0,0,0|1,0,1]=4 4488 B10R0.71 CCCNCCCOCCC 7fd6aca7b9f3bc59415db067623e55ef [1,1,0,0,0,0|0,0,1]=3 4489 B10R0.71 CCCNCCCOCCO 85649ddd4b7bb8ea6cc1e32801747e8c [1,1,0,0,0,0|1,0,1]=4 4490 B10R0.71 CCCNCCOCCCO ce755d26bb38d7d0db74dd93ed4f675f [1,1,0,0,0,0|1,0,1]=4 4491 B10R0.71 CCCNCCOCCOC 2cbde89089689bf854a3b933cabe6ba2 [1,1,0,0,0,0|1,0,1]=4 4492 B10R0.71 CCCOCCCCCC#N 80cf8a7ea89988cb83fb563eca704e39 [1,1,0,0,0,0|0,0,2]=4 4493 B10R0.71 CCCOCCCCCC=O f9a394720b00a6dd92dae6c05c91a7d4 [1,1,0,0,0,0|0,0,2]=4 4494 B10R0.71 CCCOCCCCCCF 72ffe3589386c933c936da7caa3f7256 [1,1,0,0,0,0|0,0,1]=3 4495 B10R0.71 CCCOCCCCCCS 9237106df74f11c16d22d77a5b29e426 [1,1,0,0,0,0|0,0,1]=3 4496 B10R0.71 CCCOCCCCCOC f0f1181da96b58975534715e6947023c [1,1,0,0,0,0|0,0,1]=3 4497 B10R0.71 CCCOCCCNCCBr bee87ee77ec3102d7ce6099c3a5400ee [1,1,0,0,0,0|1,0,1]=4 4498 B10R0.71 CCCOCCCNCCF 4280460a70e5ec0da532a0aef238506d [1,1,0,0,0,0|1,0,1]=4 4499 B10R0.71 CCCOCCCNCCI 5f240e521ffd9c5eda977c5ce87452ef [1,1,0,0,0,0|1,0,1]=4 4500 B10R0.71 CCCOCCCNCCO 0a8b4b1c66e483def5426f3f2c79fc1b [1,1,0,0,0,0|1,0,1]=4 4501 B10R0.71 CCCOCCCNCCS 7b5a1495544a634cb4a20606ba496232 [1,1,0,0,0,0|1,0,1]=4 4502 B10R0.71 CCCOCCCNCOC 1bea1577b514f54011229b8419bcfdb7 [1,1,0,0,0,0|1,0,1]=4 4503 B10R0.71 CCCOCCCNCSC 58701c31c8f1a07c8a8df9348f81a8e0 [1,1,0,0,0,0|1,0,1]=4 4504 B10R0.71 CCCOCCCOCCC f962260523633ca9eb2ae77ffb4aa792 [1,1,0,0,0,0|0,0,1]=3 4505 B10R0.71 CCCOCCCOCCF 3698cb40c4434046db45e1bb814e1622 [1,1,0,0,0,0|1,0,1]=4 4506 B10R0.71 CCCOCCCOCCS c412735660e2d5b16f022f520708dc55 [1,1,0,0,0,0|1,0,1]=4 4507 B10R0.71 CCCOCCCOCOC bed9246f72dff6f1dadff9d9a6e7bd82 [1,1,0,0,0,0|1,0,1]=4 4508 B10R0.71 CCCOCCNCCCCl 784632a9b2c9e6050b13054a279b5563 [1,1,0,0,0,0|1,0,1]=4 4509 B10R0.71 CCCOCCNCCCF 026f328a82fe337d42861d2ec6a5655f [1,1,0,0,0,0|1,0,1]=4 4510 B10R0.71 CCCOCCNCCCO e044842af3e92ff7eb92db45482811f4 [1,1,0,0,0,0|1,0,1]=4 4511 B10R0.71 CCCOCCNCCCS d80f2dc40273e51403b85f12b465d171 [1,1,0,0,0,0|1,0,1]=4 4512 B10R0.71 CCCOCCNCCOC b04fafbd8d2ee2c08b8f63df1798a56c [1,1,0,0,0,0|1,0,1]=4 4513 B10R0.71 CCCOCCNCCSC f57bb62307dbd266127540784f4eb500 [1,1,0,0,0,0|1,0,1]=4 4514 B10R0.71 CCCOCCNCOCC e3ae911adc1cf7303a1b72a05ebf7e83 [1,1,0,0,0,0|1,0,1]=4 4515 B10R0.71 CCCOCCOCCCF f99eaf72f24d8c38f0025bb59317ae75 [1,1,0,0,0,0|1,0,1]=4 4516 B10R0.71 CCCOCCOCCCS 29d48da73019a044d9e048470970d12c [1,1,0,0,0,0|1,0,1]=4 4517 B10R0.71 CCCOCCOCCOC 1b06cdeb8b0ec10f0136b2c501e1354c [1,1,0,0,0,0|1,0,1]=4 4518 B10R0.71 CCCOCCOCCSC dfd11617336747a54284534e611b2815 [1,1,0,0,0,0|1,0,1]=4 4519 B10R0.71 CCCOCCOCOCC 100dd6040f41719744cddfe9d7650b59 [1,1,0,0,0,0|1,0,1]=4 4520 B10R0.71 CCCSCCCCNCC 19a2007b09e5e2f3826f2c9805957fbb [1,1,0,0,0,0|0,1,1]=4 4521 B10R0.71 CCCSCCOCCCF c2df45484e1f04796f55039c6c01149a [1,1,0,0,0,0|1,0,1]=4 4522 B10R0.71 CCCSCCOCCCS 5c85cc065b8d075793169fe91e12b9a6 [1,1,0,0,0,0|1,0,1]=4 4523 B10R0.71 CCCSCCOCCOC 6ee02793d5fe53c6051c2b73c029160a [1,1,0,0,0,0|1,0,1]=4 4524 B10R0.71 CCCSCCOCCSC 619f33b0b6b5069ab424bef912e65bf1 [1,1,0,0,0,0|1,0,1]=4 4525 B10R0.71 CCCSCCOCOCC 4185e41a27ecf720c5ad46b42494d0f9 [1,1,0,0,0,0|1,0,1]=4 4526 B10R0.71 CCNCCCOCCCO 47d0e11f0fe7477fa63a8b913e01e66b [1,1,0,0,0,0|1,0,1]=4 4527 B10R0.71 CCNCCCOCCOC 2b72e76c302d9f2c23aaf01a3b73ab0a [1,1,0,0,0,0|1,0,1]=4 4528 B10R0.71 CCNCCCOCCSC f1f564b79311e99b3e72733e90006265 [1,1,0,0,0,0|1,0,1]=4 4529 B10R0.71 CCOCCCOCCCF b35bf1ac62461dff8e8a6433d528ce47 [1,1,0,0,0,0|1,0,1]=4 4530 B10R0.71 CCOCCCOCCCS 5a3fb37aab52a4b5c1a3633304843f2d [1,1,0,0,0,0|1,0,1]=4 4531 B10R0.71 CCOCCCOCCOC 86d49f1c0e918986d65abbc263be35e3 [1,1,0,0,0,0|1,0,1]=4 4532 B10R0.71 CCOCCCOCCSC 7e6593cfd8fbe8a0366c6c086d62c695 [1,1,0,0,0,0|1,0,1]=4 4533 B10R0.71 CCOCCCOCOCC bda2c234d3de22b72b74da925ab0ea52 [1,1,0,0,0,0|1,0,1]=4 4534 B10R0.71 CCOCOCCCCOC 915704c151d10769b6018e77d6159ac5 [1,1,0,0,0,0|1,0,1]=4 4535 B10R0.71 CCOCOCCCCSC 775f9873e83d33ed64cef755812a1118 [1,1,0,0,0,0|1,0,1]=4 4536 B10R0.71 CCOCOCCCSCC 0b74f7a6f67e9f31725361da5e9273b0 [1,1,0,0,0,0|1,0,1]=4 4537 B10R0.71 CCSCCCOCCCF da8ebf8ef956a447a2622665209066ff [1,1,0,0,0,0|1,0,1]=4 4538 B10R0.71 CCSCCCOCCCS 20e48a9db1d8288875a5ef6318b27a21 [1,1,0,0,0,0|1,0,1]=4 4539 B10R0.71 CCSCCCOCCOC 184324569a695c14f2d49871f1e33d60 [1,1,0,0,0,0|1,0,1]=4 4540 B10R0.71 CCSCCCOCCSC 21daf581564f85521ee1e3a25d829227 [1,1,0,0,0,0|1,0,1]=4 4541 B10R0.71 COCCCCCOCCF f3a211ec0c8c52ca98e8eb9c9f8303f1 [1,1,0,0,0,0|1,0,1]=4 4542 B10R0.71 COCCCCCOCCS 3ec9d0d72d8c29a4fa761e5a2ff812c2 [1,1,0,0,0,0|1,0,1]=4 4543 B10R0.71 COCCCCCOCOC 507fdc97f92608c5104edd21704e17b0 [1,1,0,0,0,0|1,0,1]=4 4544 B10R0.71 COCCCCOCCCF e6872cd38809d1806361f7ad32f2a527 [1,1,0,0,0,0|1,0,1]=4 4545 B10R0.71 COCCCCOCCCS ab904d46ca6f0f0892fbfc7c57dda8ab [1,1,0,0,0,0|1,0,1]=4 4546 B10R0.71 COCCCCOCCOC 379baa265a89cf9fa652b6f6ebaa5e6d [1,1,0,0,0,0|1,0,1]=4 4547 B10R0.71 COCCCCOCCSC b497ccff6bc26ea83e7425dcecf604f3 [1,1,0,0,0,0|1,0,1]=4 4548 B10R0.71 COCCOCCCCCF 4e5f4f6eedb72d35ca16a01d8e944d7b [1,1,0,0,0,0|1,0,1]=4 4549 B10R0.71 COCCOCCCCSC 9a3d705a7acc5ce3f2ef2242637c187e [1,1,0,0,0,0|1,0,1]=4 4550 B10R0.71 COCOCCCCCCF 17161ed12e555e55431c451f9ea8f8e9 [1,1,0,0,0,0|1,0,1]=4 4551 B10R0.71 COCOCCCCCCS 74af74e3e3beffe2982557911f35d8b8 [1,1,0,0,0,0|1,0,1]=4 4552 B10R0.71 CSCCCCOCCCF 8a1b3a8e971206055dce912e15fae07c [1,1,0,0,0,0|1,0,1]=4 4553 B10R0.71 CSCCCCOCCCS 60cea5c30a0a6951485423c11433ff52 [1,1,0,0,0,0|1,0,1]=4 4554 B10R0.71 CSCCCCOCCSC 7774efcc9171d86a8214b5f2ec5d591f [1,1,0,0,0,0|1,0,1]=4 4555 B10R0.71 CSCCOCCCCCF c91dfc969bda30e8e6509f126ab4281b [1,1,0,0,0,0|1,0,1]=4 4556 B10R0.71 CSCOCCCCCCF 407195bedd704b23d88aa78f6e3e9409 [1,1,0,0,0,0|1,0,1]=4 4557 B10R0.71 CSCOCCCCCCS 2b880cbb43537a4342292b63fff8bea9 [1,1,0,0,0,0|1,0,1]=4 4558 B10R0.71 FCCCCCCOCCF 00cdd59286754be6318795dcf25dcefd [1,1,0,0,0,0|1,0,1]=4 4559 B10R0.71 FCCCCCCOCCS 92d153e3bb9e1ad67b5771d0667e02fa [1,1,0,0,0,0|1,0,1]=4 4560 B10R0.71 FCCCCCOCCCF a52d1e432f2925cef5d8939d3ad10c4a [1,1,0,0,0,0|1,0,1]=4 4561 B10R0.71 FCCCCCOCCCS 798f59dd060c2f4d944bccba177b7e14 [1,1,0,0,0,0|1,0,1]=4 4562 B10R0.71 FCCOCCCCCCS 521bc1567085794b91ead8aa32f177aa [1,1,0,0,0,0|1,0,1]=4 4563 B10R0.71 SCCCCCCOCCS e394aec0ef6f50093283664965a38be0 [1,1,0,0,0,0|1,0,1]=4 4564 B10R0.74 CCC(C)CCCOCCF f375dd29a4f1451a3b9819fb54b6ce77 [1,1,0,0,0,0|1,0,1]=4 4565 B10R0.74 CCC(C)CCCOCCS 3c13472b78c68413e2d78c1a5c039ca7 [1,1,0,0,0,0|1,0,1]=4 4566 B10R0.74 CCC(C)CCCOCOC a12d9bb3b8007092c670803fef0b078d [1,1,0,0,0,0|1,0,1]=4 4567 B10R0.74 CCC(C)CCCOCSC 6e1c7bfa48af828cfb44021bcdbeea43 [1,1,0,0,0,0|1,0,1]=4 4568 B10R0.74 CCC(C)OCCCCCF 6a3c3628c413a5f1aac0fa42f865c11e [1,1,0,0,0,0|1,0,1]=4 4569 B10R0.74 CCC(C)OCCCCOC ad8bf65f6e256901999a50e5f0b60b29 [1,1,0,0,0,0|1,0,1]=4 4570 B10R0.74 CCC(C)OCCCCSC 1c9a1f1356fd194ef59b3947619dc07a [1,1,0,0,0,0|1,0,1]=4 4571 B10R0.74 CCC/C=C/CNC(C)CC 4e48ba9c0fd98caefbe85435fa5b1a78 [1,1,0,0,0,0|2,0,0]=4 4572 B10R0.74 CCC/C=C/CN[C@@H](C)CC b7605e996cb0e45ab279f62487cb2b40 [1,1,0,0,0,0|2,0,0]=4 4573 B10R0.74 CCC/C=C/CN[C@H](C)CC dd95691b136f2707f8767c08a69f2a66 [1,1,0,0,0,0|2,0,0]=4 4574 B10R0.74 CCC/C=C/COC(C)CC 9d98da554dcc872c553125211755c2f1 [1,1,0,0,0,0|2,0,0]=4 4575 B10R0.74 CCC/C=C/CO[C@@H](C)CC a336b5e3decea76f5731829ecb170ae9 [1,1,0,0,0,0|2,0,0]=4 4576 B10R0.74 CCC/C=C/CO[C@H](C)CC aeb209c4e3a2af254650316b293cd84f [1,1,0,0,0,0|2,0,0]=4 4577 B10R0.74 CCC/C=C\CNC(C)CC 93778ee7585781e977d18115d2d5927a [1,1,0,0,0,0|2,0,0]=4 4578 B10R0.74 CCC/C=C\CN[C@@H](C)CC b3e7fcd5abd5ab3c2e18e130810a40c3 [1,1,0,0,0,0|2,0,0]=4 4579 B10R0.74 CCC/C=C\CN[C@H](C)CC 2bc95e0a31d669a6c49f2c90c0267941 [1,1,0,0,0,0|2,0,0]=4 4580 B10R0.74 CCC/C=C\COC(C)CC a26ef22927ba4d735254ddc319a96279 [1,1,0,0,0,0|2,0,0]=4 4581 B10R0.74 CCC/C=C\CO[C@@H](C)CC 4c4ab28a89b9b3d70d6378bd67ee91bc [1,1,0,0,0,0|2,0,0]=4 4582 B10R0.74 CCC/C=C\CO[C@H](C)CC 52fe4cd33011e343d8fae8f0ccfc7dac [1,1,0,0,0,0|2,0,0]=4 4583 B10R0.74 CCCCCCNC(C)CC 53e44df6969c0f5db5e2ae20e833ced2 [1,1,0,0,0,0|1,0,1]=4 4584 B10R0.74 CCCCCCN[C@@H](C)CC af6ba5f4188670da2e5b1f8dc87a134c [1,1,0,0,0,0|1,0,1]=4 4585 B10R0.74 CCCCCCN[C@H](C)CC 83007d10aa75918c4280ed98b36f2e5b [1,1,0,0,0,0|1,0,1]=4 4586 B10R0.74 CCCCCCOC(C)CC 63a0e53b4936ff9a126507b425b4f873 [1,1,0,0,0,0|0,0,1]=3 4587 B10R0.74 CCCCCCOC(C)CF 557b2cc9d2559881448b3b495b5b2844 [1,1,0,0,0,0|1,0,1]=4 4588 B10R0.74 CCCCCCOC(C)CS 264de8c1030f8b41581807164d9c2c3b [1,1,0,0,0,0|1,0,1]=4 4589 B10R0.74 CCCCCCO[C@@H](C)CC 913d8fe5eb0dc2cd00df16877f67de0e [1,1,0,0,0,0|0,0,1]=3 4590 B10R0.74 CCCCCCO[C@H](C)CC c063b7a21fad8b8f0def39d173f79e48 [1,1,0,0,0,0|0,0,1]=3 4591 B10R0.74 CCCCCCO[C@H](C)CS 480e95b08328620db840677e0b53babf [1,1,0,0,0,0|1,0,1]=4 4592 B10R0.74 CCCCCNCC(C)CC e20d30575e77059b5fc8dccdcc466f74 [1,1,0,0,0,0|2,0,0]=4 4593 B10R0.74 CCCCCNCC(O)CC d6191ad3bd9358697a26014dd3c35d2e [1,1,0,0,0,0|2,0,0]=4 4594 B10R0.74 CCCCCNC[C@@H](C)CC 75624383a07a93d441194408d34bea83 [1,1,0,0,0,0|2,0,0]=4 4595 B10R0.74 CCCCCNC[C@H](C)CC b99d32d28594086efdc0317d1d89146e [1,1,0,0,0,0|2,0,0]=4 4596 B10R0.74 CCCCCNC[C@H](O)CC 141cc5eeaba79c4f9687c521abb8108f [1,1,0,0,0,0|2,0,0]=4 4597 B10R0.74 CCCCCOCC(C)CC 412dea2fff2534118021b46f8a6f4435 [1,1,0,0,0,0|2,0,0]=4 4598 B10R0.74 CCCCCOC[C@@H](C)CC 0815ce752a9002f957d8245cad9da55c [1,1,0,0,0,0|2,0,0]=4 4599 B10R0.74 CCCCCOC[C@H](C)CC 4040d63575afd64f526d6a508cd05115 [1,1,0,0,0,0|2,0,0]=4 4600 B10R0.74 CCCCNCCC(C)CC 1e9bc7ea0a0af354300a85f57c2aaa99 [1,1,0,0,0,0|2,0,0]=4 4601 B10R0.74 CCCCOCCC(C)CC f254ee673c9931edff6d585f5329842f [1,1,0,0,0,0|2,0,0]=4 4602 B10R0.74 CCCCOCCC(S)CC bc2f3b2f58c19e9a9629224575cf313f [1,1,0,0,0,0|2,0,0]=4 4603 B10R0.74 CCCCOCC[C@@H](C)CC 993c3afca03cb97ff2687a4bdbe6e055 [1,1,0,0,0,0|2,0,0]=4 4604 B10R0.74 CCCCOCOC(C)CC b1b4b0a9028982023e445a30acf0111b [1,1,0,0,0,0|1,0,1]=4 4605 B10R0.74 CCCCOCO[C@@H](C)CC cb49f022c3ab9d1366df5238e6c3b898 [1,1,0,0,0,0|1,0,1]=4 4606 B10R0.74 CCCCOCO[C@H](C)CC de52d6cb33e0e7e7e6b0bc636cc3594c [1,1,0,0,0,0|1,0,1]=4 4607 B10R0.74 CCCOCCCC(C)CC 830720c7a42a213e98aa1689bfd341de [1,1,0,0,0,0|0,0,1]=3 4608 B10R0.74 CCCOCCCN(C)CC 4b6b7ea1a0b082f6cb271198bde9bda0 [1,1,0,0,0,0|1,0,1]=4 4609 B10R0.74 CCCOCCC[C@@H](C)CC 6a40126846604dd5c0859f3f0606466c [1,1,0,0,0,0|0,0,1]=3 4610 B10R0.74 CCCOCCNC(C)CC e2e69f4ae04d5ba391c30eaacd1735b6 [1,1,0,0,0,0|1,0,1]=4 4611 B10R0.74 CCCOCCN[C@@H](C)CC 4b040ad3421edf5e9ba6d2e921911f72 [1,1,0,0,0,0|1,0,1]=4 4612 B10R0.74 CCCOCCN[C@H](C)CC f851988b5dbd5645378976ba47094792 [1,1,0,0,0,0|1,0,1]=4 4613 B10R0.74 CCCOCCOC(C)CC caa02544192185eca0b2f14146ba92c3 [1,1,0,0,0,0|1,0,1]=4 4614 B10R0.74 CCCOCCO[C@@H](C)CC 1788ab32bc60c6e109792f373c0a19a4 [1,1,0,0,0,0|1,0,1]=4 4615 B10R0.74 CCCOCCO[C@H](C)CC 1b07f88c4baf03d429c02bfb85ce8c6b [1,1,0,0,0,0|1,0,1]=4 4616 B10R0.74 CCCSCCOC(C)CC 2733f49a83cc68881a8534ace6386d1a [1,1,0,0,0,0|1,0,1]=4 4617 B10R0.74 CCOCCCOC(C)CC 1cc6268698b2b659715eacd8fc564a82 [1,1,0,0,0,0|1,0,1]=4 4618 B10R0.74 CCOCCCO[C@@H](C)CC 9b42b4c7539ecd40408526db65ae8f63 [1,1,0,0,0,0|1,0,1]=4 4619 B10R0.74 CCOCCCO[C@H](C)CC 2d084986b28a59e397ad245961112c15 [1,1,0,0,0,0|1,0,1]=4 4620 B10R0.74 CCSCCCOC(C)CC 1b107a43579c4e83b65068858d994eb9 [1,1,0,0,0,0|1,0,1]=4 4621 B10R0.74 CCSCCCO[C@@H](C)CC 748a85663364fe07fba2583562f8e5dc [1,1,0,0,0,0|1,0,1]=4 4622 B10R0.74 CCSCCCO[C@H](C)CC 68b48412af8d72ee9b1bfb34940a7d55 [1,1,0,0,0,0|1,0,1]=4 4623 B10R0.74 CC[C@@H](C)OCCCCCF fe7bde4b10b0c741125aafe39950f0b4 [1,1,0,0,0,0|1,0,1]=4 4624 B10R0.74 CC[C@@H](C)OCCCCOC 27719c27b555bb466cd80659ee9649c2 [1,1,0,0,0,0|1,0,1]=4 4625 B10R0.74 CC[C@H](C)CCCOCCF bee401b940762bbeba9b5b1bfc2d6f14 [1,1,0,0,0,0|1,0,1]=4 4626 B10R0.74 CC[C@H](C)CCCOCCS d210b5089ccb1c4603ce846fe197949f [1,1,0,0,0,0|1,0,1]=4 4627 B10R0.74 CC[C@H](C)CCCOCOC 59185bb560e9ca68aba026a3c769e94c [1,1,0,0,0,0|1,0,1]=4 4628 B10R0.74 CC[C@H](C)CCCOCSC fbbb22afe5a712d3224f36b2c7740426 [1,1,0,0,0,0|1,0,1]=4 4629 B10R0.74 CC[C@H](C)OCCCCCF 91a7577f977af415fb6b736c966e0fff [1,1,0,0,0,0|1,0,1]=4 4630 B10R0.74 CC[C@H](C)OCCCCOC a3d2e080ef653b7977f65fcdc269a75a [1,1,0,0,0,0|1,0,1]=4 4631 B12R0.2 CC(C)CC(C)CC(=O)NCCBr aff333fe11f7f8e158cee1d765002869 [0,2,0,0,0,0|2,0,0]=4 4632 B12R0.2 CC(C)CC(C)CC(=O)NCCF 79a911c1cf252de73bf9082cde4423fa [0,2,0,0,0,0|2,0,0]=4 4633 B12R0.2 CC(C)CC(C)CC(=O)NCCI 0428143e2649828cf24fbbc5a0e444c4 [0,2,0,0,0,0|2,0,0]=4 4634 B12R0.2 CC(C)CC(C)CC(=O)NCCO f900cb1d4d64674f781cf7396309a564 [0,2,0,0,0,0|2,0,0]=4 4635 B12R0.2 CC(C)CC(C)CC(=O)NCCS 65ba2d795c71d9cafacdfe20957db2ff [0,2,0,0,0,0|2,0,0]=4 4636 B12R0.2 CC(C)CC(O)CC(=O)NCCBr 57b05a05d0d58e8a2cc6c08e1cd0ce72 [0,2,0,0,0,0|2,0,0]=4 4637 B12R0.2 CC(C)CC(O)CC(=O)NCCF 12e4b465a8e3bda091deee88938d4cc2 [0,2,0,0,0,0|2,0,0]=4 4638 B12R0.2 CC(C)CC(O)CC(=O)NCCI 86f5f371fbcada59094261780a1ae4e5 [0,2,0,0,0,0|2,0,0]=4 4639 B12R0.2 CC(C)CC(O)CC(=O)NCCO 4d539d92b5c2b02477752cca2716f22f [0,2,0,0,0,0|2,0,0]=4 4640 B12R0.2 CC(C)CC(O)CC(=O)NCCS a7bf450eb6380283653860f9c5c8b4b5 [0,2,0,0,0,0|2,0,0]=4 4641 B12R0.2 CCCCC(=O)NC(C)CC(C)C 8741167164621bc1af071dca0f6daea7 [0,2,0,0,0,0|2,0,0]=4 4642 B12R0.2 CCCCC(=O)NC(C)CC(C)O 290cea5e4941770b3e3feed5cedccd0f [0,2,0,0,0,0|2,0,0]=4 4643 B12R0.2 CCCNC(=O)CC(C)CC(C)C 727306cbee96c714a7e597aade6ceb25 [0,2,0,0,0,0|1,0,0]=3 4644 B12R0.2 CCCNC(=O)CC(O)CC(C)C 1b53352b0866b04d82ad6268659878a6 [0,2,0,0,0,0|1,0,0]=3 4645 B12R0.2 CCCNC(=O)CN(C)CC(C)C 7b4f6a0869c7d59a55978a155d4ac372 [0,2,0,0,0,0|2,0,0]=4 4646 B12R0.2 CCCNC(=O)CN(C)CC(C)O 3cd01090d6ed086c878d83e8304b7161 [0,2,0,0,0,0|2,0,0]=4 4647 B12R0.2 CCCNC(=O)CN(C)C[C@@H](C)O a230e818187d860df0d5f36daa5a61b1 [0,2,0,0,0,0|2,0,0]=4 4648 B12R0.2 CCCNC(=O)CN(C)C[C@H](C)O 78ed5bc6e89b948598df3a015d9ea75a [0,2,0,0,0,0|2,0,0]=4 4649 B12R0.2 CCCNC(=O)NC(C)CC(C)C 7b8e27d87479d419d07a1309979a407d [0,2,0,0,0,0|2,0,0]=4 4650 B12R0.2 CCCNC(=O)NC(C)CC(C)O b361f6ce2c4c0708a74911a3d972c5aa [0,2,0,0,0,0|2,0,0]=4 4651 B12R0.2 CCCOC(=O)CN(C)CC(C)C 4bf3e6fa6f7b4541616d348dc2fa119a [0,2,0,0,0,0|1,0,0]=3 4652 B12R0.2 CCCOC(=O)CN(C)CC(C)O c65accd948db809d1a9f1045811a79bd [0,2,0,0,0,0|1,0,0]=3 4653 B12R0.2 CCCOC(=O)CN(C)CC(F)F 74d85c320db2ad9252b839a38cc13344 [0,2,0,0,0,0|2,0,0]=4 4654 B12R0.2 CCCOC(=O)CN(C)C[C@H](C)O 49474c318ad9d9c63d312f5746e12b2b [0,2,0,0,0,0|1,0,0]=3 4655 B12R0.2 CCCOC(C)CC(C)CC(C)C 9a556dcbdab34b4a0511dc243c8063b3 [0,2,0,0,0,0|1,0,1]=4 4656 B12R0.68 C=C(CCC)CC(=O)NC(C)CC 0d2829088fdfa1e77e9e79d0fd9af5be [0,2,0,0,0,0|1,0,1]=4 4657 B12R0.68 C=C(CCC)CC(=O)N[C@@H](C)CC a914e0bf98ef169ecf7e7077498e9ec3 [0,2,0,0,0,0|1,0,1]=4 4658 B12R0.68 C=C(CCC)CC(=O)N[C@H](C)CC 71f6d7c4d7917cc677b22ed1ef50b473 [0,2,0,0,0,0|1,0,1]=4 4659 B12R0.68 CCC(C)NC(=O)CC(C)COC 0ba3f4e0e425a0d7c5efbf21cd12c0d0 [0,2,0,0,0,0|2,0,0]=4 4660 B12R0.68 CCCC(=O)CC(=O)NC(C)CC c33227af6b2b24a2fa785c5e5d552fbf [0,2,0,0,0,0|1,0,1]=4 4661 B12R0.68 CCCC(=O)CC(=O)N[C@@H](C)CC 9c260fc011ea64601f12ab03a90b3f0c [0,2,0,0,0,0|1,0,1]=4 4662 B12R0.68 CCCC(=O)CC(=O)N[C@H](C)CC 8ccc96e1ba0a35fae3d896ca50720640 [0,2,0,0,0,0|1,0,1]=4 4663 B12R0.68 CCCC(C)CC(=O)NC(C)CC db6c08eec070cba880e24fb7accb0265 [0,2,0,0,0,0|1,0,0]=3 4664 B12R0.68 CCCC(C)CC(=O)NC(C)CO 36d4b8ae6300cbd6dd7bcda32337c89a [0,2,0,0,0,0|2,0,0]=4 4665 B12R0.68 CCCC(C)CC(=O)N[C@@H](C)CC f88e81fe66f80ae3105533e117a0af37 [0,2,0,0,0,0|1,0,0]=3 4666 B12R0.68 CCCC(C)CC(=O)N[C@@H](C)CO 84550443288a5bc96eb5c0038874d738 [0,2,0,0,0,0|2,0,0]=4 4667 B12R0.68 CCCC(C)CC(=O)N[C@H](C)CC 1872903189ac73ef48e881be56dbac49 [0,2,0,0,0,0|1,0,0]=3 4668 B12R0.68 CCCC(C)CC(=O)N[C@H](C)CO bfaaa606e92e569ce18d1141d20e2026 [0,2,0,0,0,0|2,0,0]=4 4669 B12R0.68 CCCC(C)CC(C)OC(C)CC 6ad0b101bd1e9768ebf29ff9493bd583 [0,2,0,0,0,0|1,0,1]=4 4670 B12R0.68 CCCC(C)NC(=O)CC(C)CC f7106119af865efa88accf59f72eb2a6 [0,2,0,0,0,0|2,0,0]=4 4671 B12R0.68 CCCC(C)NC(=O)CC(O)CC 0a3e0b5a23d9e146dcef4134dfe25918 [0,2,0,0,0,0|2,0,0]=4 4672 B12R0.68 CCCC(C)NC(=O)C[C@@H](C)CC 47b90e1d9ad8e9136724842241c1ed98 [0,2,0,0,0,0|2,0,0]=4 4673 B12R0.68 CCCC(C)NC(=O)C[C@@H](O)CC f522021bc12299af369a2fbbaf2929e9 [0,2,0,0,0,0|2,0,0]=4 4674 B12R0.68 CCCC(C)NC(=O)C[C@H](C)CC 15f56adbc50afda10a42bcbf8fea6c1f [0,2,0,0,0,0|2,0,0]=4 4675 B12R0.68 CCCC(C)NC(=O)C[C@H](O)CC f227b817dc7ed1ce38e762e1f3c66baa [0,2,0,0,0,0|2,0,0]=4 4676 B12R0.68 CCCC(C)NC(=O)NC(C)CC 327ad555bd4f95050e039f6503533590 [0,2,0,0,0,0|2,0,0]=4 4677 B12R0.68 CCCC(C)NC(=O)N[C@@H](C)CC 936c388754430ba3b4cf140cbb2d7c4e [0,2,0,0,0,0|2,0,0]=4 4678 B12R0.68 CCCC(C)NC(=O)N[C@H](C)CC 05703a5c1f606cf10d977bafd84a1558 [0,2,0,0,0,0|2,0,0]=4 4679 B12R0.68 CCCC(O)CC(=O)NC(C)CC 01c7266dc5300adf015acc47c17c53a2 [0,2,0,0,0,0|1,0,0]=3 4680 B12R0.68 CCCC(O)CC(=O)NC(C)CO adee073e54ab24fcf242f8423d36639e [0,2,0,0,0,0|2,0,0]=4 4681 B12R0.68 CCCC(O)CC(=O)N[C@@H](C)CC ab8a80f1d87eea643de82bd37d84ba46 [0,2,0,0,0,0|1,0,0]=3 4682 B12R0.68 CCCC(O)CC(=O)N[C@@H](C)CO 0b5d66623bf02facdffa527c3d1344eb [0,2,0,0,0,0|2,0,0]=4 4683 B12R0.68 CCCC(O)CC(=O)N[C@H](C)CC 3625a1b118073ad2db899cc5bb3443e3 [0,2,0,0,0,0|1,0,0]=3 4684 B12R0.68 CCCC(O)CC(=O)N[C@H](C)CO 739d6848a00604bb2c9c52dcb0402ccd [0,2,0,0,0,0|2,0,0]=4 4685 B12R0.68 CCCN(C)CC(=O)NC(C)CC 886046a10d85906ae9ad4e024e2e08dd [0,2,0,0,0,0|2,0,0]=4 4686 B12R0.68 CCCS(=O)CC(=O)NC(C)CC 9e8cd9dc1bf182c9129f1637616d769e [0,2,0,0,0,0|2,0,0]=4 4687 B12R0.68 CCCS(=O)CC(=O)N[C@@H](C)CC 633b9bea9d25b691eedc80694a0c9132 [0,2,0,0,0,0|2,0,0]=4 4688 B12R0.68 CCCS(=O)CC(=O)N[C@H](C)CC 076fea54b091ab3463cbd57c98e0d6e2 [0,2,0,0,0,0|2,0,0]=4 4689 B12R0.68 CCC[C@H](C)NC(=O)CC(C)CC 5129394c535914b2871b0a00c662c819 [0,2,0,0,0,0|2,0,0]=4 4690 B12R0.68 CCC[C@H](C)NC(=O)CC(O)CC daefcdb79dec7fa2bc822380565be6be [0,2,0,0,0,0|2,0,0]=4 4691 B12R0.68 CCC[C@H](C)NC(=O)C[C@@H](C)CC 45dc38e18a1b716229b6a2fe08bfd9b0 [0,2,0,0,0,0|2,0,0]=4 4692 B12R0.68 CCC[C@H](C)NC(=O)C[C@@H](O)CC 03a708f8e706a70f027146b2deae0020 [0,2,0,0,0,0|2,0,0]=4 4693 B12R0.68 CCC[C@H](C)NC(=O)C[C@H](C)CC 0dfd3719cb7ff79c0b5c2a693aa5c80e [0,2,0,0,0,0|2,0,0]=4 4694 B12R0.68 CCC[C@H](C)NC(=O)C[C@H](O)CC 27e96c625aaf33ae115e8a3ca6974f34 [0,2,0,0,0,0|2,0,0]=4 4695 B12R0.68 CCC[C@H](C)NC(=O)NC(C)CC d665056ac115b2d6ec1886bdd6303a42 [0,2,0,0,0,0|2,0,0]=4 4696 B12R0.68 CCC[C@H](C)NC(=O)N[C@@H](C)CC f8a43849cffa5fef2076c5b16282f9d7 [0,2,0,0,0,0|2,0,0]=4 4697 B12R0.68 CCC[C@H](C)NC(=O)N[C@H](C)CC aff6536ac8b153e398ff0bfa08dc61e9 [0,2,0,0,0,0|2,0,0]=4 4698 B12R0.68 CCSC(C)CC(=O)NC(C)CC d5826fac70f5757a15c3c3cbe6da8f0d [0,2,0,0,0,0|2,0,0]=4 4699 B12R0.68 CCSC(C)CC(=O)N[C@@H](C)CC d82781bdb8d0fd7a6cdfcd355006e0a6 [0,2,0,0,0,0|2,0,0]=4 4700 B12R0.68 CCSC(C)CC(=O)N[C@H](C)CC 35eb7f95d2a533fc057be27de63b5545 [0,2,0,0,0,0|2,0,0]=4 4701 B12R0.68 CC[C@@H](C)NC(=O)CC(C)COC eb544b9aad716fe35a81be3fb136b927 [0,2,0,0,0,0|2,0,0]=4 4702 B12R0.68 CC[C@H](C)NC(=O)CC(C)COC d38b8c331128554987b4f415bb5220c2 [0,2,0,0,0,0|2,0,0]=4 4703 B12R0.69 C=C(CCC)C(=O)NC(C)CCC e444e5a15fe06abade65581783e05935 [0,2,0,0,0,0|2,0,0]=4 4704 B12R0.69 C=C(CCC)C(=O)N[C@@H](C)CCC 9f813acb8462e69e1d2ec899f2623ccd [0,2,0,0,0,0|2,0,0]=4 4705 B12R0.69 C=C(CCC)CC(=O)N(C)CCC 0ad260f70ac6c28973e218ba81d7806c [0,2,0,0,0,0|1,0,1]=4 4706 B12R0.69 CCCC(=O)C(=O)NC(C)CCC 4f86c1c45a9d281e5d9c2208d03c22ac [0,2,0,0,0,0|2,0,0]=4 4707 B12R0.69 CCCC(=O)C(=O)N[C@@H](C)CCC 2cfd2cc29620b0e379a47a78dec9aaa0 [0,2,0,0,0,0|2,0,0]=4 4708 B12R0.69 CCCC(=O)CC(=O)N(C)CCC c7bffe4aa8ef8e4e8dab483dbadde435 [0,2,0,0,0,0|1,0,1]=4 4709 B12R0.69 CCCC(C)CC(=O)N(C)CCC 03a0fdacb81a8acb3836a952bb44a2ea [0,2,0,0,0,0|1,0,0]=3 4710 B12R0.69 CCCC(C)CC(=O)N(C)CCF ed0bc5a5cb2814a53a9858e10517d258 [0,2,0,0,0,0|2,0,0]=4 4711 B12R0.69 CCCC(C)CC(=O)N(C)CCO 3a39013a5529b83d81171ee9c16e7c0f [0,2,0,0,0,0|2,0,0]=4 4712 B12R0.69 CCCC(C)NC(=O)C(O)CCC e22da3b4670e192519bca7a370e50ea2 [0,2,0,0,0,0|2,0,0]=4 4713 B12R0.69 CCCC(C)NC(=O)N(C)CCC 5698b26029bb87e2ed8a916afeff661b [0,2,0,0,0,0|2,0,0]=4 4714 B12R0.69 CCCC(C)NC(=O)[C@@H](O)CCC f1973c9ed2bd3320837a4a18124e6a5a [0,2,0,0,0,0|2,0,0]=4 4715 B12R0.69 CCCC(C)NC(=O)[C@H](O)CCC ca41a87b19997cf03576ed9059401095 [0,2,0,0,0,0|2,0,0]=4 4716 B12R0.69 CCCC(O)C(=O)N[C@@H](C)CCC c36d878bd3be8abe88e484739e633986 [0,2,0,0,0,0|2,0,0]=4 4717 B12R0.69 CCCC(O)CC(=O)N(C)CCC a3f4342b0da62d2dc863573301d7e23a [0,2,0,0,0,0|1,0,0]=3 4718 B12R0.69 CCCC(O)CC(=O)N(C)CCF f06a14e77937418e795282ad705b7b13 [0,2,0,0,0,0|2,0,0]=4 4719 B12R0.69 CCCC(O)CC(=O)N(C)CCO 65f9da2cfdb079f5230bba380d678dc1 [0,2,0,0,0,0|2,0,0]=4 4720 B12R0.69 CCCN(C)C(=O)CC(C)COC f085be3a389f7d534f0a9caaed8a0c1b [0,2,0,0,0,0|2,0,0]=4 4721 B12R0.69 CCCN(C)C(=O)CC(C)SCC 20959aa79834df21158d99203aae2628 [0,2,0,0,0,0|2,0,0]=4 4722 B12R0.69 CCCN(C)C(=O)CS(=O)CCC 7b767dac5f74f851e01f90a19664182d [0,2,0,0,0,0|2,0,0]=4 4723 B12R0.69 CCC[C@@H](O)C(=O)N[C@@H](C)CCC de0db4830617d2c0d1bd4701e5f76fba [0,2,0,0,0,0|2,0,0]=4 4724 B12R0.69 CCC[C@H](C)NC(=O)N(C)CCC 9daa75c463d5b11e536a18f08286ea5c [0,2,0,0,0,0|2,0,0]=4 4725 B12R0.69 CCC[C@H](C)NC(=O)[C@@H](O)CCC 3816f64189e274dafb90702500fb389e [0,2,0,0,0,0|2,0,0]=4 4726 B12R0.103 C#CCCN(C)CC(=O)OCCC e5d2f922ba44ed78541597540a73b832 [0,2,0,0,0,0|0,0,2]=4 4727 B12R0.103 C=C(CN(C)CCCC)OCOC 09a745cca88fb94b3e02b2a772e7b0e9 [0,2,0,0,0,0|2,0,0]=4 4728 B12R0.103 C=CCCN(C)CC(=O)OCCC b7dc3cc60321b2433f4948d1773dea1a [0,2,0,0,0,0|0,0,2]=4 4729 B12R0.103 C=CCOC(=O)CN(C)CCCC 1cf2f7563923e24efa98fcd0c350b64e [0,2,0,0,0,0|0,0,2]=4 4730 B12R0.103 CC/C=C/C(=O)NC(C)CCCC 0ba316ccbdc5ed75afa50009dffd73a5 [0,2,0,0,0,0|1,0,1]=4 4731 B12R0.103 CC/C=C/C(=O)N[C@H](C)CCCC fa5ed3e7749592fdb4288140637b3501 [0,2,0,0,0,0|1,0,1]=4 4732 B12R0.103 CC/C=C\C(=O)NC(C)CCCC a3cf3dce28b5212b6f345f1cda66914e [0,2,0,0,0,0|1,0,1]=4 4733 B12R0.103 CC/C=C\C(=O)N[C@H](C)CCCC 7c47bd1212b955a328288fa36ecc697d [0,2,0,0,0,0|1,0,1]=4 4734 B12R0.103 CCC#CC(=O)NC(C)CCCC 69603891ead2acaf29c48dec15ea3779 [0,2,0,0,0,0|1,0,1]=4 4735 B12R0.103 CCC#CC(=O)N[C@H](C)CCCC 01062fd0ff212b834891aa6777d5893a [0,2,0,0,0,0|1,0,1]=4 4736 B12R0.103 CCC=CC(=O)NC(C)CCCC b78d38865b6d2262dd2c33d5e43c17dd [0,2,0,0,0,0|1,0,1]=4 4737 B12R0.103 CCC=CC(=O)N[C@H](C)CCCC 128b8ee5b0f0a7528499144244bf66fa [0,2,0,0,0,0|1,0,1]=4 4738 B12R0.103 CCCCC(=O)NC(C)CCCC 53fcf1ea0760468784741571f64c5305 [0,2,0,0,0,0|1,0,0]=3 4739 B12R0.103 CCCCC(=O)NC(C)CCCO 20364f1fe18bc3ea67df53e18fb29213 [0,2,0,0,0,0|2,0,0]=4 4740 B12R0.103 CCCCC(=O)N[C@H](C)CCCC 5c605c84e87a34425b647c9c1f530254 [0,2,0,0,0,0|1,0,0]=3 4741 B12R0.103 CCCCC(=O)N[C@H](C)CCCO bfa80ff483c72aea4d14f7088678421a [0,2,0,0,0,0|2,0,0]=4 4742 B12R0.103 CCCCC(C)CC(=O)NCCBr 414de351c6780cdd01ff75434b88dc2a [0,2,0,0,0,0|2,0,0]=4 4743 B12R0.103 CCCCC(C)CC(=O)NCCC 25e4d4c07cd918a8386f738401ff4adf [0,2,0,0,0,0|1,0,0]=3 4744 B12R0.103 CCCCC(C)CC(=O)NCCF 2e0b6d119fe6fda531136d009be04f2c [0,2,0,0,0,0|2,0,0]=4 4745 B12R0.103 CCCCC(C)CC(=O)NCCI 854175e829d6db77217f1d09b78cdac3 [0,2,0,0,0,0|2,0,0]=4 4746 B12R0.103 CCCCC(C)CC(=O)NCCO 13c5c8072755768e3b5dc9bf5d1f89d9 [0,2,0,0,0,0|2,0,0]=4 4747 B12R0.103 CCCCC(C)CC(=O)NCCS a0f5d0b4a7595bbfa9aa2a86ec29b88b [0,2,0,0,0,0|2,0,0]=4 4748 B12R0.103 CCCCC(C)NC(=O)CCCF f0c4f53b57599151e8a7de255ebb27f4 [0,2,0,0,0,0|2,0,0]=4 4749 B12R0.103 CCCCC(C)NC(=O)CCCS d9cbb312dea3eb6a4aff56ebefc0aaf5 [0,2,0,0,0,0|2,0,0]=4 4750 B12R0.103 CCCCC(C)NC(=O)CCOC 222201af1c0579ec57513c1a23bc0555 [0,2,0,0,0,0|2,0,0]=4 4751 B12R0.103 CCCCC(C)NC(=O)CCSC 378d031e14f679c34dd51c89563f96bc [0,2,0,0,0,0|2,0,0]=4 4752 B12R0.103 CCCCC(C)NC(=O)COCC 8d6a04c6a1d61e580bba71638819a2a4 [0,2,0,0,0,0|2,0,0]=4 4753 B12R0.103 CCCCC(C)NC(=O)CSCC 93fdf458e13e6b6ee75196133f5a22fb [0,2,0,0,0,0|2,0,0]=4 4754 B12R0.103 CCCCC(C)NC(=O)NCCC 4390a57f8e189ec0fc147873b7f3fb91 [0,2,0,0,0,0|1,0,0]=3 4755 B12R0.103 CCCCC(C)NC(=O)NCCF 74954e392a9943dfbf7fdb4a95ff60a3 [0,2,0,0,0,0|2,0,0]=4 4756 B12R0.103 CCCCC(C)NC(=O)NCCN 98f9dbd0df9d282b90a15da044655339 [0,2,0,0,0,0|2,0,0]=4 4757 B12R0.103 CCCCC(C)NC(=O)NCCO 084ec5f87ebce5b9d30234914e5be1d5 [0,2,0,0,0,0|2,0,0]=4 4758 B12R0.103 CCCCC(C)NC(=O)NCCS f7560bfebf74b2aabb28563b1800f3f9 [0,2,0,0,0,0|2,0,0]=4 4759 B12R0.103 CCCCC(C)NC(=S)NCCC 6769f84644158118b7abb78ff9343db4 [0,2,0,0,0,0|1,1,0]=4 4760 B12R0.103 CCCCC(O)CC(=O)NCCBr e8c258a99e2dc615628b9cfc8b457af5 [0,2,0,0,0,0|2,0,0]=4 4761 B12R0.103 CCCCC(O)CC(=O)NCCC d0863715b5f61ba0b1418c513f92fd1a [0,2,0,0,0,0|1,0,0]=3 4762 B12R0.103 CCCCC(O)CC(=O)NCCF d04ee494b1e8184f34d7dbc967ef4d27 [0,2,0,0,0,0|2,0,0]=4 4763 B12R0.103 CCCCC(O)CC(=O)NCCI 8b32d9d2010832731690b6ba76e07b11 [0,2,0,0,0,0|2,0,0]=4 4764 B12R0.103 CCCCC(O)CC(=O)NCCO c2fa675c277bb86cbf9eb21351f0c72b [0,2,0,0,0,0|2,0,0]=4 4765 B12R0.103 CCCCC(O)CC(=O)NCCS 0bd29af23d6a0abc5be7b0f5a37c20c3 [0,2,0,0,0,0|2,0,0]=4 4766 B12R0.103 CCCCN(C)CC(=O)CCSC a50519ab51ca893899d05bfff69cff15 [0,2,0,0,0,0|2,0,0]=4 4767 B12R0.103 CCCCN(C)CC(=O)NCCC 8c2bad0e786c031445615fdb64055906 [0,2,0,0,0,0|1,0,0]=3 4768 B12R0.103 CCCCN(C)CC(=O)OCCC d0da8728310c46cdfa2d69fd2f4c442f [0,2,0,0,0,0|0,0,0]=2 4769 B12R0.103 CCCC[C@@H](C)CC(=O)NCCBr f8038951522347565782ac411c94c553 [0,2,0,0,0,0|2,0,0]=4 4770 B12R0.103 CCCC[C@@H](C)CC(=O)NCCC 25421a357e45bf06e66255cbce313759 [0,2,0,0,0,0|1,0,0]=3 4771 B12R0.103 CCCC[C@@H](C)CC(=O)NCCF 5832c355ae87b273fd25e0347b862ac9 [0,2,0,0,0,0|2,0,0]=4 4772 B12R0.103 CCCC[C@@H](C)CC(=O)NCCI d86704efe4c77f457b1bac303018462f [0,2,0,0,0,0|2,0,0]=4 4773 B12R0.103 CCCC[C@@H](C)CC(=O)NCCO 3a6c14a322227a91715eb7ab5967032f [0,2,0,0,0,0|2,0,0]=4 4774 B12R0.103 CCCC[C@@H](C)CC(=O)NCCS 4836e7826ae779e4b9974c33edb12352 [0,2,0,0,0,0|2,0,0]=4 4775 B12R0.103 CCCC[C@@H](C)NC(=O)CCCF e529056a278fd9748d5276d317ded0a7 [0,2,0,0,0,0|2,0,0]=4 4776 B12R0.103 CCCC[C@@H](C)NC(=O)CCCS 8bfeaf28dc7440bd8e6fdc2bcfd1e846 [0,2,0,0,0,0|2,0,0]=4 4777 B12R0.103 CCCC[C@@H](C)NC(=O)CCOC 86e0969bd904ab193036f59a295fc706 [0,2,0,0,0,0|2,0,0]=4 4778 B12R0.103 CCCC[C@@H](C)NC(=O)CCSC ea4bc1ac2f1d99dec95f40840ccae706 [0,2,0,0,0,0|2,0,0]=4 4779 B12R0.103 CCCC[C@@H](C)NC(=O)COCC 57063707a0a71f5658b0a7ea4d9d1623 [0,2,0,0,0,0|2,0,0]=4 4780 B12R0.103 CCCC[C@@H](C)NC(=O)CSCC 5ca11b359c68a8bcc433954d439dd6dc [0,2,0,0,0,0|2,0,0]=4 4781 B12R0.103 CCCC[C@@H](C)NC(=O)NCCC 6bf786bfa15a7754210008168b2d0d8e [0,2,0,0,0,0|1,0,0]=3 4782 B12R0.103 CCCC[C@@H](C)NC(=O)NCCF 4a265e30736b38e7cc2caf56ab8bc1fc [0,2,0,0,0,0|2,0,0]=4 4783 B12R0.103 CCCC[C@@H](C)NC(=O)NCCN 8ace3526b942c194a8c1ab388cf42d56 [0,2,0,0,0,0|2,0,0]=4 4784 B12R0.103 CCCC[C@@H](C)NC(=O)NCCO fd5c432717da49891a7de51a5a60e852 [0,2,0,0,0,0|2,0,0]=4 4785 B12R0.103 CCCC[C@@H](C)NC(=O)NCCS 7eb4229caf227c762b52ffc27811f3d8 [0,2,0,0,0,0|2,0,0]=4 4786 B12R0.103 CCCC[C@@H](C)NC(=S)NCCC 9a759a3e97cdb21001842744d326991f [0,2,0,0,0,0|1,1,0]=4 4787 B12R0.103 CCCC[C@H](C)CC(=O)NCCBr 19bd1e9cc08c4f7d37abe90597dad0ec [0,2,0,0,0,0|2,0,0]=4 4788 B12R0.103 CCCC[C@H](C)CC(=O)NCCC bd9b6b0af6620502b5af4f6f7ee09fd7 [0,2,0,0,0,0|1,0,0]=3 4789 B12R0.103 CCCC[C@H](C)CC(=O)NCCF b1cfa1c2b2dc711969f45622ca41984d [0,2,0,0,0,0|2,0,0]=4 4790 B12R0.103 CCCC[C@H](C)CC(=O)NCCI 5968c58967b5536607ec38eb4e78be79 [0,2,0,0,0,0|2,0,0]=4 4791 B12R0.103 CCCC[C@H](C)CC(=O)NCCO cfa1c525f88fa7cdff85088808c9d2e9 [0,2,0,0,0,0|2,0,0]=4 4792 B12R0.103 CCCC[C@H](C)CC(=O)NCCS 07f7a4a4c6dcd7cc04ef6733e7b00330 [0,2,0,0,0,0|2,0,0]=4 4793 B12R0.103 CCCNC(=O)CN(C)CCCF 50f97544ab81eecd3f4d7f28b843e135 [0,2,0,0,0,0|2,0,0]=4 4794 B12R0.103 CCCNC(=O)CN(C)CCCO 13b693bc32117779a6510822797db314 [0,2,0,0,0,0|2,0,0]=4 4795 B12R0.103 CCCNC(=O)CN(C)CCCS 56d6e06573828ce2b57763229aa13d3d [0,2,0,0,0,0|2,0,0]=4 4796 B12R0.103 CCCNC(=O)CN(C)CCOC 32648d9dc7f4e5cd3d647dae364184ef [0,2,0,0,0,0|2,0,0]=4 4797 B12R0.103 CCCNC(=O)CN(C)CCSC 0c69143e69e932b3125676c8467d0ac3 [0,2,0,0,0,0|2,0,0]=4 4798 B12R0.103 CCCNC(=O)CN(C)COCC b36d22abb4e10f0ab2021d723b4b316f [0,2,0,0,0,0|2,0,0]=4 4799 B12R0.103 CCCNC(=O)NC(C)CCCO d2099aa265b300b106a85fe601fc8be9 [0,2,0,0,0,0|2,0,0]=4 4800 B12R0.103 CCCNC(=O)N[C@H](C)CCCO 99b53638822095991240c7f64ab2b41b [0,2,0,0,0,0|2,0,0]=4 4801 B12R0.103 CCCOC(=O)CN(C)CCC#N 4b8989b267751992ed78099061415c3c [0,2,0,0,0,0|1,0,1]=4 4802 B12R0.103 CCCOC(=O)CN(C)CCCO e2dcdef237fa7d4c5f328ebef739cf31 [0,2,0,0,0,0|1,0,0]=3 4803 B12R0.103 CCCOC(=O)CN(C)CCOC 3de14b5134b0421046bb2942bb9869db [0,2,0,0,0,0|1,0,0]=3 4804 B12R0.103 CCCOC(=O)CN(C)CCON a4127723725aa6acde1af0c5f533d366 [0,2,0,0,0,0|2,0,0]=4 4805 B12R0.103 CCCOC(=O)CN(C)CCSC bc5e0620b4935ebdc4c2ca229d3e8c46 [0,2,0,0,0,0|1,0,0]=3 4806 B12R0.132 C=CC(CC(=O)OCCC)OCC 5d78500a1e72de6cff318afea50d626e [0,2,0,0,0,0|1,0,0]=3 4807 B12R0.132 C=CC(CC(=O)OCCC)OCF 4af59978ff6089bccf2566c8ccafa3df [0,2,0,0,0,0|2,0,0]=4 4808 B12R0.132 CCCC(CC)CC(=O)NCCBr 69b707c1583d4640739b3382f87e48b4 [0,2,0,0,0,0|2,0,0]=4 4809 B12R0.132 CCCC(CC)CC(=O)NCCF fa43ee2cf3d7bb24391e8987e6064e9a [0,2,0,0,0,0|2,0,0]=4 4810 B12R0.132 CCCC(CC)CC(=O)NCCI 9b8e246631b2bbf3791c6d5908ad9852 [0,2,0,0,0,0|2,0,0]=4 4811 B12R0.132 CCCC(CC)CC(=O)NCCO 584c3b47c9498c1fa9235feb111c59f3 [0,2,0,0,0,0|2,0,0]=4 4812 B12R0.132 CCCC(CC)CC(=O)NCCS f2c0edcbcbf3ccdb088636162c3d40c2 [0,2,0,0,0,0|2,0,0]=4 4813 B12R0.132 CCCCC(=O)NC(CO)CCC 0fbd26062b3ab90dc20e20b45b0dfe4b [0,2,0,0,0,0|2,0,0]=4 4814 B12R0.132 CCCCC(=O)N[C@@H](CO)CCC 09d4f79157d7c9a2711f1f14ec082a60 [0,2,0,0,0,0|2,0,0]=4 4815 B12R0.132 CCCCC(=O)N[C@H](CO)CCC 6e5d28d08e46eded65138766f1d62a37 [0,2,0,0,0,0|2,0,0]=4 4816 B12R0.132 CCCNC(=O)CC(CC)CCC d45f108cfe34559360fcf112348e5468 [0,2,0,0,0,0|1,0,0]=3 4817 B12R0.132 CCCNC(=O)CN(CC)CCC 8362581df1735f254e6dd1b9dbda59bb [0,2,0,0,0,0|2,0,0]=4 4818 B12R0.132 CCCNC(=O)NC(CO)CCC ac0732f5712ec0c5f7981c37d3227ceb [0,2,0,0,0,0|2,0,0]=4 4819 B12R0.132 CCCNC(=O)N[C@@H](CO)CCC 05a760868ed02f4d758937638e9fec9f [0,2,0,0,0,0|2,0,0]=4 4820 B12R0.132 CCCNC(=O)N[C@H](CO)CCC 91cbd144b40a3899e2355559e8026a39 [0,2,0,0,0,0|2,0,0]=4 4821 B12R0.132 CCCOC(=O)CC(CC)OCC 95504b11e2365ac03137265c9a440120 [0,2,0,0,0,0|1,0,0]=3 4822 B12R0.132 CCCOC(=O)CC(CC)OCF a3f0474244896c9f9e25b9489ec45f58 [0,2,0,0,0,0|2,0,0]=4 4823 B12R0.132 CCCOC(=O)CN(CC)CCC b9c6b97eced56db363038d28cbee8ae7 [0,2,0,0,0,0|1,0,0]=3 4824 B12R0.132 CCCOC(=O)CN(CC)CCCl f2e674d78f792d8b79238180169307b3 [0,2,0,0,0,0|2,0,0]=4 4825 B12R0.132 CCCOC(=O)CN(CC)CCO 7956472fe8bb3bdd2869cea8e27c4a57 [0,2,0,0,0,0|2,0,0]=4 4826 B12R0.132 CCCOC(=O)CN(CO)CCO c7c36e93b653bf3c6cdff45916b8fc9a [0,2,0,0,0,0|2,0,0]=4 4827 B12R0.134 CCCCC(=O)NC(C)C(C)CC b34e8d1f379ab4703d7ac9af8fc66083 [0,2,0,0,0,0|2,0,0]=4 4828 B12R0.134 CCCNC(=O)CN(C)C(C)CC 64b328f7049fbdf0bed189fde2a97943 [0,2,0,0,0,0|2,0,0]=4 4829 B12R0.134 CCCNC(=O)NC(C)C(C)CC 60eac63e0078a45dcd8f78ce4b9543ac [0,2,0,0,0,0|2,0,0]=4 4830 B12R0.134 CCCOC(=O)CN(C)C(C)CC 42c7225ce1f2176fbb0fcc242b9bf763 [0,2,0,0,0,0|1,0,0]=3 4831 B12R0.134 CCCOC(=O)CN(C)C(C)CO ceae2596ec4b2c290dee13e14927a472 [0,2,0,0,0,0|2,0,0]=4 4832 B12R0.134 CCCOC(=O)CN(C)[C@@H](C)CO 4b9562f817442e1dbaa994fb38566de1 [0,2,0,0,0,0|2,0,0]=4 4833 B12R0.134 CCCOC(=O)CN(C)[C@H](C)CO cd8141c612f34f1291adccb37d1ed61b [0,2,0,0,0,0|2,0,0]=4 4834 B12R0.239 C#CCCNC(=O)CC(C)CCC 9f70e485c9cc0f332534ef8aff6b35c8 [0,2,0,0,0,0|1,0,1]=4 4835 B12R0.239 C#CCCNC(=O)CC(O)CCC 3995e87a0ed2b79e72d2005df0ca7f08 [0,2,0,0,0,0|1,0,1]=4 4836 B12R0.239 C=C(CCC)CC(=O)NCCCC 75bf8f0624149d9736d876123226391b [0,2,0,0,0,0|1,0,1]=4 4837 B12R0.239 C=C(CCC)CC(=O)NCCCCl beb79e82f2c256c7a35ccbe3212db8d7 [0,2,0,0,0,0|1,0,1]=4 4838 B12R0.239 C=C(CCC)CC(=O)NCCCO 2e8404ea42332f6b32214c8e426fb3a4 [0,2,0,0,0,0|1,0,1]=4 4839 B12R0.239 C=C(CCC)CC(=O)NCCOC 3409bf97984b0b17c8ccdb485148006c [0,2,0,0,0,0|1,0,1]=4 4840 B12R0.239 C=C(CCC)CC(=O)NCCSC f8d1e8b37bf5c537090d4e4be337d595 [0,2,0,0,0,0|1,0,1]=4 4841 B12R0.239 C=CCCNC(=O)CC(C)CCC 1451ead5a35dd29e9c2d0b98b3fb59cd [0,2,0,0,0,0|1,0,1]=4 4842 B12R0.239 C=CCCNC(=O)CC(O)CCC 039ce6d38baf515449da1013b134e8d2 [0,2,0,0,0,0|1,0,1]=4 4843 B12R0.239 CC#CCNC(=O)CC(O)CCC d971118a91e58f3f72e30ca5df773412 [0,2,0,0,0,0|1,0,1]=4 4844 B12R0.239 CC(CCO)NC(=O)CCCCF e998d8c85951b63d76d1754040b6f2ed [0,2,0,0,0,0|2,0,0]=4 4845 B12R0.239 CC(CCO)NC(=O)CCCCO f59dc516368e7d03065f4bd8cca6c898 [0,2,0,0,0,0|2,0,0]=4 4846 B12R0.239 CC(CCO)NC(=O)CCCCS adc09ee479cd08bf1da84372cb57332c [0,2,0,0,0,0|2,0,0]=4 4847 B12R0.239 CC=CCNC(=O)CC(C)CCC d04fa535843dc25ab3264068b59e4d6c [0,2,0,0,0,0|1,0,1]=4 4848 B12R0.239 CC=CCNC(=O)CC(O)CCC 7e3eaaef1df26111fd826cfb06f7081a [0,2,0,0,0,0|1,0,1]=4 4849 B12R0.239 CCC/C=C/C(=O)NC(C)CCC 72ea7d33237924d2e24b97a43432a10e [0,2,0,0,0,0|2,0,0]=4 4850 B12R0.239 CCC/C=C/C(=O)N[C@@H](C)CCC 3f084f72fabae27fe3f3e7000342741a [0,2,0,0,0,0|2,0,0]=4 4851 B12R0.239 CCCC#CC(=O)NC(C)CCC d0c8b9f4e3259beb450f4b10b6916a8d [0,2,0,0,0,0|2,0,0]=4 4852 B12R0.239 CCCC#CC(=O)N[C@@H](C)CCC 851a4d46d83894234fc233a71b19ca12 [0,2,0,0,0,0|2,0,0]=4 4853 B12R0.239 CCCC(=O)CC(=O)NCCCCl 770c120ff1d9ff97bbd7f41fc5f22036 [0,2,0,0,0,0|1,0,1]=4 4854 B12R0.239 CCCC(=O)CC(=O)NCCCO 414a186226085ad5c0a79b45bccfb055 [0,2,0,0,0,0|1,0,1]=4 4855 B12R0.239 CCCC(=O)CC(=O)NCCOC e2c29e1383ce506a915ac26215480101 [0,2,0,0,0,0|1,0,1]=4 4856 B12R0.239 CCCC(=O)CC(=O)NCCSC bd0f7a70ce87911fe6f5850744beec85 [0,2,0,0,0,0|1,0,1]=4 4857 B12R0.239 CCCC(C)CC(=O)NCCC#N 8d57d51b0e52753e16561621be9c0afd [0,2,0,0,0,0|1,0,1]=4 4858 B12R0.239 CCCC(C)CC(=O)NCCCCl 611cd6812c4bc79c0440121bbc5c3c08 [0,2,0,0,0,0|1,0,0]=3 4859 B12R0.239 CCCC(C)CC(=O)NCCCO 3c78e37bdffe520670b4b9b347e1f6c1 [0,2,0,0,0,0|1,0,0]=3 4860 B12R0.239 CCCC(C)CC(=O)NCCOC 93dd239fc68e2f0b98de2ba060d17be0 [0,2,0,0,0,0|1,0,0]=3 4861 B12R0.239 CCCC(C)CC(=O)NCCON 3fed0059cd24d898b5845c92c8da90c5 [0,2,0,0,0,0|2,0,0]=4 4862 B12R0.239 CCCC(C)CC(=O)NCCSC c57d3fee79cbabda082e688558469884 [0,2,0,0,0,0|1,0,0]=3 4863 B12R0.239 CCCC(C)CC(C)OCCCF f1069c0786959b007afc46f7cc015f7f [0,2,0,0,0,0|1,0,1]=4 4864 B12R0.239 CCCC(C)CC(C)OCCCS 853f5704aa8d372e40f3c523c388538b [0,2,0,0,0,0|1,0,1]=4 4865 B12R0.239 CCCC(C)CC(C)OCCOC 26c0eee4d242e182655b9814cb454d2d [0,2,0,0,0,0|1,0,1]=4 4866 B12R0.239 CCCC(C)CC(C)OCCSC c9cc4e5dae6378654abd73d53044674c [0,2,0,0,0,0|1,0,1]=4 4867 B12R0.239 CCCC(C)NC(=O)CCCCF 55c3e92baaba29b3d8f0192421d6031e [0,2,0,0,0,0|2,0,0]=4 4868 B12R0.239 CCCC(C)NC(=O)CCCCO d28a6e179a9af6f3fc356e257d6ff31f [0,2,0,0,0,0|2,0,0]=4 4869 B12R0.239 CCCC(C)NC(=O)CCCCS 7e599f9413f7865118babb5ce80657e2 [0,2,0,0,0,0|2,0,0]=4 4870 B12R0.239 CCCC(C)NC(=O)CCCOC fc52bd0005d6e4306b9614224b3c028c [0,2,0,0,0,0|2,0,0]=4 4871 B12R0.239 CCCC(C)NC(=O)CCCSC e1afec90d57895e5ef343674161ebd3b [0,2,0,0,0,0|2,0,0]=4 4872 B12R0.239 CCCC(C)NC(=O)CCOCC a11c73b62e484064760380c259bf8fa0 [0,2,0,0,0,0|2,0,0]=4 4873 B12R0.239 CCCC(C)NC(=O)CCSCC c8343daa9d4afd0c2d0b4d9cac8c6d8b [0,2,0,0,0,0|2,0,0]=4 4874 B12R0.239 CCCC(C)NC(=O)COCCO 4eef26d95352c792c0ad41c9a5063f4c [0,2,0,0,0,0|2,0,0]=4 4875 B12R0.239 CCCC(C)NC(=O)COCCS 12bd5b7fa56948c8a13fc22150f13c21 [0,2,0,0,0,0|2,0,0]=4 4876 B12R0.239 CCCC(C)NC(=O)NCCCN b026aa47edf3c7c81f0fef6d1d364cdd [0,2,0,0,0,0|2,0,0]=4 4877 B12R0.239 CCCC(C)NC(=O)NCCCO 1007f99a4de42331f8f1f08418112449 [0,2,0,0,0,0|2,0,0]=4 4878 B12R0.239 CCCC(C)NC(=O)NCCOC 10f41dd37caa89fafd2424318e06bb1b [0,2,0,0,0,0|2,0,0]=4 4879 B12R0.239 CCCC(C)NC(=O)NCCSC a1a98c6b78aaf3232a02e472cf2c40a3 [0,2,0,0,0,0|2,0,0]=4 4880 B12R0.239 CCCC(O)CC(=O)NCCC#N a264b7d4c88a3c74a769c2cd4919abd3 [0,2,0,0,0,0|1,0,1]=4 4881 B12R0.239 CCCC(O)CC(=O)NCCCCl ec776b78737e851b93254bc622601a51 [0,2,0,0,0,0|1,0,0]=3 4882 B12R0.239 CCCC(O)CC(=O)NCCCO c8a71005185b8a577312aad4a5937289 [0,2,0,0,0,0|1,0,0]=3 4883 B12R0.239 CCCC(O)CC(=O)NCCOC 893b41fbe21ad81b1a7e4808284a37d1 [0,2,0,0,0,0|1,0,0]=3 4884 B12R0.239 CCCC(O)CC(=O)NCCON 18d38a865729de8dae1b488a03e39087 [0,2,0,0,0,0|2,0,0]=4 4885 B12R0.239 CCCC(O)CC(=O)NCCSC c6663d0781c81c770ff09bebdef06b3c [0,2,0,0,0,0|1,0,0]=3 4886 B12R0.239 CCCC=CC(=O)NC(C)CCC 3964310624c5e87308e8731d170c32f4 [0,2,0,0,0,0|2,0,0]=4 4887 B12R0.239 CCCC=CC(=O)N[C@@H](C)CCC 7407ca705d0510920d5f1faf64b7bb61 [0,2,0,0,0,0|2,0,0]=4 4888 B12R0.239 CCCCCC(=O)CN(C)CCC 186754a79d2a1ad53364bd9906724541 [0,2,0,0,0,0|1,0,0]=3 4889 B12R0.239 CCCCCC(=O)CN(C)CCF ee836a703c8deb15db5c98b6ef194ddb [0,2,0,0,0,0|2,0,0]=4 4890 B12R0.239 CCCCCC(=O)CN(C)CCO 1d5ad6eb1580a235e28a4ab73ae3cd9e [0,2,0,0,0,0|2,0,0]=4 4891 B12R0.239 CCCCCC(=O)NC(C)CC#N 6ebbf32e35db1b929b30e350f2e055d0 [0,2,0,0,0,0|1,0,1]=4 4892 B12R0.239 CCCCCC(=O)NC(C)CCC b5e68f454c9a1df21e70fa3834771138 [0,2,0,0,0,0|1,0,0]=3 4893 B12R0.239 CCCCCC(=O)NC(C)CCO bb0925eb9c3f381daff5708a73879ce6 [0,2,0,0,0,0|1,0,0]=3 4894 B12R0.239 CCCCCC(=O)NC(C)COC f6897adc61cf4dad46686d7c20879f9e [0,2,0,0,0,0|1,0,0]=3 4895 B12R0.239 CCCCCC(=O)N[C@@H](C)CCC ef460164380dbec3303d49c2e973224c [0,2,0,0,0,0|1,0,0]=3 4896 B12R0.239 CCCCCC(=O)N[C@@H](C)CCO 5b12f335bd092d7799732cf459c2a11a [0,2,0,0,0,0|1,0,0]=3 4897 B12R0.239 CCCCCC(=O)N[C@@H](C)COC f3bfe4f9c2df868327c07989a8af5918 [0,2,0,0,0,0|1,0,0]=3 4898 B12R0.239 CCCCCC(=O)N[C@H](C)CCO c45a920da21ec3018d37f290c93014cf [0,2,0,0,0,0|1,0,0]=3 4899 B12R0.239 CCCCCC(=O)N[C@H](C)COC fbc109027b40bd9701ff37dbdc828026 [0,2,0,0,0,0|1,0,0]=3 4900 B12R0.239 CCCCCC(C)OC(=S)CCC cb491ca31ef38fa137f25eca9041b317 [0,2,0,0,0,0|1,0,1]=4 4901 B12R0.239 CCCCCC(C)OC(C)CCC 8b22b198dc1482cac5f3ba4b889aad07 [0,2,0,0,0,0|1,0,1]=4 4902 B12R0.239 CCCCCC(C)OC(C)COC 8b924ba78290037bad72b5021042e2b4 [0,2,0,0,0,0|1,0,1]=4 4903 B12R0.239 CCCCCC(C)OC(C)CSC bf9d9d4db3a6da45b4c612c281709325 [0,2,0,0,0,0|1,0,1]=4 4904 B12R0.239 CCCCCC(C)O[C@@H](C)CCC 20662af8300704bda003ca23ed8385e1 [0,2,0,0,0,0|1,0,1]=4 4905 B12R0.239 CCCCCC(C)O[C@@H](C)COC 4ff84388ff29f161cfb7ef6c0634774c [0,2,0,0,0,0|1,0,1]=4 4906 B12R0.239 CCCCCC(C)O[C@H](C)CCC 523872240709bbd9e9ee07496c3d20d5 [0,2,0,0,0,0|1,0,1]=4 4907 B12R0.239 CCCCCC(C)O[C@H](C)COC 1e7596f4ddf976b34875e4e1efa2be50 [0,2,0,0,0,0|1,0,1]=4 4908 B12R0.239 CCCCC[C@@H](C)OC(C)CCC 978846c067b256b9ce568a05fe467d6a [0,2,0,0,0,0|1,0,1]=4 4909 B12R0.239 CCCCC[C@@H](C)OC(C)COC f8adca8864c8f71c0bec56b14bcdc805 [0,2,0,0,0,0|1,0,1]=4 4910 B12R0.239 CCCCC[C@H](C)OC(=S)CCC 42483c12356d923e5ecc6e50b9fbd89e [0,2,0,0,0,0|1,0,1]=4 4911 B12R0.239 CCCCC[C@H](C)OC(C)CCC d688da3118a2e804530f31c73163e717 [0,2,0,0,0,0|1,0,1]=4 4912 B12R0.239 CCCCC[C@H](C)OC(C)COC 57c6d262b3521da9f3d52b296c3a5c7c [0,2,0,0,0,0|1,0,1]=4 4913 B12R0.239 CCCCC[C@H](C)OC(C)CSC e42bb104a7f97f9747b1afa1a368805d [0,2,0,0,0,0|1,0,1]=4 4914 B12R0.239 CCCCC[C@H](C)O[C@@H](C)CCC 9fc74208fa45021d6e23e7a2a53f04d8 [0,2,0,0,0,0|1,0,1]=4 4915 B12R0.239 CCCCC[C@H](C)O[C@@H](C)COC d8f151d6621631c7ec314b15fe3ee89a [0,2,0,0,0,0|1,0,1]=4 4916 B12R0.239 CCCCC[C@H](C)O[C@H](C)CCC 5e4bbf6c5217ceaf5b4a621b18e8f3ed [0,2,0,0,0,0|1,0,1]=4 4917 B12R0.239 CCCCC[C@H](C)O[C@H](C)COC ed520c28f49c0069400024630b6b689b [0,2,0,0,0,0|1,0,1]=4 4918 B12R0.239 CCCCNC(=O)/C=C(\C)/CCC ccbc09a0ce99a18641687a85d36ccc42 [0,2,0,0,0,0|2,0,0]=4 4919 B12R0.239 CCCCNC(=O)CC(=O)CCC 6f399e88e5d49c2458555fc5b272800d [0,2,0,0,0,0|1,0,1]=4 4920 B12R0.239 CCCCNC(=O)CC(C)CCC bee21f97ee3636862255f47dbc0f4505 [0,2,0,0,0,0|1,0,0]=3 4921 B12R0.239 CCCCNC(=O)CC(C)COC 89e7e4c4d8d7b336aa98315b08d8798e [0,2,0,0,0,0|2,0,0]=4 4922 B12R0.239 CCCCNC(=O)CC(C)SCC 0a2543b162478484de7c9ff4c0c64eb0 [0,2,0,0,0,0|2,0,0]=4 4923 B12R0.239 CCCCNC(=O)CC(O)CCC 5bf0e976b066f6c85daef20fa780dc13 [0,2,0,0,0,0|1,0,0]=3 4924 B12R0.239 CCCCNC(=O)CN(C)CCC f40ed349a333ac79cfebadeb8e99d5a0 [0,2,0,0,0,0|2,0,0]=4 4925 B12R0.239 CCCCNC(=O)CS(=O)CCC 67ec3163bf96bb8c3ed0bd1881d6d451 [0,2,0,0,0,0|1,1,0]=4 4926 B12R0.239 CCCCNC(=O)NC(C)CCC 39ae42c04387d30248b755d2cddb1fe8 [0,2,0,0,0,0|2,0,0]=4 4927 B12R0.239 CCCCNC(=O)NC(C)CCO 959f0c1057f7e22328566e6a1a403b1e [0,2,0,0,0,0|2,0,0]=4 4928 B12R0.239 CCCCNC(=O)NC(C)COC 07b43b711e42d62d28c1f1b707cd8696 [0,2,0,0,0,0|2,0,0]=4 4929 B12R0.239 CCCCNC(=O)N[C@@H](C)CCC 6ec8bd3d294073017beddd074ae03e70 [0,2,0,0,0,0|2,0,0]=4 4930 B12R0.239 CCCCNC(=O)N[C@@H](C)CCO 5a2cbcef1f8f391c6635d1e9582b8363 [0,2,0,0,0,0|2,0,0]=4 4931 B12R0.239 CCCCNC(=O)N[C@@H](C)COC 28e3452788871e2c9199eadd773b4847 [0,2,0,0,0,0|2,0,0]=4 4932 B12R0.239 CCCCNC(=O)N[C@H](C)CCO b43e450c7b8a4fd8df37643427b367c5 [0,2,0,0,0,0|2,0,0]=4 4933 B12R0.239 CCCCNC(=O)N[C@H](C)COC 34c9b8089b81dd6c1d21295a75ea84ae [0,2,0,0,0,0|2,0,0]=4 4934 B12R0.239 CCCCOC(=O)CN(C)CCC 172dddd1fda6b853ff6d6ec9bb232b67 [0,2,0,0,0,0|1,0,0]=3 4935 B12R0.239 CCCCOC(=O)CN(C)CCF c79856545b472f265eaa8fb430a0893c [0,2,0,0,0,0|2,0,0]=4 4936 B12R0.239 CCCCOC(=O)CN(C)CCO 9714165a1cd2bc8c5e6c39662231b1bf [0,2,0,0,0,0|2,0,0]=4 4937 B12R0.239 CCCCOC(C)CC(C)CCC 20b79404e9890505734036fcbbd98c0e [0,2,0,0,0,0|1,0,1]=4 4938 B12R0.239 CCCN(C)CC(=O)NCCOC 21f3616330aca00ba90fcc7a69b395df [0,2,0,0,0,0|2,0,0]=4 4939 B12R0.239 CCCN(C)CC(=O)OCCOC c788511c31aa2609ef0a0f8e61da3389 [0,2,0,0,0,0|1,0,0]=3 4940 B12R0.239 CCCOCC(=O)CC(=O)OCC 0994606cb19dec662684f2c038a0cd50 [0,2,0,0,0,0|1,0,1]=4 4941 B12R0.239 CCCOCC(=O)NC(C)CCC e2104fcca9f64b41b257e0783ca77cae [0,2,0,0,0,0|1,0,0]=3 4942 B12R0.239 CCCOCC(=O)NC(C)CCO 113f3cd900cdc3a59c9c81d6ae456d73 [0,2,0,0,0,0|2,0,0]=4 4943 B12R0.239 CCCOCC(=O)NC(C)COC e3370bc527b7eb95d01498f2d58cdd0a [0,2,0,0,0,0|2,0,0]=4 4944 B12R0.239 CCCOCC(=O)N[C@@H](C)CCC 4e8b36b6a9169910e6de807fe293bdbd [0,2,0,0,0,0|1,0,0]=3 4945 B12R0.239 CCCOCC(=O)N[C@@H](C)CCO ac01294876b1015ea27628b38997474c [0,2,0,0,0,0|2,0,0]=4 4946 B12R0.239 CCCOCC(=O)N[C@@H](C)COC 431f1f62384f03b26468b123f4e403ea [0,2,0,0,0,0|2,0,0]=4 4947 B12R0.239 CCCOCC(=O)N[C@H](C)CCO bf9550c346f28b75ea86ccbaa36028d4 [0,2,0,0,0,0|2,0,0]=4 4948 B12R0.239 CCCOCC(=O)N[C@H](C)COC cfaf625251481897ddb893a000a15f40 [0,2,0,0,0,0|2,0,0]=4 4949 B12R0.239 CCCS(=O)CC(=O)NCCCCl d50dfbd26c1f25316f4c26e331a12a96 [0,2,0,0,0,0|2,0,0]=4 4950 B12R0.239 CCCS(=O)CC(=O)NCCCO e2f5469766eadc8dc8885476c2015299 [0,2,0,0,0,0|2,0,0]=4 4951 B12R0.239 CCCS(=O)CC(=O)NCCOC 28506ab64fe10e3a1353dbe22cc315ab [0,2,0,0,0,0|2,0,0]=4 4952 B12R0.239 CCCS(=O)CC(=O)NCCSC 0f80d8c1e47f0e715b0a5acace047dad [0,2,0,0,0,0|2,0,0]=4 4953 B12R0.239 CCCSCC(=O)NC(C)CCC 5d1c19d953fab84bf0a8e1b8b34985c7 [0,2,0,0,0,0|1,1,0]=4 4954 B12R0.239 CCCSCC(=O)NC(C)CCO 1d0fdff5fad45c425b222aa08450d659 [0,2,0,0,0,0|2,0,0]=4 4955 B12R0.239 CCCSCC(=O)NC(C)COC 88b0e2205aec587147c44fe68cac2c6a [0,2,0,0,0,0|2,0,0]=4 4956 B12R0.239 CCCSCC(=O)N[C@@H](C)CCC 4d7feb4b4aed278291bbf9733450d31c [0,2,0,0,0,0|1,1,0]=4 4957 B12R0.239 CCCSCC(=O)N[C@@H](C)CCO d831b695504a7a1480b34eaa94b3a9ac [0,2,0,0,0,0|2,0,0]=4 4958 B12R0.239 CCCSCC(=O)N[C@@H](C)COC 90e2aa9559f5dcce9ab06a145a158f17 [0,2,0,0,0,0|2,0,0]=4 4959 B12R0.239 CCCSCC(=O)N[C@H](C)CCO a3c6b8fef4271f39f0b82201e4fbfe9d [0,2,0,0,0,0|2,0,0]=4 4960 B12R0.239 CCCSCC(=O)N[C@H](C)COC 65b6196b4cea1bec6cee4120513e78fd [0,2,0,0,0,0|2,0,0]=4 4961 B12R0.239 CCC[C@H](C)NC(=O)CCCCF 0610e67b6e6b663f0318e3bcef9ff75d [0,2,0,0,0,0|2,0,0]=4 4962 B12R0.239 CCC[C@H](C)NC(=O)CCCCO 530cbee29d74793a0e7b4b724dd1d6f1 [0,2,0,0,0,0|2,0,0]=4 4963 B12R0.239 CCC[C@H](C)NC(=O)CCCCS 608ed0caebdc33e7e66cc9cc6062dd6f [0,2,0,0,0,0|2,0,0]=4 4964 B12R0.239 CCC[C@H](C)NC(=O)CCCOC 775bd93873adfd02da27432ecba9b917 [0,2,0,0,0,0|2,0,0]=4 4965 B12R0.239 CCC[C@H](C)NC(=O)CCCSC 282769786ef95f34d80a0da93785c15e [0,2,0,0,0,0|2,0,0]=4 4966 B12R0.239 CCC[C@H](C)NC(=O)CCOCC daeb42a48b04dc095b44034811dbafe7 [0,2,0,0,0,0|2,0,0]=4 4967 B12R0.239 CCC[C@H](C)NC(=O)CCSCC c55839a87241507fceb6a427ac75e5f7 [0,2,0,0,0,0|2,0,0]=4 4968 B12R0.239 CCC[C@H](C)NC(=O)COCCO 2ee582641e660ccf193ab661d3033ab4 [0,2,0,0,0,0|2,0,0]=4 4969 B12R0.239 CCC[C@H](C)NC(=O)COCCS 1360a7273a811c59194773e489176247 [0,2,0,0,0,0|2,0,0]=4 4970 B12R0.239 CCC[C@H](C)NC(=O)NCCCN 1083927597a989ced6428d3637675cb7 [0,2,0,0,0,0|2,0,0]=4 4971 B12R0.239 CCC[C@H](C)NC(=O)NCCCO 26ec42bad92aced5f0e8c3ea842a0e10 [0,2,0,0,0,0|2,0,0]=4 4972 B12R0.239 CCC[C@H](C)NC(=O)NCCOC 23ed316c15c7a7d41ed2ba042b9eb8cf [0,2,0,0,0,0|2,0,0]=4 4973 B12R0.239 CCC[C@H](C)NC(=O)NCCSC 1f8dffcb42f5e78a0a43a02bd1ce6b11 [0,2,0,0,0,0|2,0,0]=4 4974 B12R0.239 CCOCCC(=O)NC(C)CCO ef31bb2224c653f85d8eafd473649b7a [0,2,0,0,0,0|2,0,0]=4 4975 B12R0.239 CCOCCC(=O)NC(C)COC 91d0bd89590f1297261ea46a829cf6d2 [0,2,0,0,0,0|2,0,0]=4 4976 B12R0.239 CCOCCC(=O)N[C@@H](C)CCO 5e9e6def16b87d16212853d1e628d9a2 [0,2,0,0,0,0|2,0,0]=4 4977 B12R0.239 CCOCCC(=O)N[C@@H](C)COC 4b9b787e46f04ddba2abd99f0322f8e7 [0,2,0,0,0,0|2,0,0]=4 4978 B12R0.239 CCOCCC(=O)N[C@H](C)CCO 51fbe9a867255b5097eb1939d27f0952 [0,2,0,0,0,0|2,0,0]=4 4979 B12R0.239 CCOCCC(=O)N[C@H](C)COC 49422351ddb03373acb3d99ef06cab4b [0,2,0,0,0,0|2,0,0]=4 4980 B12R0.239 CCSC(C)CC(=O)NCCCCl 352f28dba2c367744834dccff25f26d4 [0,2,0,0,0,0|2,0,0]=4 4981 B12R0.239 CCSC(C)CC(=O)NCCCO 0c11a767da70295ec69e1ba416258ccc [0,2,0,0,0,0|2,0,0]=4 4982 B12R0.239 CCSC(C)CC(=O)NCCOC ed641c460058f6a628597d3c490e8dd2 [0,2,0,0,0,0|2,0,0]=4 4983 B12R0.239 CCSC(C)CC(=O)NCCSC ebb36eb60ea2e19f34a704b80760d44a [0,2,0,0,0,0|2,0,0]=4 4984 B12R0.239 CCSCCC(=O)NC(C)CCO 02d4a9943d235b302b1a54c3caf2bc8d [0,2,0,0,0,0|2,0,0]=4 4985 B12R0.239 CCSCCC(=O)NC(C)COC 3a5c59b7f689a018148125d5e0931826 [0,2,0,0,0,0|2,0,0]=4 4986 B12R0.239 CCSCCC(=O)N[C@@H](C)CCO 66a5a83de7b0bc369c23f8c32146d192 [0,2,0,0,0,0|2,0,0]=4 4987 B12R0.239 CCSCCC(=O)N[C@@H](C)COC 69a5f3d801632d4265db44fec935a738 [0,2,0,0,0,0|2,0,0]=4 4988 B12R0.239 CCSCCC(=O)N[C@H](C)CCO 5360a6c2717532d703082dfe04099c20 [0,2,0,0,0,0|2,0,0]=4 4989 B12R0.239 CCSCCC(=O)N[C@H](C)COC c5a19310d25bbeffd3b407c91adf5982 [0,2,0,0,0,0|2,0,0]=4 4990 B12R0.239 COCC(C)CC(=O)NCCCCl 192a1940bce6a307ba02a2cc1b3843fb [0,2,0,0,0,0|2,0,0]=4 4991 B12R0.239 COCC(C)CC(=O)NCCCO 7b86ee9646ef60d6de7bd41bc114e0f4 [0,2,0,0,0,0|2,0,0]=4 4992 B12R0.239 COCC(C)CC(=O)NCCSC 6e841ae5eb50aa2bb92946a8956e7922 [0,2,0,0,0,0|2,0,0]=4 4993 B12R0.239 COCC(C)NC(=O)CCCCF fc892c74d0ab3a5e1789af7b6a876925 [0,2,0,0,0,0|2,0,0]=4 4994 B12R0.239 COCC(C)NC(=O)CCCCO 451dfe4c819ce01dc47ede5dab698722 [0,2,0,0,0,0|2,0,0]=4 4995 B12R0.239 COCC(C)NC(=O)CCCCS aab83aaf9655477543c315a4a82bc2eb [0,2,0,0,0,0|2,0,0]=4 4996 B12R0.239 COCC(C)NC(=O)CCCSC 8b88e10d8f9d15ae38e1e58f8d388ecd [0,2,0,0,0,0|2,0,0]=4 4997 B12R0.239 COCCCC(=O)NC(C)CCO 543a6ef6bd22537b981eb530d54ecd8b [0,2,0,0,0,0|2,0,0]=4 4998 B12R0.239 COCCCC(=O)NC(C)COC 1c7373a0d2bdc94b8b2a266d2d1757a6 [0,2,0,0,0,0|2,0,0]=4 4999 B12R0.239 COCCCC(=O)N[C@@H](C)CCO ca418b0174c1f84fd6f742dc583ddeb8 [0,2,0,0,0,0|2,0,0]=4 5000 B12R0.239 COCCCC(=O)N[C@@H](C)COC d1533e68a09c2b08b5b94a53a586cec4 [0,2,0,0,0,0|2,0,0]=4 5001 B12R0.239 COCCCC(=O)N[C@H](C)CCO 54176f4de95223e2b7823b921176071c [0,2,0,0,0,0|2,0,0]=4 5002 B12R0.239 COCCCC(=O)N[C@H](C)COC d6eecd4f98a21468e3bac3f3ee601799 [0,2,0,0,0,0|2,0,0]=4 5003 B12R0.239 COCCNC(=O)CC(C)COC f4922c3a3c3a80eabaa81db6c1185708 [0,2,0,0,0,0|2,0,0]=4 5004 B12R0.239 COCCOC(=O)CN(C)CCF 775085f8093a56ea7bcd14f1923566da [0,2,0,0,0,0|2,0,0]=4 5005 B12R0.239 COCCOC(=O)CN(C)CCO 56b6f3113a3e6d74f423f40ee93c3312 [0,2,0,0,0,0|2,0,0]=4 5006 B12R0.239 COC[C@@H](C)NC(=O)CCCCF 6a3414bf7f65fb56ce26d1458f820e3f [0,2,0,0,0,0|2,0,0]=4 5007 B12R0.239 COC[C@@H](C)NC(=O)CCCCO cda8444e80365d3337ed7fc57a04ae79 [0,2,0,0,0,0|2,0,0]=4 5008 B12R0.239 COC[C@@H](C)NC(=O)CCCCS 6b1058a757fd838d59ef891d3537b6d0 [0,2,0,0,0,0|2,0,0]=4 5009 B12R0.239 COC[C@@H](C)NC(=O)CCCSC 7cb1f64f7eb964b9c5ef560ddef43e3c [0,2,0,0,0,0|2,0,0]=4 5010 B12R0.239 COC[C@H](C)NC(=O)CCCCF bdb4130d3b2a9581338beb5f8b03e9d9 [0,2,0,0,0,0|2,0,0]=4 5011 B12R0.239 COC[C@H](C)NC(=O)CCCCO 72ea29a403f169bd891313866bc69495 [0,2,0,0,0,0|2,0,0]=4 5012 B12R0.239 COC[C@H](C)NC(=O)CCCCS e84877e1187e8c5de116421aece3e535 [0,2,0,0,0,0|2,0,0]=4 5013 B12R0.239 COC[C@H](C)NC(=O)CCCSC b9837216c76423c8cf5eb939b50bef00 [0,2,0,0,0,0|2,0,0]=4 5014 B12R0.239 CSCCCC(=O)NC(C)CCO 36daf9ef4d53d0ea36f2182ede199588 [0,2,0,0,0,0|2,0,0]=4 5015 B12R0.239 CSCCCC(=O)N[C@@H](C)CCO 7de72567d2f717005dce26b639bce5a5 [0,2,0,0,0,0|2,0,0]=4 5016 B12R0.239 CSCCCC(=O)N[C@H](C)CCO 95ffc4cf5ea590badc120c99da3300d6 [0,2,0,0,0,0|2,0,0]=4 5017 B12R0.239 C[C@@H](CCO)NC(=O)CCCCF dbda396bb92e9c717329a8ac1ec00904 [0,2,0,0,0,0|2,0,0]=4 5018 B12R0.239 C[C@@H](CCO)NC(=O)CCCCO 28934d38929a60cb926ef8616d2e1f11 [0,2,0,0,0,0|2,0,0]=4 5019 B12R0.239 C[C@@H](CCO)NC(=O)CCCCS 82193ff37a68154a5dd80c23b1132503 [0,2,0,0,0,0|2,0,0]=4 5020 B12R0.239 C[C@H](CCO)NC(=O)CCCCF 586f9fbefff6c6dac88ac045aefafd61 [0,2,0,0,0,0|2,0,0]=4 5021 B12R0.239 C[C@H](CCO)NC(=O)CCCCO c2e862b26446d012bd2ae81822c59ea3 [0,2,0,0,0,0|2,0,0]=4 5022 B12R0.239 C[C@H](CCO)NC(=O)CCCCS 600188e031dabeca3f902de344fe8487 [0,2,0,0,0,0|2,0,0]=4 5023 B12R0.283 C=C(C)CNC(=O)CC(C)CCC 7f7a3b65520565343878cdb408d5f711 [0,2,0,0,0,0|1,0,1]=4 5024 B12R0.283 C=C(C)CNC(=O)CC(O)CCC 5d5944e1ecd7f7ce23e5db53a8d0c5cc [0,2,0,0,0,0|1,0,1]=4 5025 B12R0.283 C=C(CCC)CC(=O)NCC(C)C 216e752db8cab1bdf1904d47210bec09 [0,2,0,0,0,0|1,0,1]=4 5026 B12R0.283 C=C(CCC)CC(=O)NCC(C)O 088d6ebd39ddcb9f67f08f8ed481ab31 [0,2,0,0,0,0|1,0,1]=4 5027 B12R0.283 C=C(CCC)CC(=O)NC[C@@H](C)O 2de036a5fd399c56ff5c94200aa0468c [0,2,0,0,0,0|1,0,1]=4 5028 B12R0.283 C=C(CCC)CC(=O)NC[C@H](C)O 9cfc83c325e94a09d656ad35bc0ec4f9 [0,2,0,0,0,0|1,0,1]=4 5029 B12R0.283 CCCC(=O)CC(=O)NCC(C)C 6da34ce0249229a18801b7e16108c807 [0,2,0,0,0,0|1,0,1]=4 5030 B12R0.283 CCCC(=O)CC(=O)NCC(C)O 1a40ab10d73ffceb6c8a0e802613e7ef [0,2,0,0,0,0|1,0,1]=4 5031 B12R0.283 CCCC(=O)CC(=O)NC[C@@H](C)O 051aeaf5d5e800e79ae2b9a592d7d5c2 [0,2,0,0,0,0|1,0,1]=4 5032 B12R0.283 CCCC(=O)CC(=O)NC[C@H](C)O 52fd2b1f319bf7c5d4ca2b3440bdb30b [0,2,0,0,0,0|1,0,1]=4 5033 B12R0.283 CCCC(C)CC(=O)NCC(=O)C 736ee81a5f0e66af1b993c94975e5eba [0,2,0,0,0,0|1,0,1]=4 5034 B12R0.283 CCCC(C)CC(=O)NCC(C)C 6eaff04232d1b70d0f7038c0bfb673ad [0,2,0,0,0,0|1,0,0]=3 5035 B12R0.283 CCCC(C)CC(=O)NCC(C)O a9caeef0f43ad8673876751f3c61fe96 [0,2,0,0,0,0|1,0,0]=3 5036 B12R0.283 CCCC(C)CC(=O)NCC(F)F 293a28141b2d315c7ca3bf35da9ab3dc [0,2,0,0,0,0|2,0,0]=4 5037 B12R0.283 CCCC(C)CC(=O)NC[C@@H](C)O 127c56352d7a8e95b5576b3b93840737 [0,2,0,0,0,0|1,0,0]=3 5038 B12R0.283 CCCC(C)CC(=O)NC[C@H](C)O 09e7175b128e0a4a92a81c7da60943da [0,2,0,0,0,0|1,0,0]=3 5039 B12R0.283 CCCC(C)CC(C)OCC(C)C 6f2d86aba42c6fc3043eee17324385c2 [0,2,0,0,0,0|1,0,1]=4 5040 B12R0.283 CCCC(C)NC(=O)CCC(C)C 3aacc80bb73bb5a419776a7433e6b2ec [0,2,0,0,0,0|2,0,0]=4 5041 B12R0.283 CCCC(C)NC(=O)CCC(C)O 5a1c48aa56b4c0060d1d6f797a182d83 [0,2,0,0,0,0|2,0,0]=4 5042 B12R0.283 CCCC(C)NC(=O)CCC(C)S 0a361b6234e82ee23296213a16c8266e [0,2,0,0,0,0|2,0,0]=4 5043 B12R0.283 CCCC(C)NC(=O)CC[C@H](C)S 370f7ba887db2914f2e639ed91da01e0 [0,2,0,0,0,0|2,0,0]=4 5044 B12R0.283 CCCC(C)NC(=O)NCC(C)C 1f2cc0543c96e20b41d92d938ba758e0 [0,2,0,0,0,0|2,0,0]=4 5045 B12R0.283 CCCC(C)NC(=O)NCC(C)O 1c6c3b688fdb19715ca3c897726d1111 [0,2,0,0,0,0|2,0,0]=4 5046 B12R0.283 CCCC(C)NC(=O)NC[C@@H](C)O 73deb0ffeb12a981223640ad5fed3c8c [0,2,0,0,0,0|2,0,0]=4 5047 B12R0.283 CCCC(C)NC(=O)NC[C@H](C)O 9b19ee5904ee3faf5c6e99ae0898f738 [0,2,0,0,0,0|2,0,0]=4 5048 B12R0.283 CCCC(O)CC(=O)NCC(=O)C 25b411e5a5d2368038bc72aec91c57b9 [0,2,0,0,0,0|1,0,1]=4 5049 B12R0.283 CCCC(O)CC(=O)NCC(C)C be6bed460c09edfa7a495cd4bb7e0fba [0,2,0,0,0,0|1,0,0]=3 5050 B12R0.283 CCCC(O)CC(=O)NCC(C)O 05369be85c33436ab535a082ab8b8071 [0,2,0,0,0,0|1,0,0]=3 5051 B12R0.283 CCCC(O)CC(=O)NCC(F)F 5c6cb62ff8d17b0655fe30428bd4525c [0,2,0,0,0,0|2,0,0]=4 5052 B12R0.283 CCCC(O)CC(=O)NC[C@@H](C)O 02b99cfce26741b48aa61ead8c0513ee [0,2,0,0,0,0|1,0,0]=3 5053 B12R0.283 CCCC(O)CC(=O)NC[C@H](C)O 05c56dfdc178ba5779e3233e3ed47eaf [0,2,0,0,0,0|1,0,0]=3 5054 B12R0.283 CCCN(C)CC(=O)NCC(C)C d640eda3cca28c5cf0cab1d809af5b80 [0,2,0,0,0,0|2,0,0]=4 5055 B12R0.283 CCCS(=O)CC(=O)NCC(C)C 01b7d2aec055cc00de76d9e22ff16795 [0,2,0,0,0,0|2,0,0]=4 5056 B12R0.283 CCCS(=O)CC(=O)NCC(C)O dac8156c2ddaa6ec3360c00110bf63ba [0,2,0,0,0,0|2,0,0]=4 5057 B12R0.283 CCCS(=O)CC(=O)NC[C@@H](C)O 79a17303eb9ffc8703af7a048ce51439 [0,2,0,0,0,0|2,0,0]=4 5058 B12R0.283 CCCS(=O)CC(=O)NC[C@H](C)O 03c08b648820b0193a70dcb0349f3a5c [0,2,0,0,0,0|2,0,0]=4 5059 B12R0.283 CCC[C@H](C)NC(=O)CCC(C)C 32a0847e29e3a3f9916d62c9763ad41f [0,2,0,0,0,0|2,0,0]=4 5060 B12R0.283 CCC[C@H](C)NC(=O)CCC(C)O 0ec743404507793691b36e8294e07474 [0,2,0,0,0,0|2,0,0]=4 5061 B12R0.283 CCC[C@H](C)NC(=O)CCC(C)S 801e073eb4a9856a0c3d0d7cffe45b0e [0,2,0,0,0,0|2,0,0]=4 5062 B12R0.283 CCC[C@H](C)NC(=O)CC[C@H](C)S 35b9062afc53d7d694c6c486b4654192 [0,2,0,0,0,0|2,0,0]=4 5063 B12R0.283 CCC[C@H](C)NC(=O)NCC(C)C 5b454ddc6f9b25c07d71e7e5e43fdab3 [0,2,0,0,0,0|2,0,0]=4 5064 B12R0.283 CCC[C@H](C)NC(=O)NCC(C)O c425b15c2401137e24671fb9ffb03716 [0,2,0,0,0,0|2,0,0]=4 5065 B12R0.283 CCC[C@H](C)NC(=O)NC[C@@H](C)O 714513a90074fc5d3ac560f9ba025a48 [0,2,0,0,0,0|2,0,0]=4 5066 B12R0.283 CCC[C@H](C)NC(=O)NC[C@H](C)O b86f49152bb026ba6877f4d0ca3a3c92 [0,2,0,0,0,0|2,0,0]=4 5067 B12R0.283 CCSC(C)CC(=O)NCC(C)C a6355283873a25243bdb7b637161183e [0,2,0,0,0,0|2,0,0]=4 5068 B12R0.283 CCSC(C)CC(=O)NCC(C)O c2fe116601abbdd3d02d3fe2b319e2cc [0,2,0,0,0,0|2,0,0]=4 5069 B12R0.283 CCSC(C)CC(=O)NC[C@@H](C)O 9c0377e6888a09724dc7a443f9ab4d05 [0,2,0,0,0,0|2,0,0]=4 5070 B12R0.283 CCSC(C)CC(=O)NC[C@H](C)O 7af3c5e5e86abe8f7b4a9039108415b9 [0,2,0,0,0,0|2,0,0]=4 5071 B12R0.283 COCC(C)CC(=O)NCC(C)C b80dc8bf314a6abd67ea47abe2e18285 [0,2,0,0,0,0|2,0,0]=4 5072 B12R0.283 COCC(C)CC(=O)NCC(C)O 6b16bd8a595039650ea36e04ee6c5f31 [0,2,0,0,0,0|2,0,0]=4 5073 B12R0.283 COCC(C)CC(=O)NC[C@@H](C)O a8fc93102ef18cd0e4a37188bafc1f3d [0,2,0,0,0,0|2,0,0]=4 5074 B12R0.283 COCC(C)CC(=O)NC[C@H](C)O 77ba66bcd8067971f5aa40999ec7012c [0,2,0,0,0,0|2,0,0]=4 5075 B12R0.353 C=C(CCC)C(=O)N(C)CCCC eedf8f13970006a0ce2589ea2dce6fc8 [0,2,0,0,0,0|2,0,0]=4 5076 B12R0.353 CCCCC(=O)C(=O)N(C)CCC 7a0589ccf0a654bb7854b1d2d6867779 [0,2,0,0,0,0|1,0,1]=4 5077 B12R0.353 CCCCC(O)C(=O)N(C)CCC 0d4f8d47351c8d99d14ab2857088bc2e [0,2,0,0,0,0|1,0,0]=3 5078 B12R0.353 CCCCC(O)C(=O)N(C)CCF d6b0685af07cd762e5d1dbce5d4d043b [0,2,0,0,0,0|2,0,0]=4 5079 B12R0.353 CCCCC(O)C(=O)N(C)CCO 95835d8a309981b8c38c438ddc2bafb3 [0,2,0,0,0,0|2,0,0]=4 5080 B12R0.353 CCCCN(C)C(=O)C(=O)CCC 4eb55af941005f7290202cb77b157d94 [0,2,0,0,0,0|2,0,0]=4 5081 B12R0.353 CCCCN(C)C(=O)C(O)CCC a26d456c4c216b7b7747f2952fb76fdd [0,2,0,0,0,0|2,0,0]=4 5082 B12R0.353 CCCCN(C)C(=O)[C@@H](O)CCC cd70f0f7c0646d549b3cfa4fc44849f2 [0,2,0,0,0,0|2,0,0]=4 5083 B12R0.353 CCCCN(C)C(=O)[C@H](O)CCC 625611c55a0d5522433521f2a04ed25b [0,2,0,0,0,0|2,0,0]=4 5084 B12R0.353 CCCC[C@@H](O)C(=O)N(C)CCC 15e1399a2cb836a2ece7575ef5a51f6d [0,2,0,0,0,0|1,0,0]=3 5085 B12R0.353 CCCC[C@@H](O)C(=O)N(C)CCF 561c1c59fa1a250df52ab376b52cf709 [0,2,0,0,0,0|2,0,0]=4 5086 B12R0.353 CCCC[C@@H](O)C(=O)N(C)CCO 3d67347159c6d82d0f32709e1ddf8d00 [0,2,0,0,0,0|2,0,0]=4 5087 B12R0.353 CCCC[C@H](O)C(=O)N(C)CCC 09cd89d84602beaf2dcd3e27b5588410 [0,2,0,0,0,0|1,0,0]=3 5088 B12R0.353 CCCC[C@H](O)C(=O)N(C)CCF 7465cdb3580a5b050a67e7c434b44fb3 [0,2,0,0,0,0|2,0,0]=4 5089 B12R0.353 CCCC[C@H](O)C(=O)N(C)CCO 200fc02f6e1ab75fa188ece46f1a123f [0,2,0,0,0,0|2,0,0]=4 5090 B12R0.353 CCCN(C)C(=O)C(O)CCSC 95ded1efd2149cb25dcbf15f543ad346 [0,2,0,0,0,0|2,0,0]=4 5091 B12R0.353 CCCNC(=O)C(C)N(C)CCC a08068f7ab2e196134dc39f0c8ccf97b [0,2,0,0,0,0|2,0,0]=4 5092 B12R0.353 CCCOC(=O)C(C)N(C)CCC 8589cc29eb921d80153c4d01afa37b29 [0,2,0,0,0,0|1,0,0]=3 5093 B12R0.353 CCCOC(=O)C(C)N(C)CCF a547c56756a738b28b4490577e35c98e [0,2,0,0,0,0|2,0,0]=4 5094 B12R0.353 CCCOC(=O)C(C)N(C)CCO df277f8c811dd17891f73b7791043da6 [0,2,0,0,0,0|2,0,0]=4 5095 B12R0.353 CCCOC(C)C(=O)N(C)CCC 85ed23fa13d9a5aade7678321b4746fd [0,2,0,0,0,0|2,0,0]=4 5096 B12R0.453 CCCC(C)(O)CC(=O)NCCBr 38d9d54151d210e9a0f4e419a3a9ffb6 [0,2,0,0,0,0|2,0,0]=4 5097 B12R0.453 CCCC(C)(O)CC(=O)NCCF 07ef2e98b7fb948af75c54dcb01ef227 [0,2,0,0,0,0|2,0,0]=4 5098 B12R0.453 CCCC(C)(O)CC(=O)NCCI 5692db4ed253bdd68c81c580b97153d0 [0,2,0,0,0,0|2,0,0]=4 5099 B12R0.453 CCCC(C)(O)CC(=O)NCCO fd3a6d04aca87c2a51d21233ad14dd30 [0,2,0,0,0,0|2,0,0]=4 5100 B12R0.453 CCCC(C)(O)CC(=O)NCCS 5ef44c982014221cb0ba650beb010d96 [0,2,0,0,0,0|2,0,0]=4 5101 B12R0.453 CCCNC(=O)CC(C)(C)COC 3aa9475b98929ba2e96a56c0efaf9064 [0,2,0,0,0,0|2,0,0]=4 5102 B12R0.453 CCCNC(=O)CC(C)(O)CCC 5eb7d8a649a48b3f27620bfc03658dda [0,2,0,0,0,0|1,0,0]=3 5103 B12R0.98 C=C(C)CNC(=O)C(O)CCCC b72e9d21f8d59e6bd7f6afc53c6aa9cf [0,2,0,0,0,0|1,0,1]=4 5104 B12R0.98 C=C(C)CNC(=O)[C@@H](O)CCCC 1bdd69007f2d771420f6585baaf12732 [0,2,0,0,0,0|1,0,1]=4 5105 B12R0.98 C=C(C)CNC(=O)[C@H](O)CCCC bf65712c3259e4752d889a36a47a7d9a [0,2,0,0,0,0|1,0,1]=4 5106 B12R0.98 C=C(C)CNC(C)C(=O)OCCC 8b68c975a746b93f40709788bfc1a0e4 [0,2,0,0,0,0|1,0,1]=4 5107 B12R0.98 C=C(C)CN[C@@H](C)C(=O)OCCC 80ade55c6d3b75edb16470c561c026fa [0,2,0,0,0,0|1,0,1]=4 5108 B12R0.98 C=C(C)COC(C)C(=O)OCCC c3e657d01075861825cdf0a1857df495 [0,2,0,0,0,0|1,0,1]=4 5109 B12R0.98 C=C(C)CO[C@@H](C)C(=O)OCCC 2dddde0d9e028e2f36b901a7262061f7 [0,2,0,0,0,0|1,0,1]=4 5110 B12R0.98 CC(C)CC[C@@H](O)C(=O)NCCF e0edf9635af6a4c6c1c565eb341e10ec [0,2,0,0,0,0|2,0,0]=4 5111 B12R0.98 CC(C)CC[C@@H](O)C(=O)NCCI cc261a48876bdb358bd8581ee31e38d3 [0,2,0,0,0,0|2,0,0]=4 5112 B12R0.98 CC(C)CC[C@@H](O)C(=O)NCCO db0e7ae3cacf995c160b040d23a86ea2 [0,2,0,0,0,0|2,0,0]=4 5113 B12R0.98 CC(C)CC[C@@H](O)C(=O)NCCS 120b7a8687c39925f7f142506a585d1f [0,2,0,0,0,0|2,0,0]=4 5114 B12R0.98 CC(C)CC[C@H](O)C(=O)NCCF 5a580afed59cf777899662bfbd8ecc0b [0,2,0,0,0,0|2,0,0]=4 5115 B12R0.98 CC(C)CC[C@H](O)C(=O)NCCI 270ac26166203e0e0afe03e8e6adcfb4 [0,2,0,0,0,0|2,0,0]=4 5116 B12R0.98 CC(C)CC[C@H](O)C(=O)NCCO 3a9f68196f6bd92e1fa3229fdf6818a4 [0,2,0,0,0,0|2,0,0]=4 5117 B12R0.98 CC(C)CC[C@H](O)C(=O)NCCS 7cf0482af969daded274875cdce7cda4 [0,2,0,0,0,0|2,0,0]=4 5118 B12R0.98 CC(C)COC(=O)[C@@H](C)OCCF 97a7f2905fd7d404e25e4c81b7ab09d6 [0,2,0,0,0,0|2,0,0]=4 5119 B12R0.98 CC(C)COC(=O)[C@@H](C)OCCS 843a43c73ce17b94bf74d85b4d155459 [0,2,0,0,0,0|2,0,0]=4 5120 B12R0.98 CCCCC(=O)C(=O)NCC(C)C 9b92011d0f63e2cf98d23e61ab539843 [0,2,0,0,0,0|1,0,1]=4 5121 B12R0.98 CCCCC(=O)C(=O)NCC(C)O 0c94dc007a915201704d5aa7854c703a [0,2,0,0,0,0|1,0,1]=4 5122 B12R0.98 CCCCC(=O)C(=O)NC[C@@H](C)O bca0a71355165c773310561a28dd0ac5 [0,2,0,0,0,0|1,0,1]=4 5123 B12R0.98 CCCCC(=O)C(=O)NC[C@H](C)O 17c078ef72e20e338b546d12bb70f430 [0,2,0,0,0,0|1,0,1]=4 5124 B12R0.98 CCCCC(=O)N(C)CCC(C)C 0c41c9af9610c8133a3e2807de8cdeed [0,2,0,0,0,0|2,0,0]=4 5125 B12R0.98 CCCCC(=O)N(C)CCC(C)O 77e20a9209fad03cf8b5c7240ba7961d [0,2,0,0,0,0|2,0,0]=4 5126 B12R0.98 CCCCC(O)C(=O)NCC(=O)C 0f49ce6ae4324c5542069f21970486fd [0,2,0,0,0,0|1,0,1]=4 5127 B12R0.98 CCCCC(O)C(=O)NCC(C)C ad166aefe9a02233a4629ad875de6074 [0,2,0,0,0,0|1,0,0]=3 5128 B12R0.98 CCCCC(O)C(=O)NCC(C)O fbbf8e9d231e813057c707c1e2ceec1a [0,2,0,0,0,0|1,0,0]=3 5129 B12R0.98 CCCCC(O)C(=O)NCC(F)F 2b5fa3deb0723d86c892b9412b11686a [0,2,0,0,0,0|2,0,0]=4 5130 B12R0.98 CCCCC(O)C(=O)NC[C@@H](C)O fcf10fed850495c8e6e2494fba1076de [0,2,0,0,0,0|1,0,0]=3 5131 B12R0.98 CCCCC(O)C(=O)NC[C@H](C)O 87b3269a1f38130d9edb441cb536b44a [0,2,0,0,0,0|1,0,0]=3 5132 B12R0.98 CCCCN(C)C(=O)CCC(C)C 0f4be99766cd991205e36e7d2f15d651 [0,2,0,0,0,0|2,0,0]=4 5133 B12R0.98 CCCCN(C)C(=O)CCC(C)O dab237253581b8be4e4ab1719768603a [0,2,0,0,0,0|2,0,0]=4 5134 B12R0.98 CCCCN(C)C(=O)CCC(C)S abb87511cbcb58cbb20630faa381403f [0,2,0,0,0,0|2,0,0]=4 5135 B12R0.98 CCCCN(C)C(=O)CC[C@H](C)S 13e95669426918944eb8f2f340c4a6f0 [0,2,0,0,0,0|2,0,0]=4 5136 B12R0.98 CCCCN(C)C(=O)NCC(C)C 58ff9c212e39f808fe27c09048fac584 [0,2,0,0,0,0|2,0,0]=4 5137 B12R0.98 CCCCN(C)C(=O)NCC(C)O c4d4de783918f723f72ac95308222f4b [0,2,0,0,0,0|2,0,0]=4 5138 B12R0.98 CCCCN(C)C(=O)NC[C@@H](C)O 3f4633f594678489654996a2de160b74 [0,2,0,0,0,0|2,0,0]=4 5139 B12R0.98 CCCCN(C)C(=O)NC[C@H](C)O d38f8a8bb6d04cc3de2056ca2d4f22dd [0,2,0,0,0,0|2,0,0]=4 5140 B12R0.98 CCCC[C@@H](O)C(=O)NCC(=O)C edea3bf78800ed89af3c3fb6ab813910 [0,2,0,0,0,0|1,0,1]=4 5141 B12R0.98 CCCC[C@@H](O)C(=O)NCC(C)C 93722412aa35a07837a8d48f5afad129 [0,2,0,0,0,0|1,0,0]=3 5142 B12R0.98 CCCC[C@@H](O)C(=O)NCC(C)O adbbf8d325b7b858597d071ba98a6c3b [0,2,0,0,0,0|1,0,0]=3 5143 B12R0.98 CCCC[C@@H](O)C(=O)NCC(F)F 7dcb80c6180be7385c501f0bb0c01f94 [0,2,0,0,0,0|2,0,0]=4 5144 B12R0.98 CCCC[C@@H](O)C(=O)NC[C@@H](C)O 65b4d096e69596778a8d10795fb19f69 [0,2,0,0,0,0|1,0,0]=3 5145 B12R0.98 CCCC[C@@H](O)C(=O)NC[C@H](C)O 62993e021ee7dd71fa47990cd4a6d6ea [0,2,0,0,0,0|1,0,0]=3 5146 B12R0.98 CCCC[C@H](O)C(=O)NCC(=O)C 44605b5554f091c17e7e42fcdb3cc86e [0,2,0,0,0,0|1,0,1]=4 5147 B12R0.98 CCCC[C@H](O)C(=O)NCC(C)C 765a3f63eb19e506f3fab129dd3c8af4 [0,2,0,0,0,0|1,0,0]=3 5148 B12R0.98 CCCC[C@H](O)C(=O)NCC(C)O 26f32777197a5f892dcfeb220c87c0b3 [0,2,0,0,0,0|1,0,0]=3 5149 B12R0.98 CCCC[C@H](O)C(=O)NCC(F)F 4caf969e87ca54664276acf7ef48580e [0,2,0,0,0,0|2,0,0]=4 5150 B12R0.98 CCCC[C@H](O)C(=O)NC[C@@H](C)O 0072c0988aff1136a25faac150a353e8 [0,2,0,0,0,0|1,0,0]=3 5151 B12R0.98 CCCC[C@H](O)C(=O)NC[C@H](C)O 83dbf8b7a6751c9b5c945340b77afc22 [0,2,0,0,0,0|1,0,0]=3 5152 B12R0.98 CCCNC(=O)C(C)NCC(C)C ca21f8bd7cf3c315c9782aa21fb73e99 [0,2,0,0,0,0|2,0,0]=4 5153 B12R0.98 CCCNC(=O)C(C)NCC(C)O 2bc5ac21edc81e55a0419a1cec8df20d [0,2,0,0,0,0|2,0,0]=4 5154 B12R0.98 CCCNC(=O)C(C)NC[C@@H](C)O 839a619e8ae2b05b1727ed6e1e36116d [0,2,0,0,0,0|2,0,0]=4 5155 B12R0.98 CCCNC(=O)C(C)NC[C@H](C)O 00d8878b517fdd18b5594592bc83f39b [0,2,0,0,0,0|2,0,0]=4 5156 B12R0.98 CCCNC(=O)C(C)OCC(C)C 6b2110492ee9af31debd1e121ecadab9 [0,2,0,0,0,0|2,0,0]=4 5157 B12R0.98 CCCNC(=O)C(C)OCC(C)F 7cac28ad331493af2154a1dd8b9b3424 [0,2,0,0,0,0|2,0,0]=4 5158 B12R0.98 CCCNC(=O)C(C)OCC(C)S 70ab13d5d2bf4f6757304f771241c609 [0,2,0,0,0,0|2,0,0]=4 5159 B12R0.98 CCCNC(=O)C(C)OC[C@@H](C)F ba5a943fb22a90315f49ba66856e3db1 [0,2,0,0,0,0|2,0,0]=4 5160 B12R0.98 CCCNC(=O)C(C)OC[C@H](C)F f4f0fe1b1c321742ab8929dbe37b2c9d [0,2,0,0,0,0|2,0,0]=4 5161 B12R0.98 CCCNC(=O)C(O)CCN(C)C 012ff4a2a69449d4fe5765282ad6df23 [0,2,0,0,0,0|2,0,0]=4 5162 B12R0.98 CCCNC(=O)N(C)CCC(C)C 98b683e9735986cd54c4327520b64232 [0,2,0,0,0,0|2,0,0]=4 5163 B12R0.98 CCCNC(=O)N(C)CCC(C)O e7bcf3d04b2f6d8b126e60daae882e9e [0,2,0,0,0,0|2,0,0]=4 5164 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[0,2,0,0,0,0|1,0,1]=4 5175 B12R0.98 CCCOC(=O)C(C)OCC(C)C 2899b96ae869304be694cabde411874f [0,2,0,0,0,0|1,0,0]=3 5176 B12R0.98 CCCOC(=O)C(C)OCC(C)F 4bed34c840a09c981610c26b0457913b [0,2,0,0,0,0|1,0,0]=3 5177 B12R0.98 CCCOC(=O)C(C)OCC(C)S fc397b44224c6be4b7dfdb953e04eeab [0,2,0,0,0,0|1,0,0]=3 5178 B12R0.98 CCCOC(=O)C(C)OCC(F)F 14b1a5b2d4f25af2ab05c65a640f0127 [0,2,0,0,0,0|2,0,0]=4 5179 B12R0.98 CCCOC(=O)C(C)OCN(C)C ef31452bb3866dd94ea0a3d8bb14803d [0,2,0,0,0,0|2,0,0]=4 5180 B12R0.98 CCCOC(=O)C(C)OC[C@@H](C)F 1bfaa6bfa134484bf8ef84ddf6a6e35b [0,2,0,0,0,0|1,0,0]=3 5181 B12R0.98 CCCOC(=O)C(C)OC[C@H](C)F a24178a273abd1f838ecdf7503dbed77 [0,2,0,0,0,0|1,0,0]=3 5182 B12R0.98 CCCOC(=O)[C@H](C)NCC(C)C f63814775dace86fd52deae78e442dd6 [0,2,0,0,0,0|1,0,0]=3 5183 B12R0.98 CCCOC(=O)[C@H](C)NCC(C)O fa52f5c2b3cc4af93210976c9ad9f9da [0,2,0,0,0,0|1,0,0]=3 5184 B12R0.98 CCCOC(=O)[C@H](C)NCC(F)F 2356b8b276ed304232395f4f6a112e7d [0,2,0,0,0,0|2,0,0]=4 5185 B12R0.98 CCCOC(=O)[C@H](C)NCN(C)C 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f29cd5189c6f3037239a07ce82b8425d [0,2,0,0,0,0|2,0,0]=4 5207 B12R0.252 CCCCC(O)C(=O)NC(C)CC a059989845900847fb11a3aad8890f9e [0,2,0,0,0,0|1,0,0]=3 5208 B12R0.252 CCCCC(O)C(=O)NC(C)CO bdf720e8c53043c2a857d28aa3ce0ea4 [0,2,0,0,0,0|2,0,0]=4 5209 B12R0.252 CCCCC(O)C(=O)N[C@@H](C)CC b64527a43adc4d1f9e74af51f7b3ef00 [0,2,0,0,0,0|1,0,0]=3 5210 B12R0.252 CCCCC(O)C(=O)N[C@@H](C)CO 12d367bfc8cf4befdcd7dfe16b8cd01c [0,2,0,0,0,0|2,0,0]=4 5211 B12R0.252 CCCCC(O)C(=O)N[C@H](C)CC 5bc86d1fd9f76f470e6d4241c78503f6 [0,2,0,0,0,0|1,0,0]=3 5212 B12R0.252 CCCCC(O)C(=O)N[C@H](C)CO 821f6cd4382ae968cbeeff89eaa3558e [0,2,0,0,0,0|2,0,0]=4 5213 B12R0.252 CCCCN(C)C(=O)CC(C)CC 144aa88b6eb2203f8d94e4e3684f6738 [0,2,0,0,0,0|2,0,0]=4 5214 B12R0.252 CCCCN(C)C(=O)CC(O)CC 05e8a3450c403379ccbc3852d043bfd5 [0,2,0,0,0,0|2,0,0]=4 5215 B12R0.252 CCCCN(C)C(=O)C[C@@H](C)CC 483936ad2117a2c5e1276dd280e1e198 [0,2,0,0,0,0|2,0,0]=4 5216 B12R0.252 CCCCN(C)C(=O)C[C@@H](O)CC beaadfee7742b975795ba304293851cf [0,2,0,0,0,0|2,0,0]=4 5217 B12R0.252 CCCCN(C)C(=O)C[C@H](C)CC c03f75ab52a336baf217ec162fb4c92d [0,2,0,0,0,0|2,0,0]=4 5218 B12R0.252 CCCCN(C)C(=O)C[C@H](O)CC 55a9f185b0b56e6b51921817985cf7dc [0,2,0,0,0,0|2,0,0]=4 5219 B12R0.252 CCCCN(C)C(=O)NC(C)CC 9153f9a6df81799af3bc198c4af97854 [0,2,0,0,0,0|2,0,0]=4 5220 B12R0.252 CCCCN(C)C(=O)N[C@@H](C)CC 76ee6b214895f50ae082069b44809bbf [0,2,0,0,0,0|2,0,0]=4 5221 B12R0.252 CCCCN(C)C(=O)N[C@H](C)CC 35cb826f4ad1c0761a5ab0574819b12b [0,2,0,0,0,0|2,0,0]=4 5222 B12R0.252 CCCC[C@@H](O)C(=O)NC(C)CC ad78396575c5ad622f00843c0b203dc7 [0,2,0,0,0,0|1,0,0]=3 5223 B12R0.252 CCCC[C@@H](O)C(=O)NC(C)CO b0cc3c75f140b7d4f4310acdc9448cd4 [0,2,0,0,0,0|2,0,0]=4 5224 B12R0.252 CCCC[C@@H](O)C(=O)N[C@@H](C)CC 36f72503922d5822e5f3df6e6f7d992e [0,2,0,0,0,0|1,0,0]=3 5225 B12R0.252 CCCC[C@@H](O)C(=O)N[C@@H](C)CO c1288ac8804a433230d77b3c6143efb9 [0,2,0,0,0,0|2,0,0]=4 5226 B12R0.252 CCCC[C@@H](O)C(=O)N[C@H](C)CC f76a4b9927c0bf6b793e9f7b5feffe59 [0,2,0,0,0,0|1,0,0]=3 5227 B12R0.252 CCCC[C@@H](O)C(=O)N[C@H](C)CO fac840ffad47b478eb64a75410896de5 [0,2,0,0,0,0|2,0,0]=4 5228 B12R0.252 CCCC[C@H](O)C(=O)NC(C)CC 85a1246c49fabafcba1302ff05417e98 [0,2,0,0,0,0|1,0,0]=3 5229 B12R0.252 CCCC[C@H](O)C(=O)NC(C)CO 3ac45bd226ceac792cfc8f86658c16aa [0,2,0,0,0,0|2,0,0]=4 5230 B12R0.252 CCCC[C@H](O)C(=O)N[C@@H](C)CC 0092cf67d5b14f57e4b8d190fba3ae52 [0,2,0,0,0,0|1,0,0]=3 5231 B12R0.252 CCCC[C@H](O)C(=O)N[C@@H](C)CO b64c162d87bb498bea3a6663b9debe0d [0,2,0,0,0,0|2,0,0]=4 5232 B12R0.252 CCCC[C@H](O)C(=O)N[C@H](C)CC e363c585418042baf2e654ef6de6475b [0,2,0,0,0,0|1,0,0]=3 5233 B12R0.252 CCCC[C@H](O)C(=O)N[C@H](C)CO 87ea0c94eda8c203727e00612f35a542 [0,2,0,0,0,0|2,0,0]=4 5234 B12R0.252 CCCNC(=O)C(C)NC(C)CC 8f8ca534e6418cb58c145f3ae537461d [0,2,0,0,0,0|2,0,0]=4 5235 B12R0.252 CCCNC(=O)C(C)N[C@@H](C)CC b0be5449d5d0e0044d154271517f9fc4 [0,2,0,0,0,0|2,0,0]=4 5236 B12R0.252 CCCNC(=O)C(C)N[C@H](C)CC 269b9017551fefbf5c79707f8be9de29 [0,2,0,0,0,0|2,0,0]=4 5237 B12R0.252 CCCNC(=O)C(C)OC(C)CC 6b64d16760bf3aac47aef86052bbb403 [0,2,0,0,0,0|2,0,0]=4 5238 B12R0.252 CCCNC(=O)C(C)O[C@@H](C)CC 69eb7ca259df560a4a1959f57f7867ea [0,2,0,0,0,0|2,0,0]=4 5239 B12R0.252 CCCNC(=O)C(C)O[C@H](C)CC 4402af442f87c6b3ff5be7dd9a08222d [0,2,0,0,0,0|2,0,0]=4 5240 B12R0.252 CCCNC(=O)N(C)CC(O)CC afd5d90be6b130ecb983465ea78ff835 [0,2,0,0,0,0|2,0,0]=4 5241 B12R0.252 CCCNC(C)C(=O)NC(C)CC 1b4fcab1f5122a073b4c2f3fe32d96e6 [0,2,0,0,0,0|2,0,0]=4 5242 B12R0.252 CCCOC(=O)C(C)NC(=O)CC 08c1f0b18f978f93de0d4c3244a2b776 [0,2,0,0,0,0|1,0,1]=4 5243 B12R0.252 CCCOC(=O)C(C)NC(C)CC 49f5ad9b140614bcd0f67dd2d7bb9730 [0,2,0,0,0,0|1,0,0]=3 5244 B12R0.252 CCCOC(=O)C(C)NC(C)CO 05b3be13f37174bbe27e7f7c07896507 [0,2,0,0,0,0|2,0,0]=4 5245 B12R0.252 CCCOC(=O)C(C)N[C@@H](C)CC 1154ab01b548262614fd50aa4527f7f3 [0,2,0,0,0,0|1,0,0]=3 5246 B12R0.252 CCCOC(=O)C(C)N[C@@H](C)CO 28a28eb883e865b0debf5cf636426a80 [0,2,0,0,0,0|2,0,0]=4 5247 B12R0.252 CCCOC(=O)C(C)N[C@H](C)CC efdd3f8f85a60fbf6c93bd95934e4103 [0,2,0,0,0,0|1,0,0]=3 5248 B12R0.252 CCCOC(=O)C(C)N[C@H](C)CO 28e414a17d2fde1dc00b815231419e7b [0,2,0,0,0,0|2,0,0]=4 5249 B12R0.252 CCCOC(=O)C(C)OC(C)CC 88e8e3f07279dc1f698b547596b14a67 [0,2,0,0,0,0|1,0,0]=3 5250 B12R0.252 CCCOC(=O)C(C)OC(C)CF 15be3451e81f12e7a62bae854b17e026 [0,2,0,0,0,0|2,0,0]=4 5251 B12R0.252 CCCOC(=O)C(C)OC(C)CS f53701ed400af920c22c47ac0d8498a7 [0,2,0,0,0,0|2,0,0]=4 5252 B12R0.252 CCCOC(=O)C(C)O[C@@H](C)CC 9da0be5a6337112b44411fae51dba899 [0,2,0,0,0,0|1,0,0]=3 5253 B12R0.252 CCCOC(=O)C(C)O[C@H](C)CC 830176f3d3b417a37c774bb76ee68b91 [0,2,0,0,0,0|1,0,0]=3 5254 B12R0.252 CCCOC(=O)C(C)O[C@H](C)CS 30fc13d56ceb1f0de116e4943c02460a [0,2,0,0,0,0|2,0,0]=4 5255 B12R0.252 CCCOC(=O)[C@H](C)NC(=O)CC a88ef1340a90392e53d6fc9a4eb4b470 [0,2,0,0,0,0|1,0,1]=4 5256 B12R0.252 CCCOC(=O)[C@H](C)NC(C)CC e7fdcbdd1e3408d8181d431d4ca3ebf2 [0,2,0,0,0,0|1,0,0]=3 5257 B12R0.252 CCCOC(=O)[C@H](C)NC(C)CO 5a088349eea8f4d51547e700002a52e2 [0,2,0,0,0,0|2,0,0]=4 5258 B12R0.252 CCCOC(=O)[C@H](C)N[C@@H](C)CO 74b01bc53a6e0f9f3b006e5cf31f2f72 [0,2,0,0,0,0|2,0,0]=4 5259 B12R0.252 CCCOC(=O)[C@H](C)N[C@H](C)CO 7186d758f7e3e2835b38e8388aec62ce [0,2,0,0,0,0|2,0,0]=4 5260 B12R0.252 CCCOC(=O)[C@H](C)OC(C)CC 88a05d09fbf2779e860f6de41015cb6d [0,2,0,0,0,0|1,0,0]=3 5261 B12R0.252 CCCOC(C)C(=O)NC(C)CC 5e7012159d7664f6ea930b51a55e5733 [0,2,0,0,0,0|2,0,0]=4 5262 B12R0.252 CCCOC(C)C(=O)N[C@@H](C)CC 9b917db1d7c89b908c14e547e1c1f0af [0,2,0,0,0,0|2,0,0]=4 5263 B12R0.252 CCCOC(C)C(=O)N[C@H](C)CC 0c911d049f0ee5baf70210709a848a70 [0,2,0,0,0,0|2,0,0]=4 5264 B12R0.252 CC[C@@H](C)NC(=O)C(O)CCSC 6d8565768bfc0d64a341ce98151de1b7 [0,2,0,0,0,0|2,0,0]=4 5265 B12R0.252 CC[C@H](C)NC(=O)C(O)CCSC 83e3c1be1a81d75d477b7e432eff9fa4 [0,2,0,0,0,0|2,0,0]=4 5266 B12R0.291 CCCCC(F)(F)C(=O)NCCBr 019a537c59d4d9d8857719a1be483382 [0,2,0,0,0,0|2,0,0]=4 5267 B12R0.291 CCCCC(F)(F)C(=O)NCCC cb3e52a7532c704da6e383d3f7de6992 [0,2,0,0,0,0|1,0,0]=3 5268 B12R0.291 CCCCC(F)(F)C(=O)NCCF 1a6d1098a25901c1be4d043cb777263b [0,2,0,0,0,0|2,0,0]=4 5269 B12R0.291 CCCCC(F)(F)C(=O)NCCI 43413271723da58527250dc7f40a6d08 [0,2,0,0,0,0|2,0,0]=4 5270 B12R0.291 CCCCC(F)(F)C(=O)NCCO b60e45fab2d45e4ff753328c8a6eaab9 [0,2,0,0,0,0|2,0,0]=4 5271 B12R0.291 CCCCC(F)(F)C(=O)NCCS 689b4c99a954bf8fbe47fec474df4a62 [0,2,0,0,0,0|2,0,0]=4 5272 B12R0.351 CCCCC(=O)N(CC)CCCC e3e1de3ae2fd1c12da21b0b03c020cf0 [0,2,0,0,0,0|2,0,0]=4 5273 B12R0.351 CCCCN(CC)C(=O)NCCC 987861560cd79d940d31d6bc77b1a882 [0,2,0,0,0,0|2,0,0]=4 5274 B12R0.351 CCCNC(=O)C(CC)NCCC 55c3a452092de86bdfbe94c516e060a1 [0,2,0,0,0,0|2,0,0]=4 5275 B12R0.351 CCCNC(=O)C(CC)OCCC c736ec5c1e9669fc628e9444f12d7072 [0,2,0,0,0,0|2,0,0]=4 5276 B12R0.351 CCCNC(=O)C(CCSC)OC bbbbb741dec0bad3a0d6b8a3d35aa436 [0,2,0,0,0,0|2,0,0]=4 5277 B12R0.351 CCCNC(=O)[C@H](CC)NCCC fa1cee9d596a93329159b880b3f1fa2e [0,2,0,0,0,0|2,0,0]=4 5278 B12R0.648 C#CCCN(C)C(=O)CCCCC 6ec142cc6af69f9b910d715e49884d10 [0,2,0,0,0,0|1,0,1]=4 5279 B12R0.648 C#CCCNC(=O)C(O)CCCC 5e1187d3904a6997bb41eb837f7b13e5 [0,2,0,0,0,0|1,0,1]=4 5280 B12R0.648 C#CCCNC(=O)[C@@H](O)CCCC 6f305511c6062e51b80c7b0a5dd6654a [0,2,0,0,0,0|1,0,1]=4 5281 B12R0.648 C#CCCNC(=O)[C@H](O)CCCC b0d73a0345b37cccaf7abefa307794d3 [0,2,0,0,0,0|1,0,1]=4 5282 B12R0.648 C#CCCNC(C)C(=O)OCCC ab2751b8ed019bdfa599885e27aeef8e [0,2,0,0,0,0|0,0,2]=4 5283 B12R0.648 C#CCCN[C@@H](C)C(=O)OCCC f2b5076b26e86a31fccf5e97dc3fb0cf [0,2,0,0,0,0|0,0,2]=4 5284 B12R0.648 C#CCCOC(C)C(=O)OCCC 12d5b15b3e039f78f837a3c5e9228f2c [0,2,0,0,0,0|0,0,2]=4 5285 B12R0.648 C#CCCO[C@@H](C)C(=O)OCCC d231fdb04a32ba660009bc05c727e869 [0,2,0,0,0,0|0,0,2]=4 5286 B12R0.648 C/C=C/CNC(C)C(=O)OCCC c2e9bd9288d7c3f6f126aaa7ad939662 [0,2,0,0,0,0|0,0,2]=4 5287 B12R0.648 C/C=C/CN[C@@H](C)C(=O)OCCC c3e4d073308dd42d10e66945c5aab51c [0,2,0,0,0,0|0,0,2]=4 5288 B12R0.648 C/C=C/COC(C)C(=O)OCCC 16277709e49bf1fc853f03826711af19 [0,2,0,0,0,0|0,0,2]=4 5289 B12R0.648 C/C=C/CO[C@@H](C)C(=O)OCCC ed14d8d74b212d0be7575753bdb52bdc [0,2,0,0,0,0|0,0,2]=4 5290 B12R0.648 C/C=C\CNC(C)C(=O)OCCC 02e9bc34cb7b0991653d0d716e57d5ea [0,2,0,0,0,0|0,0,2]=4 5291 B12R0.648 C/C=C\CN[C@@H](C)C(=O)OCCC e5914e87527a304d677cc7aece034346 [0,2,0,0,0,0|0,0,2]=4 5292 B12R0.648 C/C=C\COC(C)C(=O)OCCC 83a73fbd9085f8cf26262da084ef29d9 [0,2,0,0,0,0|0,0,2]=4 5293 B12R0.648 C/C=C\CO[C@@H](C)C(=O)OCCC d6ba76ec8b2c86943ce28ae73c6df3f1 [0,2,0,0,0,0|0,0,2]=4 5294 B12R0.648 C=CCCN(C)C(=O)CCCCC 65c2b4c4d8c4c80cedb97fbb6c6f0b8b [0,2,0,0,0,0|1,0,1]=4 5295 B12R0.648 C=CCCNC(=O)C(O)CCCC e6da98fa88d2b0bae1f2822761a5a2dc [0,2,0,0,0,0|1,0,1]=4 5296 B12R0.648 C=CCCNC(=O)[C@@H](O)CCCC 2608752cfda71f9a7b1ebf2fcaba6763 [0,2,0,0,0,0|1,0,1]=4 5297 B12R0.648 C=CCCNC(=O)[C@H](O)CCCC 8ed672830abc0e2eacdef1e278b563cd [0,2,0,0,0,0|1,0,1]=4 5298 B12R0.648 C=CCCNC(C)C(=O)OCCC 54fcc33fa2249de7dbe0ab1bfc18846e [0,2,0,0,0,0|0,0,2]=4 5299 B12R0.648 C=CCCN[C@@H](C)C(=O)OCCC f4ec0565862fa4104398095a56d83252 [0,2,0,0,0,0|0,0,2]=4 5300 B12R0.648 C=CCCOC(C)C(=O)OCCC dc12efd2c2e316ec7329864ffa0f4c99 [0,2,0,0,0,0|0,0,2]=4 5301 B12R0.648 C=CCCO[C@@H](C)C(=O)OCCC 0cf6a6164b36e16621d8afeea0018884 [0,2,0,0,0,0|0,0,2]=4 5302 B12R0.648 C=CCOC(=O)[C@H](C)NCCCC 6b7b14c58984ba2a7c5646a62190b03d [0,2,0,0,0,0|0,0,2]=4 5303 B12R0.648 CC#CCNC(=O)C(O)CCCC 104940f406509bb9a2b28cd6350147bf [0,2,0,0,0,0|1,0,1]=4 5304 B12R0.648 CC#CCNC(=O)[C@@H](O)CCCC c4269f30a1430e1de271c332081d8288 [0,2,0,0,0,0|1,0,1]=4 5305 B12R0.648 CC#CCNC(=O)[C@H](O)CCCC 4d595f7b83fe8712993b1be039ab49fd [0,2,0,0,0,0|1,0,1]=4 5306 B12R0.648 CC#CCNC(C)C(=O)OCCC 3cba166316abccc63b0e739efa213359 [0,2,0,0,0,0|0,0,2]=4 5307 B12R0.648 CC#CCOC(C)C(=O)OCCC 51484e755bc3dc6fe6b3982de5aef65e [0,2,0,0,0,0|0,0,2]=4 5308 B12R0.648 CC/C=C/C(=O)N(C)CCCCC 7ea4363cb6f7cad5869e914f0db932e7 [0,2,0,0,0,0|1,0,1]=4 5309 B12R0.648 CC/C=C\C(=O)N(C)CCCCC 10b001fe1bca2eff556760a4acb1a931 [0,2,0,0,0,0|1,0,1]=4 5310 B12R0.648 CC=CCNC(=O)C(O)CCCC dad6da9d3f1b76f81b4dc280d4b42d1f [0,2,0,0,0,0|1,0,1]=4 5311 B12R0.648 CC=CCNC(=O)[C@@H](O)CCCC 1b012e9e0d1491046e54d6641002d5af [0,2,0,0,0,0|1,0,1]=4 5312 B12R0.648 CC=CCNC(=O)[C@H](O)CCCC 3e6d71e483be5f07011fece4ba6c079a [0,2,0,0,0,0|1,0,1]=4 5313 B12R0.648 CC=CCNC(C)C(=O)OCCC 519dafe0063487e9d3a37442b1893fbf [0,2,0,0,0,0|0,0,2]=4 5314 B12R0.648 CC=CCOC(C)C(=O)OCCC 7cfae677dca3e0261c389b80d9a44a09 [0,2,0,0,0,0|0,0,2]=4 5315 B12R0.648 CCC#CC(=O)N(C)CCCCC dd8594c83c10aa971d7e4eda82ec92cb [0,2,0,0,0,0|1,0,1]=4 5316 B12R0.648 CCC/C=C(\C)/C(=O)NCCCC 226e2c4aa73e73a6b358e9a0f5daebf7 [0,2,0,0,0,0|2,0,0]=4 5317 B12R0.648 CCC/C=C/C(=O)N(C)CCCC 061fe17d5addbe08725fe9cb40d3cd8a [0,2,0,0,0,0|2,0,0]=4 5318 B12R0.648 CCC=CC(=O)N(C)CCCCC a56b538b1a64e9734974b3abd9f6a29b [0,2,0,0,0,0|1,0,1]=4 5319 B12R0.648 CCCC#CC(=O)N(C)CCCC 25147c4d4e478335d0be95fd5e018894 [0,2,0,0,0,0|2,0,0]=4 5320 B12R0.648 CCCC=CC(=O)N(C)CCCC 382fa246bdab53cd1818ea7a7a0092d8 [0,2,0,0,0,0|2,0,0]=4 5321 B12R0.648 CCCCC(=O)C(=O)NCCCCl dc4179585ff013e939bf41eb04c3f0ec [0,2,0,0,0,0|1,0,1]=4 5322 B12R0.648 CCCCC(=O)C(=O)NCCCO b46a6f0c4c3f0cd35e0ff30361b123e8 [0,2,0,0,0,0|1,0,1]=4 5323 B12R0.648 CCCCC(=O)C(=O)NCCOC 1e8e40f5332307b80a184787409c1701 [0,2,0,0,0,0|1,0,1]=4 5324 B12R0.648 CCCCC(=O)C(=O)NCCSC c9ef724a148ba0a95b05d568b2e6f7ed [0,2,0,0,0,0|1,0,1]=4 5325 B12R0.648 CCCCC(=O)N(C)CCCCO 775def692b1f8331939554df9d8e8bd0 [0,2,0,0,0,0|2,0,0]=4 5326 B12R0.648 CCCCC(=O)N(C)CCCOC 0664706663ef3d92252f5ea0cf56acf6 [0,2,0,0,0,0|2,0,0]=4 5327 B12R0.648 CCCCC(=O)N(C)CCOCC ad81704c443b8ff8cc53d7e1cb504d41 [0,2,0,0,0,0|2,0,0]=4 5328 B12R0.648 CCCCC(O)C(=O)NCCC#N 715e8d22c359d785b43f99276370bfd0 [0,2,0,0,0,0|1,0,1]=4 5329 B12R0.648 CCCCC(O)C(=O)NCCCCl de6e220f86a1072b838ecf2c2cc3d5e1 [0,2,0,0,0,0|1,0,0]=3 5330 B12R0.648 CCCCC(O)C(=O)NCCCO c4157684a86f5ed2bc4a847552022f6d [0,2,0,0,0,0|1,0,0]=3 5331 B12R0.648 CCCCC(O)C(=O)NCCOC a8331de5e1e619e9b1616fec0e59a288 [0,2,0,0,0,0|1,0,0]=3 5332 B12R0.648 CCCCC(O)C(=O)NCCON 4a10c8d569baef19f3dbeaa5a7d66f7c [0,2,0,0,0,0|2,0,0]=4 5333 B12R0.648 CCCCC(O)C(=O)NCCSC cae22aaf47f86e47512ad86ac87db299 [0,2,0,0,0,0|1,0,0]=3 5334 B12R0.648 CCCCCC(=O)C(=O)NCCBr 24a371681b14c0e648e3ffd0c0e14c69 [0,2,0,0,0,0|2,0,0]=4 5335 B12R0.648 CCCCCC(=O)C(=O)NCCC fb51708cecf5dd6a3040f4e7e4e30451 [0,2,0,0,0,0|1,0,0]=3 5336 B12R0.648 CCCCCC(=O)C(=O)NCCF 9983bf1b28b2a4bd55aac50ba844e8ad [0,2,0,0,0,0|2,0,0]=4 5337 B12R0.648 CCCCCC(=O)C(=O)NCCI 134b1ecacf3e8f953fb7386c4b9127e0 [0,2,0,0,0,0|2,0,0]=4 5338 B12R0.648 CCCCCC(=O)C(=O)NCCO ae1f17c269cc64f961462091d365c3ff [0,2,0,0,0,0|2,0,0]=4 5339 B12R0.648 CCCCCC(=O)C(=O)NCCS 1bb392fbf636a173d902893203462001 [0,2,0,0,0,0|2,0,0]=4 5340 B12R0.648 CCCCCC(=O)N(C)CCC#N 81a1f90bac41eff61194ae8a8afea303 [0,2,0,0,0,0|1,0,1]=4 5341 B12R0.648 CCCCCC(=O)N(C)CCCC 12ed8e4e55307a2a979d664f58aa0c27 [0,2,0,0,0,0|1,0,0]=3 5342 B12R0.648 CCCCCC(=O)N(C)CCCO e6408efdc071cca221021b9fb28a5603 [0,2,0,0,0,0|1,0,0]=3 5343 B12R0.648 CCCCCC(=O)N(C)CCOC 263ef4621ea8edf6d7ba3b389297ac14 [0,2,0,0,0,0|1,0,0]=3 5344 B12R0.648 CCCCCC(=O)N(C)CCON 80e4c24c1f49700ebf1d81946aa0493f [0,2,0,0,0,0|2,0,0]=4 5345 B12R0.648 CCCCCC(=O)N(C)CCSC 19178bdbc1edecef77235e12ce7ca677 [0,2,0,0,0,0|1,0,0]=3 5346 B12R0.648 CCCCCC(O)C(=O)NCCBr 3a634e891d46dc26e064d4738422f68f [0,2,0,0,0,0|2,0,0]=4 5347 B12R0.648 CCCCCC(O)C(=O)NCCC 2fd994a0f1156eb7baae1c2719d13c11 [0,2,0,0,0,0|1,0,0]=3 5348 B12R0.648 CCCCCC(O)C(=O)NCCF fd79112c59cbd4470b58c29f5f2e1663 [0,2,0,0,0,0|2,0,0]=4 5349 B12R0.648 CCCCCC(O)C(=O)NCCI f1ae2b13cbc1ebf9ec58104470d94a44 [0,2,0,0,0,0|2,0,0]=4 5350 B12R0.648 CCCCCC(O)C(=O)NCCO f00c7bf0ff8cca8995bba730431253e0 [0,2,0,0,0,0|2,0,0]=4 5351 B12R0.648 CCCCCC(O)C(=O)NCCS 080cb00524ed452ca6402d2c707e0aa2 [0,2,0,0,0,0|2,0,0]=4 5352 B12R0.648 CCCCCN(C)C(=O)CCCC b8e48fd07fbf020f91bdded241b261bc [0,2,0,0,0,0|1,0,0]=3 5353 B12R0.648 CCCCCN(C)C(=O)CCCF 8aff02d42d31bf4389df4d91e1d6b2fd [0,2,0,0,0,0|2,0,0]=4 5354 B12R0.648 CCCCCN(C)C(=O)CCCS 22e567b7248abacfeb41cb59054172c1 [0,2,0,0,0,0|2,0,0]=4 5355 B12R0.648 CCCCCN(C)C(=O)CCOC ba7e8aab5d17c7ee5bdb30601b21f080 [0,2,0,0,0,0|2,0,0]=4 5356 B12R0.648 CCCCCN(C)C(=O)CCSC 24a30220ed10c20fcdfe1df1bae7a461 [0,2,0,0,0,0|2,0,0]=4 5357 B12R0.648 CCCCCN(C)C(=O)COCC ffeeaacf47bbd227678dba268d8c7037 [0,2,0,0,0,0|2,0,0]=4 5358 B12R0.648 CCCCCN(C)C(=O)CSCC 75ac2d0aa1507a3c9291c2474fa376db [0,2,0,0,0,0|2,0,0]=4 5359 B12R0.648 CCCCCN(C)C(=O)NCCC 619c29b8c6aff279fe9860202d7945c8 [0,2,0,0,0,0|1,0,0]=3 5360 B12R0.648 CCCCCN(C)C(=O)NCCF ee5e856b038d8bd53cd62c56282e0687 [0,2,0,0,0,0|2,0,0]=4 5361 B12R0.648 CCCCCN(C)C(=O)NCCN c546589a4792631ec3aca9eab2b14d4b [0,2,0,0,0,0|2,0,0]=4 5362 B12R0.648 CCCCCN(C)C(=O)NCCO 16758958a7086c0f26a782878e33c3f3 [0,2,0,0,0,0|2,0,0]=4 5363 B12R0.648 CCCCCN(C)C(=O)NCCS 0b270c2db4ba96497e52c414ebf16529 [0,2,0,0,0,0|2,0,0]=4 5364 B12R0.648 CCCCCN(C)C(=S)NCCC d1e351e9fceaabb69c0f3a1226fefb2a [0,2,0,0,0,0|1,1,0]=4 5365 B12R0.648 CCCCN(C)C(=O)CCCCF 677bea913094807b827c888fcffc3e78 [0,2,0,0,0,0|2,0,0]=4 5366 B12R0.648 CCCCN(C)C(=O)CCCCO 6c78f7a741cc1ee92d787b55214814b1 [0,2,0,0,0,0|2,0,0]=4 5367 B12R0.648 CCCCN(C)C(=O)CCCCS 3b97c0f53568dd440a7bdfb0f5485259 [0,2,0,0,0,0|2,0,0]=4 5368 B12R0.648 CCCCN(C)C(=O)CCCOC 68c22d674a7f0229c711de590d1301e5 [0,2,0,0,0,0|2,0,0]=4 5369 B12R0.648 CCCCN(C)C(=O)CCCSC e0691a5fd4608558d10ad55ecb8dc5d1 [0,2,0,0,0,0|2,0,0]=4 5370 B12R0.648 CCCCN(C)C(=O)CCOCC f43aabe3bedc795825ae2d24212b422d [0,2,0,0,0,0|2,0,0]=4 5371 B12R0.648 CCCCN(C)C(=O)CCSCC e040f28411f6aaa93433a2b9fc245b45 [0,2,0,0,0,0|2,0,0]=4 5372 B12R0.648 CCCCN(C)C(=O)CNCCC bcd951eace41d81bc8e6812b01443e08 [0,2,0,0,0,0|2,0,0]=4 5373 B12R0.648 CCCCN(C)C(=O)COCCC 9f6e409a392176ef898a712f96c5b30b [0,2,0,0,0,0|1,0,0]=3 5374 B12R0.648 CCCCN(C)C(=O)COCCF 303f838bb979dba20c6666c7753d2ad0 [0,2,0,0,0,0|2,0,0]=4 5375 B12R0.648 CCCCN(C)C(=O)COCCO d67667e310538ea42925e16c5251c646 [0,2,0,0,0,0|2,0,0]=4 5376 B12R0.648 CCCCN(C)C(=O)COCCS bf90d2b934632cdcda447dd91f5e80f6 [0,2,0,0,0,0|2,0,0]=4 5377 B12R0.648 CCCCN(C)C(=O)COCOC eff5bb6f7ad6fde0d342db0fcbcc3e32 [0,2,0,0,0,0|2,0,0]=4 5378 B12R0.648 CCCCN(C)C(=O)CSCCC 641abe76871fdc6c09b892f594720206 [0,2,0,0,0,0|1,1,0]=4 5379 B12R0.648 CCCCN(C)C(=O)NCCCN 0a144fc87a3d7072f0ba50901bc18514 [0,2,0,0,0,0|2,0,0]=4 5380 B12R0.648 CCCCN(C)C(=O)NCCCO 1250d65926ee33479c42f8592f1c96b1 [0,2,0,0,0,0|2,0,0]=4 5381 B12R0.648 CCCCN(C)C(=O)NCCOC ec7201c7703263f2c1b561d65002baa5 [0,2,0,0,0,0|2,0,0]=4 5382 B12R0.648 CCCCN(C)C(=O)NCCSC 945d6f024dd319373b16daa72c8ba4b6 [0,2,0,0,0,0|2,0,0]=4 5383 B12R0.648 CCCCNC(=O)C(=O)CCCC 27da2b22f97f57580f57206af7a88f2e [0,2,0,0,0,0|1,0,1]=4 5384 B12R0.648 CCCCNC(=O)C(C)NCCC 37cdefe0f564f155b266f991ddffe648 [0,2,0,0,0,0|2,0,0]=4 5385 B12R0.648 CCCCNC(=O)C(C)OCCC 1defe2ab265d3359a2f0a3afabba5c83 [0,2,0,0,0,0|1,0,0]=3 5386 B12R0.648 CCCCNC(=O)C(C)OCCF 01478abe290ed2b9a278bffb39c38fb4 [0,2,0,0,0,0|2,0,0]=4 5387 B12R0.648 CCCCNC(=O)C(C)OCCS 42ccbeb9a6c527425bdc799a7a348075 [0,2,0,0,0,0|2,0,0]=4 5388 B12R0.648 CCCCNC(=O)C(C)OCOC fa52438fa00974af07eecb478b91e957 [0,2,0,0,0,0|2,0,0]=4 5389 B12R0.648 CCCCNC(=O)C(O)CCCC 527eb168d1bdc9f0fd69a7544c502701 [0,2,0,0,0,0|1,0,0]=3 5390 B12R0.648 CCCCNC(=O)C(O)CCSC 7b30f6c151052c8e58636ca5e95f6d2f [0,2,0,0,0,0|2,0,0]=4 5391 B12R0.648 CCCCNC(=O)N(C)CCCC 23a221680c26c150148d6dce1e05df42 [0,2,0,0,0,0|2,0,0]=4 5392 B12R0.648 CCCCNC(=O)N(C)CCCO 3121c53d47447c11e47d033ccd1d28a6 [0,2,0,0,0,0|2,0,0]=4 5393 B12R0.648 CCCCNC(=O)N(C)CCNC f7ef695a07a79d304eba640afb2dd341 [0,2,0,0,0,0|2,0,0]=4 5394 B12R0.648 CCCCNC(=O)N(C)CCOC 3031162da41d311e214832f593ae31dd [0,2,0,0,0,0|2,0,0]=4 5395 B12R0.648 CCCCNC(=O)N(C)CCSC 447f2c130adb091276856b04fb866f90 [0,2,0,0,0,0|2,0,0]=4 5396 B12R0.648 CCCCNC(=O)[C@@H](O)CCCC 5821783f9f05ecdc6dd6ddc4d0adb15e [0,2,0,0,0,0|1,0,0]=3 5397 B12R0.648 CCCCNC(=O)[C@H](O)CCCC 02041b62b99906754c6135ff0de8717f [0,2,0,0,0,0|1,0,0]=3 5398 B12R0.648 CCCCNC(C)C(=O)NCCC b23d68510eca035fd70283300fd1675d [0,2,0,0,0,0|1,0,0]=3 5399 B12R0.648 CCCCNC(C)C(=O)OCCC 72e5ecde69f1c450cf1966dcec87c642 [0,2,0,0,0,0|0,0,0]=2 5400 B12R0.648 CCCCN[C@@H](C)C(=O)OCCC 65ea24b695138ad698027545e262ca43 [0,2,0,0,0,0|0,0,0]=2 5401 B12R0.648 CCCCOC(=O)C(C)NCCBr 2300014a12071c96e3b753babd901c1c [0,2,0,0,0,0|2,0,0]=4 5402 B12R0.648 CCCCOC(=O)C(C)NCCC 9459fd2f433a4c730422c0695311568d [0,2,0,0,0,0|1,0,0]=3 5403 B12R0.648 CCCCOC(=O)C(C)NCCF fec401d1bd5c2f69bd22f5b88d080a79 [0,2,0,0,0,0|2,0,0]=4 5404 B12R0.648 CCCCOC(=O)C(C)NCCI 5695fb146ed426bc86b918d350aec026 [0,2,0,0,0,0|2,0,0]=4 5405 B12R0.648 CCCCOC(=O)C(C)NCCO 0ad8c77cb1f21bb546eeb932e72fe1b1 [0,2,0,0,0,0|2,0,0]=4 5406 B12R0.648 CCCCOC(=O)C(C)NCCS a4a2ffd30451b325c82d2bc56073d2ba [0,2,0,0,0,0|2,0,0]=4 5407 B12R0.648 CCCCOC(=O)C(C)OCCC 032e6ac1e30eb10db9be687f3f3b3639 [0,2,0,0,0,0|1,0,0]=3 5408 B12R0.648 CCCCOC(=O)C(C)OCCF 10983f3b1bc18066774ee3d204443f7e [0,2,0,0,0,0|2,0,0]=4 5409 B12R0.648 CCCCOC(=O)C(C)OCCS 051a20687372f0ed9198833885dc426e [0,2,0,0,0,0|2,0,0]=4 5410 B12R0.648 CCCCOC(=O)C(C)OCOC 5ca9e61a1d72683c371b6b5606c1348b [0,2,0,0,0,0|2,0,0]=4 5411 B12R0.648 CCCCOC(=O)C(C)OCSC 560c6e76286755c3a0b9aa71dcf6135d [0,2,0,0,0,0|2,0,0]=4 5412 B12R0.648 CCCCOC(=O)[C@H](C)NCCC c452e5cb19ae35c6f4298d013006d863 [0,2,0,0,0,0|1,0,0]=3 5413 B12R0.648 CCCCOC(=O)[C@H](C)NCCF bec7b68ade1aa67b973ecb3157b66093 [0,2,0,0,0,0|2,0,0]=4 5414 B12R0.648 CCCCOC(=O)[C@H](C)NCCO 5aae8b69fa4b69f6b0da1625a818ad22 [0,2,0,0,0,0|2,0,0]=4 5415 B12R0.648 CCCCOC(=O)[C@H](C)NCCS be5dcfc2b2c18b38d868a27a52532a49 [0,2,0,0,0,0|2,0,0]=4 5416 B12R0.648 CCCCOC(=O)[C@H](C)NCOC 5fcb3bbf61648dc121855c4d74ccd645 [0,2,0,0,0,0|2,0,0]=4 5417 B12R0.648 CCCCOC(=O)[C@H](C)NCSC 4077115ecad083896a60629b1f3caec6 [0,2,0,0,0,0|2,0,0]=4 5418 B12R0.648 CCCCOC(=O)[C@H](C)OCCC 5493df3e411a585a9dbe9ff5749b8d9d [0,2,0,0,0,0|1,0,0]=3 5419 B12R0.648 CCCCOC(=O)[C@H](C)OCCF 03c9ee4453170e521272a06435d260ca [0,2,0,0,0,0|2,0,0]=4 5420 B12R0.648 CCCCOC(=O)[C@H](C)OCCS 5c84591897622368c7447c169e80987f [0,2,0,0,0,0|2,0,0]=4 5421 B12R0.648 CCCCOC(=O)[C@H](C)OCOC 747d4134bb3ebb2a3f488b8d54ddd7ab [0,2,0,0,0,0|2,0,0]=4 5422 B12R0.648 CCCCOC(=O)[C@H](C)OCSC c00bc9673650ced1d1e3774e5b01fd92 [0,2,0,0,0,0|2,0,0]=4 5423 B12R0.648 CCCCOC(C)C(=O)NCCC ad7a68da42884ea4c7983bb9c889f86f [0,2,0,0,0,0|1,0,0]=3 5424 B12R0.648 CCCCOC(C)C(=O)OCCC a469c0b62bfab3caa83a1ab0b7ae6134 [0,2,0,0,0,0|0,0,0]=2 5425 B12R0.648 CCCCO[C@@H](C)C(=O)OCCC 565040bfb203ee4ec6ce02ae317071f6 [0,2,0,0,0,0|0,0,0]=2 5426 B12R0.648 CCCCSC(C)C(=O)NCCBr d181bb61e2cecec69d602fa8fef567c5 [0,2,0,0,0,0|2,0,0]=4 5427 B12R0.648 CCCCSC(C)C(=O)NCCC 74d2d766182f45db4c5a60a873fc8261 [0,2,0,0,0,0|1,0,0]=3 5428 B12R0.648 CCCCSC(C)C(=O)NCCF f1f063b6c33ad059993f156f68043dae [0,2,0,0,0,0|2,0,0]=4 5429 B12R0.648 CCCCSC(C)C(=O)NCCI d21ccc10d355392359268635aa452b7f [0,2,0,0,0,0|2,0,0]=4 5430 B12R0.648 CCCCSC(C)C(=O)NCCO eeca108a5d6977c379f1944bdd5f3b58 [0,2,0,0,0,0|2,0,0]=4 5431 B12R0.648 CCCCSC(C)C(=O)NCCS 7abb2fcd49164356dd5cab4a9bc27439 [0,2,0,0,0,0|2,0,0]=4 5432 B12R0.648 CCCC[C@@H](O)C(=O)NCCC#N 109bb78ee4c0246ec83a9058bcd8dadd [0,2,0,0,0,0|1,0,1]=4 5433 B12R0.648 CCCC[C@@H](O)C(=O)NCCCCl 86e6f0bfd0f59d6da6966d678ca1c040 [0,2,0,0,0,0|1,0,0]=3 5434 B12R0.648 CCCC[C@@H](O)C(=O)NCCCO 65b4f1557f6e81f5bd99058f2648e4eb [0,2,0,0,0,0|1,0,0]=3 5435 B12R0.648 CCCC[C@@H](O)C(=O)NCCOC f9ca70b4d04df20eebe26accc808896a [0,2,0,0,0,0|1,0,0]=3 5436 B12R0.648 CCCC[C@@H](O)C(=O)NCCON eb868b82485b0a398d432aa1dadfb53b [0,2,0,0,0,0|2,0,0]=4 5437 B12R0.648 CCCC[C@@H](O)C(=O)NCCSC c660dbb9bd7cbf8c9d68eed345d2e95f [0,2,0,0,0,0|1,0,0]=3 5438 B12R0.648 CCCC[C@H](O)C(=O)NCCC#N d424811fc807ed3a0655f738d423d560 [0,2,0,0,0,0|1,0,1]=4 5439 B12R0.648 CCCC[C@H](O)C(=O)NCCCCl ab239abaeda3efe32d4082dc5c75295c [0,2,0,0,0,0|1,0,0]=3 5440 B12R0.648 CCCC[C@H](O)C(=O)NCCCO ee0122e0cb9e12476a4b439b54c261d1 [0,2,0,0,0,0|1,0,0]=3 5441 B12R0.648 CCCC[C@H](O)C(=O)NCCOC be73e530abd8b3cd57c674dd5a88eb92 [0,2,0,0,0,0|1,0,0]=3 5442 B12R0.648 CCCC[C@H](O)C(=O)NCCON 427a584d13575dea1271a8d77131ab39 [0,2,0,0,0,0|2,0,0]=4 5443 B12R0.648 CCCC[C@H](O)C(=O)NCCSC 2d9d5a36bd193ac8687f881f998111cd [0,2,0,0,0,0|1,0,0]=3 5444 B12R0.648 CCCNC(=O)C(C)NCCCCl 11696afc5f3e0f4a026a64d8eab0c8f6 [0,2,0,0,0,0|2,0,0]=4 5445 B12R0.648 CCCNC(=O)C(C)NCCCF 11c3c31138a0225dc89761b39ef6bf5a [0,2,0,0,0,0|2,0,0]=4 5446 B12R0.648 CCCNC(=O)C(C)NCCCO 8f988fb42662b9d76e3b8f5e0dd6c18c [0,2,0,0,0,0|2,0,0]=4 5447 B12R0.648 CCCNC(=O)C(C)NCCCS d4c98855dd8038288fda3b219e88f3ec [0,2,0,0,0,0|2,0,0]=4 5448 B12R0.648 CCCNC(=O)C(C)NCCOC b16815d795b51594a8f6048b2413d601 [0,2,0,0,0,0|2,0,0]=4 5449 B12R0.648 CCCNC(=O)C(C)NCCSC 855db5047eddd23a5881935370cfc6c8 [0,2,0,0,0,0|2,0,0]=4 5450 B12R0.648 CCCNC(=O)C(C)NCOCC ce1b7f67dbd0db52d78c7d72bad99b12 [0,2,0,0,0,0|2,0,0]=4 5451 B12R0.648 CCCNC(=O)C(C)OCCCF b6230ec8b1e51461c28debd7dcb8d690 [0,2,0,0,0,0|2,0,0]=4 5452 B12R0.648 CCCNC(=O)C(C)OCCCS e86cf1332ae1c8397a42565c55917f0f [0,2,0,0,0,0|2,0,0]=4 5453 B12R0.648 CCCNC(=O)C(C)OCCOC 3883248879e1cc5846661d334b950497 [0,2,0,0,0,0|2,0,0]=4 5454 B12R0.648 CCCNC(=O)C(C)OCCSC 8dc79a4c7f526ba0cb47dc2ca90ed91b [0,2,0,0,0,0|2,0,0]=4 5455 B12R0.648 CCCNC(=O)N(C)CCCCO e6d8cca78a818dd1ab1d02e23a6f5689 [0,2,0,0,0,0|2,0,0]=4 5456 B12R0.648 CCCNC(=O)N(C)CCCNC a91b3103a42139ba214065e5f8b08156 [0,2,0,0,0,0|2,0,0]=4 5457 B12R0.648 CCCNC(=O)N(C)CCCOC 47bd82f300fedf4905efc71308c8c5da [0,2,0,0,0,0|2,0,0]=4 5458 B12R0.648 CCCNC(=O)N(C)CCOCC b78ef594ad8715b42060636fff2c74bc [0,2,0,0,0,0|2,0,0]=4 5459 B12R0.648 CCCNC(C)C(=O)NCCOC ac9bda0d61dfbddcb601bc1f11030c8e [0,2,0,0,0,0|2,0,0]=4 5460 B12R0.648 CCCOC(=O)C(C)NCCC#N c579e7290043d14971cfff4f6cf6558b [0,2,0,0,0,0|1,0,1]=4 5461 B12R0.648 CCCOC(=O)C(C)NCCC=O 3b24138de3bda4dc68e9e1f94cb91d65 [0,2,0,0,0,0|1,0,1]=4 5462 B12R0.648 CCCOC(=O)C(C)NCCCCl 200d4459d7c1c13926f03f06cacf3388 [0,2,0,0,0,0|1,0,0]=3 5463 B12R0.648 CCCOC(=O)C(C)NCCCF 5c3931e23d74cbaa7103553e0f96c932 [0,2,0,0,0,0|1,0,0]=3 5464 B12R0.648 CCCOC(=O)C(C)NCCCO 0a65d1d5fab436583cba0c461706b0fa [0,2,0,0,0,0|1,0,0]=3 5465 B12R0.648 CCCOC(=O)C(C)NCCCS 303293eb70e3bf8db6ec61fbf1a64f28 [0,2,0,0,0,0|1,0,0]=3 5466 B12R0.648 CCCOC(=O)C(C)NCCOC a0a3141ae97bca5a07d8ba28286cb714 [0,2,0,0,0,0|1,0,0]=3 5467 B12R0.648 CCCOC(=O)C(C)NCCON f52b8e1ac1312b0e91690632a089d4d5 [0,2,0,0,0,0|2,0,0]=4 5468 B12R0.648 CCCOC(=O)C(C)NCCSC 4c7a8bcfccc68b4884edfec64d6b9f8e [0,2,0,0,0,0|1,0,0]=3 5469 B12R0.648 CCCOC(=O)C(C)NCOCC 430fd36d5facf3a52eaa8ba6a733e414 [0,2,0,0,0,0|1,0,0]=3 5470 B12R0.648 CCCOC(=O)C(C)OCCC#N 5018552b47d02a48ce9be013e590b1fd [0,2,0,0,0,0|1,0,1]=4 5471 B12R0.648 CCCOC(=O)C(C)OCCC=O f5296bf9519da68c88ed6bc22044c205 [0,2,0,0,0,0|1,0,1]=4 5472 B12R0.648 CCCOC(=O)C(C)OCCCF a5645ebec96e27d7f276fade394fe31e [0,2,0,0,0,0|1,0,0]=3 5473 B12R0.648 CCCOC(=O)C(C)OCCCS 941ffbb6016c54c8ce3a5363204d9309 [0,2,0,0,0,0|1,0,0]=3 5474 B12R0.648 CCCOC(=O)C(C)OCCOC e85105b2446a78cfaa57f65b483e3dbe [0,2,0,0,0,0|1,0,0]=3 5475 B12R0.648 CCCOC(=O)C(C)OCCSC f0990b0bea664afd40442bca39993f5a [0,2,0,0,0,0|1,0,0]=3 5476 B12R0.648 CCCOC(=O)C(C)OCOCC 5fbe7ec3bf6c8e72258782f96740a983 [0,2,0,0,0,0|1,0,0]=3 5477 B12R0.648 CCCOC(=O)[C@H](C)NCCC#N 4a2e6dfffd00bd66c4fd3664d83d0c40 [0,2,0,0,0,0|1,0,1]=4 5478 B12R0.648 CCCOC(=O)[C@H](C)NCCC=O 6cea1d033fa1e98b022014fde1a41840 [0,2,0,0,0,0|1,0,1]=4 5479 B12R0.648 CCCOC(=O)[C@H](C)NCCCF acbe982bffe1d16ef3fc4307cd860998 [0,2,0,0,0,0|1,0,0]=3 5480 B12R0.648 CCCOC(=O)[C@H](C)NCCCO 6f5672c745f0d18ac65fa23a1b488dec [0,2,0,0,0,0|1,0,0]=3 5481 B12R0.648 CCCOC(=O)[C@H](C)NCCCS 004e88f22c2915d4f5d4ad54d9363cfd [0,2,0,0,0,0|1,0,0]=3 5482 B12R0.648 CCCOC(=O)[C@H](C)NCCOC c4c7b4625488b5fe02d4476e7f2afb18 [0,2,0,0,0,0|1,0,0]=3 5483 B12R0.648 CCCOC(=O)[C@H](C)NCCSC a7a6605a0c66a7f2b87ae440d0d35361 [0,2,0,0,0,0|1,0,0]=3 5484 B12R0.648 CCCOC(=O)[C@H](C)NCOCC 877eae94cfb465e47cd146bc4352a7ee [0,2,0,0,0,0|1,0,0]=3 5485 B12R0.648 CCCOC(=O)[C@H](C)OCCC#N 7331a057a6b79e49a681ec1ee8a56236 [0,2,0,0,0,0|1,0,1]=4 5486 B12R0.648 CCCOC(=O)[C@H](C)OCCC=O 1bfa9e8fa9eee88ae09f2e233c741e45 [0,2,0,0,0,0|1,0,1]=4 5487 B12R0.648 CCCOC(=O)[C@H](C)OCCCF dd3708ba45b2487094c297e48ef2ed78 [0,2,0,0,0,0|1,0,0]=3 5488 B12R0.648 CCCOC(=O)[C@H](C)OCCCS 1d37984c69d31788bbbb497d387410c9 [0,2,0,0,0,0|1,0,0]=3 5489 B12R0.648 CCCOC(=O)[C@H](C)OCCOC d6f89b83bf17eac672be61043c0b156e [0,2,0,0,0,0|1,0,0]=3 5490 B12R0.648 CCCOC(=O)[C@H](C)OCCSC 7ae6a1da175bcb4b4f5d138c970764f0 [0,2,0,0,0,0|1,0,0]=3 5491 B12R0.648 CCCOC(=O)[C@H](C)OCOCC 221f81a999bc7e478748485ba3e7a834 [0,2,0,0,0,0|1,0,0]=3 5492 B12R0.648 CCCOC(C)C(=O)NCCCCl 187b964f9623a8684a5affa7fe2b40f0 [0,2,0,0,0,0|2,0,0]=4 5493 B12R0.648 CCCOC(C)C(=O)NCCCO ebf5df0d6fb8ce20cba4b614e41dae7e [0,2,0,0,0,0|2,0,0]=4 5494 B12R0.648 CCCOC(C)C(=O)NCCOC 9d6971a349b7522e6b25ac8a3aa588fd [0,2,0,0,0,0|2,0,0]=4 5495 B12R0.648 CCCOC(C)C(=O)NCCSC e2ea662a82e54e94445ed50ae01e8168 [0,2,0,0,0,0|2,0,0]=4 5496 B12R0.648 CCCOC(C)C(=O)OCCOC bd121bd382f2a2bd187da139c2811ce2 [0,2,0,0,0,0|1,0,0]=3 5497 B12R0.648 CCCOCC(=O)N(C)CCCO 12a2d4ea5d13c6266a52370f2ec31750 [0,2,0,0,0,0|2,0,0]=4 5498 B12R0.648 CCCOCC(=O)N(C)CCOC 5d71ed9c0ec3b44011ffb08851434f22 [0,2,0,0,0,0|2,0,0]=4 5499 B12R0.648 CCCOCC(=O)N(C)CCSC 96bff18802a762e09c23f7bafffe1790 [0,2,0,0,0,0|2,0,0]=4 5500 B12R0.648 CCCSCC(=O)N(C)CCCO e0759dc075b905b81b7cd7416210d02c [0,2,0,0,0,0|2,0,0]=4 5501 B12R0.648 CCCSCC(=O)N(C)CCOC ec9d61ec3cf107d877149cdf88ab49e8 [0,2,0,0,0,0|2,0,0]=4 5502 B12R0.648 CCCSCC(=O)N(C)CCSC 5c3de3fbdaac82da3faeeb39227ce53f [0,2,0,0,0,0|2,0,0]=4 5503 B12R0.648 CCOCCC(=O)N(C)CCCO 2618a938e654b98371113734338208a3 [0,2,0,0,0,0|2,0,0]=4 5504 B12R0.648 CCOCCC(=O)N(C)CCOC 92bfd8ee912b8e44322bdddd70905339 [0,2,0,0,0,0|2,0,0]=4 5505 B12R0.648 CCOCCC(=O)N(C)CCSC cd99e65802e40f74e0a1b560ec479e1c [0,2,0,0,0,0|2,0,0]=4 5506 B12R0.648 CCSCCC(=O)N(C)CCCO 8230046b67eba3b8cde28a2f063568c3 [0,2,0,0,0,0|2,0,0]=4 5507 B12R0.648 CCSCCC(=O)N(C)CCOC 2c5a3235ad29809b222affa224b19945 [0,2,0,0,0,0|2,0,0]=4 5508 B12R0.648 CCSCCC(=O)N(C)CCSC 25f81b31016976e4769af2395752346c [0,2,0,0,0,0|2,0,0]=4 5509 B12R0.648 CN(CCCO)C(=O)CCCCF 35067d3d3eea6e34bc9daa67eb6117e6 [0,2,0,0,0,0|2,0,0]=4 5510 B12R0.648 CN(CCCO)C(=O)CCCCO 268a109a52cfb128832e2f892ae73b85 [0,2,0,0,0,0|2,0,0]=4 5511 B12R0.648 CN(CCCO)C(=O)CCCCS e4c56f9f2857c0b480da5e37fc51e100 [0,2,0,0,0,0|2,0,0]=4 5512 B12R0.648 COCCCC(=O)N(C)CCCO 9eee459973c0d3bb90456c6399698d35 [0,2,0,0,0,0|2,0,0]=4 5513 B12R0.648 COCCCC(=O)N(C)CCOC 15998cd3c54fbf46061c7fa33af73e69 [0,2,0,0,0,0|2,0,0]=4 5514 B12R0.648 COCCCC(=O)N(C)CCSC f0fc5ef4c1a385b1fdc96c24393d4ee4 [0,2,0,0,0,0|2,0,0]=4 5515 B12R0.648 COCCN(C)C(=O)CCCCF 0e5b17a9cdbbfdbca4e766a3af0c8de0 [0,2,0,0,0,0|2,0,0]=4 5516 B12R0.648 COCCN(C)C(=O)CCCCO bf8b4d8a56796bd9416eaebbd10e775c [0,2,0,0,0,0|2,0,0]=4 5517 B12R0.648 COCCN(C)C(=O)CCCCS 75dbfebe9703861245315d02ef92fa46 [0,2,0,0,0,0|2,0,0]=4 5518 B12R0.648 COCCN(C)C(=O)CCCSC f75b8a5a2cda4b07cade380712e3efc8 [0,2,0,0,0,0|2,0,0]=4 5519 B12R0.648 COCCNC(=O)C(O)CCSC 84667fcb855900b1d06ad414449a6dca [0,2,0,0,0,0|2,0,0]=4 5520 B12R0.648 COCCOC(=O)C(C)OCCF c71854037f9acad8507e5b60d0ce4087 [0,2,0,0,0,0|2,0,0]=4 5521 B12R0.648 COCCOC(=O)C(C)OCCS b35e5cb4e40e75cf0ecdaaca4fd9983f [0,2,0,0,0,0|2,0,0]=4 5522 B12R0.648 COCCOC(=O)C(C)OCOC 8a49e84ec457633b0ac4d2563464cee8 [0,2,0,0,0,0|2,0,0]=4 5523 B12R0.648 COCCOC(=O)C(C)OCSC 7cfc2b1127dc0b4238f52a4e7089ae28 [0,2,0,0,0,0|2,0,0]=4 5524 B12R0.648 CSCCC(O)C(=O)NCCCCl a438807c6262facdcf439d5533f94a7f [0,2,0,0,0,0|2,0,0]=4 5525 B12R0.648 CSCCC(O)C(=O)NCCCO 4539a42b3f1b109ee8a361fcc52c5a7d [0,2,0,0,0,0|2,0,0]=4 5526 B12R0.648 CSCCCC(=O)N(C)CCCO 19e7b7f58d5ffabf85d6ae725a7ca132 [0,2,0,0,0,0|2,0,0]=4 5527 B12R0.648 CSCCCC(=O)N(C)CCSC 89e0486557db7281cd6a5bb97812df3e [0,2,0,0,0,0|2,0,0]=4 5528 B12R0.648 CSCCN(C)C(=O)CCCCF 5a1acaa7b4f5b6ca2234703248b6b9f5 [0,2,0,0,0,0|2,0,0]=4 5529 B12R0.648 CSCCN(C)C(=O)CCCCO b772de0c54e7ce1a32d51cfbd4172e25 [0,2,0,0,0,0|2,0,0]=4 5530 B12R0.648 CSCCN(C)C(=O)CCCCS bcf3c1eedefe4951591561d2085cedaa [0,2,0,0,0,0|2,0,0]=4 5531 B12R0.648 CSCCNC(=O)C(O)CCSC 652367c46930f7de51012a3df868e43e [0,2,0,0,0,0|2,0,0]=4 5532 B12R0.44 C=C(C)CCCC(=O)NCC(C)C 60d1f7e6c2460c1423409f037977ec51 [0,2,0,0,0,0|1,0,1]=4 5533 B12R0.44 C=C(C)CCCC(=O)NCC(C)O eafb3b5e61942de3acfa378b9ac8c5be [0,2,0,0,0,0|1,0,1]=4 5534 B12R0.44 C=C(C)CCCC(=O)NC[C@@H](C)O b1c46a5ee9aeeeaacb0a06b33c419d4d [0,2,0,0,0,0|1,0,1]=4 5535 B12R0.44 C=C(C)CCCC(=O)NC[C@H](C)O 5f0d7502b31788937bcf1bd8b3c9b495 [0,2,0,0,0,0|1,0,1]=4 5536 B12R0.44 C=C(C)CNC(=O)CCCC(C)C 44f44639134d06121171a35df7342cf0 [0,2,0,0,0,0|1,0,1]=4 5537 B12R0.44 CC(=O)CCCC(=O)NCC(C)C dc21194dfe2c6dff0bef94f08658ba00 [0,2,0,0,0,0|1,0,1]=4 5538 B12R0.44 CC(=O)CCCC(=O)NCC(C)O c818f779286ee7b3492e75cf836869f9 [0,2,0,0,0,0|1,0,1]=4 5539 B12R0.44 CC(=O)CCCC(=O)NC[C@@H](C)O a5763453f65b75d05031dbc16bcbe77b [0,2,0,0,0,0|1,0,1]=4 5540 B12R0.44 CC(=O)CCCC(=O)NC[C@H](C)O 72c9bb4282843bb462beb7acc598b103 [0,2,0,0,0,0|1,0,1]=4 5541 B12R0.44 CC(=O)CNC(=O)CCCC(C)C 0eec13a599b470190907639cb26e69fd [0,2,0,0,0,0|1,0,1]=4 5542 B12R0.44 CC(C)CCC(=O)NCCC(C)O 14778feda4fcf908b296d14c3f396077 [0,2,0,0,0,0|2,0,0]=4 5543 B12R0.44 CC(C)CCC(=O)NCC[C@@H](C)O 495a6fb75dbd431b9f6d5f1e0ea5454d [0,2,0,0,0,0|2,0,0]=4 5544 B12R0.44 CC(C)CCC(=O)NCC[C@H](C)O e9ed81c8f6b964fa5a784c892e9fcfde [0,2,0,0,0,0|2,0,0]=4 5545 B12R0.44 CC(C)CCCC(=O)NCC(C)C 9433a2d36707dbbeba9dc4fb34f3a7b4 [0,2,0,0,0,0|1,0,0]=3 5546 B12R0.44 CC(C)CCCC(=O)NCC(C)O fe227a15d7912faea9b9945dba99471b [0,2,0,0,0,0|1,0,0]=3 5547 B12R0.44 CC(C)CCCC(=O)NCC(F)F 9b918a50a6e948354462fb0f266062e3 [0,2,0,0,0,0|2,0,0]=4 5548 B12R0.44 CC(C)CCCC(=O)NC[C@@H](C)O bd12a2480c517f03c3273c4fdf97f5bb [0,2,0,0,0,0|1,0,0]=3 5549 B12R0.44 CC(C)CCCC(=O)NC[C@H](C)O 530973866e92bad3a61411d729040c75 [0,2,0,0,0,0|1,0,0]=3 5550 B12R0.44 CC(C)CCCC(C)OCC(C)C c1273ad116afa5216cdac4ec5edac3db [0,2,0,0,0,0|1,0,1]=4 5551 B12R0.44 CC(C)CCNC(=O)CCC(C)C a51e610a4f662ad5c618ab698297e102 [0,2,0,0,0,0|2,0,0]=4 5552 B12R0.44 CC(C)CCNC(=O)CCC(C)O 44f69cd8599f28a5c657d89ecd0bf2ff [0,2,0,0,0,0|2,0,0]=4 5553 B12R0.44 CC(C)CCNC(=O)CCC(C)S 5a7556e8ac1232ce6713793599ad2f26 [0,2,0,0,0,0|2,0,0]=4 5554 B12R0.44 CC(C)CCNC(=O)CC[C@H](C)S 0bc97c37028883b6264b742531139719 [0,2,0,0,0,0|2,0,0]=4 5555 B12R0.44 CC(C)CCNC(=O)NCC(C)C d3f8d3930fca27c7e242cf54afc8055b [0,2,0,0,0,0|2,0,0]=4 5556 B12R0.44 CC(C)CCNC(=O)NCC(C)O c39c584f70a67fee9ea0de0a67530ec1 [0,2,0,0,0,0|2,0,0]=4 5557 B12R0.44 CC(C)CCNC(=O)NC[C@@H](C)O f7a665c95b684d59c65ebd87e8fea8e5 [0,2,0,0,0,0|2,0,0]=4 5558 B12R0.44 CC(C)CCNC(=O)NC[C@H](C)O a9d0413b686c73697b52e9506a3078bc [0,2,0,0,0,0|2,0,0]=4 5559 B12R0.44 CC(C)CNC(=O)CCCN(C)C 9d94185eb67543e6a7d1eb83d5621d75 [0,2,0,0,0,0|2,0,0]=4 5560 B12R0.44 CC(C)CNC(=O)CCOC(C)C 7a1f510559ab4c458bee7aff767191af [0,2,0,0,0,0|2,0,0]=4 5561 B12R0.44 CC(C)CNC(=O)CCSC(C)C c0bf0dd1f8d03c1424fbfb6566f9aecf [0,2,0,0,0,0|2,0,0]=4 5562 B12R0.44 CC(C)CNC(=O)CNCC(C)O ef42e20e50fb52f9ac026796f5cb42b3 [0,2,0,0,0,0|2,0,0]=4 5563 B12R0.44 CC(C)CNC(=O)CNC[C@@H](C)O ba9412e7b1eec0114d24e9a0ae31e9ac [0,2,0,0,0,0|2,0,0]=4 5564 B12R0.44 CC(C)CNC(=O)CNC[C@H](C)O 770589805c80bbacaa300c137b898d45 [0,2,0,0,0,0|2,0,0]=4 5565 B12R0.44 CC(C)CNC(=O)COCC(C)C b5beca305d9c4b9a7bd8431f8ec1bad7 [0,2,0,0,0,0|2,0,0]=4 5566 B12R0.44 CC(C)CNC(=O)COCC(C)F 7b3a0b21713af52542343e78020cab22 [0,2,0,0,0,0|2,0,0]=4 5567 B12R0.44 CC(C)CNC(=O)COCC(C)S b5325e131e6d3efbb5aaf6ed84cf8988 [0,2,0,0,0,0|2,0,0]=4 5568 B12R0.44 CC(C)CNC(=O)COC[C@@H](C)F d35b1feea45bd5612a2d6e2c7128d1fd [0,2,0,0,0,0|2,0,0]=4 5569 B12R0.44 CC(C)CNC(=O)COC[C@H](C)F f704b3c84268edc3cbf16d8601bfbab5 [0,2,0,0,0,0|2,0,0]=4 5570 B12R0.44 CC(C)CNC(=O)NCCC(C)O e6932514a3da74120b201874a8abbc81 [0,2,0,0,0,0|2,0,0]=4 5571 B12R0.44 CC(C)CNC(=O)NCC[C@@H](C)O 4a369ae24a8fc60c288ca772a5acf600 [0,2,0,0,0,0|2,0,0]=4 5572 B12R0.44 CC(C)CNC(=O)NCC[C@H](C)O 3ec863643663bc449b4f70cbf502a43f [0,2,0,0,0,0|2,0,0]=4 5573 B12R0.44 CC(C)CNCC(=O)NCC(C)C 32b23ab91ce102938a4f1dd558acbbff [0,2,0,0,0,0|2,0,0]=4 5574 B12R0.44 CC(C)COCC(=O)NCC(C)O 90d7143c149ba7cab2f0b45bcca46bc5 [0,2,0,0,0,0|2,0,0]=4 5575 B12R0.44 CC(C)COCC(=O)NC[C@@H](C)O 24c251136ac3154f1b6b2905b59068b8 [0,2,0,0,0,0|2,0,0]=4 5576 B12R0.44 CC(C)COCC(=O)NC[C@H](C)O bec9849069240649debc58a1a765bd8e [0,2,0,0,0,0|2,0,0]=4 5577 B12R0.44 CC(C)OCCC(=O)NC[C@@H](C)O 6bdd1198203259849499f70b3096a831 [0,2,0,0,0,0|2,0,0]=4 5578 B12R0.44 CC(C)OCCC(=O)NC[C@H](C)O 9c5ec4191fb3908473408941de7e7dc5 [0,2,0,0,0,0|2,0,0]=4 5579 B12R0.44 CC(C)SCCC(=O)NC[C@@H](C)O aada3d1bf856841af2e531a62d6dbc06 [0,2,0,0,0,0|2,0,0]=4 5580 B12R0.44 CC(C)SCCC(=O)NC[C@H](C)O e56ed61b5fafb36c55b82a9ee7080228 [0,2,0,0,0,0|2,0,0]=4 5581 B12R0.44 CC(O)CCC(=O)NCC[C@@H](C)O 79951079d11ec43ed87612b39b07fb38 [0,2,0,0,0,0|2,0,0]=4 5582 B12R0.44 CC(O)CCC(=O)NCC[C@H](C)O 04cff8c90ba1c74404170116f94fc86d [0,2,0,0,0,0|2,0,0]=4 5583 B12R0.44 CC(O)CCNC(=O)CCC(C)O 9e7db5542a7e9510b1e7e9351aab54e5 [0,2,0,0,0,0|2,0,0]=4 5584 B12R0.44 CC(O)CCNC(=O)CCC(C)S b71085d8a2b7e37ad7408b65418e19de [0,2,0,0,0,0|2,0,0]=4 5585 B12R0.44 CC(O)CCNC(=O)CC[C@H](C)S 4939bcebd08b4e36680c0691578d65b2 [0,2,0,0,0,0|2,0,0]=4 5586 B12R0.44 CC(O)CCNC(=O)NCC(C)O 7fe0d047cfdc783bbb68526c93f62137 [0,2,0,0,0,0|2,0,0]=4 5587 B12R0.44 CC(O)CCNC(=O)NC[C@@H](C)O 1876eee7e3ed0c0cb1b22a5c2db76c59 [0,2,0,0,0,0|2,0,0]=4 5588 B12R0.44 CC(O)CCNC(=O)NC[C@H](C)O 5b00236eb5d64c705847f304ca4acb70 [0,2,0,0,0,0|2,0,0]=4 5589 B12R0.44 CC(O)CNC(=O)CCCN(C)C 24f73d62d305409e810ce55ace1b3cd9 [0,2,0,0,0,0|2,0,0]=4 5590 B12R0.44 CC(O)CNC(=O)CCOC(C)C 8e868723afd2a6692406bcf533d4d4c2 [0,2,0,0,0,0|2,0,0]=4 5591 B12R0.44 CC(O)CNC(=O)CCSC(C)C bea6f6eafeabb1bc91cfc8e5274e90b1 [0,2,0,0,0,0|2,0,0]=4 5592 B12R0.44 CC(O)CNC(=O)NCC[C@@H](C)O 3353207071376af2019a554e02143321 [0,2,0,0,0,0|2,0,0]=4 5593 B12R0.44 CC(O)CNC(=O)NCC[C@H](C)O c14dfbfcc316f9f0910c397a40e0d372 [0,2,0,0,0,0|2,0,0]=4 5594 B12R0.44 CC(S)CCC(=O)NCC[C@@H](C)O 5e068765e4f21d87f54e0dd6f6e983ae [0,2,0,0,0,0|2,0,0]=4 5595 B12R0.44 CC(S)CCC(=O)NCC[C@H](C)O 8e52b35f5a77c59d09acbb27779128a8 [0,2,0,0,0,0|2,0,0]=4 5596 B12R0.44 C[C@@H](O)CCNC(=O)NC[C@@H](C)O b27d23fc152797098280dc6dea70944b [0,2,0,0,0,0|2,0,0]=4 5597 B12R0.44 C[C@@H](O)CNC(=O)CCCN(C)C 2c5d8fbe2f97cbf7cc08af01443ae720 [0,2,0,0,0,0|2,0,0]=4 5598 B12R0.44 C[C@H](O)CCNC(=O)CC[C@H](C)S a67017375ebf58cfecee4b619b8625b8 [0,2,0,0,0,0|2,0,0]=4 5599 B12R0.44 C[C@H](O)CCNC(=O)NC[C@@H](C)O 460b08896b5e7ed860831ebbfeb536a8 [0,2,0,0,0,0|2,0,0]=4 5600 B12R0.44 C[C@H](O)CCNC(=O)NC[C@H](C)O 7d9949988af7e524d0adfe9dea01f561 [0,2,0,0,0,0|2,0,0]=4 5601 B12R0.44 C[C@H](O)CNC(=O)CCCN(C)C 27929dfcba0946c725dbc3143cb16dee [0,2,0,0,0,0|2,0,0]=4 5602 B12R0.44 C[C@H](O)CNC(=O)NCC[C@@H](C)O d60a15d364075507afa340824ad268dc [0,2,0,0,0,0|2,0,0]=4 5603 B12R0.44 C[C@H](S)CCC(=O)NCC[C@@H](C)O c101f080c6726e16743ae3fcc84d77bd [0,2,0,0,0,0|2,0,0]=4 5604 B12R0.123 CC(C)C(C)NC(=O)CCCCF afa4c860075edabff165aebacfde4306 [0,2,0,0,0,0|2,0,0]=4 5605 B12R0.123 CC(C)C(C)NC(=O)CCCCO 7293cba71001c550f5ebb873315046cc [0,2,0,0,0,0|2,0,0]=4 5606 B12R0.123 CC(C)C(C)NC(=O)CCCCS 1d8a6fb1d45e50fe89c1df4a5a405c63 [0,2,0,0,0,0|2,0,0]=4 5607 B12R0.123 CC(C)[C@@H](C)NC(=O)CCCCF 2f9cc9c315cfe2b585ce9fc9dafa7f96 [0,2,0,0,0,0|2,0,0]=4 5608 B12R0.123 CC(C)[C@@H](C)NC(=O)CCCCO 4de37542686eb1544cae2e96ead3c0cc [0,2,0,0,0,0|2,0,0]=4 5609 B12R0.123 CC(C)[C@@H](C)NC(=O)CCCCS 978872f6961448e3285832052e0215dd [0,2,0,0,0,0|2,0,0]=4 5610 B12R0.123 CC(C)[C@H](C)NC(=O)CCCCF 22de15bdd48afad91281ce5a6fe757ce [0,2,0,0,0,0|2,0,0]=4 5611 B12R0.123 CC(C)[C@H](C)NC(=O)CCCCO 7684360fc63bcd5c6b5bab571fc4c08e [0,2,0,0,0,0|2,0,0]=4 5612 B12R0.123 CC(C)[C@H](C)NC(=O)CCCCS b617517b282afc2d0a72fe40651d5b6d [0,2,0,0,0,0|2,0,0]=4 5613 B12R0.123 CC(O)C(C)NC(=O)CCCCF 9ad5ce9e0c61a425210516fdcf06ee4d [0,2,0,0,0,0|2,0,0]=4 5614 B12R0.123 CC(O)C(C)NC(=O)CCCCO 1029b9c935334901a159940d07d97fb7 [0,2,0,0,0,0|2,0,0]=4 5615 B12R0.123 CC(O)C(C)NC(=O)CCCCS 4069faa18e51a382b38c312a18a02ddf [0,2,0,0,0,0|2,0,0]=4 5616 B12R0.123 CCCCCC(=O)CN(C)C(C)C d5370a01209ba53d8360ea3b002e7d46 [0,2,0,0,0,0|2,0,0]=4 5617 B12R0.123 CCCCCC(=O)NC(C)C(C)C 78fe5d6bdb6fbba2d37e12d287109861 [0,2,0,0,0,0|1,0,0]=3 5618 B12R0.123 CCCCCC(=O)NC(C)C(C)O dc854910f3f1a78f64bb968691cc79f9 [0,2,0,0,0,0|1,0,0]=3 5619 B12R0.123 CCCCCC(=O)N[C@@H](C)C(C)C a402998526fa306269df4a5897b2c616 [0,2,0,0,0,0|1,0,0]=3 5620 B12R0.123 CCCCCC(=O)N[C@@H](C)C(F)F fbc2144a028c8f3d31cd3787a1f5fadb [0,2,0,0,0,0|2,0,0]=4 5621 B12R0.123 CCCCCC(=O)N[C@H](C)C(C)C 0b874770c3947321a216012c5d866576 [0,2,0,0,0,0|1,0,0]=3 5622 B12R0.123 CCCCCC(=O)N[C@H](C)C(F)F 878e98651fc2938178420fb1dad628e1 [0,2,0,0,0,0|2,0,0]=4 5623 B12R0.123 CCCCCC(C)OC(C)C(C)C 136ff09ce8f8cdb4171c5ba45ab51e3b [0,2,0,0,0,0|1,0,1]=4 5624 B12R0.123 CCCCCC(C)OC(C)C(C)S 613393a55ca7247055e41f56f66ece77 [0,2,0,0,0,0|1,0,1]=4 5625 B12R0.123 CCCCCC(C)O[C@@H](C)C(C)C d90065618c83406895485552ee0e4260 [0,2,0,0,0,0|1,0,1]=4 5626 B12R0.123 CCCCCC(C)O[C@H](C)C(C)C 203ab6dd0f8d4bce8239d52fe20e12c2 [0,2,0,0,0,0|1,0,1]=4 5627 B12R0.123 CCCCC[C@@H](C)OC(C)C(C)C ff0c77168ac6e84d540caa464082c3d8 [0,2,0,0,0,0|1,0,1]=4 5628 B12R0.123 CCCCC[C@H](C)OC(C)C(C)C d3095006a34b2b83fa977a134e01bbcc [0,2,0,0,0,0|1,0,1]=4 5629 B12R0.123 CCCCC[C@H](C)OC(C)C(C)S 4749aafe02a24c7616bc10278a0cda94 [0,2,0,0,0,0|1,0,1]=4 5630 B12R0.123 CCCCC[C@H](C)O[C@@H](C)C(C)C 2c0b58b06f502e259e583c7843bc53da [0,2,0,0,0,0|1,0,1]=4 5631 B12R0.123 CCCCC[C@H](C)O[C@H](C)C(C)C 2dd465061f1a838b52612636b17573ba [0,2,0,0,0,0|1,0,1]=4 5632 B12R0.123 CCCCNC(=O)CC(C)C(C)C c37e62446d4816e32f2eb346f4876909 [0,2,0,0,0,0|2,0,0]=4 5633 B12R0.123 CCCCNC(=O)NC(C)C(C)C fe1fce39377f82554d98e0eabf2a09df [0,2,0,0,0,0|2,0,0]=4 5634 B12R0.123 CCCCNC(=O)NC(C)C(C)O 2d7380370a8fe1e4a5e880bf0684d7df [0,2,0,0,0,0|2,0,0]=4 5635 B12R0.123 CCCCNC(=O)N[C@@H](C)C(C)C dda4ba55df93e6dc47ee50c75195cd75 [0,2,0,0,0,0|2,0,0]=4 5636 B12R0.123 CCCCNC(=O)N[C@H](C)C(C)C 2d996dfa4f501efce584296eb89f7651 [0,2,0,0,0,0|2,0,0]=4 5637 B12R0.123 CCCOCC(=O)NC(C)C(C)C 34b09dcacb2869a6d1c3f25708dea885 [0,2,0,0,0,0|2,0,0]=4 5638 B12R0.123 CCCOCC(=O)NC(C)C(C)O b47f9dab6503198b9806593ccfd7b184 [0,2,0,0,0,0|2,0,0]=4 5639 B12R0.123 CCCOCC(=O)N[C@@H](C)C(C)C f94df03652eaa38217262f6d51aec1fa [0,2,0,0,0,0|2,0,0]=4 5640 B12R0.123 CCCOCC(=O)N[C@H](C)C(C)C 5061a9a0ea0cabe8a350520188e83633 [0,2,0,0,0,0|2,0,0]=4 5641 B12R0.123 CCCSCC(=O)NC(C)C(C)C 814b3978858f405c2f67aec70f24b1af [0,2,0,0,0,0|2,0,0]=4 5642 B12R0.123 CCCSCC(=O)NC(C)C(C)O 936e9f206ef03f7cb1cbf382c1b6a11a [0,2,0,0,0,0|2,0,0]=4 5643 B12R0.123 CCCSCC(=O)N[C@@H](C)C(C)C cf75b5db01e3a6061043f74db4039dea [0,2,0,0,0,0|2,0,0]=4 5644 B12R0.123 CCCSCC(=O)N[C@H](C)C(C)C cadd0929d567012ead99f69160156ed3 [0,2,0,0,0,0|2,0,0]=4 5645 B12R0.123 CCOCCC(=O)NC(C)C(C)C 643580143e272b77bbaf812a95ddf928 [0,2,0,0,0,0|2,0,0]=4 5646 B12R0.123 CCOCCC(=O)NC(C)C(C)O 3baacdca2e395b09ca7a6794ae7f9ed9 [0,2,0,0,0,0|2,0,0]=4 5647 B12R0.123 CCOCCC(=O)N[C@@H](C)C(C)C 57e5959505c386b2e74904842cbe110e [0,2,0,0,0,0|2,0,0]=4 5648 B12R0.123 CCOCCC(=O)N[C@H](C)C(C)C 7822806601be74bc0a3f1752d82b1bdc [0,2,0,0,0,0|2,0,0]=4 5649 B12R0.123 CCSCCC(=O)NC(C)C(C)C c360d1211d4ce3861ec222c086f98e83 [0,2,0,0,0,0|2,0,0]=4 5650 B12R0.123 CCSCCC(=O)NC(C)C(C)O c740d7ded2e154695f5c748558b45bf0 [0,2,0,0,0,0|2,0,0]=4 5651 B12R0.123 CCSCCC(=O)N[C@@H](C)C(C)C dc66ce429bef0873128bb5a2e387a44b [0,2,0,0,0,0|2,0,0]=4 5652 B12R0.123 CCSCCC(=O)N[C@H](C)C(C)C 3267dca25e602bcf3a300c1c752ea10e [0,2,0,0,0,0|2,0,0]=4 5653 B12R0.123 COCCCC(=O)NC(C)C(C)C c141f19bf188780e05778b19471e9d1a [0,2,0,0,0,0|2,0,0]=4 5654 B12R0.123 COCCCC(=O)NC(C)C(C)O 20e6152d96b683e73d8349560f77bc7b [0,2,0,0,0,0|2,0,0]=4 5655 B12R0.123 COCCCC(=O)N[C@@H](C)C(C)C a00ffcb76680ea2e9e7279e3965260b6 [0,2,0,0,0,0|2,0,0]=4 5656 B12R0.123 COCCCC(=O)N[C@H](C)C(C)C e1c3baaf808a4d0eb315ad11e397ab30 [0,2,0,0,0,0|2,0,0]=4 5657 B12R0.123 CSCCCC(=O)NC(C)C(C)C b6a960aec5c26b1a00516f2689919612 [0,2,0,0,0,0|2,0,0]=4 5658 B12R0.123 CSCCCC(=O)NC(C)C(C)O e1a33a4825caf6dcf1b7a485a6e37837 [0,2,0,0,0,0|2,0,0]=4 5659 B12R0.123 CSCCCC(=O)N[C@@H](C)C(C)C 344b018e80f4715e044337ba6ea902d6 [0,2,0,0,0,0|2,0,0]=4 5660 B12R0.123 CSCCCC(=O)N[C@H](C)C(C)C 5c0ee48676dce608bd6dbcd0445c2420 [0,2,0,0,0,0|2,0,0]=4 5661 B12R0.124 C#CC(CCCCC)OCC(C)C ca8739260127424a8aed79b5a5edc01f [0,2,0,0,0,0|1,0,1]=4 5662 B12R0.124 C#C[C@H](CCCCC)OCC(C)C 006f5476cf147329858cfcf9e591bfd7 [0,2,0,0,0,0|1,0,1]=4 5663 B12R0.124 C=CC(CCCCC)OCC(C)C 329bb3d47e23a7badf100f9ea6ac716f [0,2,0,0,0,0|1,0,1]=4 5664 B12R0.124 C=C[C@H](CCCCC)OCC(C)C 9eb379e4ef07a7a23cd4074762430a6a [0,2,0,0,0,0|1,0,1]=4 5665 B12R0.124 CCCCCC(CC)OCC(C)C bfd2768cbcb01d053b5b369b47a0d687 [0,2,0,0,0,0|1,0,1]=4 5666 B12R0.124 CCCCC[C@H](CC)OCC(C)C 17b768f211e4c839599c94a3b1859f9d [0,2,0,0,0,0|1,0,1]=4 5667 B12R0.141 C=C(CC(C)C)C(=O)NCCCC 2ae90c9e9dd31201313dc1d97692942e [0,2,0,0,0,0|2,0,0]=4 5668 B12R0.141 CC(C)CN(C)C(=O)CCCCF e46b70ef140f7fdf445d95f4ff2ef4f7 [0,2,0,0,0,0|2,0,0]=4 5669 B12R0.141 CC(C)CN(C)C(=O)CCCCO 3770100e20842ca318867f5a18015713 [0,2,0,0,0,0|2,0,0]=4 5670 B12R0.141 CC(C)CN(C)C(=O)CCCCS 5c4b946e26887d2c72ff626cd7c49084 [0,2,0,0,0,0|2,0,0]=4 5671 B12R0.141 CC(O)CN(C)C(=O)CCCCF a60481be914cf9da4c66e347d9de2a41 [0,2,0,0,0,0|2,0,0]=4 5672 B12R0.141 CC(O)CN(C)C(=O)CCCCO e90128954e20dfb1a978a2b77c1848e1 [0,2,0,0,0,0|2,0,0]=4 5673 B12R0.141 CC(O)CN(C)C(=O)CCCCS 28ee330cd927b83a836da44bb4881c0c [0,2,0,0,0,0|2,0,0]=4 5674 B12R0.141 CCCCCC(=O)N(C)CC(C)C cee6f6287006f0b0fc8fee0df292e89f [0,2,0,0,0,0|1,0,0]=3 5675 B12R0.141 CCCCCC(=O)N(C)CC(C)O 8f840b5a4381e7181ea3bbce5e42d43a [0,2,0,0,0,0|1,0,0]=3 5676 B12R0.141 CCCCCC(=O)N(C)CC(F)F c371b4042377fb0cc147cf4a2b57ceab [0,2,0,0,0,0|2,0,0]=4 5677 B12R0.141 CCCCCC(=O)N(C)C[C@H](C)O 5fdd2dbb763451e03dd0ab73a92751cc [0,2,0,0,0,0|1,0,0]=3 5678 B12R0.141 CCCCNC(=O)C(=O)CC(C)C 6f51d8bfc45447fb1b182832bed7f314 [0,2,0,0,0,0|2,0,0]=4 5679 B12R0.141 CCCCNC(=O)C(F)CC(C)C 0df80fe98b9a6c32a33493bc6d624c4f [0,2,0,0,0,0|2,0,0]=4 5680 B12R0.141 CCCCNC(=O)C(O)CC(C)C 0815f51e18880e6a021ca4bb4b407b26 [0,2,0,0,0,0|2,0,0]=4 5681 B12R0.141 CCCCNC(=O)N(C)CC(C)C bec2087c562b5406ad644005d91da026 [0,2,0,0,0,0|2,0,0]=4 5682 B12R0.141 CCCCNC(=O)N(C)CC(C)O 68da6f08adcd65ff66bc94f651c9347f [0,2,0,0,0,0|2,0,0]=4 5683 B12R0.141 CCCCNC(=O)N(C)C[C@H](C)O 64463d4e752c46de89713cfc4b7170d4 [0,2,0,0,0,0|2,0,0]=4 5684 B12R0.141 CCCCNC(=O)[C@@H](O)CC(C)C 64a71c35902c9d2faaf8b7c2af20d402 [0,2,0,0,0,0|2,0,0]=4 5685 B12R0.141 CCCCNC(=O)[C@H](O)CC(C)C 1cd4211f57d8ec6d8268f12260d865c9 [0,2,0,0,0,0|2,0,0]=4 5686 B12R0.141 CCCOCC(=O)N(C)CC(C)C a67a273353dbc399d3b38abdf11d95b3 [0,2,0,0,0,0|2,0,0]=4 5687 B12R0.141 CCCOCC(=O)N(C)CC(C)O 72f82cce8aa38364508a80d28a80ea9a [0,2,0,0,0,0|2,0,0]=4 5688 B12R0.141 CCCOCC(=O)N(C)C[C@H](C)O a4b31d7e6f3635570351a039323b8ede [0,2,0,0,0,0|2,0,0]=4 5689 B12R0.141 CCCSCC(=O)N(C)CC(C)C 97f36fc0b461a262ebaf1e0e6bceb958 [0,2,0,0,0,0|2,0,0]=4 5690 B12R0.141 CCCSCC(=O)N(C)CC(C)O 98e4cbf3b7da5635fd5b4258038b2fa4 [0,2,0,0,0,0|2,0,0]=4 5691 B12R0.141 CCCSCC(=O)N(C)C[C@H](C)O 06341096c703385cabd3219da92db750 [0,2,0,0,0,0|2,0,0]=4 5692 B12R0.141 CCOCCC(=O)N(C)CC(C)C 6a1c837768818317da5f9f7564fcde6b [0,2,0,0,0,0|2,0,0]=4 5693 B12R0.141 CCOCCC(=O)N(C)CC(C)O b29244c9da4c4679e9269afa44f19bf3 [0,2,0,0,0,0|2,0,0]=4 5694 B12R0.141 CCOCCC(=O)N(C)C[C@H](C)O 3be3ed148feca6649651673e4828ea52 [0,2,0,0,0,0|2,0,0]=4 5695 B12R0.141 CCSCCC(=O)N(C)CC(C)C 04c08b3d3a3f33d4ec93c1f812001320 [0,2,0,0,0,0|2,0,0]=4 5696 B12R0.141 CCSCCC(=O)N(C)CC(C)O fa50f8ccad47903a608ac1daf1de665d [0,2,0,0,0,0|2,0,0]=4 5697 B12R0.141 CCSCCC(=O)N(C)C[C@H](C)O 0172ef9d8511abd82cdea7db81622c0e [0,2,0,0,0,0|2,0,0]=4 5698 B12R0.141 COCCCC(=O)N(C)CC(C)C 93f3ce36ab741f3a75cc327eae9b2cbd [0,2,0,0,0,0|2,0,0]=4 5699 B12R0.141 COCCCC(=O)N(C)CC(C)O 32105a334480f05b128f4354b0e8706b [0,2,0,0,0,0|2,0,0]=4 5700 B12R0.141 COCCCC(=O)N(C)C[C@H](C)O d391d349c7b161264f3d9629e3c6caba [0,2,0,0,0,0|2,0,0]=4 5701 B12R0.141 CSCCCC(=O)N(C)CC(C)C cb120353711d4648fb7a94cc3afe12ed [0,2,0,0,0,0|2,0,0]=4 5702 B12R0.141 CSCCCC(=O)N(C)CC(C)O 8fae3bf35bb6f308e849fe3abc2ece40 [0,2,0,0,0,0|2,0,0]=4 5703 B12R0.141 CSCCCC(=O)N(C)C[C@H](C)O ac736e5e09ccb6bdd72e576a76c574b8 [0,2,0,0,0,0|2,0,0]=4 5704 B12R0.141 C[C@H](O)CN(C)C(=O)CCCCF 202fd482cd2b14863acf81c56fd6267e [0,2,0,0,0,0|2,0,0]=4 5705 B12R0.141 C[C@H](O)CN(C)C(=O)CCCCO 4f535007c9904ecc4fdb34e9b3268f52 [0,2,0,0,0,0|2,0,0]=4 5706 B12R0.141 C[C@H](O)CN(C)C(=O)CCCCS 1c652f4d78e31ef619decf4acfbbd8d5 [0,2,0,0,0,0|2,0,0]=4 5707 B12R0.142 C#CC(C)NCC(=O)CCCCC d3472eafa3b89be482c9c1560289584e [0,2,0,0,0,0|2,0,0]=4 5708 B12R0.142 C#CC(C)OCC(=O)CCCCC cb25d8277b5eccf6c1b5871c97dc4654 [0,2,0,0,0,0|0,0,2]=4 5709 B12R0.142 C#CCCNC(=O)CCC(C)CC 8a81b79348dc90d502c9a8305d55d967 [0,2,0,0,0,0|1,0,1]=4 5710 B12R0.142 C#C[C@@H](C)NCC(=O)CCCCC 36e88f7244cf201a4512eafdcca30d8c [0,2,0,0,0,0|2,0,0]=4 5711 B12R0.142 C#C[C@@H](C)OCC(=O)CCCCC d2135f3d388121626505c957eaad2056 [0,2,0,0,0,0|0,0,2]=4 5712 B12R0.142 C#C[C@H](C)NCC(=O)CCCCC 71a22bd941b1de4e5744fbe28b4f69d9 [0,2,0,0,0,0|2,0,0]=4 5713 B12R0.142 C#C[C@H](C)OCC(=O)CCCCC 70c12855e8d2d83cd4aa976242eac54f [0,2,0,0,0,0|0,0,2]=4 5714 B12R0.142 C=C(CC)COC(C)CCCCC 1566353bf84cabad66f4e06d820cfcb5 [0,2,0,0,0,0|1,0,1]=4 5715 B12R0.142 C=C(CC)CO[C@@H](C)CCCCC f5fd833be619950059010af27bdb3bdd [0,2,0,0,0,0|1,0,1]=4 5716 B12R0.142 C=C(CC)CO[C@H](C)CCCCC db239a1717e62d69534787bf5f3fd9f1 [0,2,0,0,0,0|1,0,1]=4 5717 B12R0.142 C=CC(C)COC(C)CCCCC 4c0331c21d088d71144d7d6396b14dd6 [0,2,0,0,0,0|1,0,1]=4 5718 B12R0.142 C=CC(C)CO[C@@H](C)CCCCC 38ecb86197d7fb03e9ec565b390ec6a9 [0,2,0,0,0,0|1,0,1]=4 5719 B12R0.142 C=CC(C)NCC(=O)CCCCC 4aa184db4a49d8a63f93ad91f874cba4 [0,2,0,0,0,0|2,0,0]=4 5720 B12R0.142 C=CC(C)OCC(=O)CCCCC 3865d6bdfbc5c1a7342c61cc924165da [0,2,0,0,0,0|0,0,2]=4 5721 B12R0.142 C=CC(O)CNC(=O)CCCCC dc8624bde9285228c86870f975a3bc42 [0,2,0,0,0,0|1,0,1]=4 5722 B12R0.142 C=CCCNC(=O)CCC(C)CC 5f26d5663a385c5bde6c21b198b85b93 [0,2,0,0,0,0|1,0,1]=4 5723 B12R0.142 C=C[C@H](C)OCC(=O)CCCCC aa1688b789abf7af874c29e86e5cfd87 [0,2,0,0,0,0|0,0,2]=4 5724 B12R0.142 CC(C#N)CNC(=O)CCCCF c6c7afea01fc9995928a445b5d2cbfea [0,2,0,0,0,0|2,0,0]=4 5725 B12R0.142 CC(C#N)CNC(=O)CCCCO c3b0fe08e9161048a2a9130cbf7ef0d4 [0,2,0,0,0,0|2,0,0]=4 5726 B12R0.142 CC(C#N)CNC(=O)CCCCS 98c73ae9937b72925bdedebab186327e [0,2,0,0,0,0|2,0,0]=4 5727 B12R0.142 CC(CO)CNC(=O)CCCCF 5ee1748684e4bd21a6d4705e62f8e049 [0,2,0,0,0,0|2,0,0]=4 5728 B12R0.142 CC(CO)CNC(=O)CCCCO ee97c5b74fbb9a34a271b34019d853ac [0,2,0,0,0,0|2,0,0]=4 5729 B12R0.142 CC(CO)CNC(=O)CCCCS c8a572e6e24f2c0d7dcb6f5f898002bf [0,2,0,0,0,0|2,0,0]=4 5730 B12R0.142 CC=CCNC(=O)CCC(C)CC 79f14c5326109a97c062b1166852e550 [0,2,0,0,0,0|1,0,1]=4 5731 B12R0.142 CCC(=O)CCC(=O)NCCCCl 4a2a78bfee2ebd46be3eec2b70a50b42 [0,2,0,0,0,0|1,0,1]=4 5732 B12R0.142 CCC(=O)CCC(=O)NCCCO 30ede28f6ae88ff6d21718b7f3003445 [0,2,0,0,0,0|1,0,1]=4 5733 B12R0.142 CCC(=O)CCC(=O)NCCOC 42fdcefb4f281080a88ed8a83b34294b [0,2,0,0,0,0|1,0,1]=4 5734 B12R0.142 CCC(=O)CCC(=O)NCCSC 619bc9157f81077a11e513302d55dac8 [0,2,0,0,0,0|1,0,1]=4 5735 B12R0.142 CCC(C)CCC(=O)NCCC#N 6bc95499615d2898cb7301203c8462c4 [0,2,0,0,0,0|1,0,1]=4 5736 B12R0.142 CCC(C)CCC(=O)NCCCCl 11f59e0d966d1da079cf9c79fac866d2 [0,2,0,0,0,0|1,0,0]=3 5737 B12R0.142 CCC(C)CCC(=O)NCCCO 04047915962f5ce6992433f71260bad4 [0,2,0,0,0,0|1,0,0]=3 5738 B12R0.142 CCC(C)CCC(=O)NCCOC f2f2855d2ee1328ad0ab1485a2bb4ab1 [0,2,0,0,0,0|1,0,0]=3 5739 B12R0.142 CCC(C)CCC(=O)NCCON 6f8f91b78c53901d3277353c0731cefa [0,2,0,0,0,0|2,0,0]=4 5740 B12R0.142 CCC(C)CCC(=O)NCCSC 3d60e1388ff58844e13371bc20bf0701 [0,2,0,0,0,0|1,0,0]=3 5741 B12R0.142 CCC(C)CCC(C)OCCCF fd2494878e624abe0ea00648af0cbb49 [0,2,0,0,0,0|1,0,1]=4 5742 B12R0.142 CCC(C)CCC(C)OCCCS e5fead569aa0854735f304b4ea52f449 [0,2,0,0,0,0|1,0,1]=4 5743 B12R0.142 CCC(C)CCC(C)OCCOC ceb3b907f7e72eb09590b062057634a4 [0,2,0,0,0,0|1,0,1]=4 5744 B12R0.142 CCC(C)CCC(C)OCCSC b02d3b09ec6a05769ac4652ab69e64fb [0,2,0,0,0,0|1,0,1]=4 5745 B12R0.142 CCC(C)CNC(=O)CCCCF 3c0ce8056ca232af3051c5925f289fdd [0,2,0,0,0,0|2,0,0]=4 5746 B12R0.142 CCC(C)CNC(=O)CCCCO 6cf9b82e2d80ef3060363525b54c893b [0,2,0,0,0,0|2,0,0]=4 5747 B12R0.142 CCC(C)CNC(=O)CCCCS 57b4dbbaecd264dd77e9836c0427f173 [0,2,0,0,0,0|2,0,0]=4 5748 B12R0.142 CCC(C)CNC(=O)CCCOC edab1020b73664716f3b1f6e043a440c [0,2,0,0,0,0|2,0,0]=4 5749 B12R0.142 CCC(C)CNC(=O)CCCSC 9515a5d02e6fc36e1e3178beb5053ae2 [0,2,0,0,0,0|2,0,0]=4 5750 B12R0.142 CCC(C)CNC(=O)COCCO 757f4339bdadc94f95110e98bb101d86 [0,2,0,0,0,0|2,0,0]=4 5751 B12R0.142 CCC(C)CNC(=O)COCCS 7738a776147cc7509f0285ba50646487 [0,2,0,0,0,0|2,0,0]=4 5752 B12R0.142 CCC(C)CNC(=O)NCCCN c93f2943a23a85c98ab5d06152fa9a3f [0,2,0,0,0,0|2,0,0]=4 5753 B12R0.142 CCC(C)CNC(=O)NCCCO 938677493a24ffd179fce9d07eda1432 [0,2,0,0,0,0|2,0,0]=4 5754 B12R0.142 CCC(C)CNC(=O)NCCOC 157500e6484a7be2454940b0b094c72c [0,2,0,0,0,0|2,0,0]=4 5755 B12R0.142 CCC(C)CNC(=O)NCCSC 1da1c1c17f6d068f729242a2ff4c6000 [0,2,0,0,0,0|2,0,0]=4 5756 B12R0.142 CCC(C)NCC(=O)NCCOC 227fd292b0f49840d4dbcbb7c113e23b [0,2,0,0,0,0|2,0,0]=4 5757 B12R0.142 CCC(C)NCC(=O)OCCOC 67ca1988ed7a11e1589a209f48123c1f [0,2,0,0,0,0|1,0,0]=3 5758 B12R0.142 CCC(C)OCC(=O)NCCCCl 693a7f5d7f3da58cf4d8739d11fdeb5f [0,2,0,0,0,0|2,0,0]=4 5759 B12R0.142 CCC(C)OCC(=O)NCCCO 836c74813c7ed8d6b25e66b3a2f50061 [0,2,0,0,0,0|2,0,0]=4 5760 B12R0.142 CCC(C)OCC(=O)NCCOC 02ddabbf5644990d2e6bbce02c4aafd1 [0,2,0,0,0,0|2,0,0]=4 5761 B12R0.142 CCC(C)OCC(=O)NCCSC a07e5039e9aa01efd55fbc0ef9dc1c64 [0,2,0,0,0,0|2,0,0]=4 5762 B12R0.142 CCC(C)OCC(=O)OCCOC 70a593a40f7951b22547711ccf8e9389 [0,2,0,0,0,0|1,0,0]=3 5763 B12R0.142 CCC(O)CNC(=O)CCCCF 17a3b4e9952d144a024b13dfda5b0564 [0,2,0,0,0,0|2,0,0]=4 5764 B12R0.142 CCC(O)CNC(=O)CCCCO 53341d71343323c0b6cf00ceb0d97501 [0,2,0,0,0,0|2,0,0]=4 5765 B12R0.142 CCC(O)CNC(=O)CCCCS b4bf859c0b46b09e02be16d5b6fbe867 [0,2,0,0,0,0|2,0,0]=4 5766 B12R0.142 CCC(O)CNC(=O)CCCOC 25f7025e4ad4b659174762b36267ee4c [0,2,0,0,0,0|2,0,0]=4 5767 B12R0.142 CCC(O)CNC(=O)CCCSC 6b81f298f41c0dff42333c28490d99ef [0,2,0,0,0,0|2,0,0]=4 5768 B12R0.142 CCC(O)CNC(=O)COCCO e8f00afbf22d7cb5b18002eb7e6f1609 [0,2,0,0,0,0|2,0,0]=4 5769 B12R0.142 CCC(O)CNC(=O)COCCS 00c4f9abfd8ee068410f9d60effd8fb7 [0,2,0,0,0,0|2,0,0]=4 5770 B12R0.142 CCC(O)CNC(=O)NCCCN 633758cf8fabb3fbd40d0afe8cf731f2 [0,2,0,0,0,0|2,0,0]=4 5771 B12R0.142 CCC(O)CNC(=O)NCCCO ad4ffd68b83194fe88550043d1be3b26 [0,2,0,0,0,0|2,0,0]=4 5772 B12R0.142 CCC(O)CNC(=O)NCCOC 4159c0af1f273022c06cd1b765972e08 [0,2,0,0,0,0|2,0,0]=4 5773 B12R0.142 CCC(O)CNC(=O)NCCSC a5f3a1e19934ff02e323d208947a55ee [0,2,0,0,0,0|2,0,0]=4 5774 B12R0.142 CCC/C=C/C(=O)NCC(C)CC 93d840147f74133ba735968027da8f58 [0,2,0,0,0,0|2,0,0]=4 5775 B12R0.142 CCC/C=C/C(=O)NCC(O)CC 487c331237168cd5168e4137a25b22fd [0,2,0,0,0,0|2,0,0]=4 5776 B12R0.142 CCC/C=C/C(=O)NC[C@@H](C)CC d7112d3cc11dc8f5e7529066cacd30f7 [0,2,0,0,0,0|2,0,0]=4 5777 B12R0.142 CCC/C=C/C(=O)NC[C@H](O)CC b572a0c85d82fbc4f416a6fb67eddd0d [0,2,0,0,0,0|2,0,0]=4 5778 B12R0.142 CCCC#CC(=O)NCC(C)CC bf3ed12a2ff8d5aefd344372b8aeffc2 [0,2,0,0,0,0|2,0,0]=4 5779 B12R0.142 CCCC#CC(=O)NCC(O)CC 44bed1ebe343dfc25d5857b498356d6e [0,2,0,0,0,0|2,0,0]=4 5780 B12R0.142 CCCC#CC(=O)NC[C@@H](C)CC c537a98cbe86bdafa42387ab3c12af80 [0,2,0,0,0,0|2,0,0]=4 5781 B12R0.142 CCCC#CC(=O)NC[C@H](O)CC ffd196db435e6470ef2e82ce64b345ee [0,2,0,0,0,0|2,0,0]=4 5782 B12R0.142 CCCC=CC(=O)NCC(C)CC df62ab3b27bafbc9ba4a0162fa0550b2 [0,2,0,0,0,0|2,0,0]=4 5783 B12R0.142 CCCC=CC(=O)NCC(O)CC c35a283192bd6a33cc110d638e8cf004 [0,2,0,0,0,0|2,0,0]=4 5784 B12R0.142 CCCC=CC(=O)NC[C@@H](C)CC dcefefe8aaf52bb8657962f0cf0493b5 [0,2,0,0,0,0|2,0,0]=4 5785 B12R0.142 CCCC=CC(=O)NC[C@H](O)CC 1284450cab07e1616e66ff5f591a36ba [0,2,0,0,0,0|2,0,0]=4 5786 B12R0.142 CCCCCC(=O)CNC(C)C#N 91c3356a0bc753e8fc5398acd1beae41 [0,2,0,0,0,0|2,0,0]=4 5787 B12R0.142 CCCCCC(=O)CNC(C)CC 45796e3ae67af7ae1a1a55ddc220157d [0,2,0,0,0,0|1,0,0]=3 5788 B12R0.142 CCCCCC(=O)CNC(C)CO 70a8b0844eacf4985a80de88c7093014 [0,2,0,0,0,0|2,0,0]=4 5789 B12R0.142 CCCCCC(=O)CN[C@@H](C)CC e5da2bcfd027c57b6b040f2c7b866255 [0,2,0,0,0,0|1,0,0]=3 5790 B12R0.142 CCCCCC(=O)CN[C@@H](C)CO 8d43100ebb3fcdd0d5f9775926b8e2f0 [0,2,0,0,0,0|2,0,0]=4 5791 B12R0.142 CCCCCC(=O)CN[C@H](C)CC 46e2367f440f5bdedc29c6c94a2075d8 [0,2,0,0,0,0|1,0,0]=3 5792 B12R0.142 CCCCCC(=O)CN[C@H](C)CO 4b85bc455930ba8f83308f109e3318d4 [0,2,0,0,0,0|2,0,0]=4 5793 B12R0.142 CCCCCC(=O)COC(C)C=O 59bbf26c038ca3e0f066016776789127 [0,2,0,0,0,0|1,0,1]=4 5794 B12R0.142 CCCCCC(=O)COC(C)CC 23192b3ebda64854f286ec1c8f950bdf [0,2,0,0,0,0|0,0,0]=2 5795 B12R0.142 CCCCCC(=O)COC(C)CF bef33e46dcf186b566a391089c6fbf95 [0,2,0,0,0,0|1,0,0]=3 5796 B12R0.142 CCCCCC(=O)COC(C)CS f8fc8fb7d37b7cd558931d0c86ccd404 [0,2,0,0,0,0|1,0,0]=3 5797 B12R0.142 CCCCCC(=O)CO[C@@H](C)CC e1cbac3306adcc53aaeeb6d0184018e2 [0,2,0,0,0,0|0,0,0]=2 5798 B12R0.142 CCCCCC(=O)CO[C@H](C)CC cf8f4dad1628751fbe7598eda14a8308 [0,2,0,0,0,0|0,0,0]=2 5799 B12R0.142 CCCCCC(=O)CO[C@H](C)CS 5e0f66ccb2a22829401008338ceb02fe [0,2,0,0,0,0|1,0,0]=3 5800 B12R0.142 CCCCCC(=O)NCC(=O)NC 437d60b416ffd6d2e7a342119477b04d [0,2,0,0,0,0|1,0,1]=4 5801 B12R0.142 CCCCCC(=O)NCC(=O)OC 7b1aeefd0c2c73fc93cc5c282a4a5d83 [0,2,0,0,0,0|1,0,1]=4 5802 B12R0.142 CCCCCC(=O)NCC(Br)CBr d421f6a4542bf418d2e055420ec4a48c [0,2,0,0,0,0|1,0,0]=3 5803 B12R0.142 CCCCCC(=O)NCC(C)C#N 825fbe168e706444faeb0a77d1814b89 [0,2,0,0,0,0|1,0,0]=3 5804 B12R0.142 CCCCCC(=O)NCC(C)CC 9b0be60c3928075cde25e32a8763441e [0,2,0,0,0,0|1,0,0]=3 5805 B12R0.142 CCCCCC(=O)NCC(C)CO 0b0331f792b9b0044ba5fc927cea45b7 [0,2,0,0,0,0|1,0,0]=3 5806 B12R0.142 CCCCCC(=O)NCC(F)CO 4fd73d4556a5b1260558b88f44c4e6cf [0,2,0,0,0,0|1,0,0]=3 5807 B12R0.142 CCCCCC(=O)NCC(O)CC ef47ec37c0867d69ba11da5584f901f8 [0,2,0,0,0,0|1,0,0]=3 5808 B12R0.142 CCCCCC(=O)NCC(O)CO 9e28802a32aa6bd39fc0fdfb2e6cf3a0 [0,2,0,0,0,0|1,0,0]=3 5809 B12R0.142 CCCCCC(=O)NC[C@@H](C)CC 4214fb11e95546a6e2241fce4676f290 [0,2,0,0,0,0|1,0,0]=3 5810 B12R0.142 CCCCCC(=O)NC[C@@H](C)OC 81fd3f472f5052ba9943be7f5b5ec3a4 [0,2,0,0,0,0|1,0,0]=3 5811 B12R0.142 CCCCCC(=O)NC[C@@H](F)CO 9b73d8bfec22d5d9703b004f5cf7f141 [0,2,0,0,0,0|1,0,0]=3 5812 B12R0.142 CCCCCC(=O)NC[C@@H](O)CO 9e9b643d4f9eced8405337ec2ec0affc [0,2,0,0,0,0|1,0,0]=3 5813 B12R0.142 CCCCCC(=O)NC[C@H](C)CO eceb9effa4dca08259eea0b18cbc2ebd [0,2,0,0,0,0|1,0,0]=3 5814 B12R0.142 CCCCCC(=O)NC[C@H](C)OC 8c063ab6a6b63fe7ee4cda9f25a5ac2b [0,2,0,0,0,0|1,0,0]=3 5815 B12R0.142 CCCCCC(=O)NC[C@H](F)CO aa6cc8788e072906b196eb24c720e7d9 [0,2,0,0,0,0|1,0,0]=3 5816 B12R0.142 CCCCCC(=O)NC[C@H](O)CC 09dd4a91f399b93eb7972495cfd32a39 [0,2,0,0,0,0|1,0,0]=3 5817 B12R0.142 CCCCCC(=O)NC[C@H](O)CO bf0a87956fec6bb1083bd1c0ae569349 [0,2,0,0,0,0|1,0,0]=3 5818 B12R0.142 CCCCCC(=O)OCN(C)CC 2d6c158e513535f65e436195ae49adff [0,2,0,0,0,0|0,0,0]=2 5819 B12R0.142 CCCCCC(C)COC(C)CC 7fae0f7ee26f4e55a77eb6760b855867 [0,2,0,0,0,0|1,0,1]=4 5820 B12R0.142 CCCCCC(C)OCC(=O)CC 1c30785791afb4721027d7aa4535e579 [0,2,0,0,0,0|1,0,1]=4 5821 B12R0.142 CCCCCC(C)OCC(Br)CBr 3194d91b03e77c4091b123b23eb571ab [0,2,0,0,0,0|1,0,1]=4 5822 B12R0.142 CCCCCC(C)OCC(C)C#N 8da03bcb9dd5b75c42ccceeaca13285d [0,2,0,0,0,0|1,0,1]=4 5823 B12R0.142 CCCCCC(C)OCC(C)CC 3d5c8d960dcec653f5679dc099b46b4a [0,2,0,0,0,0|1,0,1]=4 5824 B12R0.142 CCCCCC(C)OCC(C)OC 1a76d45215681a26f3ce2409366a9c37 [0,2,0,0,0,0|1,0,1]=4 5825 B12R0.142 CCCCCC(C)OCC(Cl)CCl 9a3e1fb97b9b026ddffcff0b4ed4c3cb [0,2,0,0,0,0|1,0,1]=4 5826 B12R0.142 CCCCCC(C)OCC(O)CO 939439442524fdd04926be8fa47ec251 [0,2,0,0,0,0|1,0,1]=4 5827 B12R0.142 CCCCCC(C)OCC(S)CS f9cba003c147903ea5e96b2e2d19a736 [0,2,0,0,0,0|1,0,1]=4 5828 B12R0.142 CCCCCC(C)OC[C@@H](C)CC 0aeceaefd472f58dc95b2e6a7d387e7b [0,2,0,0,0,0|1,0,1]=4 5829 B12R0.142 CCCCCC(C)OC[C@@H](C)OC 48a56e00bf0fc81b17e56dff362042da [0,2,0,0,0,0|1,0,1]=4 5830 B12R0.142 CCCCCC(C)OC[C@@H](O)CO bcec9867806cd972c6a1517502080b80 [0,2,0,0,0,0|1,0,1]=4 5831 B12R0.142 CCCCCC(C)OC[C@H](C)CC 779d0a58b48b745d201de827482e0547 [0,2,0,0,0,0|1,0,1]=4 5832 B12R0.142 CCCCCC(C)OC[C@H](C)OC de2e2f20abfff2209775c9c6ab91d621 [0,2,0,0,0,0|1,0,1]=4 5833 B12R0.142 CCCCCC(C)OC[C@H](O)CO 9874c68408b871b6dcf15a92f685557a [0,2,0,0,0,0|1,0,1]=4 5834 B12R0.142 CCCCC[C@@H](C)OCC(=O)CC a84236230bdc968089833c76504ec058 [0,2,0,0,0,0|1,0,1]=4 5835 B12R0.142 CCCCC[C@@H](C)OCC(C)C#N 77f61b171cfe74c345ce57f807ab003f [0,2,0,0,0,0|1,0,1]=4 5836 B12R0.142 CCCCC[C@@H](C)OCC(C)CC 28ed756d47ebf08714150d2fdd2ce5fd [0,2,0,0,0,0|1,0,1]=4 5837 B12R0.142 CCCCC[C@@H](C)OCC(C)OC cd493dc745121ac4a7bc3c0ea4f4f475 [0,2,0,0,0,0|1,0,1]=4 5838 B12R0.142 CCCCC[C@@H](C)OCC(O)CO 61e8730d2273ec658516681bfbefbf25 [0,2,0,0,0,0|1,0,1]=4 5839 B12R0.142 CCCCC[C@@H](C)OC[C@@H](C)CC 7f64dc36c9d8d63a6853245b291b70f0 [0,2,0,0,0,0|1,0,1]=4 5840 B12R0.142 CCCCC[C@@H](C)OC[C@@H](C)OC 1200dc6906c58d8f90242f63488a5b4e [0,2,0,0,0,0|1,0,1]=4 5841 B12R0.142 CCCCC[C@@H](C)OC[C@@H](O)CO 70e75339a11762397c1f5992be32ea32 [0,2,0,0,0,0|1,0,1]=4 5842 B12R0.142 CCCCC[C@@H](C)OC[C@H](C)CC 47941fff3d162c067c85dc0a7c59e6c5 [0,2,0,0,0,0|1,0,1]=4 5843 B12R0.142 CCCCC[C@@H](C)OC[C@H](C)OC 80cf78460cffc25830cee58c27f039a4 [0,2,0,0,0,0|1,0,1]=4 5844 B12R0.142 CCCCC[C@@H](C)OC[C@H](O)CO e7e91cb46ffbf9f4543f0510dcdf0852 [0,2,0,0,0,0|1,0,1]=4 5845 B12R0.142 CCCCC[C@H](C)OCC(=O)CC 535ebec0591b84fab7d612a812393cc2 [0,2,0,0,0,0|1,0,1]=4 5846 B12R0.142 CCCCC[C@H](C)OCC(Br)CBr 3d241d2511b8d35787165181e47134e7 [0,2,0,0,0,0|1,0,1]=4 5847 B12R0.142 CCCCC[C@H](C)OCC(C)C#N e334ea57ebb027ecf5684ad6afd08ca1 [0,2,0,0,0,0|1,0,1]=4 5848 B12R0.142 CCCCC[C@H](C)OCC(C)CC 0f7ce1882dc5e8f4d454480e793b924d [0,2,0,0,0,0|1,0,1]=4 5849 B12R0.142 CCCCC[C@H](C)OCC(C)OC 922cb46ea378502fed16ee171995c2d0 [0,2,0,0,0,0|1,0,1]=4 5850 B12R0.142 CCCCC[C@H](C)OCC(Cl)CCl 3c659d30d2cc011a8aaa6e203d7d8f12 [0,2,0,0,0,0|1,0,1]=4 5851 B12R0.142 CCCCC[C@H](C)OCC(O)CO 2b1976259f8a26fb9d0046ef077576ad [0,2,0,0,0,0|1,0,1]=4 5852 B12R0.142 CCCCC[C@H](C)OCC(S)CS 913e33fdc5c0323f8606f1caf27a4a5c [0,2,0,0,0,0|1,0,1]=4 5853 B12R0.142 CCCCC[C@H](C)OC[C@@H](C)CC f59bb34eedd7b64e352465f9f9c374f3 [0,2,0,0,0,0|1,0,1]=4 5854 B12R0.142 CCCCC[C@H](C)OC[C@@H](C)OC 3b47b1e7ef36dc396e2443107b7b0abf [0,2,0,0,0,0|1,0,1]=4 5855 B12R0.142 CCCCC[C@H](C)OC[C@@H](O)CO 8ecc27360ed64de3e5fde7a5b2b98bfb [0,2,0,0,0,0|1,0,1]=4 5856 B12R0.142 CCCCC[C@H](C)OC[C@H](C)CC ae409f441be78edf2c190e8be984843e [0,2,0,0,0,0|1,0,1]=4 5857 B12R0.142 CCCCC[C@H](C)OC[C@H](C)OC 296f56ed7c7421117da9976fa6c11be1 [0,2,0,0,0,0|1,0,1]=4 5858 B12R0.142 CCCCC[C@H](C)OC[C@H](O)CO 2b55fc353ce662cac1a368c4df08f710 [0,2,0,0,0,0|1,0,1]=4 5859 B12R0.142 CCCCNC(=O)CCC(=O)CC 478ee058ae71209e4fbd30a1cd041a34 [0,2,0,0,0,0|1,0,1]=4 5860 B12R0.142 CCCCNC(=O)CCC(C)CC 5a76dad5a9c89e4d1e391aa5fb2e1da8 [0,2,0,0,0,0|1,0,0]=3 5861 B12R0.142 CCCCNC(=O)CCN(C)CC ad00bced020ed89d076e057205bda2a8 [0,2,0,0,0,0|2,0,0]=4 5862 B12R0.142 CCCCNC(=O)CCS(=O)CC 69433fb2ea8e2e7675b52a6dbfc915ea [0,2,0,0,0,0|2,0,0]=4 5863 B12R0.142 CCCCNC(=O)CNC(C)CC 85c7c38442868dd4a5f53a7c0af9b60f [0,2,0,0,0,0|2,0,0]=4 5864 B12R0.142 CCCCNC(=O)CN[C@@H](C)CC 051d51bc1b1e807354b1e19ef29f8a38 [0,2,0,0,0,0|2,0,0]=4 5865 B12R0.142 CCCCNC(=O)CN[C@H](C)CC c6649393d5a530efee61ef960fdc8421 [0,2,0,0,0,0|2,0,0]=4 5866 B12R0.142 CCCCNC(=O)COC(C)CC 365df64d33ddab8a83aabf259026da00 [0,2,0,0,0,0|1,0,0]=3 5867 B12R0.142 CCCCNC(=O)COC(C)CF 6fe8c1aaa8590b56a6d048249885f727 [0,2,0,0,0,0|2,0,0]=4 5868 B12R0.142 CCCCNC(=O)COC(C)CS 8b030ce7d069b13b264e3e219f7db389 [0,2,0,0,0,0|2,0,0]=4 5869 B12R0.142 CCCCNC(=O)CO[C@@H](C)CC 3c88b15e3b373c517a809ef36593a2fa [0,2,0,0,0,0|1,0,0]=3 5870 B12R0.142 CCCCNC(=O)CO[C@H](C)CC c35364bd6ec63c6465c149e9e73ba81c [0,2,0,0,0,0|1,0,0]=3 5871 B12R0.142 CCCCNC(=O)CO[C@H](C)CS e93ee87026b53f832158c7d9be2a7de6 [0,2,0,0,0,0|2,0,0]=4 5872 B12R0.142 CCCCNC(=O)NCC(C)C#N 03efb758c738c1223093e32bf6ac3691 [0,2,0,0,0,0|2,0,0]=4 5873 B12R0.142 CCCCNC(=O)NCC(C)CC 91e573323eec31987efada8367827405 [0,2,0,0,0,0|2,0,0]=4 5874 B12R0.142 CCCCNC(=O)NCC(C)CN 7dbee09fad3d978f62d0a7d865f1ad3f [0,2,0,0,0,0|2,0,0]=4 5875 B12R0.142 CCCCNC(=O)NCC(C)CO 616c4a15572e716ffb1b2483a0acb4d1 [0,2,0,0,0,0|2,0,0]=4 5876 B12R0.142 CCCCNC(=O)NCC(F)CO c9146d6732543d54bc5721eec41ad17e [0,2,0,0,0,0|2,0,0]=4 5877 B12R0.142 CCCCNC(=O)NCC(O)CC 476b1859ec186e9effa1e4fb2904b2ff [0,2,0,0,0,0|2,0,0]=4 5878 B12R0.142 CCCCNC(=O)NCC(O)CN eb3f8308bc34d17091407e73676a4ec1 [0,2,0,0,0,0|2,0,0]=4 5879 B12R0.142 CCCCNC(=O)NCC(O)CO d56b60da445e87b0eb326289ba0f8e1a [0,2,0,0,0,0|2,0,0]=4 5880 B12R0.142 CCCCNC(=O)NC[C@@H](C)CC c9ad329ac6245b145b26aac4bd03b414 [0,2,0,0,0,0|2,0,0]=4 5881 B12R0.142 CCCCNC(=O)NC[C@@H](C)OC c18b4149eab9bda98a8110ba51b0b4d9 [0,2,0,0,0,0|2,0,0]=4 5882 B12R0.142 CCCCNC(=O)NC[C@@H](F)CO 9a1512fd34c87c99be81d9035c66ee75 [0,2,0,0,0,0|2,0,0]=4 5883 B12R0.142 CCCCNC(=O)NC[C@@H](O)CO 71a6849627a19413c47cd27c29bd90f7 [0,2,0,0,0,0|2,0,0]=4 5884 B12R0.142 CCCCNC(=O)NC[C@H](C)CO 9768ac5085a3a027ef8eb9432cae8d06 [0,2,0,0,0,0|2,0,0]=4 5885 B12R0.142 CCCCNC(=O)NC[C@H](C)OC 36fa881084bf43d898e4b7b8f9aacdba [0,2,0,0,0,0|2,0,0]=4 5886 B12R0.142 CCCCNC(=O)NC[C@H](F)CO 25ba984505b98da437d9a7254e40fc72 [0,2,0,0,0,0|2,0,0]=4 5887 B12R0.142 CCCCNC(=O)NC[C@H](O)CC 0a1612080944d454ebdf816a41e91fa1 [0,2,0,0,0,0|2,0,0]=4 5888 B12R0.142 CCCCNC(=O)NC[C@H](O)CO 5e39e202860a9dd7b8950e6179799568 [0,2,0,0,0,0|2,0,0]=4 5889 B12R0.142 CCCCOC(=O)CNC(C)CC 68086417e0a9853aa9e9b96ad188c27d [0,2,0,0,0,0|1,0,0]=3 5890 B12R0.142 CCCCOC(=O)CNC(C)CO 39bd6db7f3ec2f6ce31021ff5d06daa5 [0,2,0,0,0,0|2,0,0]=4 5891 B12R0.142 CCCCOC(=O)CN[C@@H](C)CC e262a897f7fd88de3b1398fd2bd9d879 [0,2,0,0,0,0|1,0,0]=3 5892 B12R0.142 CCCCOC(=O)CN[C@@H](C)CO 0068fa15c25f7b6b381b6edf9c8b8608 [0,2,0,0,0,0|2,0,0]=4 5893 B12R0.142 CCCCOC(=O)CN[C@H](C)CC bdbd5c513adef82acf454ed608b29605 [0,2,0,0,0,0|1,0,0]=3 5894 B12R0.142 CCCCOC(=O)CN[C@H](C)CO aeff34fa97700cad6008178709e820a0 [0,2,0,0,0,0|2,0,0]=4 5895 B12R0.142 CCCCOC(=O)COC(C)CC 0c44cc48e8f02c98cc913328a03e89ca [0,2,0,0,0,0|1,0,0]=3 5896 B12R0.142 CCCCOC(=O)COC(C)CF a4dde8265ec18a5d812ee8e73e2804b7 [0,2,0,0,0,0|2,0,0]=4 5897 B12R0.142 CCCCOC(=O)COC(C)CS 4fffe3fb1664aa63d1f12b2957f98bfc [0,2,0,0,0,0|2,0,0]=4 5898 B12R0.142 CCCCOC(=O)CO[C@@H](C)CC 5218594d191bbb6f92d43dca43e20085 [0,2,0,0,0,0|1,0,0]=3 5899 B12R0.142 CCCCOC(=O)CO[C@H](C)CC b5cd214eb588cbd0ec7fd7607db9682c [0,2,0,0,0,0|1,0,0]=3 5900 B12R0.142 CCCCOC(=O)CO[C@H](C)CS fcbdb49bac8baa9a031fd1b3fb457794 [0,2,0,0,0,0|2,0,0]=4 5901 B12R0.142 CCCCOC(=O)OCN(C)CC 70ef2e1c071837166acf1c37ba6a5c6e [0,2,0,0,0,0|1,0,0]=3 5902 B12R0.142 CCCCOC(C)CCC(C)CC 682c30109e407c6fb19c308436a79163 [0,2,0,0,0,0|1,0,1]=4 5903 B12R0.142 CCCNCC(=O)NCC(O)CO 8b23e5b7731ff0a0dc7683cdb475c850 [0,2,0,0,0,0|2,0,0]=4 5904 B12R0.142 CCCOCC(=O)CCC(=O)OC 2df3188468ccdc6ae119bf823d29d84d [0,2,0,0,0,0|1,0,1]=4 5905 B12R0.142 CCCOCC(=O)NCC(Br)CBr d830b08a40ab9ba9b147f2829fa5568c [0,2,0,0,0,0|2,0,0]=4 5906 B12R0.142 CCCOCC(=O)NCC(C)C#N 60f383eb31994b077e073edab0ec22b6 [0,2,0,0,0,0|2,0,0]=4 5907 B12R0.142 CCCOCC(=O)NCC(C)CC d009a18ceaa8121921b70982509bf595 [0,2,0,0,0,0|1,0,0]=3 5908 B12R0.142 CCCOCC(=O)NCC(C)CO ffc83ac0f6354c8426040777a3cbb622 [0,2,0,0,0,0|2,0,0]=4 5909 B12R0.142 CCCOCC(=O)NCC(F)CO 175e10e18fcb604b27fab3489c28d4c0 [0,2,0,0,0,0|2,0,0]=4 5910 B12R0.142 CCCOCC(=O)NCC(O)CC 193b83afaa63c3f61b698b98913c33d5 [0,2,0,0,0,0|1,0,0]=3 5911 B12R0.142 CCCOCC(=O)NCC(O)CO 77ae1967c42b284a9dcf8c4283b2ad9a [0,2,0,0,0,0|2,0,0]=4 5912 B12R0.142 CCCOCC(=O)NC[C@@H](C)CC 813ef707e126202b90f0b5f47afe5193 [0,2,0,0,0,0|1,0,0]=3 5913 B12R0.142 CCCOCC(=O)NC[C@@H](C)OC 7982f959f7c0133738e541f9433b565d [0,2,0,0,0,0|2,0,0]=4 5914 B12R0.142 CCCOCC(=O)NC[C@@H](F)CO 0785db6857d5fa9a683d36b5dd20142c [0,2,0,0,0,0|2,0,0]=4 5915 B12R0.142 CCCOCC(=O)NC[C@@H](O)CO d41ef7690614d447b6a2ce9453598829 [0,2,0,0,0,0|2,0,0]=4 5916 B12R0.142 CCCOCC(=O)NC[C@H](C)CO a4b8142101bdd03cabc685119bb38735 [0,2,0,0,0,0|2,0,0]=4 5917 B12R0.142 CCCOCC(=O)NC[C@H](C)OC b87901a5fa417500648806d3ed00dd65 [0,2,0,0,0,0|2,0,0]=4 5918 B12R0.142 CCCOCC(=O)NC[C@H](F)CO ba2507edc92b3347109b12efa0da98d1 [0,2,0,0,0,0|2,0,0]=4 5919 B12R0.142 CCCOCC(=O)NC[C@H](O)CC 1c5c1929dffffe84f3643c2a336d9b26 [0,2,0,0,0,0|1,0,0]=3 5920 B12R0.142 CCCOCC(=O)NC[C@H](O)CO eef47f5f574133cba6694081a5a9618e [0,2,0,0,0,0|2,0,0]=4 5921 B12R0.142 CCCOCC(C)CCC(C)CC 8941abbdc57621f39e551627046d948b [0,2,0,0,0,0|1,0,1]=4 5922 B12R0.142 CCCSCC(=O)NCC(Br)CBr dffd6c830bc640b070cc155e8f891266 [0,2,0,0,0,0|2,0,0]=4 5923 B12R0.142 CCCSCC(=O)NCC(C)C#N 047857dd568dc0934e164ef7c8bd76ca [0,2,0,0,0,0|2,0,0]=4 5924 B12R0.142 CCCSCC(=O)NCC(C)CC 2c69520cd1741ac252b5cb87f6245de0 [0,2,0,0,0,0|1,1,0]=4 5925 B12R0.142 CCCSCC(=O)NCC(C)CO a478f223ee919376511ff3ad4b4f43d3 [0,2,0,0,0,0|2,0,0]=4 5926 B12R0.142 CCCSCC(=O)NCC(F)CO cae513c3508f24e2ba4991a4a536d58f [0,2,0,0,0,0|2,0,0]=4 5927 B12R0.142 CCCSCC(=O)NCC(O)CC 1dadb1218852f8d1c09d82b2994ab431 [0,2,0,0,0,0|1,1,0]=4 5928 B12R0.142 CCCSCC(=O)NCC(O)CO 1418183125f2592627ea9cd0dc55aef6 [0,2,0,0,0,0|2,0,0]=4 5929 B12R0.142 CCCSCC(=O)NC[C@@H](C)CC cc10c1be3695e1a4c22fc1dd9ee9eb85 [0,2,0,0,0,0|1,1,0]=4 5930 B12R0.142 CCCSCC(=O)NC[C@@H](C)OC 896090131538f9b0ee454c99a7823409 [0,2,0,0,0,0|2,0,0]=4 5931 B12R0.142 CCCSCC(=O)NC[C@@H](F)CO 5a818a5a439f6a43cf95b82c04485329 [0,2,0,0,0,0|2,0,0]=4 5932 B12R0.142 CCCSCC(=O)NC[C@@H](O)CO 4e5a3941beceab7fcc34823c062cd789 [0,2,0,0,0,0|2,0,0]=4 5933 B12R0.142 CCCSCC(=O)NC[C@H](C)CO 887810a7849c5d9e9c35ea7e3783103c [0,2,0,0,0,0|2,0,0]=4 5934 B12R0.142 CCCSCC(=O)NC[C@H](C)OC 671147704c08430b3c6f7dbd440bed2d [0,2,0,0,0,0|2,0,0]=4 5935 B12R0.142 CCCSCC(=O)NC[C@H](F)CO f74a536c453af3df8df57f4e5d3b3004 [0,2,0,0,0,0|2,0,0]=4 5936 B12R0.142 CCCSCC(=O)NC[C@H](O)CC 6ab0a6ef1ad1a6cf4e21dc024e0469e7 [0,2,0,0,0,0|1,1,0]=4 5937 B12R0.142 CCCSCC(=O)NC[C@H](O)CO a606e3b57c0771f39bdc50137cc761f4 [0,2,0,0,0,0|2,0,0]=4 5938 B12R0.142 CCN(C)CCC(=O)NCCCCl 5283498e3619655d544776a5f85f7224 [0,2,0,0,0,0|2,0,0]=4 5939 B12R0.142 CCN(C)CCC(=O)NCCCO 5e2a4ef17cce8a7a9a42d941a4d91d3f [0,2,0,0,0,0|2,0,0]=4 5940 B12R0.142 CCN(C)CCC(=O)NCCOC b4a34edf0183dd240c9a60bff78abb34 [0,2,0,0,0,0|2,0,0]=4 5941 B12R0.142 CCN(C)CCC(=O)NCCSC 685e62010cdc509265cd411ea09460bd [0,2,0,0,0,0|2,0,0]=4 5942 B12R0.142 CCOCCC(=O)NCC(Br)CBr 466f05194ed6c7334ba2dfae2aa0cbbb [0,2,0,0,0,0|2,0,0]=4 5943 B12R0.142 CCOCCC(=O)NCC(C)C#N 4f231c3de29994b9ced4fc9caac828ab [0,2,0,0,0,0|2,0,0]=4 5944 B12R0.142 CCOCCC(=O)NCC(C)CC d85f958f8868696af5361eb46cbded9e [0,2,0,0,0,0|2,0,0]=4 5945 B12R0.142 CCOCCC(=O)NCC(C)CO 6370283f59c158009fb677af2dc86bf8 [0,2,0,0,0,0|2,0,0]=4 5946 B12R0.142 CCOCCC(=O)NCC(F)CO 461ab9c288018906117475801222c203 [0,2,0,0,0,0|2,0,0]=4 5947 B12R0.142 CCOCCC(=O)NCC(O)CC 1a817c200dbb9e38868110ef2ab57555 [0,2,0,0,0,0|2,0,0]=4 5948 B12R0.142 CCOCCC(=O)NCC(O)CO 435c0df8c9911c832d55c92bcadc19fd [0,2,0,0,0,0|2,0,0]=4 5949 B12R0.142 CCOCCC(=O)NC[C@@H](C)CC 22c178f4c992786b1e43d45d903cdff1 [0,2,0,0,0,0|2,0,0]=4 5950 B12R0.142 CCOCCC(=O)NC[C@@H](C)OC 5b48c754d695d90f7deabb00dbd01963 [0,2,0,0,0,0|2,0,0]=4 5951 B12R0.142 CCOCCC(=O)NC[C@@H](F)CO e755023fcd251da6a1fc9410241418e6 [0,2,0,0,0,0|2,0,0]=4 5952 B12R0.142 CCOCCC(=O)NC[C@@H](O)CO 14e7ab978ece5f1890013aab742d749d [0,2,0,0,0,0|2,0,0]=4 5953 B12R0.142 CCOCCC(=O)NC[C@H](C)CO e182454706fb8d0ead400aaaf5a9d7aa [0,2,0,0,0,0|2,0,0]=4 5954 B12R0.142 CCOCCC(=O)NC[C@H](C)OC 79b996da13e62fc602c48e7be4d87e98 [0,2,0,0,0,0|2,0,0]=4 5955 B12R0.142 CCOCCC(=O)NC[C@H](F)CO a21dc379e10b1918b47784f1a2182d0d [0,2,0,0,0,0|2,0,0]=4 5956 B12R0.142 CCOCCC(=O)NC[C@H](O)CC d7cc7e270a41a38f7c2afdba6182b56d [0,2,0,0,0,0|2,0,0]=4 5957 B12R0.142 CCOCCC(=O)NC[C@H](O)CO 2806c45fe69ae453ea2ce80f8b1c68a3 [0,2,0,0,0,0|2,0,0]=4 5958 B12R0.142 CCS(=O)CCC(=O)NCCCCl 88a0971c8dc0ad94471b7312bacf7853 [0,2,0,0,0,0|2,0,0]=4 5959 B12R0.142 CCS(=O)CCC(=O)NCCCO fd87996a112c592f948d27e64076940f [0,2,0,0,0,0|2,0,0]=4 5960 B12R0.142 CCS(=O)CCC(=O)NCCOC 09db520e8f5ee910876de7aa11e84ea6 [0,2,0,0,0,0|2,0,0]=4 5961 B12R0.142 CCS(=O)CCC(=O)NCCSC ca7917b86351dd7a19142cbabc897735 [0,2,0,0,0,0|2,0,0]=4 5962 B12R0.142 CCSCCC(=O)NCC(Br)CBr f29059fd19c87b86260ce72caeb3e46c [0,2,0,0,0,0|2,0,0]=4 5963 B12R0.142 CCSCCC(=O)NCC(C)C#N 24f816d594afb6f9ac57e463b9af00bb [0,2,0,0,0,0|2,0,0]=4 5964 B12R0.142 CCSCCC(=O)NCC(C)CC d42d477ce5253cb012f3e6040ddbabf6 [0,2,0,0,0,0|2,0,0]=4 5965 B12R0.142 CCSCCC(=O)NCC(C)CO cf8549fbda4a3733b272ff9591814c46 [0,2,0,0,0,0|2,0,0]=4 5966 B12R0.142 CCSCCC(=O)NCC(F)CO ff456c84eb997cc8e1d773cc240f7bfa [0,2,0,0,0,0|2,0,0]=4 5967 B12R0.142 CCSCCC(=O)NCC(O)CC 396c47f71da7704f34e050e139e5e064 [0,2,0,0,0,0|2,0,0]=4 5968 B12R0.142 CCSCCC(=O)NCC(O)CO be3a64d056b920c98ce4dc4fc25131ca [0,2,0,0,0,0|2,0,0]=4 5969 B12R0.142 CCSCCC(=O)NC[C@@H](C)CC aea12cd3b40bd40fa7d78967ae73905e [0,2,0,0,0,0|2,0,0]=4 5970 B12R0.142 CCSCCC(=O)NC[C@@H](C)OC 0b51ab75c075d376bf59e2690eebdecb [0,2,0,0,0,0|2,0,0]=4 5971 B12R0.142 CCSCCC(=O)NC[C@@H](F)CO 5805b72e50a28e0a19ba820d21ac5da3 [0,2,0,0,0,0|2,0,0]=4 5972 B12R0.142 CCSCCC(=O)NC[C@@H](O)CO 6c39b65e48336728ba7c2a1fae31f579 [0,2,0,0,0,0|2,0,0]=4 5973 B12R0.142 CCSCCC(=O)NC[C@H](C)CO 37369c494938eef45c26b877a661dc2c [0,2,0,0,0,0|2,0,0]=4 5974 B12R0.142 CCSCCC(=O)NC[C@H](C)OC 88bbec727bdeaf3b2ec1d00f1a5dd07f [0,2,0,0,0,0|2,0,0]=4 5975 B12R0.142 CCSCCC(=O)NC[C@H](F)CO e8fba4bc1f6e80b75c633f58f533a14e [0,2,0,0,0,0|2,0,0]=4 5976 B12R0.142 CCSCCC(=O)NC[C@H](O)CC 76f607dfc3eabd329b901706ef6e249b [0,2,0,0,0,0|2,0,0]=4 5977 B12R0.142 CCSCCC(=O)NC[C@H](O)CO c1fe18b5eee9f1d3e4a3491167634f4c [0,2,0,0,0,0|2,0,0]=4 5978 B12R0.142 CC[C@@H](C)NCC(=O)NCCOC acf410ae664496710bc3c48932fafde5 [0,2,0,0,0,0|2,0,0]=4 5979 B12R0.142 CC[C@@H](C)NCC(=O)OCCOC 095a3f7eb4ec45d6bbd5dbd54e2c4d65 [0,2,0,0,0,0|1,0,0]=3 5980 B12R0.142 CC[C@@H](C)OCC(=O)NCCOC ac13157c6778f9522f2f94b63922e970 [0,2,0,0,0,0|2,0,0]=4 5981 B12R0.142 CC[C@@H](C)OCC(=O)OCCOC f8f4a5f0f2d44075acca53c62d792b42 [0,2,0,0,0,0|1,0,0]=3 5982 B12R0.142 CC[C@@H](O)CNC(=O)CCCCF 96b3352540bb2be44ceeb3facb211201 [0,2,0,0,0,0|2,0,0]=4 5983 B12R0.142 CC[C@@H](O)CNC(=O)CCCCO d84904efe298e371f148f8ee4ad0ce21 [0,2,0,0,0,0|2,0,0]=4 5984 B12R0.142 CC[C@@H](O)CNC(=O)CCCCS 87c35b4424cececf51e2b4ddb9963467 [0,2,0,0,0,0|2,0,0]=4 5985 B12R0.142 CC[C@@H](O)CNC(=O)CCCOC 57f03abb42eda349051382e05938e45b [0,2,0,0,0,0|2,0,0]=4 5986 B12R0.142 CC[C@@H](O)CNC(=O)CCCSC 21c7f0e29bba3651061598542187d984 [0,2,0,0,0,0|2,0,0]=4 5987 B12R0.142 CC[C@@H](O)CNC(=O)COCCO 21d741c483cde004a8faed8ff2d85211 [0,2,0,0,0,0|2,0,0]=4 5988 B12R0.142 CC[C@@H](O)CNC(=O)COCCS 53882b4cf8769c449edf0f423e287a95 [0,2,0,0,0,0|2,0,0]=4 5989 B12R0.142 CC[C@@H](O)CNC(=O)NCCCN a5268d50e5ff34f7822b4b3a5ba842f0 [0,2,0,0,0,0|2,0,0]=4 5990 B12R0.142 CC[C@@H](O)CNC(=O)NCCCO 70ebfd76972875d62816692c53fe4642 [0,2,0,0,0,0|2,0,0]=4 5991 B12R0.142 CC[C@@H](O)CNC(=O)NCCOC 3b9ec5758ac22f1d2e8ce4d2ceb2a795 [0,2,0,0,0,0|2,0,0]=4 5992 B12R0.142 CC[C@@H](O)CNC(=O)NCCSC 9e56523592e75fcc391d4753b2ff3f9a [0,2,0,0,0,0|2,0,0]=4 5993 B12R0.142 CC[C@H](C)CNC(=O)CCCCF 2136f5149b2fb27167444bdcdb2339d5 [0,2,0,0,0,0|2,0,0]=4 5994 B12R0.142 CC[C@H](C)CNC(=O)CCCCO 6141f44308d5afa11069cd6ea692986b [0,2,0,0,0,0|2,0,0]=4 5995 B12R0.142 CC[C@H](C)CNC(=O)CCCCS a83d8cdab1c757ce73a8712d3e24ea4c [0,2,0,0,0,0|2,0,0]=4 5996 B12R0.142 CC[C@H](C)CNC(=O)CCCOC 0265224feeca4a50f5d453a20bbfbd52 [0,2,0,0,0,0|2,0,0]=4 5997 B12R0.142 CC[C@H](C)CNC(=O)CCCSC aa4d521b0609fdde73a485581093e435 [0,2,0,0,0,0|2,0,0]=4 5998 B12R0.142 CC[C@H](C)CNC(=O)COCCO 635971356d13db093f288809b0c42793 [0,2,0,0,0,0|2,0,0]=4 5999 B12R0.142 CC[C@H](C)CNC(=O)COCCS 9bb89d034af64785991a7468d8eef62c [0,2,0,0,0,0|2,0,0]=4 6000 B12R0.142 CC[C@H](C)CNC(=O)NCCCN e5bf6a31f4ae71505a7a1c7e6941d0c0 [0,2,0,0,0,0|2,0,0]=4 6001 B12R0.142 CC[C@H](C)CNC(=O)NCCCO 951bad82537c18e87675c82fbb30d18d [0,2,0,0,0,0|2,0,0]=4 6002 B12R0.142 CC[C@H](C)CNC(=O)NCCOC c93005cf55710394e582087883274150 [0,2,0,0,0,0|2,0,0]=4 6003 B12R0.142 CC[C@H](C)CNC(=O)NCCSC d470a54919ffdf38d8c5c50c466baddf [0,2,0,0,0,0|2,0,0]=4 6004 B12R0.142 CC[C@H](C)NCC(=O)NCCOC 522dfa960b81a83dbc9bf45415962d5f [0,2,0,0,0,0|2,0,0]=4 6005 B12R0.142 CC[C@H](C)NCC(=O)OCCOC 1dff63112bab0b1510f1e228f6960070 [0,2,0,0,0,0|1,0,0]=3 6006 B12R0.142 CC[C@H](C)OCC(=O)NCCOC 04e6a47c93c1e25595d72c271c09eb01 [0,2,0,0,0,0|2,0,0]=4 6007 B12R0.142 CC[C@H](C)OCC(=O)OCCOC 1da2875505c21dfceec966ab51685b86 [0,2,0,0,0,0|1,0,0]=3 6008 B12R0.142 COCCCC(=O)NCC(Br)CBr a8b26c26e89dfc0a168ce498cdc7f224 [0,2,0,0,0,0|2,0,0]=4 6009 B12R0.142 COCCCC(=O)NCC(C)C#N d6da240ec0c5694210dd74338ed37e89 [0,2,0,0,0,0|2,0,0]=4 6010 B12R0.142 COCCCC(=O)NCC(C)CO 29d39203542f3ef1f076d57f34ef035f [0,2,0,0,0,0|2,0,0]=4 6011 B12R0.142 COCCCC(=O)NCC(F)CO 13bd79b4a95db13fdf73842c988484ef [0,2,0,0,0,0|2,0,0]=4 6012 B12R0.142 COCCCC(=O)NCC(O)CO c9ab1656f2e1814722654762857aae28 [0,2,0,0,0,0|2,0,0]=4 6013 B12R0.142 COCCCC(=O)NC[C@@H](C)OC 9a18e88c83af9403d0bb4c8dcb40de70 [0,2,0,0,0,0|2,0,0]=4 6014 B12R0.142 COCCCC(=O)NC[C@@H](F)CO d88a86fad6c4224e58e0bce8ce24b4d0 [0,2,0,0,0,0|2,0,0]=4 6015 B12R0.142 COCCCC(=O)NC[C@@H](O)CO be5d621da8fa6953a260f6740a9dd719 [0,2,0,0,0,0|2,0,0]=4 6016 B12R0.142 COCCCC(=O)NC[C@H](C)CO 3ce760c357cef962a5d3f105555a55f8 [0,2,0,0,0,0|2,0,0]=4 6017 B12R0.142 COCCCC(=O)NC[C@H](C)OC f87658bb58a97b9a82f50ef84f842190 [0,2,0,0,0,0|2,0,0]=4 6018 B12R0.142 COCCCC(=O)NC[C@H](F)CO 471db94e3e7a2624ad3e942959d7ef63 [0,2,0,0,0,0|2,0,0]=4 6019 B12R0.142 COCCCC(=O)NC[C@H](O)CO e62fc8c2290dd0d5c4aa3202ead8af97 [0,2,0,0,0,0|2,0,0]=4 6020 B12R0.142 COCCOC(=O)CNC(C)CO 045ba29551e2f67033f479aa04237b33 [0,2,0,0,0,0|2,0,0]=4 6021 B12R0.142 COCCOC(=O)CN[C@@H](C)CO 81b0954a6012b5ff3fab009c32d64d86 [0,2,0,0,0,0|2,0,0]=4 6022 B12R0.142 COCCOC(=O)CN[C@H](C)CO 4f3fd9c50b45d02beefe761fc38da416 [0,2,0,0,0,0|2,0,0]=4 6023 B12R0.142 COCCOC(=O)COC(C)CF 1bde21ac3eed4b5ba68e204b85313478 [0,2,0,0,0,0|2,0,0]=4 6024 B12R0.142 COCCOC(=O)COC(C)CS d096bf8a5c3dbececf28c52140e24b4e [0,2,0,0,0,0|2,0,0]=4 6025 B12R0.142 COCCOC(=O)CO[C@H](C)CS 5d32879dd457a3c019a2aed446539b19 [0,2,0,0,0,0|2,0,0]=4 6026 B12R0.142 CO[C@@H](C)CNC(=O)CCCCF bb155f47b0c219c7d7f639682f59ddea [0,2,0,0,0,0|2,0,0]=4 6027 B12R0.142 CO[C@@H](C)CNC(=O)CCCCO 28fe6eceb3bf8d9e601500ce51414328 [0,2,0,0,0,0|2,0,0]=4 6028 B12R0.142 CO[C@@H](C)CNC(=O)CCCCS 9edcc47de874dd8053e8a31ad54ec729 [0,2,0,0,0,0|2,0,0]=4 6029 B12R0.142 CO[C@@H](C)CNC(=O)CCCSC 0505a347c15d3af5993b865494af4d76 [0,2,0,0,0,0|2,0,0]=4 6030 B12R0.142 CO[C@H](C)CNC(=O)CCCCF dd3e4656506d27cbcee5f6f3b468012d [0,2,0,0,0,0|2,0,0]=4 6031 B12R0.142 CO[C@H](C)CNC(=O)CCCCO 8e6af98072be30056eac86b2fc5fa3ce [0,2,0,0,0,0|2,0,0]=4 6032 B12R0.142 CO[C@H](C)CNC(=O)CCCCS 746c66e7874d490818f9d1905e6a38c9 [0,2,0,0,0,0|2,0,0]=4 6033 B12R0.142 CO[C@H](C)CNC(=O)CCCSC bad5f3614785a0f08ed224d33f05f416 [0,2,0,0,0,0|2,0,0]=4 6034 B12R0.142 CSCCCC(=O)NCC(Br)CBr f530cf0609c6d5e2bbf0451b8e2573b4 [0,2,0,0,0,0|2,0,0]=4 6035 B12R0.142 CSCCCC(=O)NCC(C)C#N 5a8202619d621e8811e6eda76e350cc0 [0,2,0,0,0,0|2,0,0]=4 6036 B12R0.142 CSCCCC(=O)NCC(C)CO f5db5c994d2a332026b80d730efd0e11 [0,2,0,0,0,0|2,0,0]=4 6037 B12R0.142 CSCCCC(=O)NCC(F)CO 17e98a02e5005be79ab9508dc1c5c088 [0,2,0,0,0,0|2,0,0]=4 6038 B12R0.142 CSCCCC(=O)NCC(O)CO 04d28c641a8fd059aa3038458a7e273d [0,2,0,0,0,0|2,0,0]=4 6039 B12R0.142 CSCCCC(=O)NC[C@@H](F)CO 16b25b38bad01471f5abd6367746312b [0,2,0,0,0,0|2,0,0]=4 6040 B12R0.142 CSCCCC(=O)NC[C@@H](O)CO 45d9b060c0935d78bb749a4f6db68b2d [0,2,0,0,0,0|2,0,0]=4 6041 B12R0.142 CSCCCC(=O)NC[C@H](C)CO 68ce9c94023e2c63c247ffd26206d79e [0,2,0,0,0,0|2,0,0]=4 6042 B12R0.142 CSCCCC(=O)NC[C@H](F)CO 1f9ff14391373c6170e07da531098596 [0,2,0,0,0,0|2,0,0]=4 6043 B12R0.142 CSCCCC(=O)NC[C@H](O)CO eba41ec2d80d917219611a594df59db6 [0,2,0,0,0,0|2,0,0]=4 6044 B12R0.142 C[C@H](CO)CNC(=O)CCCCF adcc8b90e66f0f9ceee18f85b0689ec7 [0,2,0,0,0,0|2,0,0]=4 6045 B12R0.142 C[C@H](CO)CNC(=O)CCCCO 4837010079c462aa682ab7068e29c668 [0,2,0,0,0,0|2,0,0]=4 6046 B12R0.142 C[C@H](CO)CNC(=O)CCCCS a62c29a5c6b2eca832e54920176342ca [0,2,0,0,0,0|2,0,0]=4 6047 B12R0.142 O=C(CCCCF)NCC(Br)CBr 20aa2f8f42c8599f5a863eb5defd6b67 [0,2,0,0,0,0|2,0,0]=4 6048 B12R0.142 O=C(CCCCF)NCC(F)CO 3e1ed397ba3b6de44484916b740a1482 [0,2,0,0,0,0|2,0,0]=4 6049 B12R0.142 O=C(CCCCF)NCC(O)CO c3976db1f4fd813c8ae3b13b11f49148 [0,2,0,0,0,0|2,0,0]=4 6050 B12R0.142 O=C(CCCCF)NC[C@@H](F)CO fd9271d386e8a916d02f3b5abb9e6c61 [0,2,0,0,0,0|2,0,0]=4 6051 B12R0.142 O=C(CCCCF)NC[C@@H](O)CO f64a3952e88f6a10e39955a48bee3606 [0,2,0,0,0,0|2,0,0]=4 6052 B12R0.142 O=C(CCCCF)NC[C@H](F)CO 117eda12bb4b1989c10cf831dc8fe342 [0,2,0,0,0,0|2,0,0]=4 6053 B12R0.142 O=C(CCCCF)NC[C@H](O)CO a475416bf90e374b2e582d1eb549cc56 [0,2,0,0,0,0|2,0,0]=4 6054 B12R0.142 O=C(CCCCO)NCC(Br)CBr 544e84dc5defe3f63c0ea9f77acbc08b [0,2,0,0,0,0|2,0,0]=4 6055 B12R0.142 O=C(CCCCO)NCC(F)CO 02de4b8fe8dff361d44640edbe5908f3 [0,2,0,0,0,0|2,0,0]=4 6056 B12R0.142 O=C(CCCCO)NCC(O)CO 2a2eab300d6a826f2b8918f4708d46ea [0,2,0,0,0,0|2,0,0]=4 6057 B12R0.142 O=C(CCCCO)NC[C@@H](F)CO 41a545e0eff0b8750a331b7d73670cb2 [0,2,0,0,0,0|2,0,0]=4 6058 B12R0.142 O=C(CCCCO)NC[C@@H](O)CO 8239b5922cf45ddb7307a4606bb6c1db [0,2,0,0,0,0|2,0,0]=4 6059 B12R0.142 O=C(CCCCO)NC[C@H](F)CO 881ef4498ae76e360fb1106ae67b2252 [0,2,0,0,0,0|2,0,0]=4 6060 B12R0.142 O=C(CCCCO)NC[C@H](O)CO d21be01794611870e7decd319285e2d6 [0,2,0,0,0,0|2,0,0]=4 6061 B12R0.142 O=C(CCCCS)NCC(Br)CBr ceab3fc75318dd5e4603330507a31643 [0,2,0,0,0,0|2,0,0]=4 6062 B12R0.142 O=C(CCCCS)NCC(F)CO 50fccf5dbda08e887c25914cfdb5ab62 [0,2,0,0,0,0|2,0,0]=4 6063 B12R0.142 O=C(CCCCS)NCC(O)CO 9cb0ec896375becba68b67edd4d1a02a [0,2,0,0,0,0|2,0,0]=4 6064 B12R0.142 O=C(CCCCS)NC[C@@H](F)CO c0b2f79a60598c29e688f05469820763 [0,2,0,0,0,0|2,0,0]=4 6065 B12R0.142 O=C(CCCCS)NC[C@@H](O)CO 759394d96953bdfd45beb12a7878d696 [0,2,0,0,0,0|2,0,0]=4 6066 B12R0.142 O=C(CCCCS)NC[C@H](F)CO 3f7500962f8ba901728f450ad8848ef8 [0,2,0,0,0,0|2,0,0]=4 6067 B12R0.142 O=C(CCCCS)NC[C@H](O)CO d5bcc1a3664eebb76444f6e9ad7777bb [0,2,0,0,0,0|2,0,0]=4 6068 B12R0.189 C=C(C)CNC(=O)CCC(C)CC b0b9787dc00568a44c2a6a7fa980b948 [0,2,0,0,0,0|1,0,1]=4 6069 B12R0.189 CCC(=O)CCC(=O)NCC(C)C 9d0cbc5c579e8ae1b74ec95bda78a775 [0,2,0,0,0,0|1,0,1]=4 6070 B12R0.189 CCC(=O)CCC(=O)NCC(C)O 20c6a0f07bd0a6afbb99a1d49bb1c033 [0,2,0,0,0,0|1,0,1]=4 6071 B12R0.189 CCC(=O)CCC(=O)NC[C@@H](C)O 6e16ee77978648149a7263b537f874be [0,2,0,0,0,0|1,0,1]=4 6072 B12R0.189 CCC(=O)CCC(=O)NC[C@H](C)O cb007b275136796d4e997c098ccc75c8 [0,2,0,0,0,0|1,0,1]=4 6073 B12R0.189 CCC(C)CCC(=O)NCC(=O)C 9efbf3d245319eeb3a3aab7ef59c39c7 [0,2,0,0,0,0|1,0,1]=4 6074 B12R0.189 CCC(C)CCC(=O)NCC(C)C fa2b94600ca05e53c18f9b72bcc31e80 [0,2,0,0,0,0|1,0,0]=3 6075 B12R0.189 CCC(C)CCC(=O)NCC(C)O 2c54bc3434f604df364cc3c0d1112109 [0,2,0,0,0,0|1,0,0]=3 6076 B12R0.189 CCC(C)CCC(=O)NCC(F)F 9516a1ef1b14dce99d4db1fff6cd3037 [0,2,0,0,0,0|2,0,0]=4 6077 B12R0.189 CCC(C)CCC(=O)NC[C@@H](C)O a5cf60243deb27de402e04628cfecb98 [0,2,0,0,0,0|1,0,0]=3 6078 B12R0.189 CCC(C)CCC(=O)NC[C@H](C)O 0bffa72b7b3cb8db76d877bdd0825b3c [0,2,0,0,0,0|1,0,0]=3 6079 B12R0.189 CCC(C)CCC(C)OCC(C)C 1c21361d6d15b68474280c2816c1d359 [0,2,0,0,0,0|1,0,1]=4 6080 B12R0.189 CCC(C)CNC(=O)CCC(C)C 8012212f8efc83379f2757545d3c8a7b [0,2,0,0,0,0|2,0,0]=4 6081 B12R0.189 CCC(C)CNC(=O)CCC(C)O f49e8cbdabcc39deef2e629526851c90 [0,2,0,0,0,0|2,0,0]=4 6082 B12R0.189 CCC(C)CNC(=O)CCC(C)S 67989ef8f7dc643e61f6d60db2a6a14b [0,2,0,0,0,0|2,0,0]=4 6083 B12R0.189 CCC(C)CNC(=O)CC[C@H](C)S c9b040f4b70b22de39652eb84ea32384 [0,2,0,0,0,0|2,0,0]=4 6084 B12R0.189 CCC(C)CNC(=O)NCC(C)C 28b363e859c5d7a510569ef86835140a [0,2,0,0,0,0|2,0,0]=4 6085 B12R0.189 CCC(C)CNC(=O)NCC(C)O d7a8a0aff0e61015b0fdb708e26855c4 [0,2,0,0,0,0|2,0,0]=4 6086 B12R0.189 CCC(C)CNC(=O)NC[C@@H](C)O 38987810e4f31b311377d12b2bb2eb68 [0,2,0,0,0,0|2,0,0]=4 6087 B12R0.189 CCC(C)CNC(=O)NC[C@H](C)O 2f7b1868777944ab1ef08653b4c1e65b [0,2,0,0,0,0|2,0,0]=4 6088 B12R0.189 CCC(C)NCC(=O)NCC(C)C f6b2a175cbba75592e8fc0097eb30c02 [0,2,0,0,0,0|2,0,0]=4 6089 B12R0.189 CCC(C)OCC(=O)NCC(C)C adde22b8532bccbc67282683cb7fc9f1 [0,2,0,0,0,0|2,0,0]=4 6090 B12R0.189 CCC(C)OCC(=O)NCC(C)O a1b1fcb3fd48c67ae5732ad2fc5d1ba3 [0,2,0,0,0,0|2,0,0]=4 6091 B12R0.189 CCC(C)OCC(=O)NC[C@@H](C)O 3276c44653df1dc9204f791f03c1bbce [0,2,0,0,0,0|2,0,0]=4 6092 B12R0.189 CCC(C)OCC(=O)NC[C@H](C)O 64f57814d9bb6ff52c78ef6f118ca1d4 [0,2,0,0,0,0|2,0,0]=4 6093 B12R0.189 CCC(O)CNC(=O)CCC(C)C adbb47471e510de78b49fd287f9aaa80 [0,2,0,0,0,0|2,0,0]=4 6094 B12R0.189 CCC(O)CNC(=O)CCC(C)O 08d9e1f964fefb4271cc03968bc3000f [0,2,0,0,0,0|2,0,0]=4 6095 B12R0.189 CCC(O)CNC(=O)CCC(C)S df045cac63d88cd9eaa6c8b5eb9ec6fa [0,2,0,0,0,0|2,0,0]=4 6096 B12R0.189 CCC(O)CNC(=O)CC[C@H](C)S 90962d34c915eec3dadbec2c6cf31b08 [0,2,0,0,0,0|2,0,0]=4 6097 B12R0.189 CCC(O)CNC(=O)NCC(C)C 90dcdcebed4c89f88281c4a8bf725e8b [0,2,0,0,0,0|2,0,0]=4 6098 B12R0.189 CCC(O)CNC(=O)NCC(C)O c0110a94c2ebfff955e630e87dc5acef [0,2,0,0,0,0|2,0,0]=4 6099 B12R0.189 CCC(O)CNC(=O)NC[C@@H](C)O ba3658612050deef620e74ad75376f47 [0,2,0,0,0,0|2,0,0]=4 6100 B12R0.189 CCC(O)CNC(=O)NC[C@H](C)O 82e269b953422f2cb92003bb9e134d4f [0,2,0,0,0,0|2,0,0]=4 6101 B12R0.189 CCN(C)CCC(=O)NCC(C)C 536829acbc4bf1879430d640fac1f236 [0,2,0,0,0,0|2,0,0]=4 6102 B12R0.189 CCN(C)CCC(=O)NCC(C)O bd7540a116c3a1825b65f22820719f1f [0,2,0,0,0,0|2,0,0]=4 6103 B12R0.189 CCN(C)CCC(=O)NC[C@@H](C)O 916afbaab062e4cb1d7955e8f0bf5146 [0,2,0,0,0,0|2,0,0]=4 6104 B12R0.189 CCN(C)CCC(=O)NC[C@H](C)O 23673d73e2f1e736ed35574f8ec890bc [0,2,0,0,0,0|2,0,0]=4 6105 B12R0.189 CCS(=O)CCC(=O)NCC(C)C b7391b0fd0ed1ecd54af63a5e6972dcc [0,2,0,0,0,0|2,0,0]=4 6106 B12R0.189 CCS(=O)CCC(=O)NCC(C)O 3fd6b6374a1306aeec779e7c144fec30 [0,2,0,0,0,0|2,0,0]=4 6107 B12R0.189 CCS(=O)CCC(=O)NC[C@@H](C)O 912fae37078a659ea2aaa1ab3d9ffec7 [0,2,0,0,0,0|2,0,0]=4 6108 B12R0.189 CCS(=O)CCC(=O)NC[C@H](C)O 55d2f0256daacea438fed339dc4b1105 [0,2,0,0,0,0|2,0,0]=4 6109 B12R0.189 CC[C@@H](C)NCC(=O)NCC(C)C da7949032e02dc926e716bf9bb1f2c4d [0,2,0,0,0,0|2,0,0]=4 6110 B12R0.189 CC[C@@H](C)OCC(=O)NCC(C)C 80f7521afe52e69156276fb6e151fc64 [0,2,0,0,0,0|2,0,0]=4 6111 B12R0.189 CC[C@@H](O)CNC(=O)CCC(C)C 819d2ea9e8d7eae4f53f9326d02fada9 [0,2,0,0,0,0|2,0,0]=4 6112 B12R0.189 CC[C@@H](O)CNC(=O)CCC(C)O a2d6ccd7d91a6b09e4f4104d3cbb5c83 [0,2,0,0,0,0|2,0,0]=4 6113 B12R0.189 CC[C@@H](O)CNC(=O)CCC(C)S 8f8697304bdd0793ff16e622feee7477 [0,2,0,0,0,0|2,0,0]=4 6114 B12R0.189 CC[C@@H](O)CNC(=O)CC[C@H](C)S 7f14a9cec06df94b934a30fdabee7f66 [0,2,0,0,0,0|2,0,0]=4 6115 B12R0.189 CC[C@@H](O)CNC(=O)NCC(C)C 277e203194ee62bc78538f7e25512d3a [0,2,0,0,0,0|2,0,0]=4 6116 B12R0.189 CC[C@@H](O)CNC(=O)NCC(C)O beb0e580a36d7737b7a4b2547001c357 [0,2,0,0,0,0|2,0,0]=4 6117 B12R0.189 CC[C@@H](O)CNC(=O)NC[C@@H](C)O a3ad5b167e21b96a30df07469db1e119 [0,2,0,0,0,0|2,0,0]=4 6118 B12R0.189 CC[C@@H](O)CNC(=O)NC[C@H](C)O 0f5c0c0549778817ec8a8da69b420fa1 [0,2,0,0,0,0|2,0,0]=4 6119 B12R0.189 CC[C@H](C)CNC(=O)CCC(C)C 7085cc50aaa6e5b222c5a0064de95929 [0,2,0,0,0,0|2,0,0]=4 6120 B12R0.189 CC[C@H](C)CNC(=O)CCC(C)O 796b88c0c078233db0677e76ebb2b40d [0,2,0,0,0,0|2,0,0]=4 6121 B12R0.189 CC[C@H](C)CNC(=O)CCC(C)S 0cdd5657ea6594332b07c3ef90464ad6 [0,2,0,0,0,0|2,0,0]=4 6122 B12R0.189 CC[C@H](C)CNC(=O)CC[C@H](C)S f7549513d8154da2921f5050815a56ab [0,2,0,0,0,0|2,0,0]=4 6123 B12R0.189 CC[C@H](C)CNC(=O)NCC(C)C 2de075a143db76d864193eb1e8c43624 [0,2,0,0,0,0|2,0,0]=4 6124 B12R0.189 CC[C@H](C)CNC(=O)NCC(C)O 4015f6fd2855b73021225f3d267099ed [0,2,0,0,0,0|2,0,0]=4 6125 B12R0.189 CC[C@H](C)CNC(=O)NC[C@@H](C)O f076b5515166755d6fb1a4d306434335 [0,2,0,0,0,0|2,0,0]=4 6126 B12R0.189 CC[C@H](C)CNC(=O)NC[C@H](C)O 3223c87eaf69c1a7a6ce52332de98b83 [0,2,0,0,0,0|2,0,0]=4 6127 B12R0.189 CC[C@H](C)NCC(=O)NCC(C)C 58f7875c6d8e3701b08e941c3485142b [0,2,0,0,0,0|2,0,0]=4 6128 B12R0.189 CC[C@H](C)OCC(=O)NCC(C)C 0e0453f4ca5b351c41b38fcc980ebe65 [0,2,0,0,0,0|2,0,0]=4 6129 B12R0.255 C#CCCCCC(=O)NCC(C)C 3dd7462dcf4e56049092dd5e12a7a2c7 [0,2,0,0,0,0|1,0,1]=4 6130 B12R0.255 C#CCCCCC(=O)NCC(C)O a9ad42448ee8819a8e2182ddf32dcc30 [0,2,0,0,0,0|1,0,1]=4 6131 B12R0.255 C#CCCCCC(=O)NC[C@@H](C)O f922196abd7093fef695d719b9405d75 [0,2,0,0,0,0|1,0,1]=4 6132 B12R0.255 C#CCCCCC(=O)NC[C@H](C)O 8651a2d0d9098e07db7ce6c3f86721cc [0,2,0,0,0,0|1,0,1]=4 6133 B12R0.255 C/C=C/CCCC(=O)NCC(C)C 190f65aac34278a9f29ffa96c5b75eab [0,2,0,0,0,0|1,0,1]=4 6134 B12R0.255 C/C=C/CCCC(=O)NCC(C)O 1ecad7e0d2a75c52520578d6c4d8c33a [0,2,0,0,0,0|1,0,1]=4 6135 B12R0.255 C/C=C/CCCC(=O)NC[C@@H](C)O 7603032758acad2e734d7ef17acfa7ae [0,2,0,0,0,0|1,0,1]=4 6136 B12R0.255 C/C=C/CCCC(=O)NC[C@H](C)O 60135c203d002f9936a5e25a8cdbb87f [0,2,0,0,0,0|1,0,1]=4 6137 B12R0.255 C=C(C)CCC(=O)NCCCCC 8beba77f73ae32595fee3681e6f3c6e2 [0,2,0,0,0,0|1,0,1]=4 6138 B12R0.255 C=C(C)CNC(=O)CCCCCC 5b4749c3394edf46636a663916cd1472 [0,2,0,0,0,0|1,0,1]=4 6139 B12R0.255 C=C(C)CNC(=O)CCCCCF 72d220c267b14ed3ff0eb41fcd8082cb [0,2,0,0,0,0|1,0,1]=4 6140 B12R0.255 C=C(C)CNC(=O)CCCCCO 8d17b292e247e2479c405532af09e284 [0,2,0,0,0,0|1,0,1]=4 6141 B12R0.255 C=C(C)CNC(=O)CCCCCS 57ee38116e935f6b36ac438380c8e9e2 [0,2,0,0,0,0|1,0,1]=4 6142 B12R0.255 C=C(C)CNC(=O)CCOCCC d051c743b784722028747d8a78cd3b77 [0,2,0,0,0,0|1,0,1]=4 6143 B12R0.255 C=C(C)CNC(=O)COCCCC 77a290cebe609db0502a77a85536a318 [0,2,0,0,0,0|1,0,1]=4 6144 B12R0.255 C=C(C)CNC(=O)CSCCCC 0bad052cddc403eaf0bf5286e56e9d54 [0,2,0,0,0,0|1,0,1]=4 6145 B12R0.255 C=C(C)CNC(=O)NCCCCC 9e0c6b7725f1fc15a144447c2c3df236 [0,2,0,0,0,0|1,0,1]=4 6146 B12R0.255 C=CCCCCC(=O)NCC(C)C 89c9c95345da1c45055ca24a789911a7 [0,2,0,0,0,0|1,0,1]=4 6147 B12R0.255 C=CCCCCC(=O)NCC(C)O 72d52ab4db40d6d90b17e4e5fd0b6af6 [0,2,0,0,0,0|1,0,1]=4 6148 B12R0.255 C=CCCCCC(=O)NC[C@@H](C)O f1029f5a93e02edadcaf7f0954f16799 [0,2,0,0,0,0|1,0,1]=4 6149 B12R0.255 C=CCCCCC(=O)NC[C@H](C)O f43d21199551e4774bd19ecb6ea65340 [0,2,0,0,0,0|1,0,1]=4 6150 B12R0.255 CC(=O)CNC(=O)CCCCCF 71cba2bc4f78dd6b5700361ad61c51a8 [0,2,0,0,0,0|1,0,1]=4 6151 B12R0.255 CC(=O)CNC(=O)CCCCCO fb79e39591afd61992c97df3a203b711 [0,2,0,0,0,0|1,0,1]=4 6152 B12R0.255 CC(=O)CNC(=O)CCCCCS e81e8ab0dbd4fa11da8264f2b1de48c6 [0,2,0,0,0,0|1,0,1]=4 6153 B12R0.255 CC(C)CCC(=O)NCCCCCl ab163adaf31a3ce4325b512743d16f7a [0,2,0,0,0,0|2,0,0]=4 6154 B12R0.255 CC(C)CCC(=O)NCCCCO a660b2cba3784fc6140f86c48c916e7b [0,2,0,0,0,0|2,0,0]=4 6155 B12R0.255 CC(C)CCC(=O)NCCCCS 9618e897ed8bbdd363dbd71d3896a8fe [0,2,0,0,0,0|2,0,0]=4 6156 B12R0.255 CC(C)CNC(=O)CCCCC=O 8ab3e31d339faae77bec1a3aa312b62d [0,2,0,0,0,0|1,0,1]=4 6157 B12R0.255 CC(C)CNC(=O)CCCCCF 2f0deaf2405dfbe27781c3dcff895d9e [0,2,0,0,0,0|1,0,0]=3 6158 B12R0.255 CC(C)CNC(=O)CCCCCO cdad81bee4a3b00c2034c80070845a2d [0,2,0,0,0,0|1,0,0]=3 6159 B12R0.255 CC(C)CNC(=O)CCCCCS 2312f9528001e8bef0a25e587c84f5ae [0,2,0,0,0,0|1,0,0]=3 6160 B12R0.255 CC(C)CNC(=O)CCOCCO 8a425cab7d566cc61510d5089891166f [0,2,0,0,0,0|2,0,0]=4 6161 B12R0.255 CC(C)CNC(=O)CCOCCS bc8ad0e3a97b8f28f361fc993278db22 [0,2,0,0,0,0|2,0,0]=4 6162 B12R0.255 CC(C)CNC(=O)CNCCCCl 4d358c5a9e3b5142141d58f24d33b03a [0,2,0,0,0,0|2,0,0]=4 6163 B12R0.255 CC(C)CNC(=O)CNCCCO ceaf3253014926fefaf1299231e2673a [0,2,0,0,0,0|2,0,0]=4 6164 B12R0.255 CC(C)CNC(=O)COCCCF 35dd64d06655417cffe6af9cf6df32e9 [0,2,0,0,0,0|2,0,0]=4 6165 B12R0.255 CC(C)CNC(=O)COCCCS 9e4db281f39f924cb9e3d08dd9de0dc4 [0,2,0,0,0,0|2,0,0]=4 6166 B12R0.255 CC(C)CNC(=O)NCCCCN 4a18456239f2009b828c9da149dfaa8c [0,2,0,0,0,0|2,0,0]=4 6167 B12R0.255 CC(C)CNC(=O)NCCCCO 716a06a29ef0eb455691c039d1bd3631 [0,2,0,0,0,0|2,0,0]=4 6168 B12R0.255 CC(C)CNC(=O)NCCCCS 3bab63199318795974c7034240e391b2 [0,2,0,0,0,0|2,0,0]=4 6169 B12R0.255 CC(O)CCC(=O)NCCCCCl e020d36936433fff6a900587aae22e8a [0,2,0,0,0,0|2,0,0]=4 6170 B12R0.255 CC(O)CCC(=O)NCCCCO 7a3c343d68de114d2db2414cc1aa3619 [0,2,0,0,0,0|2,0,0]=4 6171 B12R0.255 CC(O)CCC(=O)NCCCCS 554b766283302868c5371f68379e9d06 [0,2,0,0,0,0|2,0,0]=4 6172 B12R0.255 CC(O)CNC(=O)CCCCC=O 33a3aac7879e0f4d52e608b92dbbf495 [0,2,0,0,0,0|1,0,1]=4 6173 B12R0.255 CC(O)CNC(=O)CCCCCF aad3a1aa167270a752a7d15c513c0bc0 [0,2,0,0,0,0|1,0,0]=3 6174 B12R0.255 CC(O)CNC(=O)CCCCCO 247b82f9e45bd3ddf30cd75e3ff5abec [0,2,0,0,0,0|1,0,0]=3 6175 B12R0.255 CC(O)CNC(=O)CCCCCS deb7e73b9e43ba2fdcf2f35b11b1bfb6 [0,2,0,0,0,0|1,0,0]=3 6176 B12R0.255 CC(O)CNC(=O)CCOCCO dea3322f5e13be8264145f101f1159a5 [0,2,0,0,0,0|2,0,0]=4 6177 B12R0.255 CC(O)CNC(=O)CCOCCS 217f78b71dcb31ffe9ca51fd1e2db8fb [0,2,0,0,0,0|2,0,0]=4 6178 B12R0.255 CC(O)CNC(=O)NCCCCN 59f5313d303dedcdb688e9ece62cdd86 [0,2,0,0,0,0|2,0,0]=4 6179 B12R0.255 CC(O)CNC(=O)NCCCCO ba1c4ee42b20537fd29e26c3de6531ba [0,2,0,0,0,0|2,0,0]=4 6180 B12R0.255 CC(O)CNC(=O)NCCCCS 057e2c0b6e3e2e97f0d9f9797c6b3176 [0,2,0,0,0,0|2,0,0]=4 6181 B12R0.255 CC(S)CCC(=O)NCCCCCl 237515b32d31c27fada374d12fe3e156 [0,2,0,0,0,0|2,0,0]=4 6182 B12R0.255 CC(S)CCC(=O)NCCCCO 3f6fd95a9b17ff3b7fa90717d4793e97 [0,2,0,0,0,0|2,0,0]=4 6183 B12R0.255 CC(S)CCC(=O)NCCCCS 64f69b7655363b47268c6f2d83c7dab6 [0,2,0,0,0,0|2,0,0]=4 6184 B12R0.255 CCC/C=C/CC(=O)NCC(C)C af5933b88db72f34ecc256d9a0032928 [0,2,0,0,0,0|1,0,1]=4 6185 B12R0.255 CCC/C=C/CC(=O)NCC(C)O f0205cea3d925de8154aca332ff491b2 [0,2,0,0,0,0|1,0,1]=4 6186 B12R0.255 CCC/C=C/CC(=O)NC[C@@H](C)O 6762c1a40a95f71a06aba6c358f3518c [0,2,0,0,0,0|1,0,1]=4 6187 B12R0.255 CCC/C=C/CC(=O)NC[C@H](C)O 02732fe042620e13bc65ddf3c9c86ee9 [0,2,0,0,0,0|1,0,1]=4 6188 B12R0.255 CCCC/C=C/C(=O)NCC(C)C b5ddd274b67fb04a42d0d2d349061cf6 [0,2,0,0,0,0|1,0,1]=4 6189 B12R0.255 CCCC/C=C/C(=O)NCC(C)O d183129fcffea1515acd5132bb625b81 [0,2,0,0,0,0|1,0,1]=4 6190 B12R0.255 CCCC/C=C/C(=O)NC[C@@H](C)O 77db832f969822ac8860d852f72e2cf0 [0,2,0,0,0,0|1,0,1]=4 6191 B12R0.255 CCCC/C=C/C(=O)NC[C@H](C)O 97a81b6d06b63a410232c4396c72c3ff [0,2,0,0,0,0|1,0,1]=4 6192 B12R0.255 CCCCC#CC(=O)NCC(C)C d2014795c4b2864a3fb5cbdfa2975cbd [0,2,0,0,0,0|1,0,1]=4 6193 B12R0.255 CCCCC#CC(=O)NCC(C)O 4380d540bac24ee77a24ec3d75b6303c [0,2,0,0,0,0|1,0,1]=4 6194 B12R0.255 CCCCC#CC(=O)NC[C@@H](C)O a4ad070ea8126bd2f98c9ae87d10c182 [0,2,0,0,0,0|1,0,1]=4 6195 B12R0.255 CCCCC#CC(=O)NC[C@H](C)O e1b862163a099d9facf8fab47abdb428 [0,2,0,0,0,0|1,0,1]=4 6196 B12R0.255 CCCCC=CC(=O)NCC(C)C cdd25b87366fd7954d25a8021b8a0f4e [0,2,0,0,0,0|1,0,1]=4 6197 B12R0.255 CCCCC=CC(=O)NCC(C)O 54092cb23c07b951607c46aaf386bc4a [0,2,0,0,0,0|1,0,1]=4 6198 B12R0.255 CCCCC=CC(=O)NC[C@@H](C)O eb679e7aac5d1cb7200411ed06e76187 [0,2,0,0,0,0|1,0,1]=4 6199 B12R0.255 CCCCC=CC(=O)NC[C@H](C)O 441ecd271f5fac6504ee781891da1fe7 [0,2,0,0,0,0|1,0,1]=4 6200 B12R0.255 CCCCCCC(=O)NCC(=O)C 66b5691a9bf4e73254f9c1ed646b5502 [0,2,0,0,0,0|1,0,1]=4 6201 B12R0.255 CCCCCCC(=O)NCC(C)C 0c5152eb0e826684d1d413b677c75710 [0,2,0,0,0,0|1,0,0]=3 6202 B12R0.255 CCCCCCC(=O)NCC(C)O c1979e8648c94a347dab72d9885f0875 [0,2,0,0,0,0|1,0,0]=3 6203 B12R0.255 CCCCCCC(=O)NCC(F)F 07757e75cec1ab96bb876760a2faac06 [0,2,0,0,0,0|2,0,0]=4 6204 B12R0.255 CCCCCCC(=O)NC[C@@H](C)O 4e14730ab63dec4b35220e51bd599649 [0,2,0,0,0,0|1,0,0]=3 6205 B12R0.255 CCCCCCC(=O)NC[C@H](C)O b6fabc3eb769298d953797ac157bdffe [0,2,0,0,0,0|1,0,0]=3 6206 B12R0.255 CCCCCCC(C)OCC(C)C 062e8906e37f4fc31be1bc88d316b827 [0,2,0,0,0,0|1,0,1]=4 6207 B12R0.255 CCCCCCC(C)OCC(C)F d391120109c2367f3ceec481707f15df [0,2,0,0,0,0|1,0,1]=4 6208 B12R0.255 CCCCCCC(C)OCC(C)S 6c97fc2cc44484748451ede52a2c28d0 [0,2,0,0,0,0|1,0,1]=4 6209 B12R0.255 CCCCCCC(C)OC[C@@H](C)F 3b1450489f5f658ea00d4702aa7628d3 [0,2,0,0,0,0|1,0,1]=4 6210 B12R0.255 CCCCCCC(C)OC[C@H](C)F 1a1e8cfd451f44837514f29cba434253 [0,2,0,0,0,0|1,0,1]=4 6211 B12R0.255 CCCCCC[C@@H](C)OCC(C)C c161a01d216343b11cd2c57ee40f2d8b [0,2,0,0,0,0|1,0,1]=4 6212 B12R0.255 CCCCCC[C@H](C)OCC(C)C 873412fe9c3683d71d9163071cdfaa3c [0,2,0,0,0,0|1,0,1]=4 6213 B12R0.255 CCCCCNC(=O)/C=C/C(C)C dbf0eac1fd56a72e3ad8e72f2cf44312 [0,2,0,0,0,0|1,0,1]=4 6214 B12R0.255 CCCCCNC(=O)CCC(=O)C ae21b9b863047306be7a4865d5b704f2 [0,2,0,0,0,0|1,0,1]=4 6215 B12R0.255 CCCCCNC(=O)CCC(C)C 4509dfaa9996ad412b21022ad1197a9e [0,2,0,0,0,0|1,0,0]=3 6216 B12R0.255 CCCCCNC(=O)CCC(C)O 9ae4d2e8fa18dd30b74dc56d421339a8 [0,2,0,0,0,0|1,0,0]=3 6217 B12R0.255 CCCCCNC(=O)CCC(C)S 8fcca9b47bf869f2b2b12ba6d6ba9a1a [0,2,0,0,0,0|1,0,0]=3 6218 B12R0.255 CCCCCNC(=O)CCC(F)F e26089d3f485e2a318af08a5c0991324 [0,2,0,0,0,0|2,0,0]=4 6219 B12R0.255 CCCCCNC(=O)CCN(C)C 6c60026480da06afc0c07a920b4d8851 [0,2,0,0,0,0|2,0,0]=4 6220 B12R0.255 CCCCCNC(=O)CCS(=O)C 4f504edfc3a29428bab8f93ac2936763 [0,2,0,0,0,0|2,0,0]=4 6221 B12R0.255 CCCCCNC(=O)CC[C@H](C)S 32f20faa1501cb075be47f0761d88337 [0,2,0,0,0,0|1,0,0]=3 6222 B12R0.255 CCCCCNC(=O)COC(C)C 15dfb3726075f7b34aa2c16aad83efd3 [0,2,0,0,0,0|2,0,0]=4 6223 B12R0.255 CCCCCNC(=O)CSC(C)C 4eec2f8514798219a761874ff6422331 [0,2,0,0,0,0|2,0,0]=4 6224 B12R0.255 CCCCCNC(=O)NCC(=O)C 303ff37dd0ea906b436989f0d8af4cbb [0,2,0,0,0,0|1,0,1]=4 6225 B12R0.255 CCCCCNC(=O)NCC(C)C 08158b0ccb8481cebd7636491af38d12 [0,2,0,0,0,0|1,0,0]=3 6226 B12R0.255 CCCCCNC(=O)NCC(C)O 5ec8930cc3f2ba2beae2843a0139b8e2 [0,2,0,0,0,0|1,0,0]=3 6227 B12R0.255 CCCCCNC(=O)NCC(F)F b09ef5f4408eec967cc3f2d21d5c2799 [0,2,0,0,0,0|2,0,0]=4 6228 B12R0.255 CCCCCNC(=O)NC[C@@H](C)O 595779b34a71cf136763fd5118013fde [0,2,0,0,0,0|1,0,0]=3 6229 B12R0.255 CCCCCNC(=O)NC[C@H](C)O 561f576252e9d6732de03a0f3ded132b [0,2,0,0,0,0|1,0,0]=3 6230 B12R0.255 CCCCCNC(=S)NCC(C)C c1ecae1e8832c2c18e741c1203154d37 [0,2,0,0,0,0|1,1,0]=4 6231 B12R0.255 CCCCCNC(=S)NCC(C)O 85d9ffd4ccae8d88bfa2588dafefbfbb [0,2,0,0,0,0|1,1,0]=4 6232 B12R0.255 CCCCCNC(=S)NC[C@@H](C)O 6bac4fcfcfb93c2af6007831165c4147 [0,2,0,0,0,0|1,1,0]=4 6233 B12R0.255 CCCCCNC(=S)NC[C@H](C)O bf3f7c92f9626828e2c5c65218e2efbe [0,2,0,0,0,0|1,1,0]=4 6234 B12R0.255 CCCCNCC(=O)NCC(=O)C 7aa47bfedff6a669e1c6fdb36925546b [0,2,0,0,0,0|1,0,1]=4 6235 B12R0.255 CCCCNCC(=O)NCC(C)C 307fb8d9a6543e81eb58cf97b088bf16 [0,2,0,0,0,0|1,0,0]=3 6236 B12R0.255 CCCCOCC(=O)NCC(=O)C d44ebe4cbf19de7113a5ca4b74d5eb77 [0,2,0,0,0,0|1,0,1]=4 6237 B12R0.255 CCCCOCC(=O)NCC(C)C 188bb7d9fce98ecc105acfa0d846202b [0,2,0,0,0,0|1,0,0]=3 6238 B12R0.255 CCCCOCC(=O)NCC(C)O 10db8463f7dda08f13f3bf23d0fd905c [0,2,0,0,0,0|1,0,0]=3 6239 B12R0.255 CCCCOCC(=O)NCC(F)F bf5803cee075a2ccd3b2d27170a92124 [0,2,0,0,0,0|2,0,0]=4 6240 B12R0.255 CCCCOCC(=O)NC[C@@H](C)O 6da09ed3f23f277cddc4dcabb43e1550 [0,2,0,0,0,0|1,0,0]=3 6241 B12R0.255 CCCCOCC(=O)NC[C@H](C)O 4b5f37c86f3d617dbe0c1476a1a6b487 [0,2,0,0,0,0|1,0,0]=3 6242 B12R0.255 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CCCOCCC(=O)NC[C@@H](C)O 4aa45b06aecef650d0dca86f505ca263 [0,2,0,0,0,0|1,0,0]=3 6254 B12R0.255 CCCOCCC(=O)NC[C@H](C)O 05acf0f5bbcbea6e781d8a4377f94c34 [0,2,0,0,0,0|1,0,0]=3 6255 B12R0.255 CCOCC#CC(=O)OCC(C)C 4cf83f3340ca032ed36dec76b39642d9 [0,2,0,0,0,0|0,0,2]=4 6256 B12R0.255 CCOCCNC(=O)CCC(C)C 1b467f1e3de55b675df3751a1ce524ee [0,2,0,0,0,0|2,0,0]=4 6257 B12R0.255 CCOCCNC(=O)CCC(C)O 7a25dc3ee917c3693b505f95f6452db7 [0,2,0,0,0,0|2,0,0]=4 6258 B12R0.255 CCOCCNC(=O)CCC(C)S ca1e6e1a8a161da46fb784651bf23bd9 [0,2,0,0,0,0|2,0,0]=4 6259 B12R0.255 CCOCCNC(=O)CC[C@H](C)S fdc6bbfcb342f851f333391f1fbf4d7c [0,2,0,0,0,0|2,0,0]=4 6260 B12R0.255 CCOCCNC(=O)NCC(C)C 0a832740816dcb4ade4b5122bd02678f [0,2,0,0,0,0|2,0,0]=4 6261 B12R0.255 CCOCCNC(=O)NCC(C)O 680043ce23fc7a58b1bec157cef4e3ce [0,2,0,0,0,0|2,0,0]=4 6262 B12R0.255 CCOCCNC(=O)NC[C@@H](C)O dd9bddb9f80fed88ca1d822ab7487407 [0,2,0,0,0,0|2,0,0]=4 6263 B12R0.255 CCOCCNC(=O)NC[C@H](C)O fa222c4ed6467c0079297b18be31c4bc [0,2,0,0,0,0|2,0,0]=4 6264 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B12R0.255 COCCCNC(=O)CC[C@H](C)S caa6c46ab60017eaca0d2327b4c5e941 [0,2,0,0,0,0|2,0,0]=4 6276 B12R0.255 COCCCNC(=O)NCC(C)C 52877f03e921d96fc55dbc3e449ee5a6 [0,2,0,0,0,0|2,0,0]=4 6277 B12R0.255 COCCCNC(=O)NCC(C)O 28298311aa6fa95dd6a74712f9f99708 [0,2,0,0,0,0|2,0,0]=4 6278 B12R0.255 COCCCNC(=O)NC[C@@H](C)O 8cb908ed57435d59d7c1e718c1ef2aed [0,2,0,0,0,0|2,0,0]=4 6279 B12R0.255 COCCCNC(=O)NC[C@H](C)O 361ddedf51ae9c562f2eebd5f7ebf070 [0,2,0,0,0,0|2,0,0]=4 6280 B12R0.255 COCCNCC(=O)NCC(C)C da752f283327bf19a42891c050bcdbbd [0,2,0,0,0,0|2,0,0]=4 6281 B12R0.255 COCCOCC(=O)NCC(C)C 05532cb9238e0e1454aae094c302315a [0,2,0,0,0,0|2,0,0]=4 6282 B12R0.255 COCCOCC(=O)NCC(C)O 3ea9ff8c5d75a283099f684e314db22f [0,2,0,0,0,0|2,0,0]=4 6283 B12R0.255 COCCOCC(=O)NC[C@@H](C)O 7db281377cc366e3e8aabd0c836dc0ec [0,2,0,0,0,0|2,0,0]=4 6284 B12R0.255 COCCOCC(=O)NC[C@H](C)O 8e19a6a4d590ffa0cb92166740a70019 [0,2,0,0,0,0|2,0,0]=4 6285 B12R0.255 COCCSCC(=O)NCC(C)C 6c743b258bd78c3fdc773cb6a7b1d115 [0,2,0,0,0,0|2,0,0]=4 6286 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B12R0.255 CSCCNCC(=O)NCC(C)C fa8ff37593b9a065d7f0408180e00286 [0,2,0,0,0,0|2,0,0]=4 6298 B12R0.255 CSCCOCC(=O)NCC(C)C 6a69ca28c35cb3012602f487e461d5a2 [0,2,0,0,0,0|2,0,0]=4 6299 B12R0.255 CSCCOCC(=O)NCC(C)O f031488c6c3b7639579844658bce9dd3 [0,2,0,0,0,0|2,0,0]=4 6300 B12R0.255 CSCCOCC(=O)NC[C@@H](C)O fef9eb7a9dbfbb1afd98485853bee94b [0,2,0,0,0,0|2,0,0]=4 6301 B12R0.255 CSCCOCC(=O)NC[C@H](C)O 47aad73d603fbf52db2a203096d29531 [0,2,0,0,0,0|2,0,0]=4 6302 B12R0.255 CSSCCCC(=O)NCC(C)C 6aab9a277ff959f6ea2056d797c379b5 [0,2,0,0,0,0|2,0,0]=4 6303 B12R0.255 CSSCCCC(=O)NCC(C)O fb5a49fb4c74b6c88bc1d3f936fe99a5 [0,2,0,0,0,0|2,0,0]=4 6304 B12R0.255 CSSCCCC(=O)NC[C@@H](C)O 4c5648a7226ff82507fa7ff15ae27103 [0,2,0,0,0,0|2,0,0]=4 6305 B12R0.255 CSSCCCC(=O)NC[C@H](C)O 2fbf9f52910adbcb86419e8a08ca1328 [0,2,0,0,0,0|2,0,0]=4 6306 B12R0.255 C[C@@H](O)CNC(=O)CCCCC=O edd1f9440a198db4515660ccf6f1ee68 [0,2,0,0,0,0|1,0,1]=4 6307 B12R0.255 C[C@@H](O)CNC(=O)CCCCCF 1b4b7e32bd4af3eaa854f38575cd58cf [0,2,0,0,0,0|1,0,0]=3 6308 B12R0.255 C[C@@H](O)CNC(=O)CCCCCO 459efdbb64cdfa9eb9b34d612f8dd01b [0,2,0,0,0,0|1,0,0]=3 6309 B12R0.255 C[C@@H](O)CNC(=O)CCCCCS aa41a283462a3516c6c6c25829f4363c [0,2,0,0,0,0|1,0,0]=3 6310 B12R0.255 C[C@@H](O)CNC(=O)CCOCCO 4ea2dc0e515b37748b14e97f72b420b4 [0,2,0,0,0,0|2,0,0]=4 6311 B12R0.255 C[C@@H](O)CNC(=O)CCOCCS 80658db289f64592e019b5965d05afda [0,2,0,0,0,0|2,0,0]=4 6312 B12R0.255 C[C@@H](O)CNC(=O)NCCCCN bfe75acacda947489c2fcb5a9cdfa3de [0,2,0,0,0,0|2,0,0]=4 6313 B12R0.255 C[C@@H](O)CNC(=O)NCCCCO b36e03ae3e0603a8dc32bf56171bdaa5 [0,2,0,0,0,0|2,0,0]=4 6314 B12R0.255 C[C@@H](O)CNC(=O)NCCCCS cef41eb96e8725cbec4db0279f90ef00 [0,2,0,0,0,0|2,0,0]=4 6315 B12R0.255 C[C@H](O)CNC(=O)CCCCC=O 8aa8cda6997e919fe862194353415560 [0,2,0,0,0,0|1,0,1]=4 6316 B12R0.255 C[C@H](O)CNC(=O)CCCCCF 48a802559132d81a4a423a08efa684af [0,2,0,0,0,0|1,0,0]=3 6317 B12R0.255 C[C@H](O)CNC(=O)CCCCCO e62869498fe2d44ae6b256232d96f8b3 [0,2,0,0,0,0|1,0,0]=3 6318 B12R0.255 C[C@H](O)CNC(=O)CCCCCS b815bd50b32f50d5c16c26777ea61ba6 [0,2,0,0,0,0|1,0,0]=3 6319 B12R0.255 C[C@H](O)CNC(=O)CCOCCO d22eec92de3d0edadb71ae43a44c4155 [0,2,0,0,0,0|2,0,0]=4 6320 B12R0.255 C[C@H](O)CNC(=O)CCOCCS 2692b5a699558f7dcfe7fb3e6bb2da47 [0,2,0,0,0,0|2,0,0]=4 6321 B12R0.255 C[C@H](O)CNC(=O)NCCCCN 41829cefee067b2d3f559a6ec8921728 [0,2,0,0,0,0|2,0,0]=4 6322 B12R0.255 C[C@H](O)CNC(=O)NCCCCO e460c0c43b89f3bd3c8769570a0c0f89 [0,2,0,0,0,0|2,0,0]=4 6323 B12R0.255 C[C@H](O)CNC(=O)NCCCCS e8d3898bc96c082f9e4e237a11493289 [0,2,0,0,0,0|2,0,0]=4 6324 B12R0.255 C[C@H](S)CCC(=O)NCCCCCl bde931ebaf7acf7695c9202539adeb4c [0,2,0,0,0,0|2,0,0]=4 6325 B12R0.255 C[C@H](S)CCC(=O)NCCCCO cb5e62473e6879f17a70fa0022531fbb [0,2,0,0,0,0|2,0,0]=4 6326 B12R0.255 C[C@H](S)CCC(=O)NCCCCS 789ad9251459a441c445fb4616d301f0 [0,2,0,0,0,0|2,0,0]=4 6327 B12R0.255 O=C(CCCCCF)NCC(F)F 89b85c9df0a5be55d00278aba83aaef4 [0,2,0,0,0,0|2,0,0]=4 6328 B12R0.255 O=C(CCCCCO)NCC(F)F f7f68f57dea8fd88aa9af57e3389f74f [0,2,0,0,0,0|2,0,0]=4 6329 B12R0.255 O=C(CCCCCS)NCC(F)F d1b6705b4be5575e66995cda3e39d219 [0,2,0,0,0,0|2,0,0]=4 6330 B12R0.649 CC(C)(C)CNC(=O)CCCCF d579baced0c04826ba9bcdf128873582 [0,2,0,0,0,0|2,0,0]=4 6331 B12R0.649 CC(C)(C)CNC(=O)CCCCO 715acf3755262d1cb98337678b20b321 [0,2,0,0,0,0|2,0,0]=4 6332 B12R0.649 CC(C)(C)CNC(=O)CCCCS 7685e9c54645e0484a086106154d5211 [0,2,0,0,0,0|2,0,0]=4 6333 B12R0.649 CC(C)(C)COC(=O)CNCCBr ebdea7b2b977aaf08e91866bcf0f1251 [0,2,0,0,0,0|2,0,0]=4 6334 B12R0.649 CC(C)(C)COC(=O)CNCCF 8f1323d5bc38837b178cb9403b9ab00c [0,2,0,0,0,0|2,0,0]=4 6335 B12R0.649 CC(C)(C)COC(=O)CNCCI c3ab7cad244850adc5cd8fcdd6cfca0d [0,2,0,0,0,0|2,0,0]=4 6336 B12R0.649 CC(C)(C)COC(=O)CNCCO 87389a691bc3d9105ee8921167e86394 [0,2,0,0,0,0|2,0,0]=4 6337 B12R0.649 CC(C)(C)COC(=O)CNCCS fce63d7272e1f89b3042a16324bf57c5 [0,2,0,0,0,0|2,0,0]=4 6338 B12R0.649 CC(C)(C)COC(=O)COCCF 48e8de1dea09d09ad38036cfac408f1e [0,2,0,0,0,0|2,0,0]=4 6339 B12R0.649 CC(C)(C)COC(=O)COCCS d3bbc3beb7f6846a85ed9db5767df31b [0,2,0,0,0,0|2,0,0]=4 6340 B12R0.649 CC(C)(O)CNC(=O)CCCCF d27f12e5baf04bb644ba86af2ca5d29d [0,2,0,0,0,0|2,0,0]=4 6341 B12R0.649 CC(C)(O)CNC(=O)CCCCO 28ee8ef95fd28ae056edb6949a526f5a [0,2,0,0,0,0|2,0,0]=4 6342 B12R0.649 CC(C)(O)CNC(=O)CCCCS c7965277807bdb1a9e1533096b23ebfe [0,2,0,0,0,0|2,0,0]=4 6343 B12R0.649 CC(F)(F)CNC(=O)CCCCF b7a0f4e4b02e02a5d6a5ba49a88c3c54 [0,2,0,0,0,0|2,0,0]=4 6344 B12R0.649 CC(F)(F)CNC(=O)CCCCO bbbc6b4e026d601130271c3c4902bf5a [0,2,0,0,0,0|2,0,0]=4 6345 B12R0.649 CC(F)(F)CNC(=O)CCCCS 6be9d38b0a1dbb49af58e37b9b2252ea [0,2,0,0,0,0|2,0,0]=4 6346 B12R0.649 CCCCCC(=O)CNC(C)(C)C 7bd7c62f90f552099c8a6c08282640ab [0,2,0,0,0,0|2,0,0]=4 6347 B12R0.649 CCCCCC(=O)NCC(C)(C)C 059777b346ab3f817e7f5df8b508fa54 [0,2,0,0,0,0|1,0,0]=3 6348 B12R0.649 CCCCCC(=O)NCC(C)(C)O cf118830b26b9aaf977a310d5f12401b [0,2,0,0,0,0|1,0,0]=3 6349 B12R0.649 CCCCCC(=O)NCC(C)(F)F 0d4d3536a28f484b6dd333188bf3d629 [0,2,0,0,0,0|1,0,0]=3 6350 B12R0.649 CCCCCC(=O)NCC(F)(F)F ee3cee9f3847c15be35eda5560e26d43 [0,2,0,0,0,0|2,0,0]=4 6351 B12R0.649 CCCCCC(C)OCC(C)(C)C baa7c2a16017f50b939fc52ffb1f47e8 [0,2,0,0,0,0|1,0,1]=4 6352 B12R0.649 CCCCCC(C)OCC(C)(C)F 48a4644ccf8a0f0a1bc31b9a483418f0 [0,2,0,0,0,0|1,0,1]=4 6353 B12R0.649 CCCCCC(C)OCC(C)(C)O a00d6d5963a2fd319d048f5202569d8f [0,2,0,0,0,0|1,0,1]=4 6354 B12R0.649 CCCCCC(C)OCC(C)(C)S 1c5eac85028731def3ee52ed60351063 [0,2,0,0,0,0|1,0,1]=4 6355 B12R0.649 CCCCCC(C)OCC(C)(F)F e54be4ad80cb08efce2f7d0ea1ac4e22 [0,2,0,0,0,0|1,0,1]=4 6356 B12R0.649 CCCCC[C@@H](C)OCC(C)(C)C 2eb8cad6ae30ecd15eed5cd1bee9f900 [0,2,0,0,0,0|1,0,1]=4 6357 B12R0.649 CCCCC[C@@H](C)OCC(C)(C)F 8ceaa5eeb54491f58a49c12c3c74c2af [0,2,0,0,0,0|1,0,1]=4 6358 B12R0.649 CCCCC[C@@H](C)OCC(C)(C)O 3192ddcd898bc8a0f38155fad13e0af2 [0,2,0,0,0,0|1,0,1]=4 6359 B12R0.649 CCCCC[C@@H](C)OCC(C)(F)F 0f24174ad1a6ba2168e0e448ae280386 [0,2,0,0,0,0|1,0,1]=4 6360 B12R0.649 CCCCC[C@H](C)OCC(C)(C)Br 5a02320ecc57768cd701b758bae6ef30 [0,2,0,0,0,0|1,0,1]=4 6361 B12R0.649 CCCCC[C@H](C)OCC(C)(C)C fd7443838d3576de9897db0ee3145dda [0,2,0,0,0,0|1,0,1]=4 6362 B12R0.649 CCCCC[C@H](C)OCC(C)(C)F 7a80f2327193c0ea06a447b3e8f1b661 [0,2,0,0,0,0|1,0,1]=4 6363 B12R0.649 CCCCC[C@H](C)OCC(C)(C)O 19834c103a1ba2790ab901859d5d4f9a [0,2,0,0,0,0|1,0,1]=4 6364 B12R0.649 CCCCC[C@H](C)OCC(C)(C)S 79563c3fa7d07ea5863a86d08a15c6f8 [0,2,0,0,0,0|1,0,1]=4 6365 B12R0.649 CCCCC[C@H](C)OCC(C)(F)F ec51146d5d46ff74fbca4ff488de08de [0,2,0,0,0,0|1,0,1]=4 6366 B12R0.649 CCCCNC(=O)CCC(C)(C)C 7723627c23dd599e112d8960aac764da [0,2,0,0,0,0|2,0,0]=4 6367 B12R0.649 CCCCNC(=O)CCC(C)(C)F fc0073c6ce055696a3bf0128b4065a19 [0,2,0,0,0,0|2,0,0]=4 6368 B12R0.649 CCCCNC(=O)CCC(C)(C)S 4b410dbc2578c3ae4c15f1b662c6b61c [0,2,0,0,0,0|2,0,0]=4 6369 B12R0.649 CCCCNC(=O)CCC(C)(F)F b0484a5e1ba2354f4b5be36091294283 [0,2,0,0,0,0|2,0,0]=4 6370 B12R0.649 CCCCNC(=O)NCC(C)(C)C 681fa16c8b8c3a65c5a17bed25c919b9 [0,2,0,0,0,0|2,0,0]=4 6371 B12R0.649 CCCCNC(=O)NCC(C)(C)O c641043226211c56c40b9b87501277d5 [0,2,0,0,0,0|2,0,0]=4 6372 B12R0.649 CCCCNC(=O)NCC(C)(F)F 2b3daf5a10590f659a60ebce5573ba8b [0,2,0,0,0,0|2,0,0]=4 6373 B12R0.649 CCCNCC(=O)OCC(C)(C)C 1096c42ab38b7f5b5d123fe01ff87ddb [0,2,0,0,0,0|1,0,0]=3 6374 B12R0.649 CCCOCC(=O)NCC(C)(C)C 640283c591a3dc9dea22ac002f7acf21 [0,2,0,0,0,0|2,0,0]=4 6375 B12R0.649 CCCOCC(=O)NCC(C)(C)O 6ee18cbb4455fc85a562b6c8d4c4136c [0,2,0,0,0,0|2,0,0]=4 6376 B12R0.649 CCCOCC(=O)NCC(C)(F)F 2a6147f82f2fafa6df45ddffe901d6ac [0,2,0,0,0,0|2,0,0]=4 6377 B12R0.649 CCCOCC(=O)OCC(C)(C)C 93f67a84752626e9a3c4970f34ac2cb1 [0,2,0,0,0,0|1,0,0]=3 6378 B12R0.649 CCCSCC(=O)NCC(C)(C)C e648105bf6405303ef6304b26f5a2f5c [0,2,0,0,0,0|2,0,0]=4 6379 B12R0.649 CCCSCC(=O)NCC(C)(C)O 3a7c79e0804a839782d670ae965f1d05 [0,2,0,0,0,0|2,0,0]=4 6380 B12R0.649 CCCSCC(=O)NCC(C)(F)F 29b7d3e86a894d262829fbbab868178a [0,2,0,0,0,0|2,0,0]=4 6381 B12R0.649 CCOCCC(=O)NCC(C)(C)C 9d0d62dda5a479053685a0497d00a7fc [0,2,0,0,0,0|2,0,0]=4 6382 B12R0.649 CCOCCC(=O)NCC(C)(C)O e1064c169879b43f003d28ee437e2e39 [0,2,0,0,0,0|2,0,0]=4 6383 B12R0.649 CCOCCC(=O)NCC(C)(F)F d21d2ab7dd848ea79bb64c3498f88a81 [0,2,0,0,0,0|2,0,0]=4 6384 B12R0.649 CCSCCC(=O)NCC(C)(C)C 6be0b5f6d6d2f2f7e83111a1a638f969 [0,2,0,0,0,0|2,0,0]=4 6385 B12R0.649 CCSCCC(=O)NCC(C)(C)O 0e97c5f248655a23dc8bb4b752f72706 [0,2,0,0,0,0|2,0,0]=4 6386 B12R0.649 CCSCCC(=O)NCC(C)(F)F 5df320d0cdaa7db416b5f78a8821a8df [0,2,0,0,0,0|2,0,0]=4 6387 B12R0.649 COCCCC(=O)NCC(C)(C)C 2b37270c2fcb7db27897365ebf74310e [0,2,0,0,0,0|2,0,0]=4 6388 B12R0.649 COCCCC(=O)NCC(C)(C)O 3378b4a43ace663a3a43dd1b94426932 [0,2,0,0,0,0|2,0,0]=4 6389 B12R0.649 COCCCC(=O)NCC(C)(F)F 98bb633136e65906e7f03bd47e0aac81 [0,2,0,0,0,0|2,0,0]=4 6390 B12R0.649 COCOCC(=O)OCC(C)(C)C cae9cdaeba24b9f0c08af2123931dd46 [0,2,0,0,0,0|2,0,0]=4 6391 B12R0.649 CSCCCC(=O)NCC(C)(C)C 19a0c477d2ecfeeb50417f91e2b8926e [0,2,0,0,0,0|2,0,0]=4 6392 B12R0.649 CSCCCC(=O)NCC(C)(C)O 10a8dc326e3489b321eb634dda41babe [0,2,0,0,0,0|2,0,0]=4 6393 B12R0.649 CSCCCC(=O)NCC(C)(F)F 01492d88e73a877328831d7ef1b4c533 [0,2,0,0,0,0|2,0,0]=4 6394 B12R0.6 CCCCC(=O)NCC(C)(C)CC c79d505cc7af8c719558fbb02d99a714 [0,2,0,0,0,0|2,0,0]=4 6395 B12R0.6 CCCCC(=O)NCC(C)(O)CC 27db51765a642261ec4871d1b48e10f2 [0,2,0,0,0,0|2,0,0]=4 6396 B12R0.6 CCCNC(=O)CCC(C)(C)OC 5976f008fb4e8490f343f93e0ab0100d [0,2,0,0,0,0|2,0,0]=4 6397 B12R0.6 CCCNC(=O)CCS(=O)(=O)CC c920180ad9c0efeec826c94f3efc148b [0,2,0,0,0,0|2,0,0]=4 6398 B12R0.6 CCCNC(=O)CNC(C)(C)CC 086bf2c568eff66bacd1e21bd5d0299c [0,2,0,0,0,0|2,0,0]=4 6399 B12R0.6 CCCNC(=O)COC(C)(C)CC a62784399c520ad3eabfb7aca1ce83ba [0,2,0,0,0,0|2,0,0]=4 6400 B12R0.6 CCCNC(=O)NCC(C)(C)CC b7cd9836f44529b59835b8f59e22f49f [0,2,0,0,0,0|2,0,0]=4 6401 B12R0.6 CCCNC(=O)NCC(C)(O)CC 5510393ae6257d5c7bebd7f57d400d4b [0,2,0,0,0,0|2,0,0]=4 6402 B12R0.6 CCCOC(=O)CNC(C)(C)CC b35c3f29430c2c9430712c7f3d5c35aa [0,2,0,0,0,0|1,0,0]=3 6403 B12R0.6 CCCOC(=O)CNC(C)(C)CF 6be5666070c5f20007230ae14a6c2a54 [0,2,0,0,0,0|2,0,0]=4 6404 B12R0.6 CCCOC(=O)CNC(C)(C)CO 3038de9a89168bfaad778af7e1dfa5d6 [0,2,0,0,0,0|2,0,0]=4 6405 B12R0.48 CCCCC(=O)NCC(O)C(C)C 79b9499d455b41e044ea64d3848290be [0,2,0,0,0,0|2,0,0]=4 6406 B12R0.48 CCCNC(=O)CCC(=O)C(C)C 378c82929d896073b230553b269c926d [0,2,0,0,0,0|1,0,1]=4 6407 B12R0.48 CCCNC(=O)CNC(C)C(C)C 5850edd762ddf281881f92c601a7ed91 [0,2,0,0,0,0|2,0,0]=4 6408 B12R0.48 CCCNC(=O)CNC(C)C(C)O 80c18ff0ecaf871d12186825f385af3a [0,2,0,0,0,0|2,0,0]=4 6409 B12R0.48 CCCNC(=O)CN[C@@H](C)C(C)C 28ffd68d6662bfb919496b9a4204db35 [0,2,0,0,0,0|2,0,0]=4 6410 B12R0.48 CCCNC(=O)CN[C@H](C)C(C)C 0cd3674680b75cc14dffb8907a7f7b85 [0,2,0,0,0,0|2,0,0]=4 6411 B12R0.48 CCCNC(=O)COC(C)C(C)C 9dfca60cf5706994ee32937425afc00d [0,2,0,0,0,0|2,0,0]=4 6412 B12R0.48 CCCNC(=O)COC(C)C(C)S 1efb6b3612b55b7756ecba69373c4197 [0,2,0,0,0,0|2,0,0]=4 6413 B12R0.48 CCCNC(=O)CO[C@@H](C)C(C)C 9f82b13b4f624304c7f171e0ed3ce9e7 [0,2,0,0,0,0|2,0,0]=4 6414 B12R0.48 CCCNC(=O)CO[C@H](C)C(C)C fd5e8e9263285aefe516b429c75649eb [0,2,0,0,0,0|2,0,0]=4 6415 B12R0.48 CCCNC(=O)NCC(O)C(C)C 95b00f0edfcedc68d5014847c619607f [0,2,0,0,0,0|2,0,0]=4 6416 B12R0.48 CCCOC(=O)CNC(C)C(C)C 44d2879f012c8cd4eabae8de5139e0fc [0,2,0,0,0,0|1,0,0]=3 6417 B12R0.48 CCCOC(=O)CNC(C)C(C)O 87d195696d1684a0983c9cf32925fb16 [0,2,0,0,0,0|1,0,0]=3 6418 B12R0.48 CCCOC(=O)CN[C@@H](C)C(C)C 7ebda4d39eedeb1bb936a4e4ce59fd31 [0,2,0,0,0,0|1,0,0]=3 6419 B12R0.48 CCCOC(=O)CN[C@@H](C)C(F)F e2820b3869fda62eef710853b073c0b8 [0,2,0,0,0,0|2,0,0]=4 6420 B12R0.48 CCCOC(=O)CN[C@H](C)C(C)C 42e6a90ac39523612de4df1ee18fabc5 [0,2,0,0,0,0|1,0,0]=3 6421 B12R0.48 CCCOC(=O)CN[C@H](C)C(F)F 623f9d7d2c7531eed36d70172c1d6bf9 [0,2,0,0,0,0|2,0,0]=4 6422 B12R0.48 CCCOC(=O)COC(C)C(=O)C 806a539c67983ca9f455c080499f8c58 [0,2,0,0,0,0|1,0,1]=4 6423 B12R0.48 CCCOC(=O)COC(C)C(C)C d1006f0c2af912eafa26cf43e031feb7 [0,2,0,0,0,0|1,0,0]=3 6424 B12R0.48 CCCOC(=O)COC(C)C(C)S 76ccefd8c2d237a5e7173c7a37d37343 [0,2,0,0,0,0|1,0,0]=3 6425 B12R0.48 CCCOC(=O)COC(C)C(F)F e91c065bf9e3cda7b7cf47df0fadac67 [0,2,0,0,0,0|2,0,0]=4 6426 B12R0.48 CCCOC(=O)CO[C@@H](C)C(C)C 46b36c25d033a0cd91f5f500b1e3fb82 [0,2,0,0,0,0|1,0,0]=3 6427 B12R0.48 CCCOC(=O)CO[C@H](C)C(C)C 2614b5bda7adce26ef7281916dd8da4e [0,2,0,0,0,0|1,0,0]=3 6428 B12R0.48 CCCOC(=O)OCN(C)C(C)C 8fb339bb8a35331423ff76bd681d7d99 [0,2,0,0,0,0|2,0,0]=4 6429 B12R0.101 C#CCC(C)OCC(=O)OCCC cd06bf087b0b709635730689cd80f385 [0,2,0,0,0,0|0,0,2]=4 6430 B12R0.101 C/C=C/C(C)OCC(=O)OCCC a5ffb8280526ad314d28a443058996c6 [0,2,0,0,0,0|0,0,2]=4 6431 B12R0.101 C=C(CNC(C)CCC)OCOC 8ce0ec54ae450a5cd8790821d94c5aad [0,2,0,0,0,0|2,0,0]=4 6432 B12R0.101 C=C(CN[C@@H](C)CCC)OCOC 990d7ef53023faf20cce304fedd50861 [0,2,0,0,0,0|2,0,0]=4 6433 B12R0.101 C=C(COC(C)CCC)OCOC c975707bae8adc210498247f82721948 [0,2,0,0,0,0|2,0,0]=4 6434 B12R0.101 C=C(CO[C@@H](C)CCC)OCOC a5ec6e4ebb992557c9480ec073e766d4 [0,2,0,0,0,0|2,0,0]=4 6435 B12R0.101 C=C(CO[C@H](C)CCC)OCOC be1900417a33a69079aa3356b3923804 [0,2,0,0,0,0|2,0,0]=4 6436 B12R0.101 C=CCC(C)OCC(=O)OCCC 3f347cf46e89e073fd4f317fdf4c281d [0,2,0,0,0,0|0,0,2]=4 6437 B12R0.101 C=CCOC(=O)CNC(C)CCC 8fdcca2541a8eee9d40eeed513cc8436 [0,2,0,0,0,0|0,0,2]=4 6438 B12R0.101 C=CCOC(=O)CN[C@@H](C)CCC ecfab09b9998c0ab59db8b44837debbf [0,2,0,0,0,0|0,0,2]=4 6439 B12R0.101 C=CCOC(=O)COC(C)CCC af41e6d04b94ffc12ca1b8a6e24d5557 [0,2,0,0,0,0|0,0,2]=4 6440 B12R0.101 C=CCOC(=O)CO[C@@H](C)CCC afe5cd3976817534c5c5ae698da7f2c6 [0,2,0,0,0,0|0,0,2]=4 6441 B12R0.101 C=CCOC(=O)CO[C@H](C)CCC fa4a3d063ac6380a5c04ca2ac7c1e740 [0,2,0,0,0,0|0,0,2]=4 6442 B12R0.101 C=CC[C@@H](C)OCC(=O)OCCC 11204196993e033cae76fbf63a1c3e9c [0,2,0,0,0,0|0,0,2]=4 6443 B12R0.101 C=CC[C@H](C)OCC(=O)OCCC 9aa90be7191c7282fb43f8588056d507 [0,2,0,0,0,0|0,0,2]=4 6444 B12R0.101 CC#CC(C)OCC(=O)OCCC e8613a0cf553028a5cb2df5ddee94206 [0,2,0,0,0,0|0,0,2]=4 6445 B12R0.101 CC/C=C/C(=O)NCC(O)CCC 3d88715c9aeb0249647854ebdd1aa1b2 [0,2,0,0,0,0|1,0,1]=4 6446 B12R0.101 CC/C=C\C(=O)NCC(O)CCC 0f56b7a7017636306bfb7ed46c52d069 [0,2,0,0,0,0|1,0,1]=4 6447 B12R0.101 CC=CC(C)OCC(=O)OCCC c093ac7ff176b1d01beb8072c472bc5a [0,2,0,0,0,0|0,0,2]=4 6448 B12R0.101 CCC#CC(=O)NCC(O)CCC 8ab41ca8fb6ca7dac1f26bcc2c2ea231 [0,2,0,0,0,0|1,0,1]=4 6449 B12R0.101 CCC=CC(=O)NCC(O)CCC b5ced7de665a692d7fc1a76bc9efad10 [0,2,0,0,0,0|1,0,1]=4 6450 B12R0.101 CCCC(=O)CCC(=O)NCCBr 559908af6de953edf0730fbd99d14831 [0,2,0,0,0,0|2,0,0]=4 6451 B12R0.101 CCCC(=O)CCC(=O)NCCF 43e1b031c1c907a6d7261dcec2c72385 [0,2,0,0,0,0|2,0,0]=4 6452 B12R0.101 CCCC(=O)CCC(=O)NCCI 6424dff01637975bfe44d43301fa9739 [0,2,0,0,0,0|2,0,0]=4 6453 B12R0.101 CCCC(=O)CCC(=O)NCCO 60a6fa259bb091737f04c20144d172b2 [0,2,0,0,0,0|2,0,0]=4 6454 B12R0.101 CCCC(=O)CCC(=O)NCCS 84d8320030c346f7d426a74b178effcb [0,2,0,0,0,0|2,0,0]=4 6455 B12R0.101 CCCC(C)NCC(=O)CCSC 678602abc08d814f4247b31ab252849f [0,2,0,0,0,0|2,0,0]=4 6456 B12R0.101 CCCC(C)NCC(=O)NCCO 2c48b640edf664a84a8fbc709ce88603 [0,2,0,0,0,0|2,0,0]=4 6457 B12R0.101 CCCC(C)OCC(=O)CCSC 8ddccbda482b9ff8cc7c2866ca3f2bf3 [0,2,0,0,0,0|2,0,0]=4 6458 B12R0.101 CCCC(O)CNC(=O)CCCF 1d83b73b774d669ac7143c14c5c2ed7b [0,2,0,0,0,0|2,0,0]=4 6459 B12R0.101 CCCC(O)CNC(=O)CCCS 52fdce9ef4b64daf98324c8dc12bad64 [0,2,0,0,0,0|2,0,0]=4 6460 B12R0.101 CCCC(O)CNC(=O)CCOC e65b1eb279f9a92a1d1cbe18f85d3ac1 [0,2,0,0,0,0|2,0,0]=4 6461 B12R0.101 CCCC(O)CNC(=O)CCSC 6af26378a85589f08cbfc5b55d86746c [0,2,0,0,0,0|2,0,0]=4 6462 B12R0.101 CCCC(O)CNC(=O)COCC 2bff93bbfc07706496ce7bdb70e21d17 [0,2,0,0,0,0|2,0,0]=4 6463 B12R0.101 CCCC(O)CNC(=O)CSCC b67a67682e6d85c8b80a7202c8fb7d37 [0,2,0,0,0,0|2,0,0]=4 6464 B12R0.101 CCCC(O)CNC(=O)NCCF 893c6796361598eeb9723474a3635339 [0,2,0,0,0,0|2,0,0]=4 6465 B12R0.101 CCCC(O)CNC(=O)NCCN f794c95a3bb6b4889e719659064c64a4 [0,2,0,0,0,0|2,0,0]=4 6466 B12R0.101 CCCC(O)CNC(=O)NCCO 4383914b98f382801c0ffce0fe00e07f [0,2,0,0,0,0|2,0,0]=4 6467 B12R0.101 CCCC(O)CNC(=O)NCCS 1a6e53f8022048903002a34ff070f95a [0,2,0,0,0,0|2,0,0]=4 6468 B12R0.101 CCCCC(=O)NCC(C)CCO 6bd9d664f33e85f1ce6e2041f2b175df [0,2,0,0,0,0|2,0,0]=4 6469 B12R0.101 CCCCC(=O)NCC(C)OCC 2b9c0e901dd8721dd96f40cb55e76dac [0,2,0,0,0,0|2,0,0]=4 6470 B12R0.101 CCCCC(=O)NCC(O)CCC cc2f1e28246c7e8e1de091afdced28b4 [0,2,0,0,0,0|1,0,0]=3 6471 B12R0.101 CCCCC(=O)NCC(O)COC 2e6679a1eaceec29f9bed6f8e4f54fb7 [0,2,0,0,0,0|2,0,0]=4 6472 B12R0.101 CCCCC(=O)NC[C@H](O)COC 5d08c3f5947b9578d62dd3a6bed68f1c [0,2,0,0,0,0|2,0,0]=4 6473 B12R0.101 CCCCC(=O)OCN(C)CCC 88d404fc15f032c8252199b241a58a86 [0,2,0,0,0,0|2,0,0]=4 6474 B12R0.101 CCCNC(=O)CCC(=O)CCC d65621a6936762de8a28a9eec7be5e70 [0,2,0,0,0,0|1,0,0]=3 6475 B12R0.101 CCCNC(=O)CCC(=O)NCC ba21b42f2523cfe84b829fddd2fe8b3c [0,2,0,0,0,0|1,0,1]=4 6476 B12R0.101 CCCNC(=O)CCC(=O)OCC b1916e5c8985aba0b05c270c59c8f759 [0,2,0,0,0,0|1,0,1]=4 6477 B12R0.101 CCCNC(=O)CCC(C)SSC 388a64b601a58629a83aa829a6b774d3 [0,2,0,0,0,0|2,0,0]=4 6478 B12R0.101 CCCNC(=O)CCN(C)CCO 06ba28cdbb620b322c72d8135c05b060 [0,2,0,0,0,0|2,0,0]=4 6479 B12R0.101 CCCNC(=O)CC[C@H](C)CCC d531a1b95b09d308f26eccca57db6560 [0,2,0,0,0,0|1,0,0]=3 6480 B12R0.101 CCCNC(=O)CNC(=O)CCC 021814496d72275d588e50e63217b97f [0,2,0,0,0,0|1,0,1]=4 6481 B12R0.101 CCCNC(=O)CNC(C)CCC f60152428978e4d4605eae27657ae096 [0,2,0,0,0,0|1,0,0]=3 6482 B12R0.101 CCCNC(=O)CNC(C)CCO aa8eea690a8a6d11f7dfe69a6c10b34f [0,2,0,0,0,0|2,0,0]=4 6483 B12R0.101 CCCNC(=O)CNC(C)COC 54313fff29a5e57397a038bbb8377e87 [0,2,0,0,0,0|2,0,0]=4 6484 B12R0.101 CCCNC(=O)CN[C@@H](C)CCC 4e5327d918bfab34bf7aa269c1479c48 [0,2,0,0,0,0|1,0,0]=3 6485 B12R0.101 CCCNC(=O)CN[C@@H](C)CCO 9573903b8f987b2fa4cb690ff5e1aa59 [0,2,0,0,0,0|2,0,0]=4 6486 B12R0.101 CCCNC(=O)CN[C@@H](C)COC 7664e3ad039912a2147a6ed182def53b [0,2,0,0,0,0|2,0,0]=4 6487 B12R0.101 CCCNC(=O)CN[C@H](C)CCO 1c1c1d910a14d05969368b84671c0785 [0,2,0,0,0,0|2,0,0]=4 6488 B12R0.101 CCCNC(=O)CN[C@H](C)COC 51a9b7be0c3574d876faeea5b75f6646 [0,2,0,0,0,0|2,0,0]=4 6489 B12R0.101 CCCNC(=O)COC(=S)CCC 31b052247216b61f69a6bafba0e3acfa [0,2,0,0,0,0|1,0,1]=4 6490 B12R0.101 CCCNC(=O)COC(C)CCC 16a860f874f6da707a6b941b57b8889c [0,2,0,0,0,0|1,0,0]=3 6491 B12R0.101 CCCNC(=O)COC(C)COC 536ca7e9d40748c28825c781d0cfeb20 [0,2,0,0,0,0|2,0,0]=4 6492 B12R0.101 CCCNC(=O)COC(C)CSC bff7e686f65cee81b19bcb15292aa5e0 [0,2,0,0,0,0|2,0,0]=4 6493 B12R0.101 CCCNC(=O)CO[C@@H](C)CCC 32c3275d82b39d207ab6656fe32a7e76 [0,2,0,0,0,0|1,0,0]=3 6494 B12R0.101 CCCNC(=O)CO[C@@H](C)COC 5cc2c7a2947e7d0103a11b44fb9240b9 [0,2,0,0,0,0|2,0,0]=4 6495 B12R0.101 CCCNC(=O)CO[C@H](C)CCC ff7e2fd5f3fdc5ee2af4afd074cbb8bd [0,2,0,0,0,0|1,0,0]=3 6496 B12R0.101 CCCNC(=O)CO[C@H](C)COC 12545ef4da027fc6fff0a8a9d1439079 [0,2,0,0,0,0|2,0,0]=4 6497 B12R0.101 CCCNC(=O)NCC(C)CCO 18aea0bf2afe4357f6adc8b696b0df37 [0,2,0,0,0,0|2,0,0]=4 6498 B12R0.101 CCCNC(=O)NCC(C)OCC 0c72a6fa0a8de5f64e28a91bc39626a1 [0,2,0,0,0,0|2,0,0]=4 6499 B12R0.101 CCCNC(=O)NCC(O)CCC a5a8af2c6ba3d9895d02c3d8266fafd8 [0,2,0,0,0,0|1,0,0]=3 6500 B12R0.101 CCCNC(=O)NCC(O)COC 47b38987721ef72ae44c05f30aeddac0 [0,2,0,0,0,0|2,0,0]=4 6501 B12R0.101 CCCNC(=O)NC[C@H](O)COC 164aa61fa0671d136cdb59d4771dcb1c [0,2,0,0,0,0|2,0,0]=4 6502 B12R0.101 CCCNC(=S)NCC(O)CCC 13283e76e0a11f55005d89a70b2a2ad0 [0,2,0,0,0,0|1,1,0]=4 6503 B12R0.101 CCCOC(=O)CNC(C)CC#N c56da5825508c33e1346a642cba77e2f [0,2,0,0,0,0|1,0,1]=4 6504 B12R0.101 CCCOC(=O)CNC(C)CCC 746f183b42d85a347accbb81d0eb0800 [0,2,0,0,0,0|0,0,0]=2 6505 B12R0.101 CCCOC(=O)CNC(C)CCO 450ca32a40262b67415d2a03b15ea161 [0,2,0,0,0,0|1,0,0]=3 6506 B12R0.101 CCCOC(=O)CNC(C)COC 449822c44e0105a5e7bd09fae5c692a3 [0,2,0,0,0,0|1,0,0]=3 6507 B12R0.101 CCCOC(=O)CN[C@@H](C)CCC d4cf9b1de02fd8ec729e20ec2db9f89a [0,2,0,0,0,0|0,0,0]=2 6508 B12R0.101 CCCOC(=O)CN[C@@H](C)CCO 91cc321afd5efd88fd9880eb69a6584e [0,2,0,0,0,0|1,0,0]=3 6509 B12R0.101 CCCOC(=O)CN[C@@H](C)COC 2f40c0c7e35d8a971eaae8bec96f316c [0,2,0,0,0,0|1,0,0]=3 6510 B12R0.101 CCCOC(=O)CN[C@H](C)CCO 31b6bea39decd8947f71d1e00f3ddf5d [0,2,0,0,0,0|1,0,0]=3 6511 B12R0.101 CCCOC(=O)CN[C@H](C)COC 9574891eee346a88a596167ec77d50fd [0,2,0,0,0,0|1,0,0]=3 6512 B12R0.101 CCCOC(=O)COC(=S)CCC 796854fda9933326f14f0d4cb2dba154 [0,2,0,0,0,0|0,0,1]=3 6513 B12R0.101 CCCOC(=O)COC(C)CC#N 35dcd6e7472a191c3e7d2876e8eab674 [0,2,0,0,0,0|1,0,1]=4 6514 B12R0.101 CCCOC(=O)COC(C)CCC fddb2efa9c62def952a18283c19cd5c6 [0,2,0,0,0,0|0,0,0]=2 6515 B12R0.101 CCCOC(=O)COC(C)COC 5f59597320aa76eb299c9a42cf5ea58e [0,2,0,0,0,0|1,0,0]=3 6516 B12R0.101 CCCOC(=O)COC(C)CSC 449143bf00ae42eb94c16bf6ecd8aa3b [0,2,0,0,0,0|1,0,0]=3 6517 B12R0.101 CCCOC(=O)CO[C@@H](C)CC#N 8c7e07804686417aba8d64cced2175d7 [0,2,0,0,0,0|1,0,1]=4 6518 B12R0.101 CCCOC(=O)CO[C@@H](C)CCC fc6f24d65b222cc1dd99460d89600c2b [0,2,0,0,0,0|0,0,0]=2 6519 B12R0.101 CCCOC(=O)CO[C@@H](C)COC a95247d4d75a9b6b5b30d3d15b5712fe [0,2,0,0,0,0|1,0,0]=3 6520 B12R0.101 CCCOC(=O)CO[C@H](C)CC#N 939bd6bcc90ac87b33c1f8132ee7d6be [0,2,0,0,0,0|1,0,1]=4 6521 B12R0.101 CCCOC(=O)CO[C@H](C)CCC 1710f81efb242596dffd6ea3c319eb94 [0,2,0,0,0,0|0,0,0]=2 6522 B12R0.101 CCCOC(=O)CO[C@H](C)COC 692b5850fc860c189139b09f046b8dcc [0,2,0,0,0,0|1,0,0]=3 6523 B12R0.101 CCCOC(=O)OCN(C)CCC 7eb7f182f538333a80024360ea39e0cb [0,2,0,0,0,0|1,0,0]=3 6524 B12R0.101 CCCOC(=O)OCN(C)CCF 0633ed5e04773252a9404c7484573c4f [0,2,0,0,0,0|2,0,0]=4 6525 B12R0.101 CCCOC(=O)OCN(C)CCO 08a51650f27c88df8d3d4387cc2d2950 [0,2,0,0,0,0|2,0,0]=4 6526 B12R0.101 CCC[C@@H](C)CCC(=O)NCCBr 34e6c0de5287a1d51a3697f4c1313a02 [0,2,0,0,0,0|2,0,0]=4 6527 B12R0.101 CCC[C@@H](C)CCC(=O)NCCF 118f60baa4650ac65ef257f34051f526 [0,2,0,0,0,0|2,0,0]=4 6528 B12R0.101 CCC[C@@H](C)CCC(=O)NCCI 22e88e46f0d7e2e14f0f563caa81d00f [0,2,0,0,0,0|2,0,0]=4 6529 B12R0.101 CCC[C@@H](C)CCC(=O)NCCO a565350b70a7bb449de1a9b5caca248b [0,2,0,0,0,0|2,0,0]=4 6530 B12R0.101 CCC[C@@H](C)CCC(=O)NCCS d2c41f0e646eb3644fd754f2f6f42b5b [0,2,0,0,0,0|2,0,0]=4 6531 B12R0.101 CCC[C@@H](C)OCC(=O)CCSC c7d0e5ccc2a4eb9d1385fbb07ed882a2 [0,2,0,0,0,0|2,0,0]=4 6532 B12R0.101 CCC[C@H](C)NCC(=O)CCSC ade27b68b219747790862648aed4b1d8 [0,2,0,0,0,0|2,0,0]=4 6533 B12R0.101 CCC[C@H](C)OCC(=O)CCSC fc0f5b970b81f56950fb6fb643fe63d6 [0,2,0,0,0,0|2,0,0]=4 6534 B12R0.133 C#CC(CC)OCC(=O)NCCC 5137442bed8e489aa6ccf6fc8548a8a9 [0,2,0,0,0,0|2,0,0]=4 6535 B12R0.133 C#CC(CC)OCC(=O)OCCC e9713095c9352f579d51d3ed080fbc49 [0,2,0,0,0,0|1,0,0]=3 6536 B12R0.133 C=CC(CC)OCC(=O)NCCC b5f562c0866c380096c145881b3ee4c3 [0,2,0,0,0,0|2,0,0]=4 6537 B12R0.133 C=CC(CC)OCC(=O)OCCC 8c01149744c8b7087762a41d193858dc [0,2,0,0,0,0|1,0,0]=3 6538 B12R0.133 C=C[C@@H](CO)NCC(=O)OCCC 258bde00ae649a4db24644bd5892fb9e [0,2,0,0,0,0|2,0,0]=4 6539 B12R0.133 CCC(C=O)CCC(=O)NCCBr 8088c3faad890832f6ff2cb268937c41 [0,2,0,0,0,0|2,0,0]=4 6540 B12R0.133 CCC(C=O)CCC(=O)NCCF ddab7b121cb41835c9d3d97db607c56b [0,2,0,0,0,0|2,0,0]=4 6541 B12R0.133 CCC(C=O)CCC(=O)NCCI 13d5c356d63877139d59d0a03e1b014c [0,2,0,0,0,0|2,0,0]=4 6542 B12R0.133 CCC(C=O)CCC(=O)NCCO 4e34fec5c5031c49c41e8b18d4430a78 [0,2,0,0,0,0|2,0,0]=4 6543 B12R0.133 CCC(C=O)CCC(=O)NCCS 1cbf1f50baec92766ad8e2b03d8d5482 [0,2,0,0,0,0|2,0,0]=4 6544 B12R0.133 CCC(CC)CCC(=O)NCCBr 97e189cb3081e3b2eeb61f79921bbfc3 [0,2,0,0,0,0|2,0,0]=4 6545 B12R0.133 CCC(CC)CCC(=O)NCCF 3c031179089375c51a4405556a35c4e5 [0,2,0,0,0,0|2,0,0]=4 6546 B12R0.133 CCC(CC)CCC(=O)NCCI c4c890781b3be68efb80cce13cc90dc1 [0,2,0,0,0,0|2,0,0]=4 6547 B12R0.133 CCC(CC)CCC(=O)NCCO 8620a3582230fd99888a057e62e1fa52 [0,2,0,0,0,0|2,0,0]=4 6548 B12R0.133 CCC(CC)CCC(=O)NCCS 2634cc04282173af827df5a598d6a399 [0,2,0,0,0,0|2,0,0]=4 6549 B12R0.133 CCCCC(=O)NCC(CC)CC 2585237eeb5ac4a459303bb73fafc700 [0,2,0,0,0,0|2,0,0]=4 6550 B12R0.133 CCCCC(=O)NCC(CC)CO f08f88cf6700971e05d09d079ef7c411 [0,2,0,0,0,0|2,0,0]=4 6551 B12R0.133 CCCNC(=O)CCC(C=O)CC b1d69bf78e6e81930cc02ab59629867e [0,2,0,0,0,0|1,0,0]=3 6552 B12R0.133 CCCNC(=O)CCC(CC)CC 88a26c0e567426b78a164bd4953c9571 [0,2,0,0,0,0|1,0,0]=3 6553 B12R0.133 CCCNC(=O)CCC(OC)OC fbeafc21d344fe5a8301a9e3a1ab9f6c [0,2,0,0,0,0|2,0,0]=4 6554 B12R0.133 CCCNC(=O)CCN(CC)CC 16362fcbd2accca540b35936d21ebe3e [0,2,0,0,0,0|2,0,0]=4 6555 B12R0.133 CCCNC(=O)CNC(C=O)CC 1791d9c55be56fb20016ab132082bcc9 [0,2,0,0,0,0|2,0,0]=4 6556 B12R0.133 CCCNC(=O)CNC(CC)CC 174bd8385795598aca4883717b277297 [0,2,0,0,0,0|2,0,0]=4 6557 B12R0.133 CCCNC(=O)CNC(CC)CO 1d4f2c8f07bfadb09d8513a8261aa7c5 [0,2,0,0,0,0|2,0,0]=4 6558 B12R0.133 CCCNC(=O)CN[C@@H](CC)CO cb8df91337dd8289545438fb2c5143bb [0,2,0,0,0,0|2,0,0]=4 6559 B12R0.133 CCCNC(=O)CN[C@H](CC)CO 8aa61304b1ae645de4467791a619a5a1 [0,2,0,0,0,0|2,0,0]=4 6560 B12R0.133 CCCNC(=O)COC(C#N)CC fb545812d5da9c519dd8f8576b2a4380 [0,2,0,0,0,0|2,0,0]=4 6561 B12R0.133 CCCNC(=O)COC(CC)CC e4904cd363de22b2c5b44cdf5de15db7 [0,2,0,0,0,0|2,0,0]=4 6562 B12R0.133 CCCNC(=O)NCC(CC)CC f3bf8dbebd516d35d3f4c0195d3db00d [0,2,0,0,0,0|2,0,0]=4 6563 B12R0.133 CCCNC(=O)NCC(CC)CO 679be2a09d7cfd4530ccb493ff2bbe1c [0,2,0,0,0,0|2,0,0]=4 6564 B12R0.133 CCCOC(=O)CNC(CC)CC 497e09f3d03905b95755a6ca6c02c08e [0,2,0,0,0,0|1,0,0]=3 6565 B12R0.133 CCCOC(=O)CNC(CC)CO c5dc52ca32f021b1f4e382a10a9903ce [0,2,0,0,0,0|1,0,0]=3 6566 B12R0.133 CCCOC(=O)CNC(CO)CO c96a8835392ca555f4057e90c5358568 [0,2,0,0,0,0|2,0,0]=4 6567 B12R0.133 CCCOC(=O)CN[C@@H](CC)CO aa76adac814bef86d11945a95dfd9102 [0,2,0,0,0,0|1,0,0]=3 6568 B12R0.133 CCCOC(=O)CN[C@H](CC)CO 4ce77499d1584f859f235d47b34d241c [0,2,0,0,0,0|1,0,0]=3 6569 B12R0.133 CCCOC(=O)COC(C#N)CC 84d402d7ed7fe66cfa4014814854ad2d [0,2,0,0,0,0|1,0,0]=3 6570 B12R0.133 CCCOC(=O)COC(CBr)CBr aa20586e39da02ca8477767bfa44756e [0,2,0,0,0,0|2,0,0]=4 6571 B12R0.133 CCCOC(=O)COC(CC)CC e0497d8f86cb8ce56903ab186f09dea1 [0,2,0,0,0,0|1,0,0]=3 6572 B12R0.133 CCCOC(=O)COC(CCl)CBr 5562f7f26d813c5a471c3c5967e0977b [0,2,0,0,0,0|2,0,0]=4 6573 B12R0.133 CCCOC(=O)COC(CCl)CCl 09d3dc409502180ff2745e2208e4affd [0,2,0,0,0,0|2,0,0]=4 6574 B12R0.133 CCCOC(=O)COC(CF)CF 5d57c24c37de1294f7dfcff32a3328a7 [0,2,0,0,0,0|2,0,0]=4 6575 B12R0.133 CCCOC(=O)CO[C@@H](CCl)CI 3e2c86aedc0c3e3529758c36faa6347b [0,2,0,0,0,0|2,0,0]=4 6576 B12R0.133 CCCOC(=O)CO[C@H](CCl)CI af5804d177380b3eca76176f8b3903fe [0,2,0,0,0,0|2,0,0]=4 6577 B12R0.147 CCC(=O)CCC(=O)NC(C)CC 9f79dfa69f632ee3da8986ff3b3a9d1a [0,2,0,0,0,0|1,0,1]=4 6578 B12R0.147 CCC(=O)CCC(=O)N[C@@H](C)CC 331113549725cf3536e9ced41d7a1e25 [0,2,0,0,0,0|1,0,1]=4 6579 B12R0.147 CCC(=O)CCC(=O)N[C@H](C)CC 9111774324da63b8996b7e0242fcf61f [0,2,0,0,0,0|1,0,1]=4 6580 B12R0.147 CCC(C)CC(=O)NCC(O)CC c2d2d70315570f5a2dff515951de9846 [0,2,0,0,0,0|2,0,0]=4 6581 B12R0.147 CCC(C)CC(=O)NC[C@@H](C)CC e35fd29da519a4c7fc7f17a012d5b672 [0,2,0,0,0,0|2,0,0]=4 6582 B12R0.147 CCC(C)CC(=O)NC[C@H](O)CC b23daf148779e04988d9fd0eb7bf3f03 [0,2,0,0,0,0|2,0,0]=4 6583 B12R0.147 CCC(C)CCC(=O)NC(C)CC dead02aec7bd84b5cf4357d736086744 [0,2,0,0,0,0|1,0,0]=3 6584 B12R0.147 CCC(C)CCC(=O)NC(C)CO 976ba55ab9e2bb8ffdd3025a4cee2bc0 [0,2,0,0,0,0|2,0,0]=4 6585 B12R0.147 CCC(C)CCC(=O)N[C@@H](C)CC e3c5d94f9616fb5c050de07a439018f0 [0,2,0,0,0,0|1,0,0]=3 6586 B12R0.147 CCC(C)CCC(=O)N[C@@H](C)CO 80120e35583ddbbc1af2326a5c1a2ae4 [0,2,0,0,0,0|2,0,0]=4 6587 B12R0.147 CCC(C)CCC(=O)N[C@H](C)CC 6667000db726b98a84354c174eb07d9d [0,2,0,0,0,0|1,0,0]=3 6588 B12R0.147 CCC(C)CCC(=O)N[C@H](C)CO 4ee06312e9ac70f6a0a13d2a1c866378 [0,2,0,0,0,0|2,0,0]=4 6589 B12R0.147 CCC(C)CCC(C)OC(C)CC 6c8279f9fca3c5707a5ca085dd54115e [0,2,0,0,0,0|1,0,1]=4 6590 B12R0.147 CCC(C)CNC(=O)CC(C)CC dc011a3de2517fdccdd02aa9f3549f8e [0,2,0,0,0,0|2,0,0]=4 6591 B12R0.147 CCC(C)CNC(=O)CC(O)CC fb64357a90019946c4808401ffca1975 [0,2,0,0,0,0|2,0,0]=4 6592 B12R0.147 CCC(C)CNC(=O)C[C@@H](C)CC fc9a153a8ede8c68ed51021ef5cadccd [0,2,0,0,0,0|2,0,0]=4 6593 B12R0.147 CCC(C)CNC(=O)C[C@@H](O)CC fe99103df97cff8b4c7483861962be44 [0,2,0,0,0,0|2,0,0]=4 6594 B12R0.147 CCC(C)CNC(=O)C[C@H](C)CC 8f366e449074706180450d82e0fed1f2 [0,2,0,0,0,0|2,0,0]=4 6595 B12R0.147 CCC(C)CNC(=O)C[C@H](O)CC 79c17e3d1c78e37389af4d14410a4872 [0,2,0,0,0,0|2,0,0]=4 6596 B12R0.147 CCC(C)CNC(=O)NC(C)CC e6b5998931c4e344654865fdc35a269c [0,2,0,0,0,0|2,0,0]=4 6597 B12R0.147 CCC(C)CNC(=O)N[C@@H](C)CC 8dd31f304d5bfaa724d452f0381cc980 [0,2,0,0,0,0|2,0,0]=4 6598 B12R0.147 CCC(C)CNC(=O)N[C@H](C)CC d6e120c337701607dd9f629409bb393a [0,2,0,0,0,0|2,0,0]=4 6599 B12R0.147 CCC(C)NC(=O)CCN(C)CC 375453daf90f03c7f85a4018a3c640dd [0,2,0,0,0,0|2,0,0]=4 6600 B12R0.147 CCC(C)NC(=O)CCS(=O)CC 5836b7f9475611c83737240a9b6d41c3 [0,2,0,0,0,0|2,0,0]=4 6601 B12R0.147 CCC(C)NC(=O)CN[C@@H](C)CC d1c7ba7216cc2d6b1a1257af3ca66883 [0,2,0,0,0,0|2,0,0]=4 6602 B12R0.147 CCC(C)NC(=O)CN[C@H](C)CC d5c9e7c75e221289bfb350b5168c2944 [0,2,0,0,0,0|2,0,0]=4 6603 B12R0.147 CCC(C)NC(=O)COC(C)CC 373163cc7ccb86125af94d73d3411548 [0,2,0,0,0,0|2,0,0]=4 6604 B12R0.147 CCC(C)NC(=O)CO[C@@H](C)CC f4a7ca5258a21ce895f063cd620ec4b2 [0,2,0,0,0,0|2,0,0]=4 6605 B12R0.147 CCC(C)NC(=O)CO[C@H](C)CC 236b99976d667598ef08f31f984f841e [0,2,0,0,0,0|2,0,0]=4 6606 B12R0.147 CCC(C)NC(=O)NC[C@@H](C)CC c15dc0589e1315c235bd11855c719af6 [0,2,0,0,0,0|2,0,0]=4 6607 B12R0.147 CCC(C)NC(=O)NC[C@H](O)CC 9b07c1d222029c3043bd2f7faabc0e83 [0,2,0,0,0,0|2,0,0]=4 6608 B12R0.147 CCC(C)NCC(=O)NC(C)CC 033e1bec34f69d7fb21b3df86299735d [0,2,0,0,0,0|2,0,0]=4 6609 B12R0.147 CCC(C)OCC(=O)N[C@@H](C)CC f69ad6f0197d03eb2e146016a753ab24 [0,2,0,0,0,0|2,0,0]=4 6610 B12R0.147 CCC(C)OCC(=O)N[C@H](C)CC fae5531cb8ad89ae6d42346cf085cbe7 [0,2,0,0,0,0|2,0,0]=4 6611 B12R0.147 CCC(O)CC(=O)NC[C@@H](C)CC 9df679d8b5d747ffc3ece770784c487d [0,2,0,0,0,0|2,0,0]=4 6612 B12R0.147 CCC(O)CC(=O)NC[C@H](O)CC 22418230b7156dff490cbbc96337ad2b [0,2,0,0,0,0|2,0,0]=4 6613 B12R0.147 CCC(O)CNC(=O)CC(O)CC fed976b1b1694c5c259eccbd87ac1d75 [0,2,0,0,0,0|2,0,0]=4 6614 B12R0.147 CCC(O)CNC(=O)C[C@@H](C)CC b8d39a1640c56390c038bfd1f386069f [0,2,0,0,0,0|2,0,0]=4 6615 B12R0.147 CCC(O)CNC(=O)C[C@@H](O)CC 9ed325860b56002fbd33d7ae38d159fd [0,2,0,0,0,0|2,0,0]=4 6616 B12R0.147 CCC(O)CNC(=O)C[C@H](C)CC 89ef80bed593cff992005567f4e284f4 [0,2,0,0,0,0|2,0,0]=4 6617 B12R0.147 CCC(O)CNC(=O)C[C@H](O)CC 4e175628e761e9e636501b35cba17d9e [0,2,0,0,0,0|2,0,0]=4 6618 B12R0.147 CCC(O)CNC(=O)NC(C)CC e917203a8ef0b9b77ecc8a596df2d02e [0,2,0,0,0,0|2,0,0]=4 6619 B12R0.147 CCC(O)CNC(=O)N[C@@H](C)CC 8ea8a681d631085d8a9738ca70379b85 [0,2,0,0,0,0|2,0,0]=4 6620 B12R0.147 CCC(O)CNC(=O)N[C@H](C)CC 891b91f41d3d4bd587960ae2c1779eec [0,2,0,0,0,0|2,0,0]=4 6621 B12R0.147 CC[C@@H](C)CC(=O)NC[C@@H](C)CC 0091c7ad7c305d2069a55a36d8a491dd [0,2,0,0,0,0|2,0,0]=4 6622 B12R0.147 CC[C@@H](C)CC(=O)NC[C@H](O)CC 73c603597e4814c20c61a10f04ed6456 [0,2,0,0,0,0|2,0,0]=4 6623 B12R0.147 CC[C@@H](C)NC(=O)CCN(C)CC 913395fdba5114a2be25035843e7dd72 [0,2,0,0,0,0|2,0,0]=4 6624 B12R0.147 CC[C@@H](C)NC(=O)CCS(=O)CC 39f944f1defa643ed233f4a3112ac7de [0,2,0,0,0,0|2,0,0]=4 6625 B12R0.147 CC[C@@H](O)CNC(=O)C[C@@H](O)CC ac3185e989e65b6214a9f454d2bcaa51 [0,2,0,0,0,0|2,0,0]=4 6626 B12R0.147 CC[C@@H](O)CNC(=O)C[C@H](O)CC e747e4342c59ab5d6493fd00bf894007 [0,2,0,0,0,0|2,0,0]=4 6627 B12R0.147 CC[C@@H](O)CNC(=O)N[C@@H](C)CC c8d7aac9a1113b814c60457dceec27b9 [0,2,0,0,0,0|2,0,0]=4 6628 B12R0.147 CC[C@@H](O)CNC(=O)N[C@H](C)CC b6a49f31a32ae2cf46aee3744600361e [0,2,0,0,0,0|2,0,0]=4 6629 B12R0.147 CC[C@H](C)CC(=O)NC[C@H](O)CC 25b69034f3ad382cd9e84ecfde5f4ab8 [0,2,0,0,0,0|2,0,0]=4 6630 B12R0.147 CC[C@H](C)CNC(=O)C[C@@H](C)CC c628ed8821e3aecc3201aa7288713542 [0,2,0,0,0,0|2,0,0]=4 6631 B12R0.147 CC[C@H](C)CNC(=O)C[C@@H](O)CC f1d1488f8e83f6cd1f5f6ef0f1018e19 [0,2,0,0,0,0|2,0,0]=4 6632 B12R0.147 CC[C@H](C)CNC(=O)C[C@H](O)CC 760e4526ccdd9d18ff5d239245737467 [0,2,0,0,0,0|2,0,0]=4 6633 B12R0.147 CC[C@H](C)CNC(=O)N[C@@H](C)CC 61176f920e46b6bd8e5789154be495a4 [0,2,0,0,0,0|2,0,0]=4 6634 B12R0.147 CC[C@H](C)CNC(=O)N[C@H](C)CC 77208d14699d6da07d45c530533e7e9e [0,2,0,0,0,0|2,0,0]=4 6635 B12R0.147 CC[C@H](C)NC(=O)CCN(C)CC 7b57ff9d761d1537f2d31b3570618189 [0,2,0,0,0,0|2,0,0]=4 6636 B12R0.147 CC[C@H](C)NC(=O)CCS(=O)CC a3d31d8211478b3a55e2bfa7f7ebb64c [0,2,0,0,0,0|2,0,0]=4 6637 B12R0.193 C=C(CCC)C(=O)NCC(C)CC 1ea5475d0338ce73b62f914d38a5e800 [0,2,0,0,0,0|2,0,0]=4 6638 B12R0.193 C=C(CCC)C(=O)NCC(O)CC 053843b8640008c853e1ca6c7bfc4f2e [0,2,0,0,0,0|2,0,0]=4 6639 B12R0.193 C=C(CCC)C(=O)NC[C@@H](C)CC 3fd3949f86f05fed404b36165d411a2a [0,2,0,0,0,0|2,0,0]=4 6640 B12R0.193 C=C(CCC)C(=O)NC[C@H](O)CC f60734cfb2631dedb5b8251b9e538cfa [0,2,0,0,0,0|2,0,0]=4 6641 B12R0.193 CCC(C)CCC(=O)N(C)CCF 49e0de35ef9b2c8a3262e2790df16a1c [0,2,0,0,0,0|2,0,0]=4 6642 B12R0.193 CCC(C)CCC(=O)N(C)CCO 6981b99dcf0af51507557228f30b1594 [0,2,0,0,0,0|2,0,0]=4 6643 B12R0.193 CCCC(=O)C(=O)NCC(C)CC d5ea47a58681836b302c58509fab755f [0,2,0,0,0,0|2,0,0]=4 6644 B12R0.193 CCCC(=O)C(=O)NCC(O)CC fc5be6cb8007805ee4bde7e043828f78 [0,2,0,0,0,0|2,0,0]=4 6645 B12R0.193 CCCC(=O)C(=O)NC[C@@H](C)CC 3ecc388c8511c652b6eb2cc4c75d02f7 [0,2,0,0,0,0|2,0,0]=4 6646 B12R0.193 CCCC(=O)C(=O)NC[C@H](O)CC 25e597260f585a6feeccfc4563442a11 [0,2,0,0,0,0|2,0,0]=4 6647 B12R0.193 CCCC(O)C(=O)NCC(C)CC 36a5ab4b3455234463e49ba1ed46ad49 [0,2,0,0,0,0|2,0,0]=4 6648 B12R0.193 CCCC(O)C(=O)NCC(O)CC db09f747f96d44299de3a9d72b44acc0 [0,2,0,0,0,0|2,0,0]=4 6649 B12R0.193 CCCC(O)C(=O)NC[C@@H](C)CC cd44ff88f1daa2469662733be96793ff [0,2,0,0,0,0|2,0,0]=4 6650 B12R0.193 CCCC(O)C(=O)NC[C@H](O)CC 4701b56f9b1c3a6df5130b3041767f63 [0,2,0,0,0,0|2,0,0]=4 6651 B12R0.193 CCCN(C)C(=O)CCC(=O)CC f7652482860ccb144ec26457c307687e [0,2,0,0,0,0|1,0,1]=4 6652 B12R0.193 CCCN(C)C(=O)CCC(C)CC 200c0e7106f1cb38d7d7aa3f53245f29 [0,2,0,0,0,0|1,0,0]=3 6653 B12R0.193 CCCN(C)C(=O)CCN(C)CC 1294ac9f1d162ffbab9e70dfca0b3162 [0,2,0,0,0,0|2,0,0]=4 6654 B12R0.193 CCCN(C)C(=O)CCS(=O)CC 1611799ba8b214af0f7704c618b0d475 [0,2,0,0,0,0|2,0,0]=4 6655 B12R0.193 CCCN(C)C(=O)COC(C)CC d480247b905f31b4c1127c16bd700cd1 [0,2,0,0,0,0|2,0,0]=4 6656 B12R0.193 CCCN(C)C(=O)NCC(C)CC 0be734ee945c658b31fbd402f19f4c78 [0,2,0,0,0,0|2,0,0]=4 6657 B12R0.193 CCCN(C)C(=O)NCC(O)CC 80439a6beeb091d3585ba6c63e358b34 [0,2,0,0,0,0|2,0,0]=4 6658 B12R0.193 CCCN(C)C(=O)NC[C@@H](C)CC fab0b0985fc9697ac53e91e6e31e3717 [0,2,0,0,0,0|2,0,0]=4 6659 B12R0.193 CCCN(C)C(=O)NC[C@H](O)CC 31f5d225fc964301758ee350a05b5ca9 [0,2,0,0,0,0|2,0,0]=4 6660 B12R0.193 CCC[C@@H](O)C(=O)NCC(C)CC 993138f0d79d8b7d0c9eba5b005bc097 [0,2,0,0,0,0|2,0,0]=4 6661 B12R0.193 CCC[C@@H](O)C(=O)NCC(O)CC cebe822a5f35903b2a6e69a158ec4abf [0,2,0,0,0,0|2,0,0]=4 6662 B12R0.193 CCC[C@@H](O)C(=O)NC[C@@H](C)CC 25c94b63176e264c585d1c5abce2565b [0,2,0,0,0,0|2,0,0]=4 6663 B12R0.193 CCC[C@@H](O)C(=O)NC[C@H](O)CC de16f64b5d4d8667407398aaafdc291d [0,2,0,0,0,0|2,0,0]=4 6664 B12R0.193 CCC[C@H](O)C(=O)NCC(C)CC 9ff66493ef45095af5731950e54a9aa1 [0,2,0,0,0,0|2,0,0]=4 6665 B12R0.193 CCC[C@H](O)C(=O)NCC(O)CC ce9d226a1527a36b8765bad8962b2509 [0,2,0,0,0,0|2,0,0]=4 6666 B12R0.193 CCC[C@H](O)C(=O)NC[C@@H](C)CC c4bc04f612d01161049ddb0c004da44f [0,2,0,0,0,0|2,0,0]=4 6667 B12R0.193 CCC[C@H](O)C(=O)NC[C@H](O)CC 6a0182c1d108ab384462096f23b80677 [0,2,0,0,0,0|2,0,0]=4 6668 B12R0.47 C#CCCCC(=O)NCCCCC 08e0dd6d6b88e465519bbaa1758fea68 [0,2,0,0,0,0|1,0,1]=4 6669 B12R0.47 C#CCCCCC(=O)NCCCC d73a4d193e533875de1823634473f695 [0,2,0,0,0,0|1,0,1]=4 6670 B12R0.47 C#CCCCCC(=O)NCCCCl aa0bee1f2f1ba825cafaa86b069aaea2 [0,2,0,0,0,0|1,0,1]=4 6671 B12R0.47 C#CCCCCC(=O)NCCCO 08db3bca05f6bc9574c4fbac4eb19956 [0,2,0,0,0,0|1,0,1]=4 6672 B12R0.47 C#CCCCCC(=O)NCCOC 50ddad2fef34f87d12ee4f3d14c95ccb [0,2,0,0,0,0|1,0,1]=4 6673 B12R0.47 C#CCCCCC(=O)NCCSC ee197a3c53dd81cf78b0fa5549a48f75 [0,2,0,0,0,0|1,0,1]=4 6674 B12R0.47 C#CCCCNC(=O)CCCCC 7376604cf3938f8456e9b5a9597e3ab8 [0,2,0,0,0,0|1,0,0]=3 6675 B12R0.47 C#CCCCNC(=O)CCCCF 547dbb11a2913d44581f7eb6547a89e7 [0,2,0,0,0,0|2,0,0]=4 6676 B12R0.47 C#CCCCNC(=O)CCCCO 3b94b0ea9e6bf5166f8cb56c4b82e84a [0,2,0,0,0,0|2,0,0]=4 6677 B12R0.47 C#CCCCNC(=O)CCCCS f9904b6ced94ca0b2a4de08c5758fc76 [0,2,0,0,0,0|2,0,0]=4 6678 B12R0.47 C#CCCCNC(=O)CCCOC ca153ba177b2d0aa526640528dae1451 [0,2,0,0,0,0|2,0,0]=4 6679 B12R0.47 C#CCCCNC(=O)CCCSC 4671c054e633c895cc7bd75c8e2ba54c [0,2,0,0,0,0|2,0,0]=4 6680 B12R0.47 C#CCCCNC(=O)CCOCC c697e6839f6939c24aff6fb33f0c0d50 [0,2,0,0,0,0|2,0,0]=4 6681 B12R0.47 C#CCCCNC(=O)CCSCC 74aaf249ee4079ecc2566378fea0c71a [0,2,0,0,0,0|2,0,0]=4 6682 B12R0.47 C#CCCCNC(=O)COCCC 3e60b27513fe9dc6fce9184431aeb641 [0,2,0,0,0,0|0,0,2]=4 6683 B12R0.47 C#CCCCNC(=O)CSCCC 276682d7bea1bbc3b8a6540840fc45a7 [0,2,0,0,0,0|2,0,0]=4 6684 B12R0.47 C#CCCCNC(=O)NCCCC 2def0837c4c83cd8b06470944718852c [0,2,0,0,0,0|2,0,0]=4 6685 B12R0.47 C#CCCCOC(C)CCCCC 7ae0c70b60292c134c3e8e85b7d7a129 [0,2,0,0,0,0|1,0,1]=4 6686 B12R0.47 C#CCCCO[C@@H](C)CCCCC b239dcf668fa9e42d8c6be2c98918d78 [0,2,0,0,0,0|1,0,1]=4 6687 B12R0.47 C#CCCCO[C@H](C)CCCCC 1d069b14bf12e9799112ad8b84be1414 [0,2,0,0,0,0|1,0,1]=4 6688 B12R0.47 C#CCCNC(=O)CCCCCC 4a02c378c4d3d0c44fc1219dcf58c506 [0,2,0,0,0,0|1,0,1]=4 6689 B12R0.47 C#CCCNC(=O)CCCCCF 61e78ecffb19f4e532f343d05bd53202 [0,2,0,0,0,0|1,0,1]=4 6690 B12R0.47 C#CCCNC(=O)CCCCCO fc4a33aa9b433ded649db03bfd0232d5 [0,2,0,0,0,0|1,0,1]=4 6691 B12R0.47 C#CCCNC(=O)CCCCCS 48b3bf439aaa754df31afd222cc7a546 [0,2,0,0,0,0|1,0,1]=4 6692 B12R0.47 C#CCCNC(=O)CCOCCC 1e958f7c7be8fe1e6546c21cecc6af62 [0,2,0,0,0,0|1,0,1]=4 6693 B12R0.47 C#CCCNC(=O)COCCCC 7e540f707cf72e0efd6361218ee304b8 [0,2,0,0,0,0|1,0,1]=4 6694 B12R0.47 C#CCCNC(=O)CSCCCC 3db15d841ab3f65fc13af8a77a0a46e5 [0,2,0,0,0,0|1,0,1]=4 6695 B12R0.47 C#CCCNC(=O)NCCCCC c61fa0d7383c7c7fec74b342ef9d698d [0,2,0,0,0,0|1,0,1]=4 6696 B12R0.47 C#CCCNCC(=O)CCCCC 74be95c651027758b7032034d98d8821 [0,2,0,0,0,0|1,0,1]=4 6697 B12R0.47 C#CCCNCC(=O)OCCCC fc1d1d5a8050cb242447a27dd798e96f [0,2,0,0,0,0|0,0,2]=4 6698 B12R0.47 C#CCCNCC(=O)OCCOC d6cfebbaaab933ae84ba7080b50c8d75 [0,2,0,0,0,0|0,0,2]=4 6699 B12R0.47 C#CCCOCC(=O)CCCCC 78f0aa522c4cb782294eaceae7baf404 [0,2,0,0,0,0|0,0,1]=3 6700 B12R0.47 C#CCCOCC(=O)NCCCC b4c6d2e31620d0ad082ce9157db162e6 [0,2,0,0,0,0|1,0,1]=4 6701 B12R0.47 C#CCCOCC(=O)OCCCC 4bce2c5232e1a894df1f70a241a3f157 [0,2,0,0,0,0|0,0,2]=4 6702 B12R0.47 C#CCCOCC(=O)OCCOC 0efc4340a0959e845f7705b234272efd [0,2,0,0,0,0|0,0,2]=4 6703 B12R0.47 C#CCNCOC(=O)OCCCC e59e267ccc03c2b96467d2d57c47133c [0,2,0,0,0,0|1,0,1]=4 6704 B12R0.47 C#CCOCC(=O)NCCCCC de4fdfb94ca8c1d5c77ed96500a874e8 [0,2,0,0,0,0|0,0,2]=4 6705 B12R0.47 C#CCOCOC(=O)CCCCC 2f16ea4c07146af47f83d9957c508eae [0,2,0,0,0,0|0,0,1]=3 6706 B12R0.47 C#CCOCOC(=O)OCCCC 47a1d9b908ca6c361479426e535d1882 [0,2,0,0,0,0|1,0,1]=4 6707 B12R0.47 C/C=C/CCCC(=O)NCCCC de2e6151ad5e5c2db5c8ced273ace592 [0,2,0,0,0,0|1,0,1]=4 6708 B12R0.47 C/C=C/CCCC(=O)NCCCCl c659cbb0f1158d90929eb80b672de454 [0,2,0,0,0,0|1,0,1]=4 6709 B12R0.47 C/C=C/CCCC(=O)NCCCO 2b7de33d94f907db8c8a6db1ed98b50f [0,2,0,0,0,0|1,0,1]=4 6710 B12R0.47 C/C=C/CCCC(=O)NCCOC b766acc11222c3cf76e3e36adbf23820 [0,2,0,0,0,0|1,0,1]=4 6711 B12R0.47 C/C=C/CCCC(=O)NCCSC aa0c7c1e4ca5c04a02acf3d32f8ac59f [0,2,0,0,0,0|1,0,1]=4 6712 B12R0.47 C/C=C/CCOC(C)CCCCC 67effb1e633e3c454500c4c310462a86 [0,2,0,0,0,0|1,0,1]=4 6713 B12R0.47 C/C=C/CCO[C@@H](C)CCCCC 3f1866cbc2013ac258c0944a99464171 [0,2,0,0,0,0|1,0,1]=4 6714 B12R0.47 C/C=C/COCC(=O)CCCCC 31b25c46885483731a91caae1e19c361 [0,2,0,0,0,0|0,0,1]=3 6715 B12R0.47 C/C=C/COCC(=O)NCCCC 9840e1d1134210e20c6f4ec95810118c [0,2,0,0,0,0|1,0,1]=4 6716 B12R0.47 C/C=C/COCC(=O)OCCCC b4504a28f2714ad0801fe2719da9cdaf [0,2,0,0,0,0|0,0,2]=4 6717 B12R0.47 C/C=C/COCC(=O)OCCOC b7d4010dee6b9fec75d9741370e3aecd [0,2,0,0,0,0|0,0,2]=4 6718 B12R0.47 C/C=C\COCC(=O)CCCCC 51cc3cabdd12315818b4739c0e613133 [0,2,0,0,0,0|0,0,1]=3 6719 B12R0.47 C/C=C\COCC(=O)NCCCC c7922b33fa134b871ebbfd6465c1407d [0,2,0,0,0,0|1,0,1]=4 6720 B12R0.47 C/C=C\COCC(=O)OCCCC 818e5df7f6638be7a67f104f1302ac40 [0,2,0,0,0,0|0,0,2]=4 6721 B12R0.47 C/C=C\COCC(=O)OCCOC 6523a40039c9ba6ac482f08c5008baad [0,2,0,0,0,0|0,0,2]=4 6722 B12R0.47 C=CCCCC(=O)NCCCCC 35f7b86e3b7179730738061e0bc46c65 [0,2,0,0,0,0|1,0,1]=4 6723 B12R0.47 C=CCCCCC(=O)NCCCC ae16224c884a0d1a85548b1cb9ab9ab8 [0,2,0,0,0,0|1,0,1]=4 6724 B12R0.47 C=CCCCCC(=O)NCCCCl cd3b6954277bd2c475fccca02ba9a759 [0,2,0,0,0,0|1,0,1]=4 6725 B12R0.47 C=CCCCCC(=O)NCCCO 05f6e9c44640034a48511a175bdd5be3 [0,2,0,0,0,0|1,0,1]=4 6726 B12R0.47 C=CCCCCC(=O)NCCOC a63d1f3370897178543a2749b5a7c83d [0,2,0,0,0,0|1,0,1]=4 6727 B12R0.47 C=CCCCCC(=O)NCCSC 69541ad94cc15521482db9302ddaed00 [0,2,0,0,0,0|1,0,1]=4 6728 B12R0.47 C=CCCCNC(=O)CCCCC 8df269842eb2de4b34f8d9e1b63c0841 [0,2,0,0,0,0|1,0,0]=3 6729 B12R0.47 C=CCCCNC(=O)CCCCF 458c4d5e6d8d27a8727d97073860f6e6 [0,2,0,0,0,0|2,0,0]=4 6730 B12R0.47 C=CCCCNC(=O)CCCCO 080821948dfb06517a2504aa29743354 [0,2,0,0,0,0|2,0,0]=4 6731 B12R0.47 C=CCCCNC(=O)CCCCS b5314861d6fb0de2ae79841ac2b1f094 [0,2,0,0,0,0|2,0,0]=4 6732 B12R0.47 C=CCCCNC(=O)CCCOC f93ad972678026bdb7aaf2ad7857c271 [0,2,0,0,0,0|2,0,0]=4 6733 B12R0.47 C=CCCCNC(=O)CCCSC f554277c41fdfe873ed15dd942b3e4a1 [0,2,0,0,0,0|2,0,0]=4 6734 B12R0.47 C=CCCCNC(=O)CCOCC 3932ad1671f82ea084e8c03d3344061a [0,2,0,0,0,0|2,0,0]=4 6735 B12R0.47 C=CCCCNC(=O)CCSCC 8496134757c32dc3b6cec709f9a8c345 [0,2,0,0,0,0|2,0,0]=4 6736 B12R0.47 C=CCCCNC(=O)COCCC ab93c7b9ef1ded918d8c4a976865af8e [0,2,0,0,0,0|0,0,2]=4 6737 B12R0.47 C=CCCCNC(=O)CSCCC b435d7496a92a9c9dd71fd1877ad2c04 [0,2,0,0,0,0|2,0,0]=4 6738 B12R0.47 C=CCCCNC(=O)NCCCC ba9920524e104d5066e2be480dd17fc9 [0,2,0,0,0,0|2,0,0]=4 6739 B12R0.47 C=CCCCOC(C)CCCCC 847ca658075082c596fb784ebbc8d077 [0,2,0,0,0,0|1,0,1]=4 6740 B12R0.47 C=CCCCO[C@@H](C)CCCCC e40e51aab928ce702a977ee62bd961a9 [0,2,0,0,0,0|1,0,1]=4 6741 B12R0.47 C=CCCCO[C@H](C)CCCCC e637125e5042674e214218fb4e9d0a2d [0,2,0,0,0,0|1,0,1]=4 6742 B12R0.47 C=CCCNC(=O)CCCCCC c330d4c5ae68fa976499c1601e8ba2fa [0,2,0,0,0,0|1,0,1]=4 6743 B12R0.47 C=CCCNC(=O)CCCCCF c0ea07a89a41e15e8aac4423ed8b04b2 [0,2,0,0,0,0|1,0,1]=4 6744 B12R0.47 C=CCCNC(=O)CCCCCO e5861a10230523c247dd285fac8da7bc [0,2,0,0,0,0|1,0,1]=4 6745 B12R0.47 C=CCCNC(=O)CCCCCS 3fd7e67a0e66522845d70891124dc360 [0,2,0,0,0,0|1,0,1]=4 6746 B12R0.47 C=CCCNC(=O)CCOCCC c5ed8551239ad0e9ee63a9494b7ff02a [0,2,0,0,0,0|1,0,1]=4 6747 B12R0.47 C=CCCNC(=O)COCCCC 97724e25f228474c670801596f86b6a9 [0,2,0,0,0,0|1,0,1]=4 6748 B12R0.47 C=CCCNC(=O)CSCCCC 7a2cd0a1cbb6ddef19f551a75191d09b [0,2,0,0,0,0|1,0,1]=4 6749 B12R0.47 C=CCCNC(=O)NCCCCC c0cfef3dd37f161d4a1e8548504a9613 [0,2,0,0,0,0|1,0,1]=4 6750 B12R0.47 C=CCCNCC(=O)CCCCC e4f073efa6ea18c00a76ccde591e3ffd [0,2,0,0,0,0|1,0,1]=4 6751 B12R0.47 C=CCCNCC(=O)OCCCC cdd9639c85abc9b07562f06999c95ef1 [0,2,0,0,0,0|0,0,2]=4 6752 B12R0.47 C=CCCNCC(=O)OCCOC dbf378b81aa54df148cf531679fdb516 [0,2,0,0,0,0|0,0,2]=4 6753 B12R0.47 C=CCCOCC(=O)CCCCC d79ebb7412b5600fe757f7758c5359d6 [0,2,0,0,0,0|0,0,1]=3 6754 B12R0.47 C=CCCOCC(=O)NCCCC c5f7dcded66d933852b8daa4873e88be [0,2,0,0,0,0|1,0,1]=4 6755 B12R0.47 C=CCCOCC(=O)OCCCC a6cb06eb5fa9d22a9e27483c1276d2c5 [0,2,0,0,0,0|0,0,2]=4 6756 B12R0.47 C=CCCOCC(=O)OCCOC c3566e69a92c82242299850088c7dbf1 [0,2,0,0,0,0|0,0,2]=4 6757 B12R0.47 C=CCOCC(=O)NCCCCC 9a0459c63f8525b2025a8268e820c0f0 [0,2,0,0,0,0|0,0,2]=4 6758 B12R0.47 C=COCCNC(=O)CCCCC 1a0a5a6d6c70aa4844cfe96dc7042f55 [0,2,0,0,0,0|1,0,1]=4 6759 B12R0.47 CC#CCCC(=O)NCCCCC b7a1665da6cbad6e4c9005283d08bae4 [0,2,0,0,0,0|1,0,1]=4 6760 B12R0.47 CC#CCCOC(C)CCCCC 8722ca8a34faadb92b0d10dbd662ca3f [0,2,0,0,0,0|1,0,1]=4 6761 B12R0.47 CC#CCCO[C@@H](C)CCCCC 33a37e4b861594a5427630eb6cc32292 [0,2,0,0,0,0|1,0,1]=4 6762 B12R0.47 CC#CCNC(=O)CCCCCC 180d6967215ad621444e7fd2416f2229 [0,2,0,0,0,0|1,0,1]=4 6763 B12R0.47 CC#CCNC(=O)CCCCCF f87d1dbae40043a9c994b05896ffc8d1 [0,2,0,0,0,0|1,0,1]=4 6764 B12R0.47 CC#CCNC(=O)CCCCCO b4fe721f9236c2a517e1e04a4aa19df9 [0,2,0,0,0,0|1,0,1]=4 6765 B12R0.47 CC#CCNC(=O)CCCCCS a22bfeb8653eb6eaec2792098bbe106e [0,2,0,0,0,0|1,0,1]=4 6766 B12R0.47 CC#CCNC(=O)CCOCCC 65346210680b82591e2034fdeb803829 [0,2,0,0,0,0|1,0,1]=4 6767 B12R0.47 CC#CCNC(=O)COCCCC 0c51c0878952dc3aecdae9a5a2c02127 [0,2,0,0,0,0|1,0,1]=4 6768 B12R0.47 CC#CCNC(=O)CSCCCC 7c28edb67e51d6f9e434503899abe38d [0,2,0,0,0,0|1,0,1]=4 6769 B12R0.47 CC#CCNC(=O)NCCCCC 87f3e44f93a14e93e18010976ffe97cf [0,2,0,0,0,0|1,0,1]=4 6770 B12R0.47 CC#CCNCC(=O)CCCCC 00da6ec7153f5b6b0a6cc7b1c20cd5d0 [0,2,0,0,0,0|1,0,1]=4 6771 B12R0.47 CC#CCNCC(=O)OCCCC 5e882de5abea1515a0c8091c2a1de143 [0,2,0,0,0,0|0,0,2]=4 6772 B12R0.47 CC#CCNCC(=O)OCCOC 82be6872953f3ffa470353e788c93246 [0,2,0,0,0,0|0,0,2]=4 6773 B12R0.47 CC#CCOCC(=O)CCCCC 3e7a540f8345263ffb23bd6b0b7f8f42 [0,2,0,0,0,0|0,0,1]=3 6774 B12R0.47 CC#CCOCC(=O)NCCCC a55211ab3032b801018c0d2f6321dba4 [0,2,0,0,0,0|1,0,1]=4 6775 B12R0.47 CC#CCOCC(=O)OCCCC 48f21973c00e9aef54790e4af7a55736 [0,2,0,0,0,0|0,0,2]=4 6776 B12R0.47 CC#CCOCC(=O)OCCOC c7e8acfc031e7299e56977db4c9dece1 [0,2,0,0,0,0|0,0,2]=4 6777 B12R0.47 CC/C=C/CC(=O)NCCCCC 940f00cc07c5e329d645b46275494768 [0,2,0,0,0,0|1,0,1]=4 6778 B12R0.47 CC/C=C/COC(C)CCCCC 041228763cf423e11b2ebf32a8e84ab3 [0,2,0,0,0,0|1,0,1]=4 6779 B12R0.47 CC/C=C/CO[C@@H](C)CCCCC 51933f92e2e9618d71909dfa5a5da7f9 [0,2,0,0,0,0|1,0,1]=4 6780 B12R0.47 CC/C=C/CO[C@H](C)CCCCC 436dc907b7ce36ca1769290471c4d99d [0,2,0,0,0,0|1,0,1]=4 6781 B12R0.47 CC/C=C\CC(=O)NCCCCC ffa7f4f086207d8f8ec7583d6ff6101f [0,2,0,0,0,0|1,0,1]=4 6782 B12R0.47 CC/C=C\COC(C)CCCCC 822b935cb0d28486f03eec7b3bf71d47 [0,2,0,0,0,0|1,0,1]=4 6783 B12R0.47 CC/C=C\CO[C@@H](C)CCCCC 6912a19c5ed0820650103f3cc93f21a5 [0,2,0,0,0,0|1,0,1]=4 6784 B12R0.47 CC=CCCC(=O)NCCCCC 33d88b32e41bd210f1d49cf481725af0 [0,2,0,0,0,0|1,0,1]=4 6785 B12R0.47 CC=CCNC(=O)CCCCCC 3e83eef6c2da34221bc78731aa393438 [0,2,0,0,0,0|1,0,1]=4 6786 B12R0.47 CC=CCNC(=O)CCCCCF 5fa8c87fd13d00465a4d1581f04f4530 [0,2,0,0,0,0|1,0,1]=4 6787 B12R0.47 CC=CCNC(=O)CCCCCO 2c267bcfd8d47b7e9c87afd35ae30097 [0,2,0,0,0,0|1,0,1]=4 6788 B12R0.47 CC=CCNC(=O)CCCCCS c01705dde87437ec5600898e1613b19d [0,2,0,0,0,0|1,0,1]=4 6789 B12R0.47 CC=CCNC(=O)CCOCCC f602f31fccc59c567f3c23f3c9ce50ad [0,2,0,0,0,0|1,0,1]=4 6790 B12R0.47 CC=CCNC(=O)COCCCC eba85297ea2862b70c3d358743edd90c [0,2,0,0,0,0|1,0,1]=4 6791 B12R0.47 CC=CCNC(=O)CSCCCC 0d4a6acd82de24039f0dee8fb553357b [0,2,0,0,0,0|1,0,1]=4 6792 B12R0.47 CC=CCNC(=O)NCCCCC 7a1aec1b76552c50c77015175403e34b [0,2,0,0,0,0|1,0,1]=4 6793 B12R0.47 CC=CCNCC(=O)CCCCC 94da1f3f3e8c7aea9b344bb1559d7db8 [0,2,0,0,0,0|1,0,1]=4 6794 B12R0.47 CC=CCNCC(=O)OCCCC 0dc4912e000af4c8cf5fd3ef2f6f3749 [0,2,0,0,0,0|0,0,2]=4 6795 B12R0.47 CC=CCNCC(=O)OCCOC b69ec9a8bc1f7ba1656e2a18a484a10a [0,2,0,0,0,0|0,0,2]=4 6796 B12R0.47 CC=CCOCC(=O)CCCCC 09e3d15f41c1d588f5b3e1b50fddd8aa [0,2,0,0,0,0|0,0,1]=3 6797 B12R0.47 CC=CCOCC(=O)NCCCC 2a75a546a9b9146f4027489a96719f9c [0,2,0,0,0,0|1,0,1]=4 6798 B12R0.47 CC=CCOCC(=O)OCCCC 7d6b962673618088a4b54fe51c13661b [0,2,0,0,0,0|0,0,2]=4 6799 B12R0.47 CC=CCOCC(=O)OCCOC f5a970f59a2cbb2a7c658dc52fb7c728 [0,2,0,0,0,0|0,0,2]=4 6800 B12R0.47 CCC#CCOC(C)CCCCC 9f02309084d29c839859155fda8633b2 [0,2,0,0,0,0|1,0,1]=4 6801 B12R0.47 CCC#CCO[C@@H](C)CCCCC 7d6ada719abce2f6805ebc541d04b42e [0,2,0,0,0,0|1,0,1]=4 6802 B12R0.47 CCC/C=C/C(=O)NCCCCC ea643cb8790244b284ad37e1d5b63974 [0,2,0,0,0,0|1,0,0]=3 6803 B12R0.47 CCC/C=C/C(=O)NCCCCCl 7f2fb6e0e2980c78c095a53eeabe5e22 [0,2,0,0,0,0|2,0,0]=4 6804 B12R0.47 CCC/C=C/C(=O)NCCCCO b5468e0b69addca19fd254429ee670a6 [0,2,0,0,0,0|2,0,0]=4 6805 B12R0.47 CCC/C=C/C(=O)NCCCCS 13bdc9654f0f4775716c5d80527f7e49 [0,2,0,0,0,0|2,0,0]=4 6806 B12R0.47 CCC/C=C/C(=O)NCCCOC ec52c0532735efb6258af2659edd1ce6 [0,2,0,0,0,0|2,0,0]=4 6807 B12R0.47 CCC/C=C/C(=O)NCCCSC b17758f9cc1abccc3da9316217fefb19 [0,2,0,0,0,0|2,0,0]=4 6808 B12R0.47 CCC/C=C/C(=O)NCCOCC 81bf850c86addc2cd0b7cfa2e924a81b [0,2,0,0,0,0|2,0,0]=4 6809 B12R0.47 CCC/C=C/C(=O)NCCSCC 6893c2aacde230c98c295718292fee24 [0,2,0,0,0,0|2,0,0]=4 6810 B12R0.47 CCC/C=C/CC(=O)NCCCC c1d190edea25634c0a956c64ea300332 [0,2,0,0,0,0|1,0,1]=4 6811 B12R0.47 CCC/C=C/CC(=O)NCCCCl 027fe2a983b03fe61b9bdbf6abb6166e [0,2,0,0,0,0|1,0,1]=4 6812 B12R0.47 CCC/C=C/CC(=O)NCCCO a99f65229cfeb18515c40b6c0b83999d [0,2,0,0,0,0|1,0,1]=4 6813 B12R0.47 CCC/C=C/CC(=O)NCCOC 6b30b9da5ffed8920869475d2cb139a0 [0,2,0,0,0,0|1,0,1]=4 6814 B12R0.47 CCC/C=C/CC(=O)NCCSC f295a7b3ffb38fd5305acb42f5ecebef [0,2,0,0,0,0|1,0,1]=4 6815 B12R0.47 CCC=CCC(=O)NCCCCC 5e686aa7b1901d151515114dc104c375 [0,2,0,0,0,0|1,0,1]=4 6816 B12R0.47 CCCC#CC(=O)NCCCCC 4240d90a986990cfb89bcc75ae37b050 [0,2,0,0,0,0|1,0,0]=3 6817 B12R0.47 CCCC#CC(=O)NCCCCCl c9c178f976b2da77738ac2424b206abf [0,2,0,0,0,0|2,0,0]=4 6818 B12R0.47 CCCC#CC(=O)NCCCCO 22f63ff1da11bf536ce4c873bf20ee50 [0,2,0,0,0,0|2,0,0]=4 6819 B12R0.47 CCCC#CC(=O)NCCCCS b1294cb0052605149e616a3e9ca2c7b3 [0,2,0,0,0,0|2,0,0]=4 6820 B12R0.47 CCCC#CC(=O)NCCCOC d609caeb8d668dc0563a2deff6a1bfbb [0,2,0,0,0,0|2,0,0]=4 6821 B12R0.47 CCCC#CC(=O)NCCCSC ce607ea5d7173f22bb77700c3aca9c80 [0,2,0,0,0,0|2,0,0]=4 6822 B12R0.47 CCCC#CC(=O)NCCOCC f0d625babe0e065d044387bf0f052389 [0,2,0,0,0,0|2,0,0]=4 6823 B12R0.47 CCCC#CC(=O)NCCSCC 2cad7b71fc5cd7c436bb5cc74822afb5 [0,2,0,0,0,0|2,0,0]=4 6824 B12R0.47 CCCC/C=C/C(=O)NCCCC fc18913fe6c43f51a23391bf0570de5a [0,2,0,0,0,0|1,0,1]=4 6825 B12R0.47 CCCC/C=C/C(=O)NCCCCl 6a79d86a3d82af2dd359e5a20b25d49d [0,2,0,0,0,0|1,0,1]=4 6826 B12R0.47 CCCC/C=C/C(=O)NCCCO 2483b9d6265cdedffd09b40fc096f4ab [0,2,0,0,0,0|1,0,1]=4 6827 B12R0.47 CCCC/C=C/C(=O)NCCOC 836e9bdcb5c25d29672a1bf221e222d0 [0,2,0,0,0,0|1,0,1]=4 6828 B12R0.47 CCCC/C=C/C(=O)NCCSC 833c53ee1fe66b69771f2a08f9266357 [0,2,0,0,0,0|1,0,1]=4 6829 B12R0.47 CCCC=CC(=O)NCCCCC e0ffa972a54ceb76b200c86463cb940c [0,2,0,0,0,0|1,0,0]=3 6830 B12R0.47 CCCC=CC(=O)NCCCCCl 375dd82e32ea8f2f4a4ec78d45a7a10f [0,2,0,0,0,0|2,0,0]=4 6831 B12R0.47 CCCC=CC(=O)NCCCCO 978c03b606677bab7ec84038ad366b21 [0,2,0,0,0,0|2,0,0]=4 6832 B12R0.47 CCCC=CC(=O)NCCCCS e54e547e6145625b89266669f1f39c75 [0,2,0,0,0,0|2,0,0]=4 6833 B12R0.47 CCCC=CC(=O)NCCCOC 3961dee8e1c9efbe0703da7dcb79d160 [0,2,0,0,0,0|2,0,0]=4 6834 B12R0.47 CCCC=CC(=O)NCCCSC 5f9a3f3ea8f48f4477edf3a5f1361ee0 [0,2,0,0,0,0|2,0,0]=4 6835 B12R0.47 CCCC=CC(=O)NCCOCC ee7c5c17bbae83882b47961be1d119de [0,2,0,0,0,0|2,0,0]=4 6836 B12R0.47 CCCC=CC(=O)NCCSCC c1283ea277a22d96205bb71adf7c4897 [0,2,0,0,0,0|2,0,0]=4 6837 B12R0.47 CCCCC#CC(=O)NCCCC 2a89c0375ac1fb5fc88b7bfa55bdfb13 [0,2,0,0,0,0|1,0,1]=4 6838 B12R0.47 CCCCC#CC(=O)NCCCCl dc42b878447fd0ad41b36e52969f770a [0,2,0,0,0,0|1,0,1]=4 6839 B12R0.47 CCCCC#CC(=O)NCCCO 8501fbc3e5d44dc29a4646b2d79e1594 [0,2,0,0,0,0|1,0,1]=4 6840 B12R0.47 CCCCC#CC(=O)NCCOC 6015465ea0e94536b312cfee494a06d5 [0,2,0,0,0,0|1,0,1]=4 6841 B12R0.47 CCCCC#CC(=O)NCCSC 85570b31101c24068e1e1cb34e0cf0f6 [0,2,0,0,0,0|1,0,1]=4 6842 B12R0.47 CCCCC=CC(=O)NCCCC af1f565c2422d5c4cc467057db7aeb3d [0,2,0,0,0,0|1,0,1]=4 6843 B12R0.47 CCCCC=CC(=O)NCCCCl 1e89b04024dc10e5144e6cc208b3438b [0,2,0,0,0,0|1,0,1]=4 6844 B12R0.47 CCCCC=CC(=O)NCCCO e1f72be2a23cc6497679b95b69f08949 [0,2,0,0,0,0|1,0,1]=4 6845 B12R0.47 CCCCC=CC(=O)NCCOC 3a4698610640372d98165a0d9dd97e36 [0,2,0,0,0,0|1,0,1]=4 6846 B12R0.47 CCCCC=CC(=O)NCCSC 9d3ee9fd07556c1c523ca9327050f754 [0,2,0,0,0,0|1,0,1]=4 6847 B12R0.47 CCCCCC(=O)CNCCC#N 04dec60fa11217aa3a01fda024b49977 [0,2,0,0,0,0|1,0,1]=4 6848 B12R0.47 CCCCCC(=O)CNCCCC c300affc40eee1711d5b85e7ad74bc0e [0,2,0,0,0,0|1,0,0]=3 6849 B12R0.47 CCCCCC(=O)CNCCCCl fc11811e52e5db37220965459ab4c8ab [0,2,0,0,0,0|1,0,0]=3 6850 B12R0.47 CCCCCC(=O)CNCCCO 4fe1edd1650168304237943df7d7cc5f [0,2,0,0,0,0|1,0,0]=3 6851 B12R0.47 CCCCCC(=O)CNCCOC 8f9e01e1e172f1e6186c2c2623f5e0a2 [0,2,0,0,0,0|1,0,0]=3 6852 B12R0.47 CCCCCC(=O)CNCCON 7da838372a3459103fcd98fe8985c0e1 [0,2,0,0,0,0|2,0,0]=4 6853 B12R0.47 CCCCCC(=O)CNCCSC 293e89a921b1532fb1acec4e315dd523 [0,2,0,0,0,0|1,0,0]=3 6854 B12R0.47 CCCCCC(=O)COC/C=C/Cl fe8440e2c84d31b02037177beade90ee [0,2,0,0,0,0|0,0,2]=4 6855 B12R0.47 CCCCCC(=O)COCC#CI d20ec6641360db203c2f80bebdb38d89 [0,2,0,0,0,0|0,0,2]=4 6856 B12R0.47 CCCCCC(=O)COCC=CCl 0d5a2e555a29f78234e916605ebc874f [0,2,0,0,0,0|0,0,2]=4 6857 B12R0.47 CCCCCC(=O)COCCC#N dd6bc36e4a08f4df20c586129f9f17ae [0,2,0,0,0,0|0,0,1]=3 6858 B12R0.47 CCCCCC(=O)COCCC=O d23a15fa702d1daaff677a8a2e796b50 [0,2,0,0,0,0|0,0,1]=3 6859 B12R0.47 CCCCCC(=O)COCCCC 574e5f1248d45032bf11a404f8956b48 [0,2,0,0,0,0|0,0,0]=2 6860 B12R0.47 CCCCCC(=O)COCCCF e60551fe8e0c794a8e3101ef46660d0a [0,2,0,0,0,0|0,0,0]=2 6861 B12R0.47 CCCCCC(=O)COCCCS 6a65426b9b9044348f0d41580ff1fe8f [0,2,0,0,0,0|0,0,0]=2 6862 B12R0.47 CCCCCC(=O)COCCOC 53f59f9d86b60ee7163cc043f622168b [0,2,0,0,0,0|0,0,0]=2 6863 B12R0.47 CCCCCC(=O)COCCSC 1ab419c00f46de8b3eef554eaafcae28 [0,2,0,0,0,0|0,0,0]=2 6864 B12R0.47 CCCCCC(=O)NCC#CCO d039429fcd5d548207f80eaf6cb7a72e [0,2,0,0,0,0|1,0,1]=4 6865 B12R0.47 CCCCCC(=O)NCCCC#N 7e0b833e95f368304b27a4972af8bb84 [0,2,0,0,0,0|1,0,0]=3 6866 B12R0.47 CCCCCC(=O)NCCCCCl accf787a7fc15151222ada8cbe596efa [0,2,0,0,0,0|1,0,0]=3 6867 B12R0.47 CCCCCC(=O)NCCCCO 950c96f7adf5e1c718e10c6389a568ae [0,2,0,0,0,0|1,0,0]=3 6868 B12R0.47 CCCCCC(=O)NCCCCS 7ec78a20ffd9184b910af69a0fd50b57 [0,2,0,0,0,0|1,0,0]=3 6869 B12R0.47 CCCCCC(=O)NCCCOC b007441d7f742a3ec7af2d80a3a016f5 [0,2,0,0,0,0|1,0,0]=3 6870 B12R0.47 CCCCCC(=O)NCCCSC 0f8ca69922003eb4c7f5c056650f3903 [0,2,0,0,0,0|1,0,0]=3 6871 B12R0.47 CCCCCC(=O)NCCOCC 28cc0675146910d21fd237b7979809e0 [0,2,0,0,0,0|1,0,0]=3 6872 B12R0.47 CCCCCC(=O)NCCSCC caa899ffb54dbd4ab116d740a0a13ce4 [0,2,0,0,0,0|1,0,0]=3 6873 B12R0.47 CCCCCC(=O)OCNCCC b53aca10ef5419ef2deccb920e0dc3bd [0,2,0,0,0,0|0,0,0]=2 6874 B12R0.47 CCCCCC(=O)OCNCCF ab88f637eb975ab2644d07530eca542f [0,2,0,0,0,0|0,0,0]=2 6875 B12R0.47 CCCCCC(=O)OCNCCI 2442df03f35be67bfed4c5fa3cf80835 [0,2,0,0,0,0|0,0,0]=2 6876 B12R0.47 CCCCCC(=O)OCNCCO ac41b18d360578d3f5b94a89fd362448 [0,2,0,0,0,0|0,0,0]=2 6877 B12R0.47 CCCCCC(=O)OCNCCS ae0907df5d96cb5566748e5b71dc0aed [0,2,0,0,0,0|0,0,0]=2 6878 B12R0.47 CCCCCC(=O)OCOCC#N 4032073329e534877838f134a023d629 [0,2,0,0,0,0|0,0,1]=3 6879 B12R0.47 CCCCCC(=O)OCOCCC a6f3b4272717dc6f7c45519834b075d7 [0,2,0,0,0,0|0,0,0]=2 6880 B12R0.47 CCCCCC(=O)OCOCCS a273217f9f69a94ffb79cdc8d5408f20 [0,2,0,0,0,0|0,0,0]=2 6881 B12R0.47 CCCCCC(=O)OCOCOC 6a225f0740add87ef9c2e6ed3587fbfa [0,2,0,0,0,0|0,0,0]=2 6882 B12R0.47 CCCCCC(C)COCCCC 1568f2e108c6b0b7eda03d8d4a7e0a15 [0,2,0,0,0,0|1,0,1]=4 6883 B12R0.47 CCCCCC(C)COCCCF cdebe54e1ee97131f79c618657ed60be [0,2,0,0,0,0|1,0,1]=4 6884 B12R0.47 CCCCCC(C)COCCCS 7dd8df3faec3e14696ceed35ae33a643 [0,2,0,0,0,0|1,0,1]=4 6885 B12R0.47 CCCCCC(C)COCCOC f7092c0ad9109b370864e32c4b42811d [0,2,0,0,0,0|1,0,1]=4 6886 B12R0.47 CCCCCC(C)COCCSC 0da905f0cad27f17f7d4be64d35c93fc [0,2,0,0,0,0|1,0,1]=4 6887 B12R0.47 CCCCCC(C)COCOCC 2feadd1c7f8c7604b3c1b4b7ca9add73 [0,2,0,0,0,0|1,0,1]=4 6888 B12R0.47 CCCCCC(C)OCCCC#N 8bd31e3c4ec0ad6ea4d79816d5ecdef1 [0,2,0,0,0,0|1,0,1]=4 6889 B12R0.47 CCCCCC(C)OCCCC=O 6cec02ddd79c001507921dc0882943e5 [0,2,0,0,0,0|1,0,1]=4 6890 B12R0.47 CCCCCC(C)OCCCCF db1a3929431dc53db2531cc695ff9016 [0,2,0,0,0,0|1,0,1]=4 6891 B12R0.47 CCCCCC(C)OCCCCS 3c70de18d939c021f1cb1aef5b6c7726 [0,2,0,0,0,0|1,0,1]=4 6892 B12R0.47 CCCCCC(C)OCCCOC 2e826a2de41f138203a57bccb900a169 [0,2,0,0,0,0|1,0,1]=4 6893 B12R0.47 CCCCCC(C)OCCCSC b75bf6deeaa85f7cb63b4b5ba3906abb [0,2,0,0,0,0|1,0,1]=4 6894 B12R0.47 CCCCCC(C)OCCOCC 1b48b359df22add9c0ed0f902263a3e4 [0,2,0,0,0,0|1,0,1]=4 6895 B12R0.47 CCCCCC(C)OCCSCC 489a10ec911ad1118a12547b30372dc2 [0,2,0,0,0,0|1,0,1]=4 6896 B12R0.47 CCCCCCC(=O)NCCC#N 98cd2c3e54ccf23bdb791b3eebf5befb [0,2,0,0,0,0|1,0,1]=4 6897 B12R0.47 CCCCCCC(=O)NCCCC 950215fe406f48df6ea21c4bbcd323ee [0,2,0,0,0,0|1,0,0]=3 6898 B12R0.47 CCCCCCC(=O)NCCCCl f16a48c6be5b61c90800b5593eaed8e6 [0,2,0,0,0,0|1,0,0]=3 6899 B12R0.47 CCCCCCC(=O)NCCCO 6759e157de9d1c72bc88d2ef60bf8325 [0,2,0,0,0,0|1,0,0]=3 6900 B12R0.47 CCCCCCC(=O)NCCOC 4518ab08a03508ab64ca0bd9cde44d77 [0,2,0,0,0,0|1,0,0]=3 6901 B12R0.47 CCCCCCC(=O)NCCON e4809f22a5580e69bb105128b92f3f69 [0,2,0,0,0,0|2,0,0]=4 6902 B12R0.47 CCCCCCC(=O)NCCSC 1f716e995779a8d5cbc0c42739af4a81 [0,2,0,0,0,0|1,0,0]=3 6903 B12R0.47 CCCCCCC(C)COCCC 4f01491277f6f7ea73c9767ba8518a63 [0,2,0,0,0,0|1,0,1]=4 6904 B12R0.47 CCCCCCC(C)OCCCC 91c3961f3f6d22a2d014ce956e9309c9 [0,2,0,0,0,0|1,0,1]=4 6905 B12R0.47 CCCCCCC(C)OCCCF 71ce7dc14f9bcc1f63ed80da65f27345 [0,2,0,0,0,0|1,0,1]=4 6906 B12R0.47 CCCCCCC(C)OCCCS 8d72de7642bf69ea7b762c2723775fbd [0,2,0,0,0,0|1,0,1]=4 6907 B12R0.47 CCCCCCC(C)OCCOC 07f40bf4ffe0e72e73a8100ba56119e8 [0,2,0,0,0,0|1,0,1]=4 6908 B12R0.47 CCCCCCC(C)OCCSC 587d4d9df10def2ee20ba4edaa321939 [0,2,0,0,0,0|1,0,1]=4 6909 B12R0.47 CCCCCC[C@@H](C)OCCCC 513c230e19cc167fd2d4cc2df92663b4 [0,2,0,0,0,0|1,0,1]=4 6910 B12R0.47 CCCCCC[C@@H](C)OCCCF 04714c2c3630e119858e6da982f661a8 [0,2,0,0,0,0|1,0,1]=4 6911 B12R0.47 CCCCCC[C@@H](C)OCCCS b9bb0f4d314378eefd238fcae3983be4 [0,2,0,0,0,0|1,0,1]=4 6912 B12R0.47 CCCCCC[C@@H](C)OCCOC 904fd973551374cdfec85235fe91e99b [0,2,0,0,0,0|1,0,1]=4 6913 B12R0.47 CCCCCC[C@@H](C)OCCSC 803c716743404158ff888fe48d87c0e5 [0,2,0,0,0,0|1,0,1]=4 6914 B12R0.47 CCCCCC[C@H](C)OCCCC 624e39d4f4ecffa1e4ec5fe626fc0ce8 [0,2,0,0,0,0|1,0,1]=4 6915 B12R0.47 CCCCCC[C@H](C)OCCCF 3bcc7812287480ad74af886f5afa3bea [0,2,0,0,0,0|1,0,1]=4 6916 B12R0.47 CCCCCC[C@H](C)OCCCS 3203ee702b6df3d0733cbdf0c726df7b [0,2,0,0,0,0|1,0,1]=4 6917 B12R0.47 CCCCCC[C@H](C)OCCOC 60191529a17ad40c76b1ee8bc64301ea [0,2,0,0,0,0|1,0,1]=4 6918 B12R0.47 CCCCCC[C@H](C)OCCSC d4a287c39ee8f3281afff4ef367e7c8f [0,2,0,0,0,0|1,0,1]=4 6919 B12R0.47 CCCCCN(C)CCOCCC c80cdc4d6a4816ab935a22ddf8d94a37 [0,2,0,0,0,0|2,0,0]=4 6920 B12R0.47 CCCCCN(C)COCCCC 4a466ffe58e78a4308f6c0a8cae20b55 [0,2,0,0,0,0|2,0,0]=4 6921 B12R0.47 CCCCCN(C)COCCOC 77e382e18b43b0ba9f635e4892ce7bb7 [0,2,0,0,0,0|2,0,0]=4 6922 B12R0.47 CCCCCNC(=O)/C=C/COC e365aa86ad4deee4f4beddc198217dba [0,2,0,0,0,0|1,0,1]=4 6923 B12R0.47 CCCCCNC(=O)/C=C/OCC f9712b12c9119b072924bd137cd7d2eb [0,2,0,0,0,0|1,0,1]=4 6924 B12R0.47 CCCCCNC(=O)C#CCCO 7f76a1c7d46b30a643ccfb8b224a8d4d [0,2,0,0,0,0|1,0,1]=4 6925 B12R0.47 CCCCCNC(=O)C#CCOC 9978ffe71e04ef0ebd793bc7969500c9 [0,2,0,0,0,0|1,0,1]=4 6926 B12R0.47 CCCCCNC(=O)C=CCOC 098abef862bdf513d5b4a7a49eff7b5f [0,2,0,0,0,0|1,0,1]=4 6927 B12R0.47 CCCCCNC(=O)C=COCC 2fbacfc2f3defb5ef07f3d78340995d2 [0,2,0,0,0,0|1,0,1]=4 6928 B12R0.47 CCCCCNC(=O)CCCC#N a5f74611dc1b307a75df2ab894a40206 [0,2,0,0,0,0|1,0,1]=4 6929 B12R0.47 CCCCCNC(=O)CCCC=O b09ad783296d346931cf98a6dd1ae856 [0,2,0,0,0,0|1,0,1]=4 6930 B12R0.47 CCCCCNC(=O)CCCCC b5fe642543dcb5e20a67f916a9dcc468 [0,2,0,0,0,0|1,0,0]=3 6931 B12R0.47 CCCCCNC(=O)CCCCF d7d479200460399b62b9318dfc89379f [0,2,0,0,0,0|1,0,0]=3 6932 B12R0.47 CCCCCNC(=O)CCCCO c1212cbafc3a233aca40a5c966281589 [0,2,0,0,0,0|1,0,0]=3 6933 B12R0.47 CCCCCNC(=O)CCCCS 974a6ffc937bf1506409188a7705deb2 [0,2,0,0,0,0|1,0,0]=3 6934 B12R0.47 CCCCCNC(=O)CCCOC c2906328fee3052816cd637263b1222e [0,2,0,0,0,0|1,0,0]=3 6935 B12R0.47 CCCCCNC(=O)CCCSC bd5fb2b8eff18d6db3902ac33e8b45a4 [0,2,0,0,0,0|1,0,0]=3 6936 B12R0.47 CCCCCNC(=O)CCOCC cdfb470aab8a9345824c0f92b9abe48a [0,2,0,0,0,0|1,0,0]=3 6937 B12R0.47 CCCCCNC(=O)CCSCC 8f07a2091df72753d74d1e8db3695c39 [0,2,0,0,0,0|1,0,0]=3 6938 B12R0.47 CCCCCNC(=O)CCSSC 330b94fc213faef96d1bd8bd9b9654cf [0,2,0,0,0,0|2,0,0]=4 6939 B12R0.47 CCCCCNC(=O)CNCCBr 3e5bc2436a9a44cc6c868a505d20ad4d [0,2,0,0,0,0|2,0,0]=4 6940 B12R0.47 CCCCCNC(=O)CNCCC 22592a6e4195a9c61bbaf28c46ee764e [0,2,0,0,0,0|1,0,0]=3 6941 B12R0.47 CCCCCNC(=O)CNCCF 83e0ee665111b3d12d40adc8db7a3571 [0,2,0,0,0,0|2,0,0]=4 6942 B12R0.47 CCCCCNC(=O)CNCCI 3993e084f543c26a034bac8a69b9f8ee [0,2,0,0,0,0|2,0,0]=4 6943 B12R0.47 CCCCCNC(=O)CNCCO cdfb4ee3ac405e4961f2936c4a32288c [0,2,0,0,0,0|2,0,0]=4 6944 B12R0.47 CCCCCNC(=O)CNCCS 0e840fb531c3f99166c6467bfb91693a [0,2,0,0,0,0|2,0,0]=4 6945 B12R0.47 CCCCCNC(=O)COCC#N bb4fd9c30606a616764a9eea640b0b8e [0,2,0,0,0,0|1,0,1]=4 6946 B12R0.47 CCCCCNC(=O)COCCC 747800b86160b7cb84a42839beab95d1 [0,2,0,0,0,0|0,0,0]=2 6947 B12R0.47 CCCCCNC(=O)COCCF 026c86b7b6653160d0a0282ce6f69011 [0,2,0,0,0,0|1,0,0]=3 6948 B12R0.47 CCCCCNC(=O)COCCO 1004e709a2d0826a7a20995063de8765 [0,2,0,0,0,0|1,0,0]=3 6949 B12R0.47 CCCCCNC(=O)COCCS e4266792d963d82994051ca526726fc4 [0,2,0,0,0,0|1,0,0]=3 6950 B12R0.47 CCCCCNC(=O)COCOC b0ff591ee563253dbd330daf468b94e0 [0,2,0,0,0,0|1,0,0]=3 6951 B12R0.47 CCCCCNC(=O)CSCCC 3f18399479ae3f58f822f80722554d8c [0,2,0,0,0,0|0,1,0]=3 6952 B12R0.47 CCCCCNC(=O)NCCC#N 66644c75e6b56946a928f33f46f6a4f9 [0,2,0,0,0,0|1,0,1]=4 6953 B12R0.47 CCCCCNC(=O)NCCCC 6be9e272633a1eb6f56b2d0608a5a7ae [0,2,0,0,0,0|1,0,0]=3 6954 B12R0.47 CCCCCNC(=O)NCCCN b04e4d5b7c2260d01a7f5367f5f06bce [0,2,0,0,0,0|1,0,0]=3 6955 B12R0.47 CCCCCNC(=O)NCCCO f5ee728d425f4b5d73071383e404f28c [0,2,0,0,0,0|1,0,0]=3 6956 B12R0.47 CCCCCNC(=O)NCCOC 7a40fd3265cd7bef22dd86f95afc26ee [0,2,0,0,0,0|1,0,0]=3 6957 B12R0.47 CCCCCNC(=O)NCCON 22d8f92cc036753440f3c2c82a195045 [0,2,0,0,0,0|2,0,0]=4 6958 B12R0.47 CCCCCNC(=O)NCCSC 3eed7de4e6aabcce5d785a2c6d22ae72 [0,2,0,0,0,0|1,0,0]=3 6959 B12R0.47 CCCCCNC(=S)NCCCC a97c5744f058d9ff2daf622cba58216c [0,2,0,0,0,0|1,1,0]=4 6960 B12R0.47 CCCCCNC(=S)NCCCN 729a2ddd0a042cb0380d190450e7a29e [0,2,0,0,0,0|1,1,0]=4 6961 B12R0.47 CCCCCNC(=S)NCCCO 3f0b6f92136aa3add0ecfecf4a9706d2 [0,2,0,0,0,0|1,1,0]=4 6962 B12R0.47 CCCCCNC(=S)NCCOC 8c1ae860abef2fdb572cfc893efbe32c [0,2,0,0,0,0|1,1,0]=4 6963 B12R0.47 CCCCCNC(=S)NCCSC 7f2ca4639d0c71eaf34931e847f70d66 [0,2,0,0,0,0|1,1,0]=4 6964 B12R0.47 CCCCCOC(C)CCCCC 7443a84e40d2932ee1d5a472c2231e17 [0,2,0,0,0,0|1,0,1]=4 6965 B12R0.47 CCCCCOC(C)COCCC 258736fdf5058f983f2e3e25a3da1659 [0,2,0,0,0,0|1,0,1]=4 6966 B12R0.47 CCCCCO[C@@H](C)CCCCC 5b2337bab3407ac539351ae21058fba3 [0,2,0,0,0,0|1,0,1]=4 6967 B12R0.47 CCCCCO[C@H](C)CCCCC 341c46d1c539437246e8853668633897 [0,2,0,0,0,0|1,0,1]=4 6968 B12R0.47 CCCCC[C@@H](C)OCCCC#N 34b32437acabf1ac70247d4896147ba3 [0,2,0,0,0,0|1,0,1]=4 6969 B12R0.47 CCCCC[C@@H](C)OCCCC=O b54ed70834a40d4730ab7b00e5ec3669 [0,2,0,0,0,0|1,0,1]=4 6970 B12R0.47 CCCCC[C@@H](C)OCCCCF 2530db3e470a33b98a497af20d18d763 [0,2,0,0,0,0|1,0,1]=4 6971 B12R0.47 CCCCC[C@@H](C)OCCCOC 58e5103470566c47683036413199fcaf [0,2,0,0,0,0|1,0,1]=4 6972 B12R0.47 CCCCC[C@@H](C)OCCCSC 35adc5f7c82b359a9a8d2ed1d3d12db3 [0,2,0,0,0,0|1,0,1]=4 6973 B12R0.47 CCCCC[C@@H](C)OCCOCC 0e2053ad662cb9641497d1805e1a4c26 [0,2,0,0,0,0|1,0,1]=4 6974 B12R0.47 CCCCC[C@@H](C)OCCSCC 0600729f922be77d60e7fa49bd3c7144 [0,2,0,0,0,0|1,0,1]=4 6975 B12R0.47 CCCCC[C@H](C)OCCCC#N c8dd89d293033ebe3c12d48aa19bc93e [0,2,0,0,0,0|1,0,1]=4 6976 B12R0.47 CCCCC[C@H](C)OCCCC=O 566f0c8f020e7e3177d39cf4ad0bc53f [0,2,0,0,0,0|1,0,1]=4 6977 B12R0.47 CCCCC[C@H](C)OCCCCF 28a9e39065f2fa613025a001b12dc059 [0,2,0,0,0,0|1,0,1]=4 6978 B12R0.47 CCCCC[C@H](C)OCCCCS 112cb6b11e08a0bbc7d229419e33ea4b [0,2,0,0,0,0|1,0,1]=4 6979 B12R0.47 CCCCC[C@H](C)OCCCOC 8b835d302f993b01090d3cc30f345308 [0,2,0,0,0,0|1,0,1]=4 6980 B12R0.47 CCCCC[C@H](C)OCCCSC bb5a2165c1759fb4f6bf1dfb3c02f21d [0,2,0,0,0,0|1,0,1]=4 6981 B12R0.47 CCCCC[C@H](C)OCCOCC f1c8a8bb8ba730d391477c60a2e2fca7 [0,2,0,0,0,0|1,0,1]=4 6982 B12R0.47 CCCCC[C@H](C)OCCSCC 9701f671d38c4b53ba827ff31c744685 [0,2,0,0,0,0|1,0,1]=4 6983 B12R0.47 CCCCNC(=O)CCCCC=O 13d687ad4c95961bd828029c4d1ebe10 [0,2,0,0,0,0|1,0,1]=4 6984 B12R0.47 CCCCNC(=O)CCCCCF 2d2ace780ba2ba4cd1b15057005fa5cc [0,2,0,0,0,0|1,0,0]=3 6985 B12R0.47 CCCCNC(=O)CCCCCO d48cb3643aa594621d14c8897847d40c [0,2,0,0,0,0|1,0,0]=3 6986 B12R0.47 CCCCNC(=O)CCCCCS be9a3a920d54b6e82a40a20194e4c1b1 [0,2,0,0,0,0|1,0,0]=3 6987 B12R0.47 CCCCNC(=O)CCCSSC eb30006fa729bbb77216520388b0df5b [0,2,0,0,0,0|2,0,0]=4 6988 B12R0.47 CCCCNC(=O)CCOCCC d0e2a9e04e899c5c1a5e3ed9f368e4df [0,2,0,0,0,0|1,0,0]=3 6989 B12R0.47 CCCCNC(=O)CCOCCO bfd53542618d130fb9a805ef09fae66a [0,2,0,0,0,0|2,0,0]=4 6990 B12R0.47 CCCCNC(=O)CCOCCS 3154054f83d17c116b4a1f6eb8157448 [0,2,0,0,0,0|2,0,0]=4 6991 B12R0.47 CCCCNC(=O)CNCCCCl 0de92577860b83252d814ff9a024f2b6 [0,2,0,0,0,0|2,0,0]=4 6992 B12R0.47 CCCCNC(=O)CNCCCF 227d459834b8c0580b3edc1094ec6075 [0,2,0,0,0,0|2,0,0]=4 6993 B12R0.47 CCCCNC(=O)CNCCCO 3af979107eb2d8d9bdeb32ba356ea2a1 [0,2,0,0,0,0|2,0,0]=4 6994 B12R0.47 CCCCNC(=O)CNCCCS e897111a948a72ac30171269be650fb0 [0,2,0,0,0,0|2,0,0]=4 6995 B12R0.47 CCCCNC(=O)CNCCOC cef472bc08d7cb698b2c7c2e1e2e6878 [0,2,0,0,0,0|2,0,0]=4 6996 B12R0.47 CCCCNC(=O)CNCCSC fb2299486442ec83b88a20bb39e8bf95 [0,2,0,0,0,0|2,0,0]=4 6997 B12R0.47 CCCCNC(=O)CNCOCC a53c9a233cbf639034cb560ecb61ca99 [0,2,0,0,0,0|2,0,0]=4 6998 B12R0.47 CCCCNC(=O)COCCC#N 71c44880ce58765b0a985060437e36a9 [0,2,0,0,0,0|1,0,1]=4 6999 B12R0.47 CCCCNC(=O)COCCC=O 7ce100e053d2f02938118569e04f76a7 [0,2,0,0,0,0|1,0,1]=4 7000 B12R0.47 CCCCNC(=O)COCCCC 40ca8b8d38d2249a1a63f53a5e2ed5e3 [0,2,0,0,0,0|1,0,0]=3 7001 B12R0.47 CCCCNC(=O)COCCCF 683c385d9b72d3a97c701afcaf1bc15c [0,2,0,0,0,0|1,0,0]=3 7002 B12R0.47 CCCCNC(=O)COCCCS 95acda49a565d36ad57b179c5d65b5e4 [0,2,0,0,0,0|1,0,0]=3 7003 B12R0.47 CCCCNC(=O)COCCOC 03c783f20d997d92c00497911e6eaa92 [0,2,0,0,0,0|1,0,0]=3 7004 B12R0.47 CCCCNC(=O)COCCSC 67f26523846e81478a62a77d43af1511 [0,2,0,0,0,0|1,0,0]=3 7005 B12R0.47 CCCCNC(=O)CSCCCC a2f8d26d207f56e96cc1240c72fea9aa [0,2,0,0,0,0|1,0,0]=3 7006 B12R0.47 CCCCNC(=O)CSCCOC af2801d85e7b2bd911784e9811301d3c [0,2,0,0,0,0|1,1,0]=4 7007 B12R0.47 CCCCNC(=O)NCCCC#N 49e825c3a07744770bf67ad6a872c703 [0,2,0,0,0,0|2,0,0]=4 7008 B12R0.47 CCCCNC(=O)NCCCCN 732915f33de9e5dc03c61a61c2426dd8 [0,2,0,0,0,0|2,0,0]=4 7009 B12R0.47 CCCCNC(=O)NCCCCO 66faf07cb3bd94c7af8d1c83cfb49d16 [0,2,0,0,0,0|2,0,0]=4 7010 B12R0.47 CCCCNC(=O)NCCCCS 38c0dff629b0d50785068041d2a078fa [0,2,0,0,0,0|2,0,0]=4 7011 B12R0.47 CCCCNC(=O)NCCCOC 8082f0038f0a1fb9d04a8491ae55be24 [0,2,0,0,0,0|2,0,0]=4 7012 B12R0.47 CCCCNC(=O)NCCCSC cf25447c99527e6e280dcb4ddba175ec [0,2,0,0,0,0|2,0,0]=4 7013 B12R0.47 CCCCNC(=O)NCCOCC 41f9ee57cc6753202e7053a67b6e25ed [0,2,0,0,0,0|2,0,0]=4 7014 B12R0.47 CCCCNC(=O)NCCSCC f3286dde26ab2165ae9470c5ee117e83 [0,2,0,0,0,0|2,0,0]=4 7015 B12R0.47 CCCCNCC(=O)NCCC#N 9a3228b795230638f812ef6f46b84005 [0,2,0,0,0,0|1,0,1]=4 7016 B12R0.47 CCCCNCC(=O)NCCCC a409d1a8bd6f9d37045735bb5b772384 [0,2,0,0,0,0|1,0,0]=3 7017 B12R0.47 CCCCNCC(=O)NCCOC daac41d263013022a696e72b483e34bc [0,2,0,0,0,0|1,0,0]=3 7018 B12R0.47 CCCCNCC(=O)OCCCC 8cf36cfe80d146e028be9b047eb4b88c [0,2,0,0,0,0|0,0,0]=2 7019 B12R0.47 CCCCNCC(=O)OCCOC 069ddb12c169e4b2c894bdf9cd5698fb [0,2,0,0,0,0|0,0,0]=2 7020 B12R0.47 CCCCOC(=O)CCCOCC 0a6013eb1423d39275d7f3a4a0490909 [0,2,0,0,0,0|0,0,0]=2 7021 B12R0.47 CCCCOC(=O)CCCOCF ac9f6c224a9199a1edd8dd33a56fb91c [0,2,0,0,0,0|1,0,0]=3 7022 B12R0.47 CCCCOC(=O)CNCCC#N 9e4af3220890c4c56edb101d67fe7725 [0,2,0,0,0,0|1,0,1]=4 7023 B12R0.47 CCCCOC(=O)CNCCCCl 89e2a9f23f88113578df0c4c6aa1b10a [0,2,0,0,0,0|1,0,0]=3 7024 B12R0.47 CCCCOC(=O)CNCCCO ca8ca649bbd90712da23438f56b61779 [0,2,0,0,0,0|1,0,0]=3 7025 B12R0.47 CCCCOC(=O)CNCCOC 17da6f3932425b4ca698128aacac912f [0,2,0,0,0,0|1,0,0]=3 7026 B12R0.47 CCCCOC(=O)CNCCON 8d631934dcb52056e2c79a9ed24cc102 [0,2,0,0,0,0|2,0,0]=4 7027 B12R0.47 CCCCOC(=O)CNCCSC 84feb03096a60d05abdfca24be440007 [0,2,0,0,0,0|1,0,0]=3 7028 B12R0.47 CCCCOC(=O)COCCC#N db58c71275aefda675b182ff1f1e163d [0,2,0,0,0,0|1,0,1]=4 7029 B12R0.47 CCCCOC(=O)COCCC=O 71bf4f4ec25daf362c8d0f6f0f548ac4 [0,2,0,0,0,0|1,0,1]=4 7030 B12R0.47 CCCCOC(=O)COCCCF 4e67d2cbad77261a2cd0d3de48e96c62 [0,2,0,0,0,0|1,0,0]=3 7031 B12R0.47 CCCCOC(=O)COCCCS 5b80b53db885545e9899e378e88d89a2 [0,2,0,0,0,0|1,0,0]=3 7032 B12R0.47 CCCCOC(=O)COCCOC f47df171bc9e2a5b9f741157e46c54c4 [0,2,0,0,0,0|1,0,0]=3 7033 B12R0.47 CCCCOC(=O)COCCSC 0945955f101639625f5e4088cd7c6f6e [0,2,0,0,0,0|1,0,0]=3 7034 B12R0.47 CCCCOC(=O)COCOCC a1ed03e585b64e5c67e84d33bd9a7ae7 [0,2,0,0,0,0|1,0,0]=3 7035 B12R0.47 CCCCOC(=O)OCNCC#N 884a369e2e68800ef74813b7e97725f8 [0,2,0,0,0,0|1,0,1]=4 7036 B12R0.47 CCCCOC(=O)OCNCCBr e5cc5e8b86f5531c33384198a73d88ce [0,2,0,0,0,0|1,0,0]=3 7037 B12R0.47 CCCCOC(=O)OCNCCC ce3e29aaf03e4dc0deced2dce2975a25 [0,2,0,0,0,0|1,0,0]=3 7038 B12R0.47 CCCCOC(=O)OCNCCF 55f55797454695296216536be7ca0994 [0,2,0,0,0,0|1,0,0]=3 7039 B12R0.47 CCCCOC(=O)OCNCCI e9f7a4c5f6740cf3a0a35910efbe0fd9 [0,2,0,0,0,0|1,0,0]=3 7040 B12R0.47 CCCCOC(=O)OCNCCO ce5030ba9cef868e700abd0934c9c387 [0,2,0,0,0,0|1,0,0]=3 7041 B12R0.47 CCCCOC(=O)OCNCCS 61bb1ee95705e4020200b10124c1b8fb [0,2,0,0,0,0|1,0,0]=3 7042 B12R0.47 CCCCOC(=O)OCOCC#N 565203aed3a8f6901e3721b4ff7b4403 [0,2,0,0,0,0|1,0,1]=4 7043 B12R0.47 CCCCOC(=O)OCOCCC 0b7e31575fe79e55e910c65c27aca9bc [0,2,0,0,0,0|1,0,0]=3 7044 B12R0.47 CCCCOC(=O)OCOCCF 80985ff96adf15e912b0be73a4f8870d [0,2,0,0,0,0|1,0,0]=3 7045 B12R0.47 CCCCOC(=O)OCOCCS 7aa94607db4117a0d319892a8ce6d2d9 [0,2,0,0,0,0|1,0,0]=3 7046 B12R0.47 CCCCOC(=O)OCOCOC 6cfeff46e4cabf6f542f2f795d12662a [0,2,0,0,0,0|1,0,0]=3 7047 B12R0.47 CCCCOCC(=O)NCCC#N 1f1c6deef0307f540074d1a66377873b [0,2,0,0,0,0|1,0,1]=4 7048 B12R0.47 CCCCOCC(=O)NCCCCl 5df0871f050ae494734d0277243e8c82 [0,2,0,0,0,0|1,0,0]=3 7049 B12R0.47 CCCCOCC(=O)NCCCO e8d83686e66909aa7db541d8544ed325 [0,2,0,0,0,0|1,0,0]=3 7050 B12R0.47 CCCCOCC(=O)NCCOC 34d104f4d6daa0f2cb228b269b5183f1 [0,2,0,0,0,0|1,0,0]=3 7051 B12R0.47 CCCCOCC(=O)NCCON 16d40309da2f7e4d759e7c92da594e99 [0,2,0,0,0,0|2,0,0]=4 7052 B12R0.47 CCCCOCC(=O)NCCSC 0abb1275428c4b79c7314e0c7d0049d6 [0,2,0,0,0,0|1,0,0]=3 7053 B12R0.47 CCCCOCC(=O)OCCCC ccfbb6321c0687b52bcffe6aebfb7b82 [0,2,0,0,0,0|0,0,0]=2 7054 B12R0.47 CCCCOCC(=O)OCCOC 03a6b96b7e42c407dba7c09a13aecb33 [0,2,0,0,0,0|0,0,0]=2 7055 B12R0.47 CCCCOCC(C)COCCC 4d954215eac38a6b923d8034159009ff [0,2,0,0,0,0|1,0,1]=4 7056 B12R0.47 CCCCOCC(C)OCCCC c79109f93ec5d8593451a53a391547f5 [0,2,0,0,0,0|1,0,1]=4 7057 B12R0.47 CCCCOCC(C)OCCCF e848c2269840d57b2cbca24d62ebdcd4 [0,2,0,0,0,0|1,0,1]=4 7058 B12R0.47 CCCCOCC(C)OCCCS b3a020f43f3584e9bd25c74896e45d92 [0,2,0,0,0,0|1,0,1]=4 7059 B12R0.47 CCCCOCC(C)OCCOC 46e7613566c4a07c300afd5f3ee5f407 [0,2,0,0,0,0|1,0,1]=4 7060 B12R0.47 CCCCOCC(C)OCCSC 69485b46986c5836ff80ef73975efcc9 [0,2,0,0,0,0|1,0,1]=4 7061 B12R0.47 CCCCSCC(=O)NCCC#N 6880c9c06b5229a5b620a358454432b0 [0,2,0,0,0,0|1,0,1]=4 7062 B12R0.47 CCCCSCC(=O)NCCCCl 0ffa47edd6d692f4bc4fc4b6733f0c90 [0,2,0,0,0,0|1,0,0]=3 7063 B12R0.47 CCCCSCC(=O)NCCCO 6832fc3d6092154539432cb00c3cf41f [0,2,0,0,0,0|1,0,0]=3 7064 B12R0.47 CCCCSCC(=O)NCCOC c30787cab975537d5660734f405800a4 [0,2,0,0,0,0|1,0,0]=3 7065 B12R0.47 CCCCSCC(=O)NCCON ffc07b0a65e0eb322fb995b7e04d5f9c [0,2,0,0,0,0|2,0,0]=4 7066 B12R0.47 CCCCSCC(=O)NCCSC a211f590f879ef2319ff01d912df2317 [0,2,0,0,0,0|1,0,0]=3 7067 B12R0.47 CCCNCC(=O)NCCOCC f7d0c896b060058411e91dc4761f247d [0,2,0,0,0,0|2,0,0]=4 7068 B12R0.47 CCCNCC(=O)OCCOCC 05ea51f226d1004901f7e416f22e7390 [0,2,0,0,0,0|1,0,0]=3 7069 B12R0.47 CCCOCC(=O)NCCCC#N a85db7676fc155b2029ce86a09000660 [0,2,0,0,0,0|1,0,1]=4 7070 B12R0.47 CCCOCC(=O)NCCCCCl cdbbdaeadcb3deaaa4c48508ddaa5515 [0,2,0,0,0,0|1,0,0]=3 7071 B12R0.47 CCCOCC(=O)NCCCCO bdaa51d13edfa29a45cf15fdb7e2bd10 [0,2,0,0,0,0|1,0,0]=3 7072 B12R0.47 CCCOCC(=O)NCCCCS 818b5dd4c5e39861682881a9a7de95f2 [0,2,0,0,0,0|1,0,0]=3 7073 B12R0.47 CCCOCC(=O)NCCCOC a0e2646720167fda978a544dd347ed63 [0,2,0,0,0,0|1,0,0]=3 7074 B12R0.47 CCCOCC(=O)NCCCSC 0783f9be49d03c68e8f784b1d03cd695 [0,2,0,0,0,0|1,0,0]=3 7075 B12R0.47 CCCOCC(=O)NCCOCC 050d7334078f086c263cc29fdce7b976 [0,2,0,0,0,0|1,0,0]=3 7076 B12R0.47 CCCOCC(=O)NCCSCC a606c5c4494de65255e42816935e4b64 [0,2,0,0,0,0|1,0,0]=3 7077 B12R0.47 CCCOCC(=O)OCCOCC 808c13b53d8a9dbfebd44fc14370a72d [0,2,0,0,0,0|1,0,0]=3 7078 B12R0.47 CCCOCCC(=O)NCCC#N e830ac876725e4d2b7cba96c0d36beef [0,2,0,0,0,0|1,0,1]=4 7079 B12R0.47 CCCOCCC(=O)NCCCCl 333a18b8cf73c0f1a4819c7a5f32a44d [0,2,0,0,0,0|1,0,0]=3 7080 B12R0.47 CCCOCCC(=O)NCCCO 2d27b683f37bfb7b6e3757c9d51021a7 [0,2,0,0,0,0|1,0,0]=3 7081 B12R0.47 CCCOCCC(=O)NCCOC a39c60042c874ab2e5561717beaf6476 [0,2,0,0,0,0|1,0,0]=3 7082 B12R0.47 CCCOCCC(=O)NCCON 5227a2d9135ddaa4889225ada921eb12 [0,2,0,0,0,0|2,0,0]=4 7083 B12R0.47 CCCOCCC(=O)NCCSC a2405d22a7ef3ade6d2da5252e5168d5 [0,2,0,0,0,0|1,0,0]=3 7084 B12R0.47 CCCSCC(=O)NCCCC#N 07a09a2cec1a80afb41df72386df979c [0,2,0,0,0,0|2,0,0]=4 7085 B12R0.47 CCCSCC(=O)NCCCCCl a2117c863453c609050f94fd70b0337f [0,2,0,0,0,0|1,1,0]=4 7086 B12R0.47 CCCSCC(=O)NCCCCO 682875cdc8f98070d205e21f71626540 [0,2,0,0,0,0|1,1,0]=4 7087 B12R0.47 CCCSCC(=O)NCCCCS 49f1325f6a5a8102395a6b7b2a96d79c [0,2,0,0,0,0|1,1,0]=4 7088 B12R0.47 CCCSCC(=O)NCCCOC e7d7996cf140084e5dd3f28c96888ccc [0,2,0,0,0,0|1,1,0]=4 7089 B12R0.47 CCCSCC(=O)NCCCSC 20ee2f93fd60fb93bb016437cfd7e1b5 [0,2,0,0,0,0|1,1,0]=4 7090 B12R0.47 CCCSCC(=O)NCCOCC f41afa6a9a8a2652c3b4ccb592d6ca28 [0,2,0,0,0,0|1,1,0]=4 7091 B12R0.47 CCCSCC(=O)NCCSCC b8e0b345abefbc171f1cd226bf812fa1 [0,2,0,0,0,0|1,1,0]=4 7092 B12R0.47 CCOCCC(=O)NCCCC#N 8894d6bb1810657808b65d7d6fc8721e [0,2,0,0,0,0|2,0,0]=4 7093 B12R0.47 CCOCCC(=O)NCCCCCl f730159477ec6aa4526af117e062873e [0,2,0,0,0,0|2,0,0]=4 7094 B12R0.47 CCOCCC(=O)NCCCCO 18600941f9841444db1c391f619e9201 [0,2,0,0,0,0|2,0,0]=4 7095 B12R0.47 CCOCCC(=O)NCCCCS e110b16d7d7b76d0847606747890017d [0,2,0,0,0,0|2,0,0]=4 7096 B12R0.47 CCOCCC(=O)NCCCOC 4da9180f8a26bd52a872960bb54c4e3f [0,2,0,0,0,0|2,0,0]=4 7097 B12R0.47 CCOCCC(=O)NCCCSC 7d97a20dcc046ff7c11196f10172e730 [0,2,0,0,0,0|2,0,0]=4 7098 B12R0.47 CCOCCC(=O)NCCSCC 143d8950408b077b51b88a546763575d [0,2,0,0,0,0|2,0,0]=4 7099 B12R0.47 CCOCCNC(=O)CCCCF 942ae8927750639c877efcca29658fdc [0,2,0,0,0,0|2,0,0]=4 7100 B12R0.47 CCOCCNC(=O)CCCCO 279ebc38131b8d9ded00a21fa2a1bd1e [0,2,0,0,0,0|2,0,0]=4 7101 B12R0.47 CCOCCNC(=O)CCCCS 208b709a954e18ffdffb3b02c292aba3 [0,2,0,0,0,0|2,0,0]=4 7102 B12R0.47 CCOCCNC(=O)CCCOC 47eb81594740634d79dfa20026c8abfc [0,2,0,0,0,0|2,0,0]=4 7103 B12R0.47 CCOCCNC(=O)CCCSC a558b63bb51116e10c38170263722671 [0,2,0,0,0,0|2,0,0]=4 7104 B12R0.47 CCOCCNC(=O)CCOCC 95b4cbba92255b65fe657e0f95240dff [0,2,0,0,0,0|2,0,0]=4 7105 B12R0.47 CCOCCNC(=O)CCSCC c03e83e7c11fafba53a5f4e1f11ed4d0 [0,2,0,0,0,0|2,0,0]=4 7106 B12R0.47 CCOCCNC(=O)COCCF e7f8095a70227460579623b202cfda85 [0,2,0,0,0,0|2,0,0]=4 7107 B12R0.47 CCOCCNC(=O)COCCO 89ecfe68143f58978d9de0b8b84f9e56 [0,2,0,0,0,0|2,0,0]=4 7108 B12R0.47 CCOCCNC(=O)COCCS 2ef0c25584e12432ba58c9c6e1d2d24d [0,2,0,0,0,0|2,0,0]=4 7109 B12R0.47 CCOCCNC(=O)COCOC d005fc368477dcf276f3479d2392bb9b [0,2,0,0,0,0|2,0,0]=4 7110 B12R0.47 CCOCCNC(=O)NCCCN fb7c5c20b6323f546395617158ff71a0 [0,2,0,0,0,0|2,0,0]=4 7111 B12R0.47 CCOCCNC(=O)NCCCO d8d39c374fd0162e76558887f8740379 [0,2,0,0,0,0|2,0,0]=4 7112 B12R0.47 CCOCCNC(=O)NCCOC 1bea08d2499a0c8217b1d921206d4d9a [0,2,0,0,0,0|2,0,0]=4 7113 B12R0.47 CCOCCNC(=O)NCCSC 5e248b1cc23dcab4a40623b310592b68 [0,2,0,0,0,0|2,0,0]=4 7114 B12R0.47 CCOCCOC(=O)CNCCBr 4de2f12111458464ec2bd4b500ba3960 [0,2,0,0,0,0|2,0,0]=4 7115 B12R0.47 CCOCCOC(=O)CNCCF b1ca95997938e6be2f5b4873f613a023 [0,2,0,0,0,0|2,0,0]=4 7116 B12R0.47 CCOCCOC(=O)CNCCI 05a4d129aeb516845ec24683cefd758b [0,2,0,0,0,0|2,0,0]=4 7117 B12R0.47 CCOCCOC(=O)CNCCO ba2fa857981d68fd777faa3463dc4d43 [0,2,0,0,0,0|2,0,0]=4 7118 B12R0.47 CCOCCOC(=O)CNCCS c6bc828269e3b1cb752424183ba3c344 [0,2,0,0,0,0|2,0,0]=4 7119 B12R0.47 CCOCCOC(=O)COCCF 9cbf9e6037ef96c1437537188d29c49b [0,2,0,0,0,0|2,0,0]=4 7120 B12R0.47 CCOCCOC(=O)COCCS 0accb185e5de5e498838aa25fe3843de [0,2,0,0,0,0|2,0,0]=4 7121 B12R0.47 CCOCCOC(=O)COCOC 213d3d891471aa2831e64aa26e79a978 [0,2,0,0,0,0|2,0,0]=4 7122 B12R0.47 CCSCCC(=O)NCCCC#N 0d5623d561518a7df267438ce198c2d2 [0,2,0,0,0,0|2,0,0]=4 7123 B12R0.47 CCSCCC(=O)NCCCCCl 7622eb52e5dcd823bad60a896e68797e [0,2,0,0,0,0|2,0,0]=4 7124 B12R0.47 CCSCCC(=O)NCCCCO 99bf65960c4a88963cf7063c5e1bb8d6 [0,2,0,0,0,0|2,0,0]=4 7125 B12R0.47 CCSCCC(=O)NCCCCS b809ea20bb52b8ad78b13607d35e66c2 [0,2,0,0,0,0|2,0,0]=4 7126 B12R0.47 CCSCCC(=O)NCCCOC a2d083ecc1e9791705fce0baa693e4c6 [0,2,0,0,0,0|2,0,0]=4 7127 B12R0.47 CCSCCC(=O)NCCCSC 67ede9f798510c912b72f6de26c26f02 [0,2,0,0,0,0|2,0,0]=4 7128 B12R0.47 CCSCCNC(=O)CCCCF 32c83c0d6184d12abc73fc4ad1e611e0 [0,2,0,0,0,0|2,0,0]=4 7129 B12R0.47 CCSCCNC(=O)CCCCO 11c6eaae63aa7ed15eda9bf72ab00955 [0,2,0,0,0,0|2,0,0]=4 7130 B12R0.47 CCSCCNC(=O)CCCCS d97a31eae3b472261542fa6523e270bf [0,2,0,0,0,0|2,0,0]=4 7131 B12R0.47 CCSCCNC(=O)CCCOC 25ae2ebddb57413236485c652812c179 [0,2,0,0,0,0|2,0,0]=4 7132 B12R0.47 CCSCCNC(=O)CCCSC 2fdbf4774e7d50ae8af8f22669f53efa [0,2,0,0,0,0|2,0,0]=4 7133 B12R0.47 CCSCCNC(=O)CCSCC 0d7aab15e47319bf4a13f3a06c874ca1 [0,2,0,0,0,0|2,0,0]=4 7134 B12R0.47 CCSCCNC(=O)COCCO df9830f328c99437f1094add19d9c1c0 [0,2,0,0,0,0|2,0,0]=4 7135 B12R0.47 CCSCCNC(=O)COCCS c835610ebd6d0f0493f5a64e3c7a04e5 [0,2,0,0,0,0|2,0,0]=4 7136 B12R0.47 CCSCCNC(=O)NCCCN 71c8e0d82e8c17a62d96b5bf11bf2243 [0,2,0,0,0,0|2,0,0]=4 7137 B12R0.47 CCSCCNC(=O)NCCCO 6b73eb7e07581e66bb3a125822605434 [0,2,0,0,0,0|2,0,0]=4 7138 B12R0.47 CCSCCNC(=O)NCCOC 6be46b9d0401bb16e371dbab56a977de [0,2,0,0,0,0|2,0,0]=4 7139 B12R0.47 CCSCCNC(=O)NCCSC a7e214c8ce7bbb5c96d471f5f8eee3b5 [0,2,0,0,0,0|2,0,0]=4 7140 B12R0.47 COCCCC(=O)NCCCC#N 9f823b8384eac69174aeca1d5f0bc9be [0,2,0,0,0,0|2,0,0]=4 7141 B12R0.47 COCCCC(=O)NCCCCCl 2812340047a4821ee5a0bf89a01325a0 [0,2,0,0,0,0|2,0,0]=4 7142 B12R0.47 COCCCC(=O)NCCCCO 31534a4ea1620b1237eb047084a0be2f [0,2,0,0,0,0|2,0,0]=4 7143 B12R0.47 COCCCC(=O)NCCCCS c4e83ba19f68cc2de5944dc508181d5b [0,2,0,0,0,0|2,0,0]=4 7144 B12R0.47 COCCCC(=O)NCCCSC 9e517666128423e31a0300cc39be475d [0,2,0,0,0,0|2,0,0]=4 7145 B12R0.47 COCCCNC(=O)CCCCF cf6ecc544211453e50895013ba7a24f3 [0,2,0,0,0,0|2,0,0]=4 7146 B12R0.47 COCCCNC(=O)CCCCO a91186f506302bf4bc1ce468a8d829b9 [0,2,0,0,0,0|2,0,0]=4 7147 B12R0.47 COCCCNC(=O)CCCCS e3aacda0d278b2d6a9dd2f1085856a5f [0,2,0,0,0,0|2,0,0]=4 7148 B12R0.47 COCCCNC(=O)CCCOC 456041e4f15be2c6f45a98ccf1177ff3 [0,2,0,0,0,0|2,0,0]=4 7149 B12R0.47 COCCCNC(=O)CCCSC b26bf6ff0136629622f9fe2a08d6b649 [0,2,0,0,0,0|2,0,0]=4 7150 B12R0.47 COCCCNC(=O)COCCO 65d60fe9de229a386335838bdd823d85 [0,2,0,0,0,0|2,0,0]=4 7151 B12R0.47 COCCCNC(=O)COCCS ef040f6802a642509061680dd951c0da [0,2,0,0,0,0|2,0,0]=4 7152 B12R0.47 COCCCNC(=O)NCCCN 6a9b7f761954499fac14e44aeb10139b [0,2,0,0,0,0|2,0,0]=4 7153 B12R0.47 COCCCNC(=O)NCCCO ce683c850c225c10a3bce75848a550fb [0,2,0,0,0,0|2,0,0]=4 7154 B12R0.47 COCCCNC(=O)NCCOC 45fa2fc53e3ea10f483ef3a6b121304a [0,2,0,0,0,0|2,0,0]=4 7155 B12R0.47 COCCCNC(=O)NCCSC 522a30a6f54fd3dbb6fbf9f9e30fd090 [0,2,0,0,0,0|2,0,0]=4 7156 B12R0.47 COCCNC(=O)CCCCC=O 60ad843da13c8ea38430c11bf567758e [0,2,0,0,0,0|1,0,1]=4 7157 B12R0.47 COCCNC(=O)CCCCCF 5ba8d48836703643efdf3dc90d017f84 [0,2,0,0,0,0|1,0,0]=3 7158 B12R0.47 COCCNC(=O)CCCCCO 203e307ef494eb9126905f7e2bd0d5da [0,2,0,0,0,0|1,0,0]=3 7159 B12R0.47 COCCNC(=O)CCCCCS e3f51094703d205071942a256b71e66f [0,2,0,0,0,0|1,0,0]=3 7160 B12R0.47 COCCNC(=O)CCCSSC 87cf3af2da8b1e7d7747aa12ca56ff4d [0,2,0,0,0,0|2,0,0]=4 7161 B12R0.47 COCCNC(=O)CCOCCO ace3f76577d351741ad87bb2c2f6ee44 [0,2,0,0,0,0|2,0,0]=4 7162 B12R0.47 COCCNC(=O)CCOCCS 690bc6474f4bf6bcf9c499137102e8df [0,2,0,0,0,0|2,0,0]=4 7163 B12R0.47 COCCNC(=O)CNCCCCl 92895cba27fb6b22529762060869f919 [0,2,0,0,0,0|2,0,0]=4 7164 B12R0.47 COCCNC(=O)CNCCCO 07d6889e19420b238bd8ebb714eca932 [0,2,0,0,0,0|2,0,0]=4 7165 B12R0.47 COCCNC(=O)CNCCSC bb9f5d486962e887661697ca35f62bf1 [0,2,0,0,0,0|2,0,0]=4 7166 B12R0.47 COCCNC(=O)COCCCF 98488487b78c6e51c56578178b286a84 [0,2,0,0,0,0|2,0,0]=4 7167 B12R0.47 COCCNC(=O)COCCCS ee8d7a8253bf3e17ca8528611b04d525 [0,2,0,0,0,0|2,0,0]=4 7168 B12R0.47 COCCNC(=O)COCCOC 696a255424fba49ea3405276a4f0a221 [0,2,0,0,0,0|2,0,0]=4 7169 B12R0.47 COCCNC(=O)COCCSC f5bc62705c7480ed2b89fa0e1ebde0fb [0,2,0,0,0,0|2,0,0]=4 7170 B12R0.47 COCCNC(=O)CSCCOC 4c19eb839d50ba23068c3890bcfbb5d7 [0,2,0,0,0,0|2,0,0]=4 7171 B12R0.47 COCCNC(=O)NCCCCN 13aeb0734db584cf1ac5fd6728b8a85d [0,2,0,0,0,0|2,0,0]=4 7172 B12R0.47 COCCNC(=O)NCCCCO 253c6a8d4bb92d84ca1b7a4794179cc2 [0,2,0,0,0,0|2,0,0]=4 7173 B12R0.47 COCCNC(=O)NCCCCS 8a33aa7e1f989ab8a6fc469924df278c [0,2,0,0,0,0|2,0,0]=4 7174 B12R0.47 COCCNC(=O)NCCCSC b1f8133731217b01ad7eba3933f68723 [0,2,0,0,0,0|2,0,0]=4 7175 B12R0.47 COCCNCC(=O)NCCOC 112a286b896ab7a9fee0378cf3e8731b [0,2,0,0,0,0|2,0,0]=4 7176 B12R0.47 COCCNCC(=O)OCCOC 8f94bd0467f5c4921dbdaedecd9bc105 [0,2,0,0,0,0|1,0,0]=3 7177 B12R0.47 COCCOC(=O)CNCCC#N 45af0724bfae8ba1e18653a801879700 [0,2,0,0,0,0|1,0,1]=4 7178 B12R0.47 COCCOC(=O)CNCCCCl aa4c7986e2ac0522ff93531e1fc0f896 [0,2,0,0,0,0|1,0,0]=3 7179 B12R0.47 COCCOC(=O)CNCCCO 02a1458f87711a6f24bdf3d82f65512e [0,2,0,0,0,0|1,0,0]=3 7180 B12R0.47 COCCOC(=O)CNCCON 8bd12db2d0bcd16b5a356a4fec036ef1 [0,2,0,0,0,0|2,0,0]=4 7181 B12R0.47 COCCOC(=O)CNCCSC cc16dab037ad48babe6759b940c5a80f [0,2,0,0,0,0|1,0,0]=3 7182 B12R0.47 COCCOC(=O)COCCC#N 4056b17e64e7bea1cdc2badaf4343627 [0,2,0,0,0,0|1,0,1]=4 7183 B12R0.47 COCCOC(=O)COCCC=O 61d1011b74d4d4fbe90e330b49a388b9 [0,2,0,0,0,0|1,0,1]=4 7184 B12R0.47 COCCOC(=O)COCCCF 7eb0f0410e543afbb751c22855e166ea [0,2,0,0,0,0|1,0,0]=3 7185 B12R0.47 COCCOC(=O)COCCCS 7f73aec110efa4cdedb8a8ffd7ddb4fd [0,2,0,0,0,0|1,0,0]=3 7186 B12R0.47 COCCOC(=O)COCCSC f3aa9bfc90c758e824ad2ec080bdcba2 [0,2,0,0,0,0|1,0,0]=3 7187 B12R0.47 COCCOCC(=O)NCCCCl d68bc3f1bfb9c669c4d14619d625a7ac [0,2,0,0,0,0|2,0,0]=4 7188 B12R0.47 COCCOCC(=O)NCCCO dec6b22e0f163d15dc8e14ea7898a04d [0,2,0,0,0,0|2,0,0]=4 7189 B12R0.47 COCCOCC(=O)NCCSC e68a2d154a3f60351c878b020d22919a [0,2,0,0,0,0|2,0,0]=4 7190 B12R0.47 COCCOCC(=O)OCCOC 63389e27fc89b2b752ebe163dcfb5f5e [0,2,0,0,0,0|1,0,0]=3 7191 B12R0.47 COCCSCC(=O)NCCCCl 5316a40d2a4554d585b3670e37b75a4d [0,2,0,0,0,0|2,0,0]=4 7192 B12R0.47 COCCSCC(=O)NCCCO 4ecbf46b0196c6d0380b904e6e1c90fd [0,2,0,0,0,0|2,0,0]=4 7193 B12R0.47 COCCSCC(=O)NCCSC 226dfd66aed8ff724caedd51213d5a96 [0,2,0,0,0,0|2,0,0]=4 7194 B12R0.47 CSCCCC(=O)NCCCC#N 5a075f151f6f0271ec074e9d3e096518 [0,2,0,0,0,0|2,0,0]=4 7195 B12R0.47 CSCCCC(=O)NCCCCCl 4b35a02309973a34ccae95e0dbf6730e [0,2,0,0,0,0|2,0,0]=4 7196 B12R0.47 CSCCCC(=O)NCCCCO a97f056bf5a43d506419371701642639 [0,2,0,0,0,0|2,0,0]=4 7197 B12R0.47 CSCCCC(=O)NCCCCS 8094f21c43bf609ba6fbde1bcbaaaba0 [0,2,0,0,0,0|2,0,0]=4 7198 B12R0.47 CSCCCNC(=O)CCCCF 7fe062f89b2b0b236a3fdacbce4fa19e [0,2,0,0,0,0|2,0,0]=4 7199 B12R0.47 CSCCCNC(=O)CCCCO 714e7b7c139c0d0a1e6dd4e5b237fe99 [0,2,0,0,0,0|2,0,0]=4 7200 B12R0.47 CSCCCNC(=O)CCCCS 43b022be2cb1ef0c68146430a2386cb1 [0,2,0,0,0,0|2,0,0]=4 7201 B12R0.47 CSCCCNC(=O)CCCSC e5f0e6b5ca2523d680c09396a97e9709 [0,2,0,0,0,0|2,0,0]=4 7202 B12R0.47 CSCCCNC(=O)COCCO 18203c6579507364383d4a4992afefd4 [0,2,0,0,0,0|2,0,0]=4 7203 B12R0.47 CSCCCNC(=O)COCCS f9616c417112cab4c1c4c21b084a4137 [0,2,0,0,0,0|2,0,0]=4 7204 B12R0.47 CSCCCNC(=O)NCCCN 1cc4cf2bdcd9fd73e25d715f298834f9 [0,2,0,0,0,0|2,0,0]=4 7205 B12R0.47 CSCCCNC(=O)NCCCO 4bf0142ed806dd8985108ed0826dfffc [0,2,0,0,0,0|2,0,0]=4 7206 B12R0.47 CSCCCNC(=O)NCCSC f964e432128d9e4201dc5902be73824e [0,2,0,0,0,0|2,0,0]=4 7207 B12R0.47 CSCCNC(=O)CCCCC=O 2db4129af0a7257118fde800e6ddf4a6 [0,2,0,0,0,0|1,0,1]=4 7208 B12R0.47 CSCCNC(=O)CCCCCF f0b5ed40377d7970d4758c97e7ddf887 [0,2,0,0,0,0|1,0,0]=3 7209 B12R0.47 CSCCNC(=O)CCCCCO 8ff79ee576670f9a78470d8da47dc930 [0,2,0,0,0,0|1,0,0]=3 7210 B12R0.47 CSCCNC(=O)CCCCCS 87ab24b279c74b6a306f289d9d1fac5e [0,2,0,0,0,0|1,0,0]=3 7211 B12R0.47 CSCCNC(=O)CCCSSC 83e07e75871cc46734184fc7ff65fde2 [0,2,0,0,0,0|2,0,0]=4 7212 B12R0.47 CSCCNC(=O)CCOCCO 4ca15f11fc632488a24416ac88c1f275 [0,2,0,0,0,0|2,0,0]=4 7213 B12R0.47 CSCCNC(=O)CCOCCS a6902a26df33a0701d348d7b4402a1b5 [0,2,0,0,0,0|2,0,0]=4 7214 B12R0.47 CSCCNC(=O)COCCSC c8ab60719174586894de32f35ddb60f6 [0,2,0,0,0,0|2,0,0]=4 7215 B12R0.47 CSCCNC(=O)NCCCCN a574550a3fe7cd9077e1e7510734485e [0,2,0,0,0,0|2,0,0]=4 7216 B12R0.47 CSCCNC(=O)NCCCCO db80dda8794814e1967450e23d21fcb5 [0,2,0,0,0,0|2,0,0]=4 7217 B12R0.47 CSCCNC(=O)NCCCCS 54aeb3ab2604db51b6d2a5c34126180a [0,2,0,0,0,0|2,0,0]=4 7218 B12R0.47 CSCCOCC(=O)NCCCCl 8e0963c576ecca25dcdb9aceb5e6e8b1 [0,2,0,0,0,0|2,0,0]=4 7219 B12R0.47 CSCCOCC(=O)NCCCO b82d34dabc58858ed222bfb1e7e6a9b6 [0,2,0,0,0,0|2,0,0]=4 7220 B12R0.47 CSSCCCC(=O)NCCCCl 2b99c9f4485e6ac67de2e3fcc396b0da [0,2,0,0,0,0|2,0,0]=4 7221 B12R0.47 CSSCCCC(=O)NCCCO 99cfe6ceb411b1f9970a8663739ae8f7 [0,2,0,0,0,0|2,0,0]=4 7222 B12R0.47 N#CCCCNC(=O)CCCCF ce33aa0693c65c22dc911d98e5e8f250 [0,2,0,0,0,0|2,0,0]=4 7223 B12R0.47 N#CCCCNC(=O)CCCCO b6fbfe9d2b7b777d852379233c7b70d4 [0,2,0,0,0,0|2,0,0]=4 7224 B12R0.47 N#CCCCNC(=O)CCCCS 371966d401151726c41b8ce6beff2f0a [0,2,0,0,0,0|2,0,0]=4 7225 B12R0.47 N#CCCNC(=O)CCCCCF 84951157b7ff6af91d212eaac1045359 [0,2,0,0,0,0|1,0,1]=4 7226 B12R0.47 N#CCCNC(=O)CCCCCO 3a2c8f898c16dcc5cb731bbd173bcdf9 [0,2,0,0,0,0|1,0,1]=4 7227 B12R0.47 N#CCCNC(=O)CCCCCS 2f4ddce84dc1822aac996da3b81da804 [0,2,0,0,0,0|1,0,1]=4 7228 B12R0.47 NCCCCNC(=O)NCCCN c72a2583169272cb7b66e26823101742 [0,2,0,0,0,0|2,0,0]=4 7229 B12R0.47 NCCCCNC(=O)NCCCO 2c1b73fd7440471b0c9f8a2edf5fc13b [0,2,0,0,0,0|2,0,0]=4 7230 B12R0.47 NCCCNC(=O)NCCCCO d02bf775d8c14a1fa5a9b314b03a859c [0,2,0,0,0,0|2,0,0]=4 7231 B12R0.47 NCCCNC(=O)NCCCCS 12593f7530645a413828da34ffd95b97 [0,2,0,0,0,0|2,0,0]=4 7232 B12R0.47 NOCCNC(=O)CCCCCF 7fd8d45848a0f6d18e629a30c5ec012f [0,2,0,0,0,0|2,0,0]=4 7233 B12R0.47 NOCCNC(=O)CCCCCO 9bc788d8a8c47140e74c82c5a72fe7fd [0,2,0,0,0,0|2,0,0]=4 7234 B12R0.47 NOCCNC(=O)CCCCCS db6652e25fd297cf174198cdb09568e8 [0,2,0,0,0,0|2,0,0]=4 7235 B12R0.47 O=C(CCCCCF)NCCCCl 7bc933fe6c42e0ec07ea5ebf788b7403 [0,2,0,0,0,0|1,0,0]=3 7236 B12R0.47 O=C(CCCCCF)NCCCO 21bcd7776dd5a3550806debe124a7671 [0,2,0,0,0,0|1,0,0]=3 7237 B12R0.47 O=C(CCCCCO)NCCCCl 5060431376b9213703cd129faf6dc841 [0,2,0,0,0,0|1,0,0]=3 7238 B12R0.47 O=C(CCCCCO)NCCCO 58fbda4522589346b1696fe1620d2c73 [0,2,0,0,0,0|1,0,0]=3 7239 B12R0.47 O=C(CCCCCS)NCCCCl fb1fb711c429dee83ab9389c6eddcbd6 [0,2,0,0,0,0|1,0,0]=3 7240 B12R0.47 O=C(CCCCCS)NCCCO 042ff2247efcfaf396e4490a80c6c8da [0,2,0,0,0,0|1,0,0]=3 7241 B12R0.47 O=C(CCCCF)NCCCCCl 00f2c46ab87a0f133ef7caedf6f94145 [0,2,0,0,0,0|2,0,0]=4 7242 B12R0.47 O=C(CCCCF)NCCCCO c32fe7089cf09bc614c7bd0cc01b4881 [0,2,0,0,0,0|2,0,0]=4 7243 B12R0.47 O=C(CCCCF)NCCCCS 2b521eb7d4f1eabca16d8585f1650cc6 [0,2,0,0,0,0|2,0,0]=4 7244 B12R0.47 O=C(CCCCO)NCCCCCl 2623ef8679f8feb386e8c0c9a49943ca [0,2,0,0,0,0|2,0,0]=4 7245 B12R0.47 O=C(CCCCO)NCCCCO a585272ad0aee499a666c9e693fb4eae [0,2,0,0,0,0|2,0,0]=4 7246 B12R0.47 O=C(CCCCO)NCCCCS b2071d76bef3f4eb64942b3b1f474f94 [0,2,0,0,0,0|2,0,0]=4 7247 B12R0.47 O=C(CCCCS)NCCCCCl 72d350174439732b16f9922bddb41375 [0,2,0,0,0,0|2,0,0]=4 7248 B12R0.47 O=C(CCCCS)NCCCCO 040cd317dc15cc1b75aa40bc956cda5e [0,2,0,0,0,0|2,0,0]=4 7249 B12R0.47 O=C(CCCCS)NCCCCS d25d1de634fdc838c8a574721d6680ae [0,2,0,0,0,0|2,0,0]=4 7250 B12R0.47 O=C(CCOCCO)NCCCCl 57ad9317bf0e8e0772fefe7075db6fc4 [0,2,0,0,0,0|2,0,0]=4 7251 B12R0.47 O=C(CCOCCO)NCCCO 792cdd2f82319290cb3d61199b01426c [0,2,0,0,0,0|2,0,0]=4 7252 B12R0.47 O=C(CCOCCS)NCCCCl 927911489572ba8f09db8e41ed804459 [0,2,0,0,0,0|2,0,0]=4 7253 B12R0.47 O=C(CCOCCS)NCCCO 02101472759214c1bf725157f826dfd0 [0,2,0,0,0,0|2,0,0]=4 7254 B12R0.47 O=C(COCCO)NCCCCCl df67d0be4ea32e754f802fc28b6d5e3d [0,2,0,0,0,0|2,0,0]=4 7255 B12R0.47 O=C(COCCO)NCCCCO 7038715475f899dcdd10ec4033504e74 [0,2,0,0,0,0|2,0,0]=4 7256 B12R0.47 O=C(COCCO)NCCCCS 16e828fc769a3e5f2fd6bae7ef3bdaf1 [0,2,0,0,0,0|2,0,0]=4 7257 B12R0.47 O=C(COCCS)NCCCCCl cd37abbb1fdd303d01ee895765c6adb3 [0,2,0,0,0,0|2,0,0]=4 7258 B12R0.47 O=C(COCCS)NCCCCO 8d488bc48240b45fabb87b8d81b13b7e [0,2,0,0,0,0|2,0,0]=4 7259 B12R0.47 O=C(COCCS)NCCCCS 0a93f96d1607e88def28efdb792c61a0 [0,2,0,0,0,0|2,0,0]=4 7260 B12R0.47 O=C(NCCCO)NCCCCO a311830fcb7bb320da834cbf139d35e2 [0,2,0,0,0,0|2,0,0]=4 7261 B12R0.47 O=C(NCCCO)NCCCCS 5ffb2c99c918ea0cd79aa98e6a980851 [0,2,0,0,0,0|2,0,0]=4 7262 B12R0.47 O=CCCCCC(=O)NCCCCl df512648c71be7bace0fd67e4a16d9d9 [0,2,0,0,0,0|1,0,1]=4 7263 B12R0.47 O=CCCCCC(=O)NCCCO ef42b476925acc0a69ded1ef883e364f [0,2,0,0,0,0|1,0,1]=4 7264 B12R0.95 C=C(Br)CCOCC(=O)OCCC 279058e752cbcb6115a9fe86cd7302ef [0,2,0,0,0,0|0,0,2]=4 7265 B12R0.95 C=C(Br)COCCC(=O)OCCC 3df9d77b025e047fc07735d32f271f4b [0,2,0,0,0,0|0,0,2]=4 7266 B12R0.95 C=C(C)CCNCC(=O)NCCC b800750029730fa12bbe90333545c739 [0,2,0,0,0,0|1,0,1]=4 7267 B12R0.95 C=C(C)CCNCC(=O)OCCC 42dd603f820fbb1bbdb5187639da3c4b [0,2,0,0,0,0|0,0,1]=3 7268 B12R0.95 C=C(C)CCOCC(=O)NCCC 2f09c7e6523a3a7b27cb4f03f17376b3 [0,2,0,0,0,0|1,0,1]=4 7269 B12R0.95 C=C(C)CCOCC(=O)OCCC 59c343094d45b09ebb54d18a52d6660c [0,2,0,0,0,0|0,0,1]=3 7270 B12R0.95 C=C(C)CNCOC(=O)OCCC 921a4a660c5c7dce5e9fe052be480cd8 [0,2,0,0,0,0|1,0,1]=4 7271 B12R0.95 C=C(C)COCCC(=O)OCCC ac5799374f2ecb930f4b7160739187a2 [0,2,0,0,0,0|0,0,1]=3 7272 B12R0.95 C=C(C)COCOC(=O)OCCC f5f7d23f64d3572328ba0fcb045a706a [0,2,0,0,0,0|1,0,1]=4 7273 B12R0.95 C=C(CNCCC(C)C)OCOC 31c1bb7173b1489be4e37b7f1910c77e [0,2,0,0,0,0|2,0,0]=4 7274 B12R0.95 C=C(CNCCC(C)O)OCOC 2dc56ec12efcfe678f92a6a3d9c86850 [0,2,0,0,0,0|2,0,0]=4 7275 B12R0.95 C=C(CNCC[C@@H](C)O)OCOC 0e23620d7263fa05dd9aa8b4aaccd61c [0,2,0,0,0,0|2,0,0]=4 7276 B12R0.95 C=C(CNCC[C@H](C)O)OCOC 54ce57dcf497940c34428ec12e8727de [0,2,0,0,0,0|2,0,0]=4 7277 B12R0.95 C=C(COCCC(C)C)OCOC 067701fabdd5ae6cef1f60514024d4ca [0,2,0,0,0,0|2,0,0]=4 7278 B12R0.95 C=C(Cl)COCCC(=O)OCCC a10e6b7e70bd3396aaef8a34639f82ba [0,2,0,0,0,0|0,0,2]=4 7279 B12R0.95 C=C(F)COCCC(=O)OCCC 1e51e36ef55b0b853e947c865d7e57f6 [0,2,0,0,0,0|0,0,2]=4 7280 B12R0.95 C=CCOC(=O)CCCOC(C)C 37d9320334c3e7955103725c8f7968a4 [0,2,0,0,0,0|0,0,2]=4 7281 B12R0.95 C=CCOC(=O)CNCCC(C)C 5aa17089f72b77d5cb903d397d19ea3c [0,2,0,0,0,0|0,0,2]=4 7282 B12R0.95 C=CCOC(=O)CNCCC(C)O ac7837a9ba2c1437673c73039a38aea7 [0,2,0,0,0,0|0,0,2]=4 7283 B12R0.95 C=CCOC(=O)CNCC[C@@H](C)O 521c466b7dbe5660b7abb59802088f86 [0,2,0,0,0,0|0,0,2]=4 7284 B12R0.95 C=CCOC(=O)CNCC[C@H](C)O b0fad05fd907c0c9e9d75f6f117091c7 [0,2,0,0,0,0|0,0,2]=4 7285 B12R0.95 C=CCOC(=O)COCCC(C)C d278eb063cf5ce356e96158c5b35b27f [0,2,0,0,0,0|0,0,2]=4 7286 B12R0.95 CC(=O)CCCCC(=O)NCCBr 7ace5a16ebd61b5e70cfd53ef61f1682 [0,2,0,0,0,0|2,0,0]=4 7287 B12R0.95 CC(=O)CCCCC(=O)NCCF 8ad666240d6c544d72adf22cd21b39b9 [0,2,0,0,0,0|2,0,0]=4 7288 B12R0.95 CC(=O)CCCCC(=O)NCCI 316073701aa763b4706d15a2ca054167 [0,2,0,0,0,0|2,0,0]=4 7289 B12R0.95 CC(=O)CCCCC(=O)NCCO 05f7aee80343ed18025602e40df7664c [0,2,0,0,0,0|2,0,0]=4 7290 B12R0.95 CC(=O)CCCCC(=O)NCCS e2e2cb1d90593e5e0dd852a26847519a [0,2,0,0,0,0|2,0,0]=4 7291 B12R0.95 CC(C)CCCCC(=O)NCCBr f8bf5c4aee30e18c138849a9589130ad [0,2,0,0,0,0|2,0,0]=4 7292 B12R0.95 CC(C)CCCCC(=O)NCCF cbf249a019f3ddd6cdcf4dfb91b8da64 [0,2,0,0,0,0|2,0,0]=4 7293 B12R0.95 CC(C)CCCCC(=O)NCCI f05299986aa6cdf24bda00b2655c1c52 [0,2,0,0,0,0|2,0,0]=4 7294 B12R0.95 CC(C)CCCCC(=O)NCCO 9a5c8e6c15524d7fb8fe5c88b77eb99e [0,2,0,0,0,0|2,0,0]=4 7295 B12R0.95 CC(C)CCCCC(=O)NCCS 32a75eb9b58b17b0ed886e34a88807e5 [0,2,0,0,0,0|2,0,0]=4 7296 B12R0.95 CC(C)CCCNC(=O)CCCF b1cc9b254e3f963b95e8a832d6cf1b7c [0,2,0,0,0,0|2,0,0]=4 7297 B12R0.95 CC(C)CCCNC(=O)CCCS f6da542094d1e1704ea418dccf825300 [0,2,0,0,0,0|2,0,0]=4 7298 B12R0.95 CC(C)CCCNC(=O)NCCF 827158e51c8db7ddcf73e112b36c24d5 [0,2,0,0,0,0|2,0,0]=4 7299 B12R0.95 CC(C)CCCNC(=O)NCCN 8bde9a8ed2044939c532a98ac5718fad [0,2,0,0,0,0|2,0,0]=4 7300 B12R0.95 CC(C)CCCNC(=O)NCCO 2c5c203a1bff98ad3d13063ae2021149 [0,2,0,0,0,0|2,0,0]=4 7301 B12R0.95 CC(C)CCCNC(=O)NCCS e0329481866afea0142ce88fd980861d [0,2,0,0,0,0|2,0,0]=4 7302 B12R0.95 CC(C)CCNCC(=O)NCCO 671bcbac067d72945a997f4ea6d6c30e [0,2,0,0,0,0|2,0,0]=4 7303 B12R0.95 CC(C)SCCCC(=O)NCCBr 1645f9f1e1531f58f1849dee6831c91e [0,2,0,0,0,0|2,0,0]=4 7304 B12R0.95 CC(C)SCCCC(=O)NCCF 945df5eefcaa04a585f14719c301cdaf [0,2,0,0,0,0|2,0,0]=4 7305 B12R0.95 CC(C)SCCCC(=O)NCCI 4aa0f61a739c2f31f200e57c83f4364d [0,2,0,0,0,0|2,0,0]=4 7306 B12R0.95 CC(C)SCCCC(=O)NCCO 9c7666d87b20557dfbe792ebb2fd3a34 [0,2,0,0,0,0|2,0,0]=4 7307 B12R0.95 CC(C)SCCCC(=O)NCCS 9853a589454c799b9ce9be0bc190990e [0,2,0,0,0,0|2,0,0]=4 7308 B12R0.95 CC(O)CCNCC(=O)NCCO 6b60b8a316b1b011bae10bc8a4df73c9 [0,2,0,0,0,0|2,0,0]=4 7309 B12R0.95 CC/C=C/C(=O)NCCCC(C)C 3ebe3c580f0665574c2dd500d3cb2bfa [0,2,0,0,0,0|1,0,1]=4 7310 B12R0.95 CC/C=C\C(=O)NCCCC(C)C 8f91eb5b5c26d03d9c94b91d7b1ae27f [0,2,0,0,0,0|1,0,1]=4 7311 B12R0.95 CCC#CC(=O)NCCCC(C)C 04e030695e2ce6d0350e8b1bddea49b9 [0,2,0,0,0,0|1,0,1]=4 7312 B12R0.95 CCC=CC(=O)NCCCC(C)C 8005c5a41188fb3f84b12403b1093cf0 [0,2,0,0,0,0|1,0,1]=4 7313 B12R0.95 CCCCC(=O)NCCCC(C)C 4cfbd8cd4787b68f67725c2f6395b859 [0,2,0,0,0,0|1,0,0]=3 7314 B12R0.95 CCCCC(=O)NCCCN(C)C c9aac6fc3f3134bdb9f9101491a3ee41 [0,2,0,0,0,0|2,0,0]=4 7315 B12R0.95 CCCCC(=O)NCCCS(=O)C f634605a58baa86b20003ff0071b7212 [0,2,0,0,0,0|2,0,0]=4 7316 B12R0.95 CCCCC(=O)NCCOC(C)C 6fdc7d7ca2aabe1a6cdd81d4c3e9f3e6 [0,2,0,0,0,0|2,0,0]=4 7317 B12R0.95 CCCCC(=O)OCNCC(C)C 398b5c2dd73854504a11d47800dfa85c [0,2,0,0,0,0|2,0,0]=4 7318 B12R0.95 CCCCC(=O)OCNCC(C)O 44153623ecf39cc3939ac933198b5245 [0,2,0,0,0,0|2,0,0]=4 7319 B12R0.95 CCCCC(=O)OCNC[C@@H](C)O 154d85b5e31ba6f85d6cd62d8271e631 [0,2,0,0,0,0|2,0,0]=4 7320 B12R0.95 CCCCC(=O)OCNC[C@H](C)O e3492d206ed25d7c1e0ea2b05bf1e2bd [0,2,0,0,0,0|2,0,0]=4 7321 B12R0.95 CCCCC(=O)OCOCC(C)C d415ef9bdea7f5aca14fd71c6f1d7e8e [0,2,0,0,0,0|2,0,0]=4 7322 B12R0.95 CCCCC(=O)OCOCC(C)F 40d933d076752a93a273432d476a671f [0,2,0,0,0,0|2,0,0]=4 7323 B12R0.95 CCCCC(=O)OCOCC(C)S cc9e25e72674342f1ff946950434f5e5 [0,2,0,0,0,0|2,0,0]=4 7324 B12R0.95 CCCCC(=O)OCOC[C@@H](C)F a391fe0f327a4a5711323c423e71c560 [0,2,0,0,0,0|2,0,0]=4 7325 B12R0.95 CCCCC(=O)OCOC[C@H](C)F da7ea854b57a8ef4e443cccb85659192 [0,2,0,0,0,0|2,0,0]=4 7326 B12R0.95 CCCNC(=O)CCCCC(=O)C 63bbf587efef0fe76ac27cee2a045295 [0,2,0,0,0,0|1,0,0]=3 7327 B12R0.95 CCCNC(=O)CCCCC(=O)N bf0c0390ec669fb4b396882fff685d91 [0,2,0,0,0,0|1,0,1]=4 7328 B12R0.95 CCCNC(=O)CCCCC(C)C df71677e2f93f09f4955ba2e6046b4ae [0,2,0,0,0,0|1,0,0]=3 7329 B12R0.95 CCCNC(=O)CCCCC(F)F 92a63354bd517711f45501b0f89e57dc [0,2,0,0,0,0|1,0,0]=3 7330 B12R0.95 CCCNC(=O)CCCCN(C)C 48164338f3f788a9e9adefe4f0b203ff [0,2,0,0,0,0|1,0,0]=3 7331 B12R0.95 CCCNC(=O)CCCNC(=O)C 72aad05ba5ee610cd122fb08a752910a [0,2,0,0,0,0|1,0,1]=4 7332 B12R0.95 CCCNC(=O)CCCOC(C)C 6619ef7fa7ad414c01db075aa0bcbeae [0,2,0,0,0,0|1,0,0]=3 7333 B12R0.95 CCCNC(=O)CCCSC(=O)C fd05be196ccbac2378751cbf252275a1 [0,2,0,0,0,0|1,0,1]=4 7334 B12R0.95 CCCNC(=O)CCCSC(C)C 33f210d0bf587bc303a0e7e3713bd406 [0,2,0,0,0,0|1,0,0]=3 7335 B12R0.95 CCCNC(=O)CNCCC(=O)C dd787198cd1d60c1bf34b285a7dafe8f [0,2,0,0,0,0|1,0,1]=4 7336 B12R0.95 CCCNC(=O)CNCCC(C)C bcc3a0e80af9747011f089d13b7b27f1 [0,2,0,0,0,0|1,0,0]=3 7337 B12R0.95 CCCNC(=O)CNCCC(C)O 7b52e17ee86d5a2c7b090ba4c1b70491 [0,2,0,0,0,0|1,0,0]=3 7338 B12R0.95 CCCNC(=O)CNCCC(F)F d6b2cc38e16a76d8728ec3310a24112b [0,2,0,0,0,0|2,0,0]=4 7339 B12R0.95 CCCNC(=O)CNCCN(C)C e7d39c86e0eb4fd3526b73feb7ea03f9 [0,2,0,0,0,0|2,0,0]=4 7340 B12R0.95 CCCNC(=O)CNCCS(=O)C 3d68a672429c93a51b915ed97aacf3f9 [0,2,0,0,0,0|2,0,0]=4 7341 B12R0.95 CCCNC(=O)CNCC[C@@H](C)O 6b1c7f1e8c60a4e619e4fea5e48331ae [0,2,0,0,0,0|1,0,0]=3 7342 B12R0.95 CCCNC(=O)CNCC[C@H](C)O 3f22f1a13aa7a440aef7f4569b2e26c0 [0,2,0,0,0,0|1,0,0]=3 7343 B12R0.95 CCCNC(=O)CNCOC(C)C 1b1c03a4734b5bbfd5408d1d08fea89e [0,2,0,0,0,0|2,0,0]=4 7344 B12R0.95 CCCNC(=O)COCCC(=O)C 8538033b52b5093377175cea82bdc107 [0,2,0,0,0,0|1,0,1]=4 7345 B12R0.95 CCCNC(=O)COCCC(C)C 0106111ffd98343174db62b7bd4737c2 [0,2,0,0,0,0|1,0,0]=3 7346 B12R0.95 CCCNC(=O)COCCC(F)F 10156559986cc90db9c70171834d8545 [0,2,0,0,0,0|2,0,0]=4 7347 B12R0.95 CCCNC(=O)COCCN(C)C 15d6564f6909715b3ab0a77416ed9f89 [0,2,0,0,0,0|2,0,0]=4 7348 B12R0.95 CCCNC(=O)COCCS(=O)C 49483ba41d1153b37ee9512d4697380d [0,2,0,0,0,0|2,0,0]=4 7349 B12R0.95 CCCNC(=O)NCCCC(C)C 5ff58622df6f6304e760f5ebf6f1c6e7 [0,2,0,0,0,0|1,0,0]=3 7350 B12R0.95 CCCNC(=O)NCCCN(C)C ad782b311d2c09eb0cdd8ca62ce15b52 [0,2,0,0,0,0|2,0,0]=4 7351 B12R0.95 CCCNC(=O)NCCCS(=O)C 5a28dcaacd87e036a386131fc03c26a1 [0,2,0,0,0,0|2,0,0]=4 7352 B12R0.95 CCCNC(=O)NCCOC(C)C 44ee4d686aba83ef294389f4fc8b329d [0,2,0,0,0,0|2,0,0]=4 7353 B12R0.95 CCCNC(=S)NCCCC(C)C 1d5e85810e10e7acdd60107309599612 [0,2,0,0,0,0|1,1,0]=4 7354 B12R0.95 CCCOC(=O)CCOCC(=O)N 69ab882e20299779eca7b9171e1f952e [0,2,0,0,0,0|1,0,1]=4 7355 B12R0.95 CCCOC(=O)CCOCC(=O)O f42f3c48d0a645369f2ef2c33a7290b7 [0,2,0,0,0,0|1,0,1]=4 7356 B12R0.95 CCCOC(=O)CCOCC(C)C 325bd84036096b35d689a2aeacebb45a [0,2,0,0,0,0|0,0,0]=2 7357 B12R0.95 CCCOC(=O)CCOCC(F)F 7be1b79b204b27759bff155d32a1d77c [0,2,0,0,0,0|1,0,0]=3 7358 B12R0.95 CCCOC(=O)CCOCN(C)C 0a88160f536451c8b08421f070889911 [0,2,0,0,0,0|1,0,0]=3 7359 B12R0.95 CCCOC(=O)CCOC[N+](=O)[O-] cec91720935ebc8a25cea018730280f0 [0,2,0,0,0,0|2,0,0]=4 7360 B12R0.95 CCCOC(=O)CNCC=C(C)C 68159e503748bf21d535429139d30ae9 [0,2,0,0,0,0|0,0,2]=4 7361 B12R0.95 CCCOC(=O)CNCCC(=O)N 8121910903a3da8f950740ed6e0aca28 [0,2,0,0,0,0|1,0,1]=4 7362 B12R0.95 CCCOC(=O)CNCCC(=O)O 7cf0c4f8fc497705e7d820739185d7a0 [0,2,0,0,0,0|1,0,1]=4 7363 B12R0.95 CCCOC(=O)CNCCC(=S)N 2a1106f800e4c1c6874701f88598ed28 [0,2,0,0,0,0|1,0,1]=4 7364 B12R0.95 CCCOC(=O)CNCCC(C)C 74b2549c7197ab3eb9a019d32e1efe79 [0,2,0,0,0,0|0,0,0]=2 7365 B12R0.95 CCCOC(=O)CNCCC(C)O c366f7c3e376a8b7e4758f4cbb892ff7 [0,2,0,0,0,0|0,0,0]=2 7366 B12R0.95 CCCOC(=O)CNCCC(F)F b19d666602e74588e687abf30739fd7d [0,2,0,0,0,0|1,0,0]=3 7367 B12R0.95 CCCOC(=O)CNCCN(C)C a83934c95731ca7decb307a25d2b2a59 [0,2,0,0,0,0|1,0,0]=3 7368 B12R0.95 CCCOC(=O)CNCCS(=O)C cc1bfb32a48f46afc60ee15d62a61c1d [0,2,0,0,0,0|1,0,0]=3 7369 B12R0.95 CCCOC(=O)CNCCS(=O)O 6fa5912321b0a60adad26e19085b27cd [0,2,0,0,0,0|2,0,0]=4 7370 B12R0.95 CCCOC(=O)CNCC[C@@H](C)O a9bcf3a7044bef31157516e087e5742d [0,2,0,0,0,0|0,0,0]=2 7371 B12R0.95 CCCOC(=O)CNCC[C@H](C)O 720e7d2cac2a4b47d1e391b4ee911556 [0,2,0,0,0,0|0,0,0]=2 7372 B12R0.95 CCCOC(=O)COC/C=C(/C)\Cl 6fb03a90bd3788af12a0ad8e7fb30ed9 [0,2,0,0,0,0|0,0,2]=4 7373 B12R0.95 CCCOC(=O)COC/C=C(/C)\I 3289d0ca6b25b48e275c001c7f02ba93 [0,2,0,0,0,0|0,0,2]=4 7374 B12R0.95 CCCOC(=O)COCC=C(C)C 0c33a2730062a58554b755f472f890d6 [0,2,0,0,0,0|0,0,2]=4 7375 B12R0.95 CCCOC(=O)COCC=C(C)I d6d2311c00ccaefee5ad3bd065a7c5f3 [0,2,0,0,0,0|0,0,2]=4 7376 B12R0.95 CCCOC(=O)COCCC(=O)C 3ca13b555a6844ed813e1ef5a70d276b [0,2,0,0,0,0|0,0,1]=3 7377 B12R0.95 CCCOC(=O)COCCC(=O)N df936d98f535c3fe2e0b107a2229386b [0,2,0,0,0,0|1,0,1]=4 7378 B12R0.95 CCCOC(=O)COCCC(=O)O 165198d296352edfd4fe04737c3e8a2c [0,2,0,0,0,0|1,0,1]=4 7379 B12R0.95 CCCOC(=O)COCCC(C)C 704338dc796d61c02b256ccaf9246466 [0,2,0,0,0,0|0,0,0]=2 7380 B12R0.95 CCCOC(=O)COCCC(F)F 709461c71c00f035611dc9a7d2098e0f [0,2,0,0,0,0|1,0,0]=3 7381 B12R0.95 CCCOC(=O)COCCN(C)C 95b629ab65be3b41c33265423e7c7868 [0,2,0,0,0,0|1,0,0]=3 7382 B12R0.95 CCCOC(=O)COCCS(=O)C 7e7270fd6ba33e668f65cfb68aa3ab89 [0,2,0,0,0,0|1,0,0]=3 7383 B12R0.95 CCCOC(=O)COCC[N+](=O)[O-] 97d3bb32eeb6cb39357f10c2a1dada71 [0,2,0,0,0,0|2,0,0]=4 7384 B12R0.95 CCCOC(=O)COCNC(=O)C e4d018319013f9f250cbe3ba3c76c9ec [0,2,0,0,0,0|1,0,1]=4 7385 B12R0.95 CCCOC(=O)OCNCC(=O)C 5f7f5e4112b9ec96621d303097daf913 [0,2,0,0,0,0|1,0,1]=4 7386 B12R0.95 CCCOC(=O)OCNCC(C)C 8d599ea8b6caaf060699dcf00967f7a2 [0,2,0,0,0,0|1,0,0]=3 7387 B12R0.95 CCCOC(=O)OCNCC(C)O e4bc2fc2ac6b2503af04e76bfafac06e [0,2,0,0,0,0|1,0,0]=3 7388 B12R0.95 CCCOC(=O)OCNCC(F)F 4c81803f650d6fdb8a617b6ffb404967 [0,2,0,0,0,0|2,0,0]=4 7389 B12R0.95 CCCOC(=O)OCNC[C@@H](C)O 90b5184da8659c866ac6c109eec45287 [0,2,0,0,0,0|1,0,0]=3 7390 B12R0.95 CCCOC(=O)OCNC[C@H](C)O 37966f1752165176ba6af5cbea0ef508 [0,2,0,0,0,0|1,0,0]=3 7391 B12R0.95 CCCOC(=O)OCOCC(=O)C 870b62ee833da611d1cf12ab4d6112a9 [0,2,0,0,0,0|1,0,1]=4 7392 B12R0.95 CCCOC(=O)OCOCC(C)C 58f5c456bfe26d581a8fcd3b6568ec0c [0,2,0,0,0,0|1,0,0]=3 7393 B12R0.95 CCCOC(=O)OCOCC(C)F f5da25d3dd07a459db094fef5b336307 [0,2,0,0,0,0|1,0,0]=3 7394 B12R0.95 CCCOC(=O)OCOCC(C)S be45b1edc190f03b77fff069ccd6cd3a [0,2,0,0,0,0|1,0,0]=3 7395 B12R0.95 CCCOC(=O)OCOCC(F)F f075d23f305f7ab8102759c3be16edda [0,2,0,0,0,0|2,0,0]=4 7396 B12R0.95 CCCOC(=O)OCOC[C@@H](C)F 6f8ef3305bd8903aba91036b57d220b0 [0,2,0,0,0,0|1,0,0]=3 7397 B12R0.95 CCCOC(=O)OCOC[C@H](C)F 57df96ac24d4f8bd9147a6c22f3c8334 [0,2,0,0,0,0|1,0,0]=3 7398 B12R0.95 CCOCC(=O)NCCCC(C)C 328089ac347b1bd5125ac943dccc78a3 [0,2,0,0,0,0|2,0,0]=4 7399 B12R0.95 CCSCC(=O)NCCCC(C)C 8997e9db122ddb08389490255ae88ac2 [0,2,0,0,0,0|2,0,0]=4 7400 B12R0.95 CN(C)CCCCC(=O)NCCBr 10648ef3be93f94629008e9765d991eb [0,2,0,0,0,0|2,0,0]=4 7401 B12R0.95 CN(C)CCCCC(=O)NCCF 4581365673b47ff617ae3ee656e880d6 [0,2,0,0,0,0|2,0,0]=4 7402 B12R0.95 CN(C)CCCCC(=O)NCCI e61024c8cb85fd097296ab6ab2c56556 [0,2,0,0,0,0|2,0,0]=4 7403 B12R0.95 CN(C)CCCCC(=O)NCCO f855db61c58f24b3a78601f4772259cd [0,2,0,0,0,0|2,0,0]=4 7404 B12R0.95 CN(C)CCCCC(=O)NCCS a2bc57c2dae0b5f36909eaf35c4a7364 [0,2,0,0,0,0|2,0,0]=4 7405 B12R0.95 COCCC(=O)NCCCC(C)C 44c3bb2306e35aae764faa470f8d793e [0,2,0,0,0,0|2,0,0]=4 7406 B12R0.95 CSCCC(=O)CNCCC(C)C 33b7e66c24185d101d2d4384ec8aab3e [0,2,0,0,0,0|2,0,0]=4 7407 B12R0.95 CSCCC(=O)CNCCC(C)O d724ab708646770f61c82f1808fff2c7 [0,2,0,0,0,0|2,0,0]=4 7408 B12R0.95 CSCCC(=O)CNCC[C@@H](C)O 534ba15a1ac9507ae5c81ac270c767ca [0,2,0,0,0,0|2,0,0]=4 7409 B12R0.95 CSCCC(=O)CNCC[C@H](C)O 92750f6f24508a0b910919aa15228561 [0,2,0,0,0,0|2,0,0]=4 7410 B12R0.95 CSCCC(=O)COCCC(C)C dc1b1a3c2c3e37b0f082196ae87fd8ea [0,2,0,0,0,0|2,0,0]=4 7411 B12R0.95 CSCCC(=O)NCCCC(C)C fe065b4e3051b1be70442927276cd6e9 [0,2,0,0,0,0|2,0,0]=4 7412 B12R0.95 O=C(CCCCC(F)F)NCCBr c667b77c29146075057826ec937f49e2 [0,2,0,0,0,0|2,0,0]=4 7413 B12R0.95 O=C(CCCCC(F)F)NCCF 2cb97896e630961cb1992efee0a1670e [0,2,0,0,0,0|2,0,0]=4 7414 B12R0.95 O=C(CCCCC(F)F)NCCI 333704030920105cf23146e659ac2f8f [0,2,0,0,0,0|2,0,0]=4 7415 B12R0.95 O=C(CCCCC(F)F)NCCO 7097a53fb577f397d5c70b1609b7fdaf [0,2,0,0,0,0|2,0,0]=4 7416 B12R0.95 O=C(CCCCC(F)F)NCCS 9f46daaf3e80006aa8ae244afb5da408 [0,2,0,0,0,0|2,0,0]=4 7417 B12R0.102 C#CC(C)NCOC(=O)OCCC 18bcdbc6f0f995b5729bd5c2bc5a906d [0,2,0,0,0,0|2,0,0]=4 7418 B12R0.102 C#CC(C)OCCC(=O)OCCC 4cb4b1fb01b3088b2eb24c31e6b33a87 [0,2,0,0,0,0|1,0,0]=3 7419 B12R0.102 C#CC(C)OCOC(=O)OCCC a87a721321121b0f00a63a52ddb0c20e [0,2,0,0,0,0|2,0,0]=4 7420 B12R0.102 C#C[C@@H](C)NCOC(=O)OCCC bdd93713845e25d753e059b51c2ab673 [0,2,0,0,0,0|2,0,0]=4 7421 B12R0.102 C#C[C@@H](C)OCOC(=O)OCCC b95315074652c899011e5298c5c47118 [0,2,0,0,0,0|2,0,0]=4 7422 B12R0.102 C#C[C@H](C)NCOC(=O)OCCC 35f2e67def32a736cba2fbb07811c7a4 [0,2,0,0,0,0|2,0,0]=4 7423 B12R0.102 C#C[C@H](C)OCOC(=O)OCCC db1861bb961a130a5a050789793e1908 [0,2,0,0,0,0|2,0,0]=4 7424 B12R0.102 C=C(CC)CNCC(=O)NCCC 62b1a4087b6731258521082bb72cc386 [0,2,0,0,0,0|1,0,1]=4 7425 B12R0.102 C=C(CNCC(C)CC)OCOC b4b89d9b4e2e446333c0b8a81340d7d3 [0,2,0,0,0,0|2,0,0]=4 7426 B12R0.102 C=C(CNCC(O)CC)OCOC 9930917120b536b91154b2e4ca09580b [0,2,0,0,0,0|2,0,0]=4 7427 B12R0.102 C=C(CNC[C@@H](C)CC)OCOC 6a45591966f6855ee4db566eca4748d7 [0,2,0,0,0,0|2,0,0]=4 7428 B12R0.102 C=C(CNC[C@H](O)CC)OCOC 3412a890f977f7f92c511c0800ff9f2b [0,2,0,0,0,0|2,0,0]=4 7429 B12R0.102 C=C(COCC(C)CC)OCOC b325eb8728dd4fb870bb7ce33b2a97be [0,2,0,0,0,0|2,0,0]=4 7430 B12R0.102 C=C(COC[C@@H](C)CC)OCOC bfd56265c7f6e84878c5a77246fd5e1a [0,2,0,0,0,0|2,0,0]=4 7431 B12R0.102 C=C(COC[C@H](C)CC)OCOC 7327cb6f2cfac2271267d86e651f7cf6 [0,2,0,0,0,0|2,0,0]=4 7432 B12R0.102 C=CC(C)COCC(=O)NCCC e7977b1054055ec740e39f2836031320 [0,2,0,0,0,0|2,0,0]=4 7433 B12R0.102 C=CC(C)COCC(=O)OCCC f9095a8f614858d89d6b5900033bf7dc [0,2,0,0,0,0|1,0,0]=3 7434 B12R0.102 C=CC(C)NCOC(=O)OCCC 3f81a8224befb8df9d7bda1f8f64b0af [0,2,0,0,0,0|2,0,0]=4 7435 B12R0.102 C=CC(C)OCCC(=O)OCCC 654ed2b522bc6eb8104660fa2b226ba0 [0,2,0,0,0,0|1,0,0]=3 7436 B12R0.102 C=CC(C)OCOC(=O)OCCC 843b46ecbed0bd637d12a7c2db88f248 [0,2,0,0,0,0|2,0,0]=4 7437 B12R0.102 C=CC(O)CNCC(=O)OCCC fca991b1236d89c2608d4756b2f25faa [0,2,0,0,0,0|0,0,2]=4 7438 B12R0.102 C=CCOC(=O)CCCN(C)CC f2ce82c51ebff3a52f6bb54e03afea60 [0,2,0,0,0,0|0,0,2]=4 7439 B12R0.102 C=CCOC(=O)CNCC(C)CC d14332a0858f82f5572c8bb34779f6a6 [0,2,0,0,0,0|0,0,2]=4 7440 B12R0.102 C=CCOC(=O)CNCC(O)CC 2ddfb9057d147e24c7ee6d8b1670e315 [0,2,0,0,0,0|0,0,2]=4 7441 B12R0.102 C=CCOC(=O)CNC[C@@H](C)CC 65adc6b5478bbee0b01dec00c886a4ac [0,2,0,0,0,0|0,0,2]=4 7442 B12R0.102 C=CCOC(=O)CNC[C@H](O)CC c33136841b2978a09647ebfa6dbefd17 [0,2,0,0,0,0|0,0,2]=4 7443 B12R0.102 C=CCOC(=O)COCC(C)CC 7994d8e4ba4eb324aeb8c26b6e6289ab [0,2,0,0,0,0|0,0,2]=4 7444 B12R0.102 C=CCOC(=O)COC[C@@H](C)CC edbf3f8662d38993aee5af330cc6af48 [0,2,0,0,0,0|0,0,2]=4 7445 B12R0.102 C=CCOC(=O)COC[C@H](C)CC 589e583079ff55fd700f748a0e87d8b9 [0,2,0,0,0,0|0,0,2]=4 7446 B12R0.102 C=C[C@H](C)OCOC(=O)OCCC 7dca50346447d8035cae4807644fa51a [0,2,0,0,0,0|2,0,0]=4 7447 B12R0.102 CC/C=C/C(=O)NCCC(C)CC 9cb74c9c55c4b0038cb442a0db896f54 [0,2,0,0,0,0|1,0,1]=4 7448 B12R0.102 CC/C=C\C(=O)NCCC(C)CC 2a2bdb41d5016490d51c55527e451f75 [0,2,0,0,0,0|1,0,1]=4 7449 B12R0.102 CCC#CC(=O)NCCC(C)CC 828cb2accd13887f594e49ad452eded9 [0,2,0,0,0,0|1,0,1]=4 7450 B12R0.102 CCC(=O)CCCC(=O)NCCBr 1882d58d7cd5738843bbc95947bad6ff [0,2,0,0,0,0|2,0,0]=4 7451 B12R0.102 CCC(=O)CCCC(=O)NCCF 025722367f96cbee5cdfa5ddf64d8108 [0,2,0,0,0,0|2,0,0]=4 7452 B12R0.102 CCC(=O)CCCC(=O)NCCI b0fab90b4e7c90f99f39772707d649d1 [0,2,0,0,0,0|2,0,0]=4 7453 B12R0.102 CCC(=O)CCCC(=O)NCCO dda506e68c698dfa7b5caea595ddc50d [0,2,0,0,0,0|2,0,0]=4 7454 B12R0.102 CCC(=O)CCCC(=O)NCCS 785ed5fc3c01200c3be987ffff5c0eb9 [0,2,0,0,0,0|2,0,0]=4 7455 B12R0.102 CCC(C)CCCC(=O)NCCBr 095a1cff7185270e0838885293e7d521 [0,2,0,0,0,0|2,0,0]=4 7456 B12R0.102 CCC(C)CCCC(=O)NCCF 47846ade57715c14591e16ac69af9dea [0,2,0,0,0,0|2,0,0]=4 7457 B12R0.102 CCC(C)CCCC(=O)NCCI dd3ab5b3f64526ff1f14989c08f7b55c [0,2,0,0,0,0|2,0,0]=4 7458 B12R0.102 CCC(C)CCCC(=O)NCCO 0b4f42a8a2cf5341f8036296e8ebc3cd [0,2,0,0,0,0|2,0,0]=4 7459 B12R0.102 CCC(C)CCCC(=O)NCCS 0a52fff91e0587ad6f9074c05b667950 [0,2,0,0,0,0|2,0,0]=4 7460 B12R0.102 CCC(C)CCNC(=O)CCCF 9a17f1f931f2104e39a8e613c133be64 [0,2,0,0,0,0|2,0,0]=4 7461 B12R0.102 CCC(C)CCNC(=O)CCCS 40dff8918d538d24ee069214a3af73d7 [0,2,0,0,0,0|2,0,0]=4 7462 B12R0.102 CCC(C)CCNC(=O)CCOC a44de6d4a8d32122a33bd453bf85ae19 [0,2,0,0,0,0|2,0,0]=4 7463 B12R0.102 CCC(C)CCNC(=O)CCSC 6edf7b18823512935d0930adcefee25d [0,2,0,0,0,0|2,0,0]=4 7464 B12R0.102 CCC(C)CCNC(=O)NCCF 8aab774176ff6245eb29af8093fc1448 [0,2,0,0,0,0|2,0,0]=4 7465 B12R0.102 CCC(C)CCNC(=O)NCCN 1ddaca81f4e614145fd0938cd377fbdc [0,2,0,0,0,0|2,0,0]=4 7466 B12R0.102 CCC(C)CCNC(=O)NCCO d13fe0789c0f96794244e0f6472d5c3e [0,2,0,0,0,0|2,0,0]=4 7467 B12R0.102 CCC(C)CCNC(=O)NCCS 49db7a35e5f28ba15f2bda451fae571e [0,2,0,0,0,0|2,0,0]=4 7468 B12R0.102 CCC(C)CNCC(=O)CCSC aba84d3b33646c7d8408dff8248c608b [0,2,0,0,0,0|2,0,0]=4 7469 B12R0.102 CCC(C)CNCC(=O)NCCO 8e3b41ebf804869320ecee786843a232 [0,2,0,0,0,0|2,0,0]=4 7470 B12R0.102 CCC(C)COCC(=O)CCSC 5a3ce4035bca6de49f2e8d3c04b098f5 [0,2,0,0,0,0|2,0,0]=4 7471 B12R0.102 CCC(O)CNCC(=O)CCSC c3d14cce469886d435340c614e6b9a73 [0,2,0,0,0,0|2,0,0]=4 7472 B12R0.102 CCC(O)CNCC(=O)NCCO 46d99a221c9f17aba7033d79fe80f53b [0,2,0,0,0,0|2,0,0]=4 7473 B12R0.102 CCC=CC(=O)NCCC(C)CC 5ec3d8c8a2a52df802f6dcbf8e865c54 [0,2,0,0,0,0|1,0,1]=4 7474 B12R0.102 CCCCC(=O)NCCC(C)CC 4f52569bb623d7f775801ee22b5dd215 [0,2,0,0,0,0|1,0,0]=3 7475 B12R0.102 CCCCC(=O)NCCC(C)CO 5e2035af1b9cf5b3ad3e9bb748d9d252 [0,2,0,0,0,0|2,0,0]=4 7476 B12R0.102 CCCCC(=O)NCCC(O)CO 24690e6bb904f590614a7a8240da0ced [0,2,0,0,0,0|2,0,0]=4 7477 B12R0.102 CCCCC(=O)NCC[C@@H](C)CO d3bcb3d3997876d0eaa24754af811d20 [0,2,0,0,0,0|2,0,0]=4 7478 B12R0.102 CCCCC(=O)OCOC(C)CC 0457cc5379377c62c69654ef906d7882 [0,2,0,0,0,0|2,0,0]=4 7479 B12R0.102 CCCCC(=O)OCO[C@@H](C)CC 941a8a6f02825443379a92f0d33b4e68 [0,2,0,0,0,0|2,0,0]=4 7480 B12R0.102 CCCCC(=O)OCO[C@H](C)CC fa459134ab25a7d5a1e347714e81ffec [0,2,0,0,0,0|2,0,0]=4 7481 B12R0.102 CCCNC(=O)CCCC(=O)CC 1961ac9f040acfc591cd5015cf471778 [0,2,0,0,0,0|1,0,0]=3 7482 B12R0.102 CCCNC(=O)CCCC(=O)NC c730e69c6410a213583e2d4ed0171a4e [0,2,0,0,0,0|1,0,1]=4 7483 B12R0.102 CCCNC(=O)CCCC(=O)OC 7af4d7803136e9b244e10e297e7b47c6 [0,2,0,0,0,0|1,0,1]=4 7484 B12R0.102 CCCNC(=O)CCCC(C)CC 5f07022bdfedacfc51c3a7f7a1097226 [0,2,0,0,0,0|1,0,0]=3 7485 B12R0.102 CCCNC(=O)CCCC(O)CO 114599b45222067e007a1434bf966552 [0,2,0,0,0,0|1,0,0]=3 7486 B12R0.102 CCCNC(=O)CCCN(C)CC 499e2d2c74349cfae6461b3c3be04711 [0,2,0,0,0,0|1,0,0]=3 7487 B12R0.102 CCCNC(=O)CCNC(=O)CC 47ea83769e1cd5760ccf18b3a6b57781 [0,2,0,0,0,0|1,0,1]=4 7488 B12R0.102 CCCNC(=O)CNCC(=O)CC e2d6ddfeef6b7a6b4655f3d5bf2415fb [0,2,0,0,0,0|1,0,1]=4 7489 B12R0.102 CCCNC(=O)CNCC(Br)CBr 8ff476ebdaf40208ea30209bd50574bc [0,2,0,0,0,0|2,0,0]=4 7490 B12R0.102 CCCNC(=O)CNCC(C)C#N c7791ce214009a2ee2f1d5e52498e2f4 [0,2,0,0,0,0|2,0,0]=4 7491 B12R0.102 CCCNC(=O)CNCC(C)CC c7d050cefd9773b43d811e9fe45bc962 [0,2,0,0,0,0|1,0,0]=3 7492 B12R0.102 CCCNC(=O)CNCC(C)CO 57bd769c853a2259d5d604518cda0855 [0,2,0,0,0,0|2,0,0]=4 7493 B12R0.102 CCCNC(=O)CNCC(C)OC f72ab4ee979ad0b1de9d9ed9310df95f [0,2,0,0,0,0|2,0,0]=4 7494 B12R0.102 CCCNC(=O)CNCC(F)CO 92e2f49a7f55084a2cc382e6350cc926 [0,2,0,0,0,0|2,0,0]=4 7495 B12R0.102 CCCNC(=O)CNCC(O)CC 5013a969c04d211ffedc44566b8e9542 [0,2,0,0,0,0|1,0,0]=3 7496 B12R0.102 CCCNC(=O)CNCC(O)CF 95aab5002b67ddd50b3a51d2073a375f [0,2,0,0,0,0|2,0,0]=4 7497 B12R0.102 CCCNC(=O)CNCC(O)CO d5618748985c3c2ebcf8453b6f4eec28 [0,2,0,0,0,0|2,0,0]=4 7498 B12R0.102 CCCNC(=O)CNC[C@@H](C)CC 743f3429fe5160d519918a358a1ab12a [0,2,0,0,0,0|1,0,0]=3 7499 B12R0.102 CCCNC(=O)CNC[C@@H](C)CO e658ff15bd8b682c6b05caefcbe0c707 [0,2,0,0,0,0|2,0,0]=4 7500 B12R0.102 CCCNC(=O)CNC[C@@H](C)OC a3effca595d17d9cad27a2668c553d4a [0,2,0,0,0,0|2,0,0]=4 7501 B12R0.102 CCCNC(=O)CNC[C@@H](F)CO b0ba3a1625eda8dd6b028186e313545a [0,2,0,0,0,0|2,0,0]=4 7502 B12R0.102 CCCNC(=O)CNC[C@@H](O)CO 90181af3e520bd50c4ef7b7a51dca058 [0,2,0,0,0,0|2,0,0]=4 7503 B12R0.102 CCCNC(=O)CNC[C@H](C)CC 0987f0241775c56d413ef3d311cdd088 [0,2,0,0,0,0|1,0,0]=3 7504 B12R0.102 CCCNC(=O)CNC[C@H](C)CO 4edda69af6916de5f5580103a702c8f8 [0,2,0,0,0,0|2,0,0]=4 7505 B12R0.102 CCCNC(=O)CNC[C@H](C)OC 058ce0cad87be1d0bd03d784c2887386 [0,2,0,0,0,0|2,0,0]=4 7506 B12R0.102 CCCNC(=O)CNC[C@H](F)CO 8be8596bd2f9ef026f97fc178c320bfc [0,2,0,0,0,0|2,0,0]=4 7507 B12R0.102 CCCNC(=O)CNC[C@H](O)CC ecd252d9e743c19529340831cf8f65fa [0,2,0,0,0,0|1,0,0]=3 7508 B12R0.102 CCCNC(=O)CNC[C@H](O)CO d082825b4b7ff05ab92784c9dc1db896 [0,2,0,0,0,0|2,0,0]=4 7509 B12R0.102 CCCNC(=O)COCC(=O)CC 928790e5c202a6ee6e979865b8125360 [0,2,0,0,0,0|1,0,1]=4 7510 B12R0.102 CCCNC(=O)COCC(Br)CBr 008ac52f423676535aa6cabfbe6fa2e9 [0,2,0,0,0,0|2,0,0]=4 7511 B12R0.102 CCCNC(=O)COCC(C)C#N aa445542be78e574ce39089f12a946d5 [0,2,0,0,0,0|2,0,0]=4 7512 B12R0.102 CCCNC(=O)COCC(C)CC 2a1e9bdd100448a42cf961013e371f63 [0,2,0,0,0,0|1,0,0]=3 7513 B12R0.102 CCCNC(=O)COCC(C)OC b7fbd1c0a21a07c762c142c97d965572 [0,2,0,0,0,0|2,0,0]=4 7514 B12R0.102 CCCNC(=O)COCC(Cl)CCl e2fa84948c60776e1466d70f730e90fc [0,2,0,0,0,0|2,0,0]=4 7515 B12R0.102 CCCNC(=O)COCC(S)CS c4d0979927fae0b8525294593abdfd9e [0,2,0,0,0,0|2,0,0]=4 7516 B12R0.102 CCCNC(=O)COC[C@@H](C)CC 746a0ccbc80b2f03cea15e7437a2ab65 [0,2,0,0,0,0|1,0,0]=3 7517 B12R0.102 CCCNC(=O)COC[C@@H](C)OC 430e8675c74e5bcb68f05e08cfd2feac [0,2,0,0,0,0|2,0,0]=4 7518 B12R0.102 CCCNC(=O)COC[C@H](C)CC ed60da0041bc873bcc24c6ff59958c62 [0,2,0,0,0,0|1,0,0]=3 7519 B12R0.102 CCCNC(=O)COC[C@H](C)OC c5eef827f532efdbb9dcb236cc804665 [0,2,0,0,0,0|2,0,0]=4 7520 B12R0.102 CCCNC(=O)NCCC(C)CC b35acf027356ff7995ff8b1d372ec683 [0,2,0,0,0,0|1,0,0]=3 7521 B12R0.102 CCCNC(=O)NCCC(C)CO 14dadc5359e5a798f7e66c9eef32ab6d [0,2,0,0,0,0|2,0,0]=4 7522 B12R0.102 CCCNC(=O)NCCC(O)CO 251fe261339115adbc199f24f026434c [0,2,0,0,0,0|2,0,0]=4 7523 B12R0.102 CCCNC(=O)NCC[C@@H](C)CO 5135aea1aebbc236175bff804d4a893e [0,2,0,0,0,0|2,0,0]=4 7524 B12R0.102 CCCNC(=S)NCCC(C)CC 2489fac057f261725238d765e4e0f508 [0,2,0,0,0,0|1,1,0]=4 7525 B12R0.102 CCCOC(=O)CCOC(C)C=O 63eadf5052d5ae84639cccbf215c0c6c [0,2,0,0,0,0|1,0,0]=3 7526 B12R0.102 CCCOC(=O)CCOC(C)CC 19e0038b42890ca21ea46c8192401969 [0,2,0,0,0,0|0,0,0]=2 7527 B12R0.102 CCCOC(=O)CCO[C@H](C)C=O 8ae532ca579211e68433895882d595e7 [0,2,0,0,0,0|1,0,0]=3 7528 B12R0.102 CCCOC(=O)CNCC(=O)NC 5aa4bd652b24299688f78f18b24a3f9c [0,2,0,0,0,0|1,0,1]=4 7529 B12R0.102 CCCOC(=O)CNCC(=O)OC a29c0c50e95f506b27f39c9fa666b5b3 [0,2,0,0,0,0|1,0,1]=4 7530 B12R0.102 CCCOC(=O)CNCC(Br)CBr 885d2f1a97ee4e2960150a14a90e400f [0,2,0,0,0,0|1,0,0]=3 7531 B12R0.102 CCCOC(=O)CNCC(C)C#N 4012b038e631c1e81ce4a5745c8d2d93 [0,2,0,0,0,0|1,0,0]=3 7532 B12R0.102 CCCOC(=O)CNCC(C)CC 1132b7f89ad758024981f29495d4d279 [0,2,0,0,0,0|0,0,0]=2 7533 B12R0.102 CCCOC(=O)CNCC(C)CO e62aa33d8dc0c9921bf66e7c63a41175 [0,2,0,0,0,0|1,0,0]=3 7534 B12R0.102 CCCOC(=O)CNCC(F)CO 0463bd35037ae10215447964251a3085 [0,2,0,0,0,0|1,0,0]=3 7535 B12R0.102 CCCOC(=O)CNCC(O)CC 20d518a90b8ef2ce518441cf22669142 [0,2,0,0,0,0|0,0,0]=2 7536 B12R0.102 CCCOC(=O)CNCC(O)CO ae71187e70f56f437d1fe1de0bab59eb [0,2,0,0,0,0|1,0,0]=3 7537 B12R0.102 CCCOC(=O)CNC[C@@H](C)CC 96a55438ede02281d7b7e05fcf0b8b2e [0,2,0,0,0,0|0,0,0]=2 7538 B12R0.102 CCCOC(=O)CNC[C@@H](C)OC 0a008d840347d5111ce867849a5a7005 [0,2,0,0,0,0|1,0,0]=3 7539 B12R0.102 CCCOC(=O)CNC[C@@H](F)CO 759ba460f3a41ea77698cf10df7447cf [0,2,0,0,0,0|1,0,0]=3 7540 B12R0.102 CCCOC(=O)CNC[C@@H](O)CO ea24b6b59d49ddc03686fec8de925a7d [0,2,0,0,0,0|1,0,0]=3 7541 B12R0.102 CCCOC(=O)CNC[C@H](C)CO a5077dcd386b257f6ca9dee8c0d04361 [0,2,0,0,0,0|1,0,0]=3 7542 B12R0.102 CCCOC(=O)CNC[C@H](C)OC 43c488240c2bb852459421f8e1153e34 [0,2,0,0,0,0|1,0,0]=3 7543 B12R0.102 CCCOC(=O)CNC[C@H](F)CO bed2fd15a32371d2199b28450d17a588 [0,2,0,0,0,0|1,0,0]=3 7544 B12R0.102 CCCOC(=O)CNC[C@H](O)CC 379004329bd17066496d6a36f2d4ca0f [0,2,0,0,0,0|0,0,0]=2 7545 B12R0.102 CCCOC(=O)CNC[C@H](O)CO bdd43492ba9695e46a94a5b58f1dfe06 [0,2,0,0,0,0|1,0,0]=3 7546 B12R0.102 CCCOC(=O)COC/C(=C/I)/C c0000047b725e4943a607a5a4f44cabb [0,2,0,0,0,0|1,0,1]=4 7547 B12R0.102 CCCOC(=O)COCC(=CI)C 0d282ce19a578353bc8bd9c2aabd0e97 [0,2,0,0,0,0|1,0,1]=4 7548 B12R0.102 CCCOC(=O)COCC(=O)CC 6958fb2f355e612061fc84b93bd00042 [0,2,0,0,0,0|0,0,1]=3 7549 B12R0.102 CCCOC(=O)COCC(=O)NC ded6372400f01e308bd53b2b20c56a65 [0,2,0,0,0,0|1,0,1]=4 7550 B12R0.102 CCCOC(=O)COCC(=O)OC 957e10de399fb279910d9782f5d3996c [0,2,0,0,0,0|1,0,1]=4 7551 B12R0.102 CCCOC(=O)COCC(Br)CBr 3d439e1a4510dd5ad36996b538b9b963 [0,2,0,0,0,0|1,0,0]=3 7552 B12R0.102 CCCOC(=O)COCC(C)C#N c15f58efcbb6b4fdd19098a95732241f [0,2,0,0,0,0|1,0,0]=3 7553 B12R0.102 CCCOC(=O)COCC(C)CC 627027b241f3196bd7925a25b615e010 [0,2,0,0,0,0|0,0,0]=2 7554 B12R0.102 CCCOC(=O)COCC(C)OC 03abf72159602a8532796cfa410303e6 [0,2,0,0,0,0|1,0,0]=3 7555 B12R0.102 CCCOC(=O)COCC(Cl)CCl 947dc9b62ba7ed2910a5a8b1f70bb42d [0,2,0,0,0,0|1,0,0]=3 7556 B12R0.102 CCCOC(=O)COCC(S)CS 888b544380b5854480190d39d498457f [0,2,0,0,0,0|1,0,0]=3 7557 B12R0.102 CCCOC(=O)COC[C@@H](C)CC 58c93d1c7873f31ad88efb43266d594b [0,2,0,0,0,0|0,0,0]=2 7558 B12R0.102 CCCOC(=O)COC[C@@H](C)OC 22296be3e80b222629293c8b288a0487 [0,2,0,0,0,0|1,0,0]=3 7559 B12R0.102 CCCOC(=O)COC[C@H](C)CC e36ca0e50b404bc3448d25ae6bb9dc7e [0,2,0,0,0,0|0,0,0]=2 7560 B12R0.102 CCCOC(=O)COC[C@H](C)OC 778927330e7a5cae244d9148768a3f49 [0,2,0,0,0,0|1,0,0]=3 7561 B12R0.102 CCCOC(=O)OCNC(C)C#N d1bb91154863005047ef57c17c7825b0 [0,2,0,0,0,0|2,0,0]=4 7562 B12R0.102 CCCOC(=O)OCNC(C)CC 4183f2f365a416b889b1574932ad9c2c [0,2,0,0,0,0|1,0,0]=3 7563 B12R0.102 CCCOC(=O)OCNC(C)CO bd3c641981777d60b0689e5fd535ff4d [0,2,0,0,0,0|2,0,0]=4 7564 B12R0.102 CCCOC(=O)OCN[C@@H](C)CC 1a35b2cf6c652fb0c72e456b117fb72a [0,2,0,0,0,0|1,0,0]=3 7565 B12R0.102 CCCOC(=O)OCN[C@@H](C)CO a71c7e7f7f1b1e2d3b388e1d524190a9 [0,2,0,0,0,0|2,0,0]=4 7566 B12R0.102 CCCOC(=O)OCN[C@H](C)CC f178b81e79b7fc175a19e64247140878 [0,2,0,0,0,0|1,0,0]=3 7567 B12R0.102 CCCOC(=O)OCN[C@H](C)CO 1f334dc9a9a200186ab7f2631f0d3ece [0,2,0,0,0,0|2,0,0]=4 7568 B12R0.102 CCCOC(=O)OCOC(C)C=O c421168bd8890fd013e16b9e7b4f1c56 [0,2,0,0,0,0|2,0,0]=4 7569 B12R0.102 CCOCC(=O)NCCC(C)CC dcfe821ec39561aa68ead1e2b701b71f [0,2,0,0,0,0|2,0,0]=4 7570 B12R0.102 CCSCC(=O)NCCC(C)CC 034027570cb4f6dd4b5618e2cab5d942 [0,2,0,0,0,0|2,0,0]=4 7571 B12R0.102 CC[C@@H](C)CNCC(=O)NCCO b2d2084ed946ff0a1539a0e312a2ebde [0,2,0,0,0,0|2,0,0]=4 7572 B12R0.102 CC[C@@H](C)COCC(=O)CCSC 7069f155f551688645d4d196cb61ed0a [0,2,0,0,0,0|2,0,0]=4 7573 B12R0.102 CC[C@@H](O)CNCC(=O)CCSC 4853067d3e9ac8aa3181c543f82ad79e [0,2,0,0,0,0|2,0,0]=4 7574 B12R0.102 CC[C@H](C)CNCC(=O)CCSC b68c2e0fbb9f59329bbc3075d49a6be9 [0,2,0,0,0,0|2,0,0]=4 7575 B12R0.102 CC[C@H](C)CNCC(=O)NCCO 6baded732fa5e3b52f0ea50af71eb1a0 [0,2,0,0,0,0|2,0,0]=4 7576 B12R0.102 CC[C@H](C)COCC(=O)CCSC 161be4a5926f8dd849ae20c01661d418 [0,2,0,0,0,0|2,0,0]=4 7577 B12R0.102 O=C(CCCC(O)CO)NCCBr 81a0638c38035cc171bc569178212a6b [0,2,0,0,0,0|2,0,0]=4 7578 B12R0.102 O=C(CCCC(O)CO)NCCF b3547cca15e209e0824404971a222259 [0,2,0,0,0,0|2,0,0]=4 7579 B12R0.102 O=C(CCCC(O)CO)NCCI f5ce33fc2ada58603ad849497eef9cc6 [0,2,0,0,0,0|2,0,0]=4 7580 B12R0.102 O=C(CCCC(O)CO)NCCO 04bc891f5294ad628bf3e7af05b0db0d [0,2,0,0,0,0|2,0,0]=4 7581 B12R0.102 O=C(CCCC(O)CO)NCCS 109f4e44658d095a80d1d17483ac03e6 [0,2,0,0,0,0|2,0,0]=4 7582 B12R0.111 C=CC(CCCCCC)OCCC 611eeb5b78bb4f9da38a90e0b40e8517 [0,2,0,0,0,0|1,0,1]=4 7583 B12R0.111 CCC/C=C(\CC)/COCCCC 78005f27323d1bf764cb25980466dc34 [0,2,0,0,0,0|2,0,0]=4 7584 B12R0.111 CCCCCCC(CC)OCCC e625bc7a43e183a77f628967ba9888bf [0,2,0,0,0,0|1,0,1]=4 7585 B12R0.111 CCCCCCN(C=O)CCCC a9de1010a63ea7527524d261ee197eb3 [0,2,0,0,0,0|2,0,0]=4 7586 B12R0.113 C#CCCCCC(=O)NC(C)CC daea24ff27966efe46bf2dd03619426d [0,2,0,0,0,0|1,0,1]=4 7587 B12R0.113 C#CCCCCC(=O)N[C@@H](C)CC 762d3d395da755703edcb21cac4b4ac4 [0,2,0,0,0,0|1,0,1]=4 7588 B12R0.113 C#CCCCCC(=O)N[C@H](C)CC 28ef063edac444b6398c0579880e0c95 [0,2,0,0,0,0|1,0,1]=4 7589 B12R0.113 C/C=C/CCCC(=O)NC(C)CC d4661c95a92b756a7efea9ecf01b09f3 [0,2,0,0,0,0|1,0,1]=4 7590 B12R0.113 C/C=C/CCCC(=O)N[C@@H](C)CC b8dc4e37c9b930b51c0642b01ec5fddb [0,2,0,0,0,0|1,0,1]=4 7591 B12R0.113 C/C=C/CCCC(=O)N[C@H](C)CC 6b34abe7c9aac9ac8c533fe05f387af3 [0,2,0,0,0,0|1,0,1]=4 7592 B12R0.113 C=CCCCCC(=O)NC(C)CC e6e69b4decfa456753d5a33396f53f02 [0,2,0,0,0,0|1,0,1]=4 7593 B12R0.113 C=CCCCCC(=O)N[C@@H](C)CC a15df1e89bccceb6e5845b6f22749ed6 [0,2,0,0,0,0|1,0,1]=4 7594 B12R0.113 C=CCCCCC(=O)N[C@H](C)CC fd9b27ca9de9e54b9e2dcb8b7c3f5357 [0,2,0,0,0,0|1,0,1]=4 7595 B12R0.113 CC(CO)NC(=O)CCCCCF b514259216e6f0c1d2f352277ac0175c [0,2,0,0,0,0|2,0,0]=4 7596 B12R0.113 CC(CO)NC(=O)CCCCCO e6caca2f29bebf7fa9059bd91047ee85 [0,2,0,0,0,0|2,0,0]=4 7597 B12R0.113 CC(CO)NC(=O)CCCCCS fe23a2a0779b338262d333c5cad7eafd [0,2,0,0,0,0|2,0,0]=4 7598 B12R0.113 CCC(C)CC(=O)NCCCCCl 0fbdc4f50908d2fdca25043c1c30e188 [0,2,0,0,0,0|2,0,0]=4 7599 B12R0.113 CCC(C)CC(=O)NCCCCO 91b99315d87ee965b0347ac7da325a99 [0,2,0,0,0,0|2,0,0]=4 7600 B12R0.113 CCC(C)CC(=O)NCCCCS 3e4c3ce3110d7d32c7816c59021badd8 [0,2,0,0,0,0|2,0,0]=4 7601 B12R0.113 CCC(C)CC(=O)NCCCOC a266c0dbefe7ab842046751f58a279d2 [0,2,0,0,0,0|2,0,0]=4 7602 B12R0.113 CCC(C)CC(=O)NCCCSC c91b63461580912966d0f2408e9572c8 [0,2,0,0,0,0|2,0,0]=4 7603 B12R0.113 CCC(C)NC(=O)CCCCC=O 046ffcd3db414db283861760fedf616b [0,2,0,0,0,0|1,0,1]=4 7604 B12R0.113 CCC(C)NC(=O)CCCCCF 521f13cca278fd03e17faf7fbb013cca [0,2,0,0,0,0|1,0,0]=3 7605 B12R0.113 CCC(C)NC(=O)CCCCCO ec0172474b66962edb01717a0575b7d7 [0,2,0,0,0,0|1,0,0]=3 7606 B12R0.113 CCC(C)NC(=O)CCCCCS 7ef268234ddd9bcc84ba558bf5b2420a [0,2,0,0,0,0|1,0,0]=3 7607 B12R0.113 CCC(C)NC(=O)CCCSSC bf08cf5173bb0c3ceecd6b256d139bda [0,2,0,0,0,0|2,0,0]=4 7608 B12R0.113 CCC(C)NC(=O)CCOCCO 98d15d489a95ef6382938573dfa2de22 [0,2,0,0,0,0|2,0,0]=4 7609 B12R0.113 CCC(C)NC(=O)CCOCCS eb771334642240132598d8e3e44d2a41 [0,2,0,0,0,0|2,0,0]=4 7610 B12R0.113 CCC(C)NC(=O)CNCCCCl 56a4bb8a0cfc801b1bde20982ca4ea44 [0,2,0,0,0,0|2,0,0]=4 7611 B12R0.113 CCC(C)NC(=O)CNCCCO c841a6c68b7596173e9b9a519a09d1f3 [0,2,0,0,0,0|2,0,0]=4 7612 B12R0.113 CCC(C)NC(=O)CNCCOC ecb02588872f51f183217b985a82b6a7 [0,2,0,0,0,0|2,0,0]=4 7613 B12R0.113 CCC(C)NC(=O)CNCCSC 7e503313680bd8954fe798ff51a308dd [0,2,0,0,0,0|2,0,0]=4 7614 B12R0.113 CCC(C)NC(=O)COCCCF a81108859ec0db27e6e76c65b07ca4fb [0,2,0,0,0,0|2,0,0]=4 7615 B12R0.113 CCC(C)NC(=O)COCCCS 80573caa42c4eefb13fc6ffafbfb7be7 [0,2,0,0,0,0|2,0,0]=4 7616 B12R0.113 CCC(C)NC(=O)COCCOC 23bc0ce5507a8987c957cd55af3882f0 [0,2,0,0,0,0|2,0,0]=4 7617 B12R0.113 CCC(C)NC(=O)COCCSC 80c3504e9ef1ec4a510032cd1ff1f94a [0,2,0,0,0,0|2,0,0]=4 7618 B12R0.113 CCC(C)NC(=O)CSCCOC 4e868fc05f30e9122eadbbc8801d3a25 [0,2,0,0,0,0|2,0,0]=4 7619 B12R0.113 CCC(C)NC(=O)NCCCCN 5699288c08ce89a308dfcf5c4bd0dcf9 [0,2,0,0,0,0|2,0,0]=4 7620 B12R0.113 CCC(C)NC(=O)NCCCCO 4b15061b920b9a7203c86a982ea07e46 [0,2,0,0,0,0|2,0,0]=4 7621 B12R0.113 CCC(C)NC(=O)NCCCCS f07dae5a7a5a3ee0a5531303d7575175 [0,2,0,0,0,0|2,0,0]=4 7622 B12R0.113 CCC(C)NC(=O)NCCCOC db37457cea45569bca936260fb762e78 [0,2,0,0,0,0|2,0,0]=4 7623 B12R0.113 CCC(C)NC(=O)NCCCSC 822b961eb7e9324967b5fb1c2412fbe1 [0,2,0,0,0,0|2,0,0]=4 7624 B12R0.113 CCC(O)CC(=O)NCCCCCl 99d38c23a3c6fdd6186f269704bd23bb [0,2,0,0,0,0|2,0,0]=4 7625 B12R0.113 CCC(O)CC(=O)NCCCCO 1038db4abb59b60073da4fa4bbbec5bc [0,2,0,0,0,0|2,0,0]=4 7626 B12R0.113 CCC(O)CC(=O)NCCCCS 088d6e76ef9e055bf86de10ab657d3bb [0,2,0,0,0,0|2,0,0]=4 7627 B12R0.113 CCC(O)CC(=O)NCCCOC 7041ed07075afbf86ab1c8f20e73d39f [0,2,0,0,0,0|2,0,0]=4 7628 B12R0.113 CCC(O)CC(=O)NCCCSC 1e08f7621fd2f8b28d0c95e0a67b4a2f [0,2,0,0,0,0|2,0,0]=4 7629 B12R0.113 CCC/C=C/CC(=O)NC(C)CC 1fc2f0f082f0afd775ccf7cd46b9a695 [0,2,0,0,0,0|1,0,1]=4 7630 B12R0.113 CCC/C=C/CC(=O)N[C@@H](C)CC fb88a5645f5a22f664f19ce5ce20b5c4 [0,2,0,0,0,0|1,0,1]=4 7631 B12R0.113 CCC/C=C/CC(=O)N[C@H](C)CC ac395f4b6ad518a140b78307623953d7 [0,2,0,0,0,0|1,0,1]=4 7632 B12R0.113 CCCC/C=C/C(=O)NC(C)CC 6eed70e2e216d374cf352de9364799dd [0,2,0,0,0,0|1,0,1]=4 7633 B12R0.113 CCCC/C=C/C(=O)N[C@@H](C)CC e09b9f13985082dd7103ad81addc809e [0,2,0,0,0,0|1,0,1]=4 7634 B12R0.113 CCCC/C=C/C(=O)N[C@H](C)CC e37c8d79c9eb304d8a46f360e38822b7 [0,2,0,0,0,0|1,0,1]=4 7635 B12R0.113 CCCCC#CC(=O)NC(C)CC 1243c8904053fab980d192cfa7897ad7 [0,2,0,0,0,0|1,0,1]=4 7636 B12R0.113 CCCCC#CC(=O)N[C@@H](C)CC e83db8ffbcff0416c00c2291370e9a50 [0,2,0,0,0,0|1,0,1]=4 7637 B12R0.113 CCCCC#CC(=O)N[C@H](C)CC 36c777035a7cfb9d66cb38d57003dc30 [0,2,0,0,0,0|1,0,1]=4 7638 B12R0.113 CCCCC=CC(=O)NC(C)CC f37e9fbfeefdef8079bef3ebdc7694ff [0,2,0,0,0,0|1,0,1]=4 7639 B12R0.113 CCCCC=CC(=O)N[C@@H](C)CC 41e8fa45582f77f32024d88deb2d4aa0 [0,2,0,0,0,0|1,0,1]=4 7640 B12R0.113 CCCCC=CC(=O)N[C@H](C)CC ae64527a3e2ce1edf6d6a8d0f5bfbda2 [0,2,0,0,0,0|1,0,1]=4 7641 B12R0.113 CCCCCCC(=O)NC(C)CC 4d6755fc6b0c3b305083fdeac803dd8d [0,2,0,0,0,0|1,0,0]=3 7642 B12R0.113 CCCCCCC(=O)NC(C)CO b7a9d2df5ced26fc3fba5d216d98f92e [0,2,0,0,0,0|2,0,0]=4 7643 B12R0.113 CCCCCCC(=O)N[C@@H](C)CC a9b9ebd896df25a0338bc1f71d3bf636 [0,2,0,0,0,0|1,0,0]=3 7644 B12R0.113 CCCCCCC(=O)N[C@@H](C)CO 7f4a8b3f9546873d74f637047e80e1ef [0,2,0,0,0,0|2,0,0]=4 7645 B12R0.113 CCCCCCC(=O)N[C@H](C)CC a00351c3396cd0832e6d4eb23686ea7c [0,2,0,0,0,0|1,0,0]=3 7646 B12R0.113 CCCCCCC(=O)N[C@H](C)CO 1ac69948e41f89fe29e9c3faae70bb45 [0,2,0,0,0,0|2,0,0]=4 7647 B12R0.113 CCCCCCC(C)OC(C)CC ef9eb615ac7a3f92f3d475ca66803e27 [0,2,0,0,0,0|1,0,1]=4 7648 B12R0.113 CCCCCCC(C)O[C@@H](C)CC ca995e5d393d7c1e370ef5a896483f7c [0,2,0,0,0,0|1,0,1]=4 7649 B12R0.113 CCCCCCC(C)O[C@H](C)CC 62df7ba11443a07bb3f9058b9ffae58b [0,2,0,0,0,0|1,0,1]=4 7650 B12R0.113 CCCCCC[C@@H](C)OC(C)CC 12c3746082e0c5689e184cf9b7d3c0ba [0,2,0,0,0,0|1,0,1]=4 7651 B12R0.113 CCCCCC[C@H](C)OC(C)CC 56a00d0a5d3d4d47be94f799cfa97ad0 [0,2,0,0,0,0|1,0,1]=4 7652 B12R0.113 CCCCCNC(=O)/C=C(/C)\CC ad5c1d98ed271871cfe377ce6e3d07f2 [0,2,0,0,0,0|1,0,1]=4 7653 B12R0.113 CCCCCNC(=O)/C=C(\C)/CC 3d2805c9dd3f87627f84150cdc57b8a7 [0,2,0,0,0,0|1,0,1]=4 7654 B12R0.113 CCCCCNC(=O)CC(C)CC f7055e01481448307fbb56c6ba0a086b [0,2,0,0,0,0|1,0,0]=3 7655 B12R0.113 CCCCCNC(=O)CC(C)OC 3ed000ebf905477fcc975d6daf1444bc [0,2,0,0,0,0|2,0,0]=4 7656 B12R0.113 CCCCCNC(=O)CC(O)CC bec883dd847725cd1242dfce46146527 [0,2,0,0,0,0|1,0,0]=3 7657 B12R0.113 CCCCCNC(=O)CN(C)CC 6afcb8eddd66439fca076973b27aee89 [0,2,0,0,0,0|2,0,0]=4 7658 B12R0.113 CCCCCNC(=O)C[C@@H](C)CC 6828e80832fb96a9cada9a521fe40da4 [0,2,0,0,0,0|1,0,0]=3 7659 B12R0.113 CCCCCNC(=O)C[C@@H](O)CC af78e84a1cad93172d8bf487f9ae9beb [0,2,0,0,0,0|1,0,0]=3 7660 B12R0.113 CCCCCNC(=O)C[C@H](C)CC 7e5866c799cf610387e8027c8b2d0ed1 [0,2,0,0,0,0|1,0,0]=3 7661 B12R0.113 CCCCCNC(=O)C[C@H](O)CC b1954248f57a23c226e64fa5f3efef57 [0,2,0,0,0,0|1,0,0]=3 7662 B12R0.113 CCCCCNC(=O)NC(C)CC 9a2670f2252297b4fbe22c8cb4f63fc2 [0,2,0,0,0,0|1,0,0]=3 7663 B12R0.113 CCCCCNC(=O)NC(C)CO cdfe9394cdb2755847ebdd82b41da92f [0,2,0,0,0,0|2,0,0]=4 7664 B12R0.113 CCCCCNC(=O)N[C@@H](C)CC c2a1c2d444fe4de21f465c1ae9f21924 [0,2,0,0,0,0|1,0,0]=3 7665 B12R0.113 CCCCCNC(=O)N[C@@H](C)CO 2fe73fbda942135f237fba8d9caf80c4 [0,2,0,0,0,0|2,0,0]=4 7666 B12R0.113 CCCCCNC(=O)N[C@H](C)CC 085f59681eaaba3c1a1c4ee2a1d91eb5 [0,2,0,0,0,0|1,0,0]=3 7667 B12R0.113 CCCCCNC(=O)N[C@H](C)CO 3bb77a8daeaab1cf3f4193552a0e3590 [0,2,0,0,0,0|2,0,0]=4 7668 B12R0.113 CCCCCNC(=S)NC(C)CC 5864c642361057eea61c8be6cad8d55d [0,2,0,0,0,0|1,1,0]=4 7669 B12R0.113 CCCCCNC(=S)N[C@@H](C)CC ad97072310b9a5bce7d70fda1889c997 [0,2,0,0,0,0|1,1,0]=4 7670 B12R0.113 CCCCCNC(=S)N[C@H](C)CC 28ecdc8bac3292b78a0b71b8df7dd95e [0,2,0,0,0,0|1,1,0]=4 7671 B12R0.113 CCCCNCC(=O)NC(C)CC 3a68e4f9e338f45e8f53909c06008fc2 [0,2,0,0,0,0|1,0,0]=3 7672 B12R0.113 CCCCNCC(=O)NC(C)CO 72010e484c31c014b48a1024574b35e1 [0,2,0,0,0,0|2,0,0]=4 7673 B12R0.113 CCCCOCC(=O)NC(C)CC ec98bf1b2cef750ffd7ba414d0b750f7 [0,2,0,0,0,0|1,0,0]=3 7674 B12R0.113 CCCCOCC(=O)NC(C)CO 93297cbafc65dc4ad9eb0d917b0e34ad [0,2,0,0,0,0|2,0,0]=4 7675 B12R0.113 CCCCOCC(=O)N[C@@H](C)CC d26b815724c0640a0671a343348d1f81 [0,2,0,0,0,0|1,0,0]=3 7676 B12R0.113 CCCCOCC(=O)N[C@@H](C)CO 2dca11d66ffea2aadc22b6b00be2ba18 [0,2,0,0,0,0|2,0,0]=4 7677 B12R0.113 CCCCOCC(=O)N[C@H](C)CC 40394689f42a0468422ee8894ca43f4f [0,2,0,0,0,0|1,0,0]=3 7678 B12R0.113 CCCCOCC(=O)N[C@H](C)CO ecaee67915fd2246e6f90044ddbef0a4 [0,2,0,0,0,0|2,0,0]=4 7679 B12R0.113 CCCCOCC(C)OC(C)CC 33856aa43c2bf78aa5ec08e39f0e5640 [0,2,0,0,0,0|1,0,1]=4 7680 B12R0.113 CCCCSCC(=O)NC(C)CC 4b8dbf25a5faa4ca04e39122af6c6a87 [0,2,0,0,0,0|1,0,0]=3 7681 B12R0.113 CCCCSCC(=O)NC(C)CO af09ad0e521cfe3d2a133cd109031f73 [0,2,0,0,0,0|2,0,0]=4 7682 B12R0.113 CCCCSCC(=O)N[C@@H](C)CC f7e145d7711796cd9c1955c55c57a03f [0,2,0,0,0,0|1,0,0]=3 7683 B12R0.113 CCCCSCC(=O)N[C@@H](C)CO 1d16dd6e31333c482349527fe1377ad3 [0,2,0,0,0,0|2,0,0]=4 7684 B12R0.113 CCCCSCC(=O)N[C@H](C)CC b315804dcb66f0ae2ab24f7d7d7b5e74 [0,2,0,0,0,0|1,0,0]=3 7685 B12R0.113 CCCCSCC(=O)N[C@H](C)CO aa141a7bd1f7ff0b96818d329cdf8546 [0,2,0,0,0,0|2,0,0]=4 7686 B12R0.113 CCCOCCC(=O)NC(C)CC 790f51c0e02b461e8439f9e8d4f15e4c [0,2,0,0,0,0|1,0,0]=3 7687 B12R0.113 CCCOCCC(=O)NC(C)CO 98ae2568f2ba69b3ca5f92c8cf91fbaa [0,2,0,0,0,0|2,0,0]=4 7688 B12R0.113 CCCOCCC(=O)N[C@@H](C)CC da9b698c9b7217585448c741882040e9 [0,2,0,0,0,0|1,0,0]=3 7689 B12R0.113 CCCOCCC(=O)N[C@@H](C)CO 8280e1ea1e6d677b684a1dbc3592b049 [0,2,0,0,0,0|2,0,0]=4 7690 B12R0.113 CCCOCCC(=O)N[C@H](C)CC 4c22e7333cd5880f47ee5fae10f8ad90 [0,2,0,0,0,0|1,0,0]=3 7691 B12R0.113 CCCOCCC(=O)N[C@H](C)CO 1f451a407e7b7308bded04b551eec0eb [0,2,0,0,0,0|2,0,0]=4 7692 B12R0.113 CCOCCNC(=O)CC(C)CC 9d1251c204741441e0c3a765ca28a484 [0,2,0,0,0,0|2,0,0]=4 7693 B12R0.113 CCOCCNC(=O)CC(O)CC 77805c92c48843fa668da5c19057903e [0,2,0,0,0,0|2,0,0]=4 7694 B12R0.113 CCOCCNC(=O)C[C@@H](C)CC b716723c8d7a9c58b353ed4205931e7e [0,2,0,0,0,0|2,0,0]=4 7695 B12R0.113 CCOCCNC(=O)C[C@@H](O)CC b74835b805b9767097a29cf097c58301 [0,2,0,0,0,0|2,0,0]=4 7696 B12R0.113 CCOCCNC(=O)C[C@H](C)CC 73c5a1d1b0deaaf7c4fcbe702963f915 [0,2,0,0,0,0|2,0,0]=4 7697 B12R0.113 CCOCCNC(=O)C[C@H](O)CC c06f877f0d4e82c6e4a3c879474cdc43 [0,2,0,0,0,0|2,0,0]=4 7698 B12R0.113 CCOCCNC(=O)NC(C)CC 3f2d5e3f970bc402f5de6d374ac446f1 [0,2,0,0,0,0|2,0,0]=4 7699 B12R0.113 CCOCCNC(=O)N[C@@H](C)CC bd58051df4b6ca0585259c3005254f28 [0,2,0,0,0,0|2,0,0]=4 7700 B12R0.113 CCOCCNC(=O)N[C@H](C)CC 0d50e84f4eb7c8818aa3bfc8b42965b4 [0,2,0,0,0,0|2,0,0]=4 7701 B12R0.113 CCSCCNC(=O)CC(C)CC 34c9e25d6de3bfab3354eb23e4577594 [0,2,0,0,0,0|2,0,0]=4 7702 B12R0.113 CCSCCNC(=O)CC(O)CC 701deb0a31bdc68b225c52192e2a6471 [0,2,0,0,0,0|2,0,0]=4 7703 B12R0.113 CCSCCNC(=O)C[C@@H](C)CC ba9ef97d20b6a7d2788235abcd72e3e6 [0,2,0,0,0,0|2,0,0]=4 7704 B12R0.113 CCSCCNC(=O)C[C@@H](O)CC eb47750484af85b2819379ae48ac5499 [0,2,0,0,0,0|2,0,0]=4 7705 B12R0.113 CCSCCNC(=O)C[C@H](C)CC 8bb081bf0269ca39191e27698ff55b2a [0,2,0,0,0,0|2,0,0]=4 7706 B12R0.113 CCSCCNC(=O)C[C@H](O)CC 558f46725a751d78384837015f5d6c21 [0,2,0,0,0,0|2,0,0]=4 7707 B12R0.113 CCSCCNC(=O)NC(C)CC 8807e57ab8b4d91817d64323a099de65 [0,2,0,0,0,0|2,0,0]=4 7708 B12R0.113 CCSCCNC(=O)N[C@@H](C)CC 622a247f3c31c68cb68c2bce1f16da39 [0,2,0,0,0,0|2,0,0]=4 7709 B12R0.113 CCSCCNC(=O)N[C@H](C)CC 6026241e4128775c4c7ee43d6149ae94 [0,2,0,0,0,0|2,0,0]=4 7710 B12R0.113 CC[C@@H](C)CC(=O)NCCCCCl 5616af5b8213fb0c398e193d3ec480ab [0,2,0,0,0,0|2,0,0]=4 7711 B12R0.113 CC[C@@H](C)CC(=O)NCCCCO 7236fc45cd61074d37c35572715f695c [0,2,0,0,0,0|2,0,0]=4 7712 B12R0.113 CC[C@@H](C)CC(=O)NCCCCS 1be17ef087e49089155da204068bbcf9 [0,2,0,0,0,0|2,0,0]=4 7713 B12R0.113 CC[C@@H](C)CC(=O)NCCCOC 3c7cd3c8f7e798b1783ef2df62a68054 [0,2,0,0,0,0|2,0,0]=4 7714 B12R0.113 CC[C@@H](C)CC(=O)NCCCSC bb08537d479156a724cb7d9c04cee3be [0,2,0,0,0,0|2,0,0]=4 7715 B12R0.113 CC[C@@H](C)NC(=O)CCCCC=O 9d241e88698ac8811e7bf4a2a665093f [0,2,0,0,0,0|1,0,1]=4 7716 B12R0.113 CC[C@@H](C)NC(=O)CCCCCF e3a9acd7b7753e2d2e3669f659d786d1 [0,2,0,0,0,0|1,0,0]=3 7717 B12R0.113 CC[C@@H](C)NC(=O)CCCCCO 41d7783bae943fcad5089a18ba36706e [0,2,0,0,0,0|1,0,0]=3 7718 B12R0.113 CC[C@@H](C)NC(=O)CCCCCS 483e6656dbfe0310c99630dc07b5acbb [0,2,0,0,0,0|1,0,0]=3 7719 B12R0.113 CC[C@@H](C)NC(=O)CCCSSC d9bc17c16510e74bf05b24499d48671d [0,2,0,0,0,0|2,0,0]=4 7720 B12R0.113 CC[C@@H](C)NC(=O)CCOCCO b5bab6f6b364b2c9f3cb1389f8ce6a7e [0,2,0,0,0,0|2,0,0]=4 7721 B12R0.113 CC[C@@H](C)NC(=O)CCOCCS 8669b2462a12a04c1e3924200b53801a [0,2,0,0,0,0|2,0,0]=4 7722 B12R0.113 CC[C@@H](C)NC(=O)COCCOC 4f389514f9eb3afef1d06541cb2001e7 [0,2,0,0,0,0|2,0,0]=4 7723 B12R0.113 CC[C@@H](C)NC(=O)COCCSC e0a6ecbe76298bfb6155fbdac79e5b28 [0,2,0,0,0,0|2,0,0]=4 7724 B12R0.113 CC[C@@H](C)NC(=O)CSCCOC f9b5381ed81f6e1c426763582363172a [0,2,0,0,0,0|2,0,0]=4 7725 B12R0.113 CC[C@@H](C)NC(=O)NCCCCN d2818c596e6526775c485f8df5c98a7a [0,2,0,0,0,0|2,0,0]=4 7726 B12R0.113 CC[C@@H](C)NC(=O)NCCCCO f6eb97b74c91d8c47fd7750b04cca4f1 [0,2,0,0,0,0|2,0,0]=4 7727 B12R0.113 CC[C@@H](C)NC(=O)NCCCCS 3c10a16133d79197680516a1bdce80b5 [0,2,0,0,0,0|2,0,0]=4 7728 B12R0.113 CC[C@@H](C)NC(=O)NCCCOC 91bb4db3cb1174348bfa54cb5a65a7ef [0,2,0,0,0,0|2,0,0]=4 7729 B12R0.113 CC[C@@H](C)NC(=O)NCCCSC 063a3e0d1d873f251790fb2d6d3e8412 [0,2,0,0,0,0|2,0,0]=4 7730 B12R0.113 CC[C@@H](O)CC(=O)NCCCCCl af70d89e8b185304af203114e2d1ce46 [0,2,0,0,0,0|2,0,0]=4 7731 B12R0.113 CC[C@@H](O)CC(=O)NCCCCO 30bc17ba034a0d79174d1e4ed1211788 [0,2,0,0,0,0|2,0,0]=4 7732 B12R0.113 CC[C@@H](O)CC(=O)NCCCCS 58bf92365051f97699c2f65031ae3a83 [0,2,0,0,0,0|2,0,0]=4 7733 B12R0.113 CC[C@@H](O)CC(=O)NCCCOC 4222a6a6c17973f050f27b038aeeb5cd [0,2,0,0,0,0|2,0,0]=4 7734 B12R0.113 CC[C@@H](O)CC(=O)NCCCSC f071a5931472033cd9c0d890c5b6531e [0,2,0,0,0,0|2,0,0]=4 7735 B12R0.113 CC[C@H](C)CC(=O)NCCCCCl 35a7ef5aaaa079ae3d8e02a7dbbfd371 [0,2,0,0,0,0|2,0,0]=4 7736 B12R0.113 CC[C@H](C)CC(=O)NCCCCO 52f9d16b406bcadcd152ec3606d06d28 [0,2,0,0,0,0|2,0,0]=4 7737 B12R0.113 CC[C@H](C)CC(=O)NCCCCS 3095765d43cf43d65b5637724ec5294d [0,2,0,0,0,0|2,0,0]=4 7738 B12R0.113 CC[C@H](C)CC(=O)NCCCOC 6b7e9c7218dc3a8d692d80b48566c53d [0,2,0,0,0,0|2,0,0]=4 7739 B12R0.113 CC[C@H](C)CC(=O)NCCCSC 452a7fbede0c4a929fdfbbb45da1ed84 [0,2,0,0,0,0|2,0,0]=4 7740 B12R0.113 CC[C@H](C)NC(=O)CCCCC=O 06d29328d98766d94279ccc97eab183e [0,2,0,0,0,0|1,0,1]=4 7741 B12R0.113 CC[C@H](C)NC(=O)CCCCCF 45d40dd8ebeb2a07d048172728c4f787 [0,2,0,0,0,0|1,0,0]=3 7742 B12R0.113 CC[C@H](C)NC(=O)CCCCCO 053f11202e86c26b98166d7486a7b039 [0,2,0,0,0,0|1,0,0]=3 7743 B12R0.113 CC[C@H](C)NC(=O)CCCCCS 2fd635bbc847355612e34aa179e54419 [0,2,0,0,0,0|1,0,0]=3 7744 B12R0.113 CC[C@H](C)NC(=O)CCCSSC 7f60e398ea32658cb4b4e419eecbe890 [0,2,0,0,0,0|2,0,0]=4 7745 B12R0.113 CC[C@H](C)NC(=O)CCOCCO ccca4937c3849490bafb39c75cd3c568 [0,2,0,0,0,0|2,0,0]=4 7746 B12R0.113 CC[C@H](C)NC(=O)CCOCCS a3434d6907ab66d5013e1e22755342eb [0,2,0,0,0,0|2,0,0]=4 7747 B12R0.113 CC[C@H](C)NC(=O)COCCOC 8c29600f5397d41c9fe89f9fd56f5244 [0,2,0,0,0,0|2,0,0]=4 7748 B12R0.113 CC[C@H](C)NC(=O)COCCSC 9cb29d8217e631fe47f2fe501ed80a11 [0,2,0,0,0,0|2,0,0]=4 7749 B12R0.113 CC[C@H](C)NC(=O)CSCCOC 39a79039850e3eaaf031bd03120c916c [0,2,0,0,0,0|2,0,0]=4 7750 B12R0.113 CC[C@H](C)NC(=O)NCCCCN cc692e9db19120d820dcbf932af65951 [0,2,0,0,0,0|2,0,0]=4 7751 B12R0.113 CC[C@H](C)NC(=O)NCCCCO 877ef35a0deeff4ceacc5b1682887938 [0,2,0,0,0,0|2,0,0]=4 7752 B12R0.113 CC[C@H](C)NC(=O)NCCCCS 2e402a5d1b49a8c38ab9365b404ac04d [0,2,0,0,0,0|2,0,0]=4 7753 B12R0.113 CC[C@H](C)NC(=O)NCCCOC eb9359cb498cfa37fb7323e699813073 [0,2,0,0,0,0|2,0,0]=4 7754 B12R0.113 CC[C@H](C)NC(=O)NCCCSC bcef4c6215aa060c9f4bfcbfbf884ec6 [0,2,0,0,0,0|2,0,0]=4 7755 B12R0.113 CC[C@H](O)CC(=O)NCCCCCl 17d8fe0687ff8091904e0828104929f0 [0,2,0,0,0,0|2,0,0]=4 7756 B12R0.113 CC[C@H](O)CC(=O)NCCCCO 239f584debb74c69f32727d364492ea0 [0,2,0,0,0,0|2,0,0]=4 7757 B12R0.113 CC[C@H](O)CC(=O)NCCCCS 1fed79db27e03ca51198cf3d6d84b075 [0,2,0,0,0,0|2,0,0]=4 7758 B12R0.113 CC[C@H](O)CC(=O)NCCCOC c2b7920bf6a813d5a2fe21e0dce30170 [0,2,0,0,0,0|2,0,0]=4 7759 B12R0.113 CC[C@H](O)CC(=O)NCCCSC a44a51e98486c5bd32468089cc31a3e7 [0,2,0,0,0,0|2,0,0]=4 7760 B12R0.113 C[C@@H](CO)NC(=O)CCCCCF fa36581154c5ebf3993b1a1a8afcaf44 [0,2,0,0,0,0|2,0,0]=4 7761 B12R0.113 C[C@@H](CO)NC(=O)CCCCCO 1601d9111d44b955701d65ab0ffe44a9 [0,2,0,0,0,0|2,0,0]=4 7762 B12R0.113 C[C@@H](CO)NC(=O)CCCCCS ca8e104ae9d6a2fc79f894b78f39dde8 [0,2,0,0,0,0|2,0,0]=4 7763 B12R0.113 C[C@H](CO)NC(=O)CCCCCF b87405c8db2d7ed723426b6dd7eebb63 [0,2,0,0,0,0|2,0,0]=4 7764 B12R0.113 C[C@H](CO)NC(=O)CCCCCO 84daa654c128869a09a38b4cf856f227 [0,2,0,0,0,0|2,0,0]=4 7765 B12R0.113 C[C@H](CO)NC(=O)CCCCCS e58ae580966979a990dd1fe9a0a4b35b [0,2,0,0,0,0|2,0,0]=4 7766 B12R0.114 C#CCCCCC(=O)N(C)CCC 3d91b8edd794ff49b796142e88380025 [0,2,0,0,0,0|1,0,1]=4 7767 B12R0.114 C/C=C/CCCC(=O)N(C)CCC 9964d7083fe87a90e8cdb00fd19d6f32 [0,2,0,0,0,0|1,0,1]=4 7768 B12R0.114 C=C(CCC)C(=O)NCCCCC 12f5f55db48ecee7d07cd9633e41e55d [0,2,0,0,0,0|1,0,0]=3 7769 B12R0.114 C=C(CCC)C(=O)NCCCCCl 1cc43a65d91b46b83b0148c311caf3ba [0,2,0,0,0,0|2,0,0]=4 7770 B12R0.114 C=C(CCC)C(=O)NCCCCO a5b9c87c2da525e881b1742af68d6416 [0,2,0,0,0,0|2,0,0]=4 7771 B12R0.114 C=C(CCC)C(=O)NCCCCS 78e741cf34e5471815f5acca8b18b02f [0,2,0,0,0,0|2,0,0]=4 7772 B12R0.114 C=C(CCC)C(=O)NCCCOC e94fcb2d4d08a42262fe178912427e7f [0,2,0,0,0,0|2,0,0]=4 7773 B12R0.114 C=C(CCC)C(=O)NCCCSC cfd4ab00991a2d6b3876771a7ab51346 [0,2,0,0,0,0|2,0,0]=4 7774 B12R0.114 C=C(CCC)C(=O)NCCOCC baea1d67a113f6a9c53c2a60bc5dd307 [0,2,0,0,0,0|2,0,0]=4 7775 B12R0.114 C=C(CCC)C(=O)NCCSCC 362588e9d7df1590c4313e7628cd57a1 [0,2,0,0,0,0|2,0,0]=4 7776 B12R0.114 C=C(COC)C(=O)NCCCCC 8f11d67c54b6c28ce122e1dbc4ca5d31 [0,2,0,0,0,0|2,0,0]=4 7777 B12R0.114 C=C(CSC)C(=O)NCCCCC a1f85f5aec263c44ae62571cd0bca11a [0,2,0,0,0,0|2,0,0]=4 7778 B12R0.114 C=CCCCCC(=O)N(C)CCC d720bfab921d1d70d0cd6a5c4a8e2318 [0,2,0,0,0,0|1,0,1]=4 7779 B12R0.114 CC/C=C(\C)/C(=O)NCCCCC 7b1e8bd7936c7a683ce1db9333212314 [0,2,0,0,0,0|1,0,1]=4 7780 B12R0.114 CCC/C=C/CC(=O)N(C)CCC 51154d1e2bcf37a9c998903b51f5ef93 [0,2,0,0,0,0|1,0,1]=4 7781 B12R0.114 CCC=C(C)C(=O)NCCCCC 20d67e72dbce8598b2ab3131c5745d41 [0,2,0,0,0,0|1,0,1]=4 7782 B12R0.114 CCCC(=O)C(=O)NCCCCCl 32bd68b786138943602fe3840e129b49 [0,2,0,0,0,0|2,0,0]=4 7783 B12R0.114 CCCC(=O)C(=O)NCCCCO f940ff7b84a23985260db26f5781609b [0,2,0,0,0,0|2,0,0]=4 7784 B12R0.114 CCCC(=O)C(=O)NCCCCS 025fa1542726997d83d6c2359cab73b4 [0,2,0,0,0,0|2,0,0]=4 7785 B12R0.114 CCCC(=O)C(=O)NCCCOC 3b38ebf4f2b5b09bb01c15668c6478fb [0,2,0,0,0,0|2,0,0]=4 7786 B12R0.114 CCCC(=O)C(=O)NCCCSC 61ebf1beadcf29290a7cc3604063dacb [0,2,0,0,0,0|2,0,0]=4 7787 B12R0.114 CCCC(=O)C(=O)NCCOCC 7b413ddf4264e4d201a7df3dfc452478 [0,2,0,0,0,0|2,0,0]=4 7788 B12R0.114 CCCC(=O)C(=O)NCCSCC 4091031b0a8f8bc7b7dc0028d0192e39 [0,2,0,0,0,0|2,0,0]=4 7789 B12R0.114 CCCC(O)C(=O)NCCCCCl 23b9f6bf728781254b357de7d5297a85 [0,2,0,0,0,0|2,0,0]=4 7790 B12R0.114 CCCC(O)C(=O)NCCCCO 39e752b468d62d4638ddeee6c58cdd18 [0,2,0,0,0,0|2,0,0]=4 7791 B12R0.114 CCCC(O)C(=O)NCCCCS 3a5e4d2e5df184b2c081bcddb973a531 [0,2,0,0,0,0|2,0,0]=4 7792 B12R0.114 CCCC(O)C(=O)NCCCOC 90f8a79482a2627d17f47fc7af55b5f2 [0,2,0,0,0,0|2,0,0]=4 7793 B12R0.114 CCCC(O)C(=O)NCCCSC bae18a32ee41a1f7e7a0b3a8c567d3db [0,2,0,0,0,0|2,0,0]=4 7794 B12R0.114 CCCC(O)C(=O)NCCOCC 5f031c032811e79b799a340463ce096e [0,2,0,0,0,0|2,0,0]=4 7795 B12R0.114 CCCC(O)C(=O)NCCSCC cece07dbd8f61d5c0b7777073b87c12b [0,2,0,0,0,0|2,0,0]=4 7796 B12R0.114 CCCC/C=C/C(=O)N(C)CCC 9b19fc22b2711dc68c806c76748a2303 [0,2,0,0,0,0|1,0,1]=4 7797 B12R0.114 CCCCC#CC(=O)N(C)CCC 17da66317806754fe42a877b81320959 [0,2,0,0,0,0|1,0,1]=4 7798 B12R0.114 CCCCC=CC(=O)N(C)CCC 56bbe0443bc08dfd8e369f15dacfef26 [0,2,0,0,0,0|1,0,1]=4 7799 B12R0.114 CCCCCCC(=O)N(C)CCC 82cc5c9eb8a9cae40afed1798a78601a [0,2,0,0,0,0|1,0,0]=3 7800 B12R0.114 CCCCCCC(=O)N(C)CCF 22b4990569d453b7312992f217b75a87 [0,2,0,0,0,0|2,0,0]=4 7801 B12R0.114 CCCCCCC(=O)N(C)CCO 06ec9b6faf4d5aa7847ecc6d3adee2dd [0,2,0,0,0,0|2,0,0]=4 7802 B12R0.114 CCCCCNC(=O)C(=O)CCC 48952cafc2751de5911915e179bcaa20 [0,2,0,0,0,0|1,0,0]=3 7803 B12R0.114 CCCCCNC(=O)C(=O)NCC e6c6af9723e371f661c0dd91073a5a7b [0,2,0,0,0,0|2,0,0]=4 7804 B12R0.114 CCCCCNC(=O)C(=O)OCC e6aaafe64f009d3f596470e19f26b2ea [0,2,0,0,0,0|2,0,0]=4 7805 B12R0.114 CCCCCNC(=O)C(C)OCC ebd18bc1ab327be49271d95838f23924 [0,2,0,0,0,0|2,0,0]=4 7806 B12R0.114 CCCCCNC(=O)C(C)SCC 44d880d1ccfabcf2ee9c20dd151e5ae2 [0,2,0,0,0,0|2,0,0]=4 7807 B12R0.114 CCCCCNC(=O)C(O)CCC 43466e53c70282100af78253aacbb998 [0,2,0,0,0,0|1,0,0]=3 7808 B12R0.114 CCCCCNC(=O)C(O)CSC 9412d7fbe4c03f75bf67fd92c6137186 [0,2,0,0,0,0|2,0,0]=4 7809 B12R0.114 CCCCCNC(=O)N(C)CCC 9d3d82fab3a05b22cff4bbffff7a0721 [0,2,0,0,0,0|1,0,0]=3 7810 B12R0.114 CCCCCNC(=O)N(C)CCF 01d5c06797650dc5275a53d7ed46c781 [0,2,0,0,0,0|2,0,0]=4 7811 B12R0.114 CCCCCNC(=O)N(C)CCO 70d42a0756a3bde2dc25aa38f3ef1d20 [0,2,0,0,0,0|2,0,0]=4 7812 B12R0.114 CCCCCNC(=O)[C@@H](O)CCC 126a01baa38526ca0c5d75c773791486 [0,2,0,0,0,0|1,0,0]=3 7813 B12R0.114 CCCCCNC(=O)[C@H](O)CCC 3dcee0f9908373d031a17ff48e46a6ec [0,2,0,0,0,0|1,0,0]=3 7814 B12R0.114 CCCCCNC(=S)N(C)CCC 3ec41230782470752e9ac6d04ff48216 [0,2,0,0,0,0|1,1,0]=4 7815 B12R0.114 CCCCOCC(=O)N(C)CCC f3d572ae4687b53f7a89d2356aacfe8f [0,2,0,0,0,0|1,0,0]=3 7816 B12R0.114 CCCCOCC(=O)N(C)CCF b54f9ae5dbb0a9b23503b00dd9a45b79 [0,2,0,0,0,0|2,0,0]=4 7817 B12R0.114 CCCCOCC(=O)N(C)CCO 465aef33e84f726aada825bdd29b88c1 [0,2,0,0,0,0|2,0,0]=4 7818 B12R0.114 CCCCSCC(=O)N(C)CCC fa9c58bdc18d4c854bf15cda2dee227f [0,2,0,0,0,0|1,0,0]=3 7819 B12R0.114 CCCCSCC(=O)N(C)CCF b930b23717134f839eb108668908a3d5 [0,2,0,0,0,0|2,0,0]=4 7820 B12R0.114 CCCCSCC(=O)N(C)CCO 9a7f82b8fe4fe525189bd04afa5a01fa [0,2,0,0,0,0|2,0,0]=4 7821 B12R0.114 CCCN(C)C(=O)CCCCC=O 7d52c993686c443f3d369211f00ee717 [0,2,0,0,0,0|1,0,1]=4 7822 B12R0.114 CCCN(C)C(=O)CCCCCF 752840df8bb8c19a167bf1bda29ad04a [0,2,0,0,0,0|1,0,0]=3 7823 B12R0.114 CCCN(C)C(=O)CCCCCO 1025f0d940c211b7c429ff8f31520202 [0,2,0,0,0,0|1,0,0]=3 7824 B12R0.114 CCCN(C)C(=O)CCCCCS ae1a8ef6b368fc2dc30e25ad9a0a818f [0,2,0,0,0,0|1,0,0]=3 7825 B12R0.114 CCCN(C)C(=O)CCCSSC 0c4b0ef7727e44729ccdd16c423c8761 [0,2,0,0,0,0|2,0,0]=4 7826 B12R0.114 CCCN(C)C(=O)CCOCCO 743d5961f3f569260d473bee8c40fd58 [0,2,0,0,0,0|2,0,0]=4 7827 B12R0.114 CCCN(C)C(=O)CCOCCS 32d349af61c5d3ff597fa513f517cf82 [0,2,0,0,0,0|2,0,0]=4 7828 B12R0.114 CCCN(C)C(=O)COCCOC 177cc4a497c5f5addb9fb6ec14739aec [0,2,0,0,0,0|2,0,0]=4 7829 B12R0.114 CCCN(C)C(=O)COCCSC e29ead901cbb9de41d78e48bf428e714 [0,2,0,0,0,0|2,0,0]=4 7830 B12R0.114 CCCN(C)C(=O)CSCCOC f585423f36f8ef16b0ef32933b5e562a [0,2,0,0,0,0|2,0,0]=4 7831 B12R0.114 CCCN(C)C(=O)NCCCCN 2eb90cfb5794e622ce2e0b95f9e94d9b [0,2,0,0,0,0|2,0,0]=4 7832 B12R0.114 CCCN(C)C(=O)NCCCCO d681b1d33627113361fe034e55d42601 [0,2,0,0,0,0|2,0,0]=4 7833 B12R0.114 CCCN(C)C(=O)NCCCCS fea11b6d3aca882e56f3be4c4039a33e [0,2,0,0,0,0|2,0,0]=4 7834 B12R0.114 CCCN(C)C(=O)NCCCOC bbe2c66c318a1f4df9230eca1ad734a2 [0,2,0,0,0,0|2,0,0]=4 7835 B12R0.114 CCCN(C)C(=O)NCCCSC 863704fcf8185b52542bba6d1292aece [0,2,0,0,0,0|2,0,0]=4 7836 B12R0.114 CCCN(C)C(=O)NCCOCC bfd67d00a0d2d6bf1be4ecf23b8712cd [0,2,0,0,0,0|2,0,0]=4 7837 B12R0.114 CCCN(C)C(=O)NCCSCC 2bb4f708931dc140c6957fe8e2a15f3a [0,2,0,0,0,0|2,0,0]=4 7838 B12R0.114 CCCOCCC(=O)N(C)CCC 19fb3351ae983404dce5e79a93f03d01 [0,2,0,0,0,0|1,0,0]=3 7839 B12R0.114 CCCOCCC(=O)N(C)CCF 274c92f0cffa3f9bae6e1b21c664f322 [0,2,0,0,0,0|2,0,0]=4 7840 B12R0.114 CCCOCCC(=O)N(C)CCO cc5809f46016293863f236429eb88c9b [0,2,0,0,0,0|2,0,0]=4 7841 B12R0.114 CCC[C@@H](O)C(=O)NCCCCCl 50814b950ee6c46a5f5e8714ddf802b4 [0,2,0,0,0,0|2,0,0]=4 7842 B12R0.114 CCC[C@@H](O)C(=O)NCCCCO b1cefbdeaeba39577344c34acb4cc165 [0,2,0,0,0,0|2,0,0]=4 7843 B12R0.114 CCC[C@@H](O)C(=O)NCCCCS ca62d72a5249d2e076da15537b86b331 [0,2,0,0,0,0|2,0,0]=4 7844 B12R0.114 CCC[C@@H](O)C(=O)NCCCOC 06b638451ad94b081b36727685c3b9d0 [0,2,0,0,0,0|2,0,0]=4 7845 B12R0.114 CCC[C@@H](O)C(=O)NCCCSC c6126877dfaf7c66fc5b203d73673fd9 [0,2,0,0,0,0|2,0,0]=4 7846 B12R0.114 CCC[C@@H](O)C(=O)NCCOCC 5aa7339400a4b3f04ff444c233ed6009 [0,2,0,0,0,0|2,0,0]=4 7847 B12R0.114 CCC[C@@H](O)C(=O)NCCSCC bc94a83104229705eb6c54a2db16db48 [0,2,0,0,0,0|2,0,0]=4 7848 B12R0.114 CCC[C@H](O)C(=O)NCCCCCl 0fe063ae1138f4f455a7a38c8245fbe4 [0,2,0,0,0,0|2,0,0]=4 7849 B12R0.114 CCC[C@H](O)C(=O)NCCCCO 653812ed571d322d6ad763178065d33a [0,2,0,0,0,0|2,0,0]=4 7850 B12R0.114 CCC[C@H](O)C(=O)NCCCCS 0f14a0f75ef7172a68bbc1fc944124a2 [0,2,0,0,0,0|2,0,0]=4 7851 B12R0.114 CCC[C@H](O)C(=O)NCCCOC 62afe8decaf7df9b2b0af77a1e13ceb4 [0,2,0,0,0,0|2,0,0]=4 7852 B12R0.114 CCC[C@H](O)C(=O)NCCCSC 93a1412264114f3dff0334d789d399c0 [0,2,0,0,0,0|2,0,0]=4 7853 B12R0.114 CCC[C@H](O)C(=O)NCCOCC 2cb5e905bda30d9f11aff114fb920e98 [0,2,0,0,0,0|2,0,0]=4 7854 B12R0.114 CCC[C@H](O)C(=O)NCCSCC 6945d0c9b2ad255f83cd37a6441d84c5 [0,2,0,0,0,0|2,0,0]=4 7855 B12R0.114 CN(CCF)C(=O)CCCCCF 4bb64c480465931a30ae7770cd4e26c9 [0,2,0,0,0,0|2,0,0]=4 7856 B12R0.114 CN(CCF)C(=O)CCCCCO 20bd64a23ff2bfd96416002e3f64ca34 [0,2,0,0,0,0|2,0,0]=4 7857 B12R0.114 CN(CCF)C(=O)CCCCCS 05434edbb4b49da6c8a095e066d226d2 [0,2,0,0,0,0|2,0,0]=4 7858 B12R0.114 CN(CCO)C(=O)CCCCCF 380a43432f7ffca75fd013de3a49d0f0 [0,2,0,0,0,0|2,0,0]=4 7859 B12R0.114 CN(CCO)C(=O)CCCCCO cf7bdcd2377f119ab1f81623b1136fc4 [0,2,0,0,0,0|2,0,0]=4 7860 B12R0.114 CN(CCO)C(=O)CCCCCS 9fcd9df19135aaf0f91bdb03a7e51614 [0,2,0,0,0,0|2,0,0]=4 7861 B12R0.206 C#CCCCCCC(=O)NCCBr 7053bb6aa158de80d2e40550b5ab15b0 [0,2,0,0,0,0|2,0,0]=4 7862 B12R0.206 C#CCCCCCC(=O)NCCC 01bf69a4fa4c4f5284ad335d1426172b [0,2,0,0,0,0|1,0,0]=3 7863 B12R0.206 C#CCCCCCC(=O)NCCF db26310cf1f903ea0a4f05aeac0d0b5a [0,2,0,0,0,0|2,0,0]=4 7864 B12R0.206 C#CCCCCCC(=O)NCCI 201fb9cd84079326e60ebbbdcb67d1a1 [0,2,0,0,0,0|2,0,0]=4 7865 B12R0.206 C#CCCCCCC(=O)NCCO 988f34694cb7424d4428cf53fdfd8ae1 [0,2,0,0,0,0|2,0,0]=4 7866 B12R0.206 C#CCCCCCC(=O)NCCS b697c6adc099ca9ea7813713f6901d2a [0,2,0,0,0,0|2,0,0]=4 7867 B12R0.206 C#CCCCCNC(=O)CCCC db132b322557b46407370753bebf96c9 [0,2,0,0,0,0|1,0,1]=4 7868 B12R0.206 C#CCCCCNC(=O)NCCC 0803fea9f4ae41abd94479a91cccbfbb [0,2,0,0,0,0|1,0,1]=4 7869 B12R0.206 C#CCCCNCC(=O)NCCC 3ca1c991beef04b2e0859cae731f3504 [0,2,0,0,0,0|1,0,1]=4 7870 B12R0.206 C#CCCCNCC(=O)OCCC 28365ac7dd1befdb9f544dd9a465411a [0,2,0,0,0,0|0,0,1]=3 7871 B12R0.206 C#CCCCOCC(=O)NCCC 71c33630e2122260f33860dab4e65bdc [0,2,0,0,0,0|1,0,1]=4 7872 B12R0.206 C#CCCCOCC(=O)OCCC 79acff10e3ee391c6aea44fdbe37fa7d [0,2,0,0,0,0|0,0,1]=3 7873 B12R0.206 C#CCCNCOC(=O)OCCC 318350ace6d7688bc5726ca8604b4f7d [0,2,0,0,0,0|0,0,2]=4 7874 B12R0.206 C#CCCOCCC(=O)OCCC b75445f5b4edbc3987ae30e9dc794846 [0,2,0,0,0,0|0,0,1]=3 7875 B12R0.206 C#CCCOCOC(=O)OCCC a37e374f6ae9f7769aee60200e55541e [0,2,0,0,0,0|0,0,2]=4 7876 B12R0.206 C#CCNCCCC(=O)NCCC 12bcdf6c1fa96da667b34c91b119ef12 [0,2,0,0,0,0|1,0,1]=4 7877 B12R0.206 C#CCOCCCC(=O)NCCC 0cd21962fe495a453f8153362d0b218b [0,2,0,0,0,0|1,0,1]=4 7878 B12R0.206 C/C=C/CCOCC(=O)NCCC 1274e692c0653600c2cf37f7cb41c6a3 [0,2,0,0,0,0|1,0,1]=4 7879 B12R0.206 C/C=C/CCOCC(=O)OCCC 962c94b45bf359ac562a62b8b58bd89d [0,2,0,0,0,0|0,0,1]=3 7880 B12R0.206 C/C=C/COCCC(=O)OCCC c03139bfa1d20541acc2e844938b7f37 [0,2,0,0,0,0|0,0,1]=3 7881 B12R0.206 C/C=C/COCOC(=O)OCCC 93ae5696d43baa24e28e2d5ee07a8532 [0,2,0,0,0,0|0,0,2]=4 7882 B12R0.206 C/C=C\COCCC(=O)OCCC 20baa645248dfbc0a6e8a9f3461aeccc [0,2,0,0,0,0|0,0,1]=3 7883 B12R0.206 C/C=C\COCOC(=O)OCCC ae467fad0e8acd69276c93c11b93d991 [0,2,0,0,0,0|0,0,2]=4 7884 B12R0.206 C=C(CNCCCCC)OCOC cd2f91854a6e3a9ba0f664c827cd6897 [0,2,0,0,0,0|2,0,0]=4 7885 B12R0.206 C=C(CNCCCCCl)OCOC 8da154db74554ebaf3b6b3078a08bf2e [0,2,0,0,0,0|2,0,0]=4 7886 B12R0.206 C=C(CNCCCCO)OCOC 56dd833ad37898dde8e81c006ca4b89d [0,2,0,0,0,0|2,0,0]=4 7887 B12R0.206 C=C(CNCCCCS)OCOC c70332b6e9ca80dbce655c7a188440ce [0,2,0,0,0,0|2,0,0]=4 7888 B12R0.206 C=C(CNCCCOC)OCOC 6083393e965cbe77cd6c77b7ba33af56 [0,2,0,0,0,0|2,0,0]=4 7889 B12R0.206 C=C(CNCCCSC)OCOC 0a07ed2ae475318ac84b7635aedaeca8 [0,2,0,0,0,0|2,0,0]=4 7890 B12R0.206 C=C(CNCCOCC)OCOC 231cb1a3355c5e0bb1f9283805c7213a [0,2,0,0,0,0|2,0,0]=4 7891 B12R0.206 C=C(CNCCSCC)OCOC 28a06c0f9fb2445b22a830306c119b3b [0,2,0,0,0,0|2,0,0]=4 7892 B12R0.206 C=C(COCCCCC)OCOC 0bae17c92eaf610ff0ef21bb907e0496 [0,2,0,0,0,0|2,0,0]=4 7893 B12R0.206 C=C(COCCCCF)OCOC f3c0fbe5aa101f5d9850b45e98eb0b35 [0,2,0,0,0,0|2,0,0]=4 7894 B12R0.206 C=C(COCCCCS)OCOC 9e8cbffc8fd6ce1bec632c8cff6d3e0f [0,2,0,0,0,0|2,0,0]=4 7895 B12R0.206 C=C(COCCCOC)OCOC 7f50543fe58f1edb018686a6606476df [0,2,0,0,0,0|2,0,0]=4 7896 B12R0.206 C=C(COCCCSC)OCOC 0fd70fddbde72d7d3f4504059eb1aeb5 [0,2,0,0,0,0|2,0,0]=4 7897 B12R0.206 C=C(COCCOCC)OCOC cf2236edcc225d22c544cedb50627412 [0,2,0,0,0,0|2,0,0]=4 7898 B12R0.206 C=C(COCCSCC)OCOC 428580934787258723b7f8cfe72fea85 [0,2,0,0,0,0|2,0,0]=4 7899 B12R0.206 C=C=CCCOCC(=O)OCCC 1de0b3353efd58d8f7acebbdc1db35b2 [0,2,0,0,0,0|0,0,2]=4 7900 B12R0.206 C=CCCCCCC(=O)NCCBr e7110b5794fcf3fe5de37b398250f903 [0,2,0,0,0,0|2,0,0]=4 7901 B12R0.206 C=CCCCCCC(=O)NCCC e359ca5b652420d1420c84090e381385 [0,2,0,0,0,0|1,0,0]=3 7902 B12R0.206 C=CCCCCCC(=O)NCCF 227fb8b59e86ba96f847229f4cd922a4 [0,2,0,0,0,0|2,0,0]=4 7903 B12R0.206 C=CCCCCCC(=O)NCCI 00a67c1ec2b22d7d0251f3284db8ff31 [0,2,0,0,0,0|2,0,0]=4 7904 B12R0.206 C=CCCCCCC(=O)NCCO 0e9d8a6bf8148ef40adc6a62edb70aa3 [0,2,0,0,0,0|2,0,0]=4 7905 B12R0.206 C=CCCCCCC(=O)NCCS 584e2f41f97fbc436688d2b6fff4182d [0,2,0,0,0,0|2,0,0]=4 7906 B12R0.206 C=CCCCCNC(=O)CCCC 2cbe5fcec8c623502cf57bad7080bed0 [0,2,0,0,0,0|1,0,1]=4 7907 B12R0.206 C=CCCCCNC(=O)NCCC 8f0262e938e23fbe7c7e2bd07480e1df [0,2,0,0,0,0|1,0,1]=4 7908 B12R0.206 C=CCCCNCC(=O)NCCC dcd7b88aa718db3d112988eb8ab877df [0,2,0,0,0,0|1,0,1]=4 7909 B12R0.206 C=CCCCNCC(=O)OCCC 021893c260d27163bcb8474e46548981 [0,2,0,0,0,0|0,0,1]=3 7910 B12R0.206 C=CCCCOCC(=O)NCCC aff542e389ca96bc9a7b052be80c7ddd [0,2,0,0,0,0|1,0,1]=4 7911 B12R0.206 C=CCCCOCC(=O)OCCC 07e5ca9d361d2f19767972324924de91 [0,2,0,0,0,0|0,0,1]=3 7912 B12R0.206 C=CCCNCOC(=O)OCCC e011545c7402f7ecf27fe3d09b47ebea [0,2,0,0,0,0|0,0,2]=4 7913 B12R0.206 C=CCCOCCC(=O)OCCC 264c81b2bbc0632f2d37fecb9c763099 [0,2,0,0,0,0|0,0,1]=3 7914 B12R0.206 C=CCCOCOC(=O)OCCC 2e6072fd7d8c11668b4e307045eebb15 [0,2,0,0,0,0|0,0,2]=4 7915 B12R0.206 C=CCOC(=O)CCCCOCC 99e1c103a2de0ca1fe0cb7d098d46dda [0,2,0,0,0,0|0,0,2]=4 7916 B12R0.206 C=CCOC(=O)CCCCOCF b625e37d0468cca71d96603b0eeaa366 [0,2,0,0,0,0|0,0,2]=4 7917 B12R0.206 C=CCOC(=O)CCCNCCBr 0594c429b2181d52db53b035c5147505 [0,2,0,0,0,0|0,0,2]=4 7918 B12R0.206 C=CCOC(=O)CCCNCCC 34f42d60f6961873148730379571bcb4 [0,2,0,0,0,0|0,0,2]=4 7919 B12R0.206 C=CCOC(=O)CCCNCCF a2b0b58253668f28bff116c78ef36518 [0,2,0,0,0,0|0,0,2]=4 7920 B12R0.206 C=CCOC(=O)CCCNCCI 86ff3e16f85182986cafc548fdc0a097 [0,2,0,0,0,0|0,0,2]=4 7921 B12R0.206 C=CCOC(=O)CCCNCCO d25fa2bc8766294fad48b25d27e74c6e [0,2,0,0,0,0|0,0,2]=4 7922 B12R0.206 C=CCOC(=O)CCCNCCS 383a45a2cdce2fa50d35da93eaac210a [0,2,0,0,0,0|0,0,2]=4 7923 B12R0.206 C=CCOC(=O)CCCOCCC 0d620d62efac06d4d1dad33b4385751e [0,2,0,0,0,0|0,0,2]=4 7924 B12R0.206 C=CCOC(=O)CCCOCCF fe9a5823ffaa3ad2175d0de9220fc873 [0,2,0,0,0,0|0,0,2]=4 7925 B12R0.206 C=CCOC(=O)CCCOCCS a3de5f5e69293249556c27e1955cb23d [0,2,0,0,0,0|0,0,2]=4 7926 B12R0.206 C=CCOC(=O)CCCOCOC fb824b86aa2cf951b98e80c834a66162 [0,2,0,0,0,0|0,0,2]=4 7927 B12R0.206 C=CCOC(=O)CNCCCCC 7a0e6176a5425acb280ff9abe0f50b50 [0,2,0,0,0,0|0,0,2]=4 7928 B12R0.206 C=CCOC(=O)CNCCCCCl 958f920dabdf4c2340f80f758a88c576 [0,2,0,0,0,0|0,0,2]=4 7929 B12R0.206 C=CCOC(=O)CNCCCCO e0b8496dacc93f9e42b8d550d6481aab [0,2,0,0,0,0|0,0,2]=4 7930 B12R0.206 C=CCOC(=O)CNCCCCS 7cf03954bb0f3acf219445a7c1644887 [0,2,0,0,0,0|0,0,2]=4 7931 B12R0.206 C=CCOC(=O)CNCCCOC c341eee3264aece1173d2023671b59bc [0,2,0,0,0,0|0,0,2]=4 7932 B12R0.206 C=CCOC(=O)CNCCCSC acbfb202892fbd14e10b704d0c283c89 [0,2,0,0,0,0|0,0,2]=4 7933 B12R0.206 C=CCOC(=O)CNCCOCC 4996fad02a06fac9e20fa3df88de8481 [0,2,0,0,0,0|0,0,2]=4 7934 B12R0.206 C=CCOC(=O)CNCCSCC b3c1449edf9bb7ee27827bbcb0651d10 [0,2,0,0,0,0|0,0,2]=4 7935 B12R0.206 C=CCOC(=O)COCCCCC b54153f4f28e3f1525c52d8945a68907 [0,2,0,0,0,0|0,0,2]=4 7936 B12R0.206 C=CCOC(=O)COCCCCF c21622c8cd6f84f4db937eef96ca0aad [0,2,0,0,0,0|0,0,2]=4 7937 B12R0.206 C=CCOC(=O)COCCCCS 2386695869fb56d6284d0cb5c4dcb235 [0,2,0,0,0,0|0,0,2]=4 7938 B12R0.206 C=CCOC(=O)COCCCOC 00dd293a6cf494436cbe91856bfcc31d [0,2,0,0,0,0|0,0,2]=4 7939 B12R0.206 C=CCOC(=O)COCCCSC 55fcd454c7f6bdd321225c441ee9656e [0,2,0,0,0,0|0,0,2]=4 7940 B12R0.206 C=CCOC(=O)COCCOCC 09304d2337c625bedd28259b2a7fefd4 [0,2,0,0,0,0|0,0,2]=4 7941 B12R0.206 C=CCOC(=O)COCCSCC b6caa83c3b69f30c3df337880867b8df [0,2,0,0,0,0|0,0,2]=4 7942 B12R0.206 C=CCOCCCC(=O)NCCC f31b51c7a2d89b574db6b219370c5ab7 [0,2,0,0,0,0|1,0,1]=4 7943 B12R0.206 C=COCCNCC(=O)OCCC 34294610e04fa152fb86c7c7dfe4a1e2 [0,2,0,0,0,0|0,0,2]=4 7944 B12R0.206 C=COCCOCC(=O)OCCC da414b895155b88c2082afef0ea44e1e [0,2,0,0,0,0|0,0,2]=4 7945 B12R0.206 CC#CCCOCC(=O)NCCC 0f933d41a852d49c09bc930339c8fa70 [0,2,0,0,0,0|1,0,1]=4 7946 B12R0.206 CC#CCCOCC(=O)OCCC 8ed7d4bbb125a4e6131f994306658a47 [0,2,0,0,0,0|0,0,1]=3 7947 B12R0.206 CC#CCNCOC(=O)OCCC 485c4ea40c0c0f302792f08d169d4d7c [0,2,0,0,0,0|0,0,2]=4 7948 B12R0.206 CC#CCOCOC(=O)OCCC 53b58a8e5ad21b7f819a47cac66ff99c [0,2,0,0,0,0|0,0,2]=4 7949 B12R0.206 CC/C=C/C(=O)NCCCCCC 0ae15ea0c3e1227f52271a15cb9574cb [0,2,0,0,0,0|1,0,1]=4 7950 B12R0.206 CC/C=C/C(=O)NCCCCCCl 1cba487f460b09f1117d282504a3f081 [0,2,0,0,0,0|1,0,1]=4 7951 B12R0.206 CC/C=C/C(=O)NCCCCCO b86e40289aadda76aa3cbe3c0857311a [0,2,0,0,0,0|1,0,1]=4 7952 B12R0.206 CC/C=C/C(=O)NCCCCOC 5c5a3b1455cc5b829b8bf19c7dbc5493 [0,2,0,0,0,0|1,0,1]=4 7953 B12R0.206 CC/C=C/C(=O)NCCCCSC c1d7e06e841647504ae4a9ff573003c9 [0,2,0,0,0,0|1,0,1]=4 7954 B12R0.206 CC/C=C/C(=O)NCCCOCC b111194ca0ab4d8c523569b9281861bc [0,2,0,0,0,0|1,0,1]=4 7955 B12R0.206 CC/C=C/C(=O)NCCOCCC 478f48dcb3fd780550ceb865b553162e [0,2,0,0,0,0|1,0,1]=4 7956 B12R0.206 CC/C=C/CNCC(=O)NCCC bf70af709524f032c63aebd06cb8d204 [0,2,0,0,0,0|1,0,1]=4 7957 B12R0.206 CC/C=C/COCC(=O)NCCC 99117867365771a6ee0d9c4b9dfa611f [0,2,0,0,0,0|1,0,1]=4 7958 B12R0.206 CC/C=C/COCC(=O)OCCC 148277ebe64a5aabc6b02ad4b47563d2 [0,2,0,0,0,0|0,0,1]=3 7959 B12R0.206 CC/C=C\C(=O)NCCCCCC 8353d9dd77ca4f6ada77e5a2bc3fdb7a [0,2,0,0,0,0|1,0,1]=4 7960 B12R0.206 CC/C=C\C(=O)NCCCCCCl 44da58920145d6e00cd9929feb8461d3 [0,2,0,0,0,0|1,0,1]=4 7961 B12R0.206 CC/C=C\C(=O)NCCCCCO 39169b8c7eb3c2f4295438dc946c7e27 [0,2,0,0,0,0|1,0,1]=4 7962 B12R0.206 CC/C=C\C(=O)NCCCCOC 9b5e239d8ecbc141a3cc94bd180cd0ef [0,2,0,0,0,0|1,0,1]=4 7963 B12R0.206 CC/C=C\C(=O)NCCCCSC 09c86987b305c9c4d560bb9371df6e9a [0,2,0,0,0,0|1,0,1]=4 7964 B12R0.206 CC/C=C\C(=O)NCCCOCC 9bf000f91e72a72a1ddb40833d3bfc11 [0,2,0,0,0,0|1,0,1]=4 7965 B12R0.206 CC/C=C\C(=O)NCCOCCC 2c1aa52933a35b8ff43b1a02c5396350 [0,2,0,0,0,0|1,0,1]=4 7966 B12R0.206 CC/C=C\COCC(=O)NCCC 3e3952e3c631db51da9abfdfef94ecc3 [0,2,0,0,0,0|1,0,1]=4 7967 B12R0.206 CC/C=C\COCC(=O)OCCC 44307ea44b3c248be23eb8777239ebea [0,2,0,0,0,0|0,0,1]=3 7968 B12R0.206 CC=CCNCOC(=O)OCCC df63a5b0f0e125bb5788e8aa1d9e9991 [0,2,0,0,0,0|0,0,2]=4 7969 B12R0.206 CC=CCOCOC(=O)OCCC 2865c6e6422b8db3097a0a67397799c2 [0,2,0,0,0,0|0,0,2]=4 7970 B12R0.206 CCC#CC(=O)NCCCCCC ada9c64f0bee8fac9284992c4fe286c4 [0,2,0,0,0,0|1,0,1]=4 7971 B12R0.206 CCC#CC(=O)NCCCCCCl e47642ca48a0e364c21f54bfd8f5d90d [0,2,0,0,0,0|1,0,1]=4 7972 B12R0.206 CCC#CC(=O)NCCCCCO 984217d04c045907f271c83629f51094 [0,2,0,0,0,0|1,0,1]=4 7973 B12R0.206 CCC#CC(=O)NCCCCOC 5d16c62a9b96557cda01ab85fca10e53 [0,2,0,0,0,0|1,0,1]=4 7974 B12R0.206 CCC#CC(=O)NCCCCSC ffbcdc2fc825e02c4562295585bd1167 [0,2,0,0,0,0|1,0,1]=4 7975 B12R0.206 CCC#CC(=O)NCCCOCC 5e1b7640b78e11f79bd36a00250cb23e [0,2,0,0,0,0|1,0,1]=4 7976 B12R0.206 CCC#CC(=O)NCCOCCC 6c1a30fbadf6a3952d2eb714462b1424 [0,2,0,0,0,0|1,0,1]=4 7977 B12R0.206 CCC#CCOCC(=O)NCCC b5a05f2897af743fe679974c868c9e3f [0,2,0,0,0,0|1,0,1]=4 7978 B12R0.206 CCC#CCOCC(=O)OCCC f8b7a48e2fc3a5dc902214288c37daff [0,2,0,0,0,0|0,0,1]=3 7979 B12R0.206 CCC/C=C/CCC(=O)NCCBr 7f3a3d1af847e3e7192d74d5c6284922 [0,2,0,0,0,0|2,0,0]=4 7980 B12R0.206 CCC/C=C/CCC(=O)NCCC 17e3c7580280fb58ca270138a5bcee72 [0,2,0,0,0,0|1,0,0]=3 7981 B12R0.206 CCC/C=C/CCC(=O)NCCF 09e00b808dd19000153429f4557fc337 [0,2,0,0,0,0|2,0,0]=4 7982 B12R0.206 CCC/C=C/CCC(=O)NCCI bdc9f0dccd00ae021f4b937c6d0669ae [0,2,0,0,0,0|2,0,0]=4 7983 B12R0.206 CCC/C=C/CCC(=O)NCCO 0a5f3cb907b0d5fc90ded805da9634a1 [0,2,0,0,0,0|2,0,0]=4 7984 B12R0.206 CCC/C=C/CCC(=O)NCCS 0f17749198e730ef72e6630b8a43c111 [0,2,0,0,0,0|2,0,0]=4 7985 B12R0.206 CCC/C=C\CCC(=O)NCCBr 304b31f35eb0eb0f389d3cac3f8fb218 [0,2,0,0,0,0|2,0,0]=4 7986 B12R0.206 CCC/C=C\CCC(=O)NCCC 57c13cab41f080ae0ca043de717f3601 [0,2,0,0,0,0|1,0,0]=3 7987 B12R0.206 CCC/C=C\CCC(=O)NCCF 66ccdca4c41e1aa2cc88e8933d950898 [0,2,0,0,0,0|2,0,0]=4 7988 B12R0.206 CCC/C=C\CCC(=O)NCCI 8a05faef15dad25cccf43de5f91d0acf [0,2,0,0,0,0|2,0,0]=4 7989 B12R0.206 CCC/C=C\CCC(=O)NCCO f3b38e438b13da3df66fe4aaebee32e4 [0,2,0,0,0,0|2,0,0]=4 7990 B12R0.206 CCC/C=C\CCC(=O)NCCS 6612fb75bdb8fea5e23cc8ee33961b57 [0,2,0,0,0,0|2,0,0]=4 7991 B12R0.206 CCC=CC(=O)NCCCCCC 13ff3a32fc5dcac22caca9b21b4d62d5 [0,2,0,0,0,0|1,0,1]=4 7992 B12R0.206 CCC=CC(=O)NCCCCCCl 63eac8337644e0aa55edf8882c0d16ea [0,2,0,0,0,0|1,0,1]=4 7993 B12R0.206 CCC=CC(=O)NCCCCCO 664eb37c530fca1a64092d1a39d64956 [0,2,0,0,0,0|1,0,1]=4 7994 B12R0.206 CCC=CC(=O)NCCCCOC fa7533635f0c2b2c12d32f0aee334d29 [0,2,0,0,0,0|1,0,1]=4 7995 B12R0.206 CCC=CC(=O)NCCCCSC 0d2772c21c3f48f5e78488a276ef8c5a [0,2,0,0,0,0|1,0,1]=4 7996 B12R0.206 CCC=CC(=O)NCCCOCC b46924b039266f54dd429efa0fcae4e9 [0,2,0,0,0,0|1,0,1]=4 7997 B12R0.206 CCC=CC(=O)NCCOCCC 7ce0e4ce6704995bd86dd7ab2a7c4fc7 [0,2,0,0,0,0|1,0,1]=4 7998 B12R0.206 CCCC/C=C/CC(=O)NCCBr 593387f3f60246a9da9a236ff0d5b178 [0,2,0,0,0,0|2,0,0]=4 7999 B12R0.206 CCCC/C=C/CC(=O)NCCC 7add7e2ffa91e9c8710b926d01cbc72c [0,2,0,0,0,0|1,0,0]=3 8000 B12R0.206 CCCC/C=C/CC(=O)NCCF 5d28ac1a18575b799feaabcbec8a98fd [0,2,0,0,0,0|2,0,0]=4 8001 B12R0.206 CCCC/C=C/CC(=O)NCCI 8ef910f3ff36fa55dd3c914c886fcb46 [0,2,0,0,0,0|2,0,0]=4 8002 B12R0.206 CCCC/C=C/CC(=O)NCCO 7429e1e68faa713e0548678b2f2a83ab [0,2,0,0,0,0|2,0,0]=4 8003 B12R0.206 CCCC/C=C/CC(=O)NCCS 7ed991822fc5b6bac550f9015786aa5d [0,2,0,0,0,0|2,0,0]=4 8004 B12R0.206 CCCCC#CCC(=O)NCCC 973a8b2e756c94f6536d9d6a04e20eab [0,2,0,0,0,0|1,0,0]=3 8005 B12R0.206 CCCCC#CCC(=O)NCCF 7ad0a0e9a4489b8f204a4a0ee00db94b [0,2,0,0,0,0|2,0,0]=4 8006 B12R0.206 CCCCC#CCC(=O)NCCI a3cd0e11082dbb41e48fe45877c3fe24 [0,2,0,0,0,0|2,0,0]=4 8007 B12R0.206 CCCCC#CCC(=O)NCCO e9244e66e5f73c48c89ea0bf6e7800a1 [0,2,0,0,0,0|2,0,0]=4 8008 B12R0.206 CCCCC#CCC(=O)NCCS c43fd10f9e3040c1808c24bde307d8da [0,2,0,0,0,0|2,0,0]=4 8009 B12R0.206 CCCCC(=O)NCCCCC#N 8a8c03388dfedfe37d1b0b58c712e9cd [0,2,0,0,0,0|1,0,1]=4 8010 B12R0.206 CCCCC(=O)NCCCCCCl dcdbba3f08bf0589d9296e6e29d70622 [0,2,0,0,0,0|1,0,0]=3 8011 B12R0.206 CCCCC(=O)NCCCCCO 708187ab56d55406ad6cd96937fc37bb [0,2,0,0,0,0|1,0,0]=3 8012 B12R0.206 CCCCC(=O)NCCCCOC c4313a1c3e6c2aebdb57cb893af968e7 [0,2,0,0,0,0|1,0,0]=3 8013 B12R0.206 CCCCC(=O)NCCCCSC 7eb15abe44572fb34f98eb85f223c298 [0,2,0,0,0,0|1,0,0]=3 8014 B12R0.206 CCCCC(=O)NCCCOCC 1ab2a8b6d814674961e457a217ed670b [0,2,0,0,0,0|1,0,0]=3 8015 B12R0.206 CCCCC(=O)NCCOCCC 6a024cb730827e4472b09220771d10fd [0,2,0,0,0,0|1,0,0]=3 8016 B12R0.206 CCCCC(=O)NCCOCCO fb5a87d9004d14d46c082a30e17aa6a2 [0,2,0,0,0,0|2,0,0]=4 8017 B12R0.206 CCCCC(=O)NCCOCCS 44cea7c89d0d6d6c982dd09890a5b8f2 [0,2,0,0,0,0|2,0,0]=4 8018 B12R0.206 CCCCC(=O)NCCSCCO bd125690773aaf407ed0ae754e92a98a [0,2,0,0,0,0|2,0,0]=4 8019 B12R0.206 CCCCC(=O)OCNCCCCl 2b82437783a22e441e7af4b857b75da5 [0,2,0,0,0,0|2,0,0]=4 8020 B12R0.206 CCCCC(=O)OCNCCCO a21688c02faef6a46a4d0fd1a2d1a399 [0,2,0,0,0,0|2,0,0]=4 8021 B12R0.206 CCCCC(=O)OCNCCOC a17bb70a03baa300c62dcd09166d8f5a [0,2,0,0,0,0|2,0,0]=4 8022 B12R0.206 CCCCC(=O)OCNCCSC f6e1e41007aefec042962bbd8a2d8ae5 [0,2,0,0,0,0|2,0,0]=4 8023 B12R0.206 CCCCC(=O)OCOCCCF 310538ecf4f81a7112815e982f334f02 [0,2,0,0,0,0|2,0,0]=4 8024 B12R0.206 CCCCC(=O)OCOCCCS bfb274ea145689aeed7fedbbe26273b5 [0,2,0,0,0,0|2,0,0]=4 8025 B12R0.206 CCCCC(=O)OCOCCOC 67464e6bcd00b2f399726c08cf6df997 [0,2,0,0,0,0|2,0,0]=4 8026 B12R0.206 CCCCC(=O)OCOCCSC c0956cf633ab54833b5339fa281db62d [0,2,0,0,0,0|2,0,0]=4 8027 B12R0.206 CCCCC/C=C/C(=O)NCCBr 2d86ad87dcba7433ab905eb4ee63721d [0,2,0,0,0,0|2,0,0]=4 8028 B12R0.206 CCCCC/C=C/C(=O)NCCC 228634eae84737332c0778e1f0951576 [0,2,0,0,0,0|1,0,0]=3 8029 B12R0.206 CCCCC/C=C/C(=O)NCCF 449fae9f7a807a6eb13c8efd8e7834d4 [0,2,0,0,0,0|2,0,0]=4 8030 B12R0.206 CCCCC/C=C/C(=O)NCCI 8e804df18898082efee8df9bb245d38c [0,2,0,0,0,0|2,0,0]=4 8031 B12R0.206 CCCCC/C=C/C(=O)NCCO 763a49a7c41cfb9f53f1b2abad8d3f5e [0,2,0,0,0,0|2,0,0]=4 8032 B12R0.206 CCCCC/C=C/C(=O)NCCS 87e9a313bd5ad5047689dabcbb274481 [0,2,0,0,0,0|2,0,0]=4 8033 B12R0.206 CCCCCC#CC(=O)NCCBr fc2e7c4c5814fc6b8dd52a21b3f06dd5 [0,2,0,0,0,0|2,0,0]=4 8034 B12R0.206 CCCCCC#CC(=O)NCCC 0714bb493c9de9fcb293f38363d2f976 [0,2,0,0,0,0|1,0,0]=3 8035 B12R0.206 CCCCCC#CC(=O)NCCF a6e7de0f933777c447bb11253df8f09b [0,2,0,0,0,0|2,0,0]=4 8036 B12R0.206 CCCCCC#CC(=O)NCCI 50eb05f111924eafd257e8b343518a71 [0,2,0,0,0,0|2,0,0]=4 8037 B12R0.206 CCCCCC#CC(=O)NCCO 4ebfa428bada6f0cdcd24392de810f9a [0,2,0,0,0,0|2,0,0]=4 8038 B12R0.206 CCCCCC#CC(=O)NCCS e13e0fffddbdcfc600157d95161282cb [0,2,0,0,0,0|2,0,0]=4 8039 B12R0.206 CCCCCCCC(=O)NCCBr aeb33913f692f8aeb2d88e85e8864d12 [0,2,0,0,0,0|2,0,0]=4 8040 B12R0.206 CCCCCCCC(=O)NCCC 803c3b5f65103b7f1c85f768d717c2f2 [0,2,0,0,0,0|1,0,0]=3 8041 B12R0.206 CCCCCCCC(=O)NCCF 5666ccc6ed2fb377267cd4664f7225c7 [0,2,0,0,0,0|2,0,0]=4 8042 B12R0.206 CCCCCCCC(=O)NCCI 6b13edd0735d1d59f96550bb7c54373a [0,2,0,0,0,0|2,0,0]=4 8043 B12R0.206 CCCCCCCC(=O)NCCO 59acf39a97659be39079e33de1548aab [0,2,0,0,0,0|2,0,0]=4 8044 B12R0.206 CCCCCCCC(=O)NCCS 3ddbaed3b0e1909b1a6b62a66497a6cb [0,2,0,0,0,0|2,0,0]=4 8045 B12R0.206 CCCCCCCC(C)OCCC ff15cb47ec2eae70e616a2b282843d08 [0,2,0,0,0,0|1,0,1]=4 8046 B12R0.206 CCCCCCNC(=O)CCCC 70acaae11b2c6b1fd45feafe6ffa5b78 [0,2,0,0,0,0|1,0,0]=3 8047 B12R0.206 CCCCCCNC(=O)CCCF 0e993041ca52f0859a511df998766182 [0,2,0,0,0,0|2,0,0]=4 8048 B12R0.206 CCCCCCNC(=O)CCCS d10e075b1852f7856eaccec0857dcaaa [0,2,0,0,0,0|2,0,0]=4 8049 B12R0.206 CCCCCCNC(=O)CCOC b4c31b8a66eba6314d589b98dd099b43 [0,2,0,0,0,0|2,0,0]=4 8050 B12R0.206 CCCCCCNC(=O)CCSC 59d90d84443cb158320da85f181ac89e [0,2,0,0,0,0|2,0,0]=4 8051 B12R0.206 CCCCCCNC(=O)COCC 4c932b059f758f3b35b21b0624ff070a [0,2,0,0,0,0|2,0,0]=4 8052 B12R0.206 CCCCCCNC(=O)CSCC 5c1f59ea001a51aa153486a70e0a9d7e [0,2,0,0,0,0|2,0,0]=4 8053 B12R0.206 CCCCCCNC(=O)NCCC f36e2e39309d437e377f2067d3d3eff8 [0,2,0,0,0,0|1,0,0]=3 8054 B12R0.206 CCCCCCNC(=O)NCCF 13c674784da2709752dfed6a4658c69d [0,2,0,0,0,0|2,0,0]=4 8055 B12R0.206 CCCCCCNC(=O)NCCN 7f84ff0455b061bd0347d6aa73d0f51d [0,2,0,0,0,0|2,0,0]=4 8056 B12R0.206 CCCCCCNC(=O)NCCO e6e5324d912a2eb8a44e9bd8f0362eb9 [0,2,0,0,0,0|2,0,0]=4 8057 B12R0.206 CCCCCCNC(=O)NCCS 63c266e8d4232b081ad99720135ec884 [0,2,0,0,0,0|2,0,0]=4 8058 B12R0.206 CCCCCCNC(=S)NCCC fac2e7aebea1c7b5266f06058bfe6047 [0,2,0,0,0,0|1,1,0]=4 8059 B12R0.206 CCCCCNCC(=O)CCSC b8660bc8e2dae8d3245382c0aefef5b9 [0,2,0,0,0,0|2,0,0]=4 8060 B12R0.206 CCCCCNCC(=O)NCCC 485c0e9fef70d914d1fa68888287aa18 [0,2,0,0,0,0|1,0,0]=3 8061 B12R0.206 CCCCCNCC(=O)NCCO 9f811f81b7a80a50c5a8848a082e7a7e [0,2,0,0,0,0|2,0,0]=4 8062 B12R0.206 CCCCCNCC(=O)OCCC de2a306fea09af86abf0893fd5e0c26b [0,2,0,0,0,0|0,0,0]=2 8063 B12R0.206 CCCCCOCC(=O)CCSC e0465f9fcf86d30a9a9b3a436d617fe7 [0,2,0,0,0,0|2,0,0]=4 8064 B12R0.206 CCCCCOCC(=O)NCCC abc22212e9071637d4f7daf41e0c511d [0,2,0,0,0,0|1,0,0]=3 8065 B12R0.206 CCCCCOCC(=O)OCCC e665b649604e19dd7431faa0ad8c8b23 [0,2,0,0,0,0|0,0,0]=2 8066 B12R0.206 CCCCNCOC(=O)CCCC 1bafb601242da8a8d946db52f1bbeaf0 [0,2,0,0,0,0|1,0,0]=3 8067 B12R0.206 CCCCNCOC(=O)OCCC d83cefbdb3981c9e3c96c1cd40b4f56b [0,2,0,0,0,0|0,0,0]=2 8068 B12R0.206 CCCCOCCC(=O)NCCBr 1f6476d461fab6f2d3cf2b6fa4703df2 [0,2,0,0,0,0|2,0,0]=4 8069 B12R0.206 CCCCOCCC(=O)NCCC 73e057edf46603d2370e38c443d4a9b3 [0,2,0,0,0,0|1,0,0]=3 8070 B12R0.206 CCCCOCCC(=O)NCCF db1a56ade117c6b7b0ed0a0477088223 [0,2,0,0,0,0|2,0,0]=4 8071 B12R0.206 CCCCOCCC(=O)NCCI 4b5bcc697d9e410ccd2ea2cbf9faefd6 [0,2,0,0,0,0|2,0,0]=4 8072 B12R0.206 CCCCOCCC(=O)NCCO 67d4d72ef2bbabeb91fa0d8f5a17fbb5 [0,2,0,0,0,0|2,0,0]=4 8073 B12R0.206 CCCCOCCC(=O)NCCS 5beb6b5ee01b21622525c5f22e5baef6 [0,2,0,0,0,0|2,0,0]=4 8074 B12R0.206 CCCCOCCC(=O)OCCC 2a1b433dcea9d2880480901bab6925a9 [0,2,0,0,0,0|0,0,0]=2 8075 B12R0.206 CCCCOCOC(=O)CCCC fba6deb132e6e7f7f7861343ba29d758 [0,2,0,0,0,0|1,0,0]=3 8076 B12R0.206 CCCCOCOC(=O)OCCC 071c97a3bb68cd2ecd9925c15aaf1564 [0,2,0,0,0,0|0,0,0]=2 8077 B12R0.206 CCCNC(=O)CCCCCC=O a8e9e3cb9258f7f377f9d83a3afd88bd [0,2,0,0,0,0|1,0,0]=3 8078 B12R0.206 CCCNC(=O)CCCCCCF fe0c0826cc2a628723d94a0538063122 [0,2,0,0,0,0|1,0,0]=3 8079 B12R0.206 CCCNC(=O)CCCCCCO 06682eecaa9b10b95e75ffa3df2459d9 [0,2,0,0,0,0|1,0,0]=3 8080 B12R0.206 CCCNC(=O)CCCCCCS ba9f55ea28a9b7b31a9b4116bfb6bb62 [0,2,0,0,0,0|1,0,0]=3 8081 B12R0.206 CCCNC(=O)CCCCCOC 245314515c1d97c13d9adf584ef34ad0 [0,2,0,0,0,0|1,0,0]=3 8082 B12R0.206 CCCNC(=O)CCCCOCC b5b1837a84cecb8e93b60a73927b2d74 [0,2,0,0,0,0|1,0,0]=3 8083 B12R0.206 CCCNC(=O)CCCNCC#N 8368489fc9d225a069d86a8610e4b8ce [0,2,0,0,0,0|1,0,1]=4 8084 B12R0.206 CCCNC(=O)CCCNCCBr 4fa3d7ab3d24793e7559d291fc3e0cd0 [0,2,0,0,0,0|1,0,0]=3 8085 B12R0.206 CCCNC(=O)CCCNCCF 3cc53ae75b0c0fd5595a7919885414a5 [0,2,0,0,0,0|1,0,0]=3 8086 B12R0.206 CCCNC(=O)CCCNCCI 452f68022b6e7a6d67d389d3260e0119 [0,2,0,0,0,0|1,0,0]=3 8087 B12R0.206 CCCNC(=O)CCCNCCO f185ad42ede60c10b0251a44cbc057be [0,2,0,0,0,0|1,0,0]=3 8088 B12R0.206 CCCNC(=O)CCCNCCS 07a3f2f6611f77ce1ccdf721e9ae5eb8 [0,2,0,0,0,0|1,0,0]=3 8089 B12R0.206 CCCNC(=O)CCCOCC#N 185581e2017b37447ed9aedbf8a7a5aa [0,2,0,0,0,0|1,0,1]=4 8090 B12R0.206 CCCNC(=O)CCCOCCC 435e5a2e43d294bff9b948a4f65ab99d [0,2,0,0,0,0|1,0,0]=3 8091 B12R0.206 CCCNC(=O)CCCOCCF 8115036f6d300124bf91f447e7fc1d65 [0,2,0,0,0,0|1,0,0]=3 8092 B12R0.206 CCCNC(=O)CCCOCCS 4ab3f2ebe1a9f23128ec5bf3cb960077 [0,2,0,0,0,0|1,0,0]=3 8093 B12R0.206 CCCNC(=O)CCCOCOC 21cb1379c229cade9043d990095529ac [0,2,0,0,0,0|1,0,0]=3 8094 B12R0.206 CCCNC(=O)CCOCCC#N 03a1815ddc57ac6b062c4f36b58bda1b [0,2,0,0,0,0|1,0,1]=4 8095 B12R0.206 CCCNC(=O)CCOCCOC 944c62a51034113604155675c11442bc [0,2,0,0,0,0|1,0,0]=3 8096 B12R0.206 CCCNC(=O)CCSSCCO d1e4ef691de4f8e4182dcc0fb4470e85 [0,2,0,0,0,0|2,0,0]=4 8097 B12R0.206 CCCNC(=O)CNCCCC#N 5aa84f489c7c8f0a1a5565a58817aaa3 [0,2,0,0,0,0|1,0,1]=4 8098 B12R0.206 CCCNC(=O)CNCCCC=O 3f5caee61c8b15c10dad4f738397ab2c [0,2,0,0,0,0|1,0,1]=4 8099 B12R0.206 CCCNC(=O)CNCCCCCl be671185708e2cc6ae114eab4b33f89b [0,2,0,0,0,0|1,0,0]=3 8100 B12R0.206 CCCNC(=O)CNCCCCF 0afb27739ae3d7ce8e9c841c1dfe516a [0,2,0,0,0,0|1,0,0]=3 8101 B12R0.206 CCCNC(=O)CNCCCCO 4e04494b3a8ce39053c54760b63e8c39 [0,2,0,0,0,0|1,0,0]=3 8102 B12R0.206 CCCNC(=O)CNCCCCS d549174cf1342aa8161d38ad736463e6 [0,2,0,0,0,0|1,0,0]=3 8103 B12R0.206 CCCNC(=O)CNCCCOC f1d559c50a4238e42afd5c2b201380f0 [0,2,0,0,0,0|1,0,0]=3 8104 B12R0.206 CCCNC(=O)CNCCCSC 83399536b7b4ed54e7857f5c6777ea6f [0,2,0,0,0,0|1,0,0]=3 8105 B12R0.206 CCCNC(=O)CNCCOCC c7cd1afbfa1112b2db289eb78589529d [0,2,0,0,0,0|1,0,0]=3 8106 B12R0.206 CCCNC(=O)CNCCSCC 656339fa6b28d4123d42827c5e2d0b6d [0,2,0,0,0,0|1,0,0]=3 8107 B12R0.206 CCCNC(=O)COCCCC#N 0839532c3b6400c29de80068a5c1fe78 [0,2,0,0,0,0|1,0,1]=4 8108 B12R0.206 CCCNC(=O)COCCCC=O bbcf886eb4db65929e1bcdfa8ab23180 [0,2,0,0,0,0|1,0,1]=4 8109 B12R0.206 CCCNC(=O)COCCCCF c9b82e69fa17b4aefca8d0d00aae0aae [0,2,0,0,0,0|1,0,0]=3 8110 B12R0.206 CCCNC(=O)COCCCCS ea53eaedadf6023dd32c22bf87eec6b6 [0,2,0,0,0,0|1,0,0]=3 8111 B12R0.206 CCCNC(=O)COCCCOC 7f360a2792f4040b0fb0bfec743b6b00 [0,2,0,0,0,0|1,0,0]=3 8112 B12R0.206 CCCNC(=O)COCCCSC eb36332993f7710ddb644cca55e6d16b [0,2,0,0,0,0|1,0,0]=3 8113 B12R0.206 CCCNC(=O)COCCOCC 75da184737f045ab1cb4d25be30a51db [0,2,0,0,0,0|1,0,0]=3 8114 B12R0.206 CCCNC(=O)COCCSCC 4e252423249147465b1fd78bdb26182f [0,2,0,0,0,0|1,0,0]=3 8115 B12R0.206 CCCNC(=O)NCCCCC#N fe4e8f7c854d029139aa35738a6c7634 [0,2,0,0,0,0|1,0,1]=4 8116 B12R0.206 CCCNC(=O)NCCCCCN 48f071fbd062de65f3de6b55455d654d [0,2,0,0,0,0|1,0,0]=3 8117 B12R0.206 CCCNC(=O)NCCCCCO 3d6d5434d619855100527a2575cc0921 [0,2,0,0,0,0|1,0,0]=3 8118 B12R0.206 CCCNC(=O)NCCCCOC 653f1b3fa4dcf79f739f85c91c17721d [0,2,0,0,0,0|1,0,0]=3 8119 B12R0.206 CCCNC(=O)NCCCCSC f2b71315989a58cef03f8f190de6f5b1 [0,2,0,0,0,0|1,0,0]=3 8120 B12R0.206 CCCNC(=O)NCCCOCC d714c40e165f327a9a129525803ce408 [0,2,0,0,0,0|1,0,0]=3 8121 B12R0.206 CCCNC(=O)NCCOCCC 270129a94826db6ababc00fc15112a7b [0,2,0,0,0,0|1,0,0]=3 8122 B12R0.206 CCCNC(=O)NCCOCCN e8d856b9894361c40c4779c110342ba9 [0,2,0,0,0,0|2,0,0]=4 8123 B12R0.206 CCCNC(=O)NCCOCCO 4cab1597b84f015f6a006a7b391d40fd [0,2,0,0,0,0|2,0,0]=4 8124 B12R0.206 CCCNC(=O)NCCOCCS 91a0b5501303087b625ddd43210b3ccd [0,2,0,0,0,0|2,0,0]=4 8125 B12R0.206 CCCNC(=O)NCCSCCN 08d898c91bc068506c2e5d9b6625da80 [0,2,0,0,0,0|2,0,0]=4 8126 B12R0.206 CCCNC(=O)NCCSCCO 0a95222bb0b9f2869a646e8d60d5de65 [0,2,0,0,0,0|2,0,0]=4 8127 B12R0.206 CCCNC(=S)NCCCCCN ff78fa31ed10b80862fee62d9c0fe094 [0,2,0,0,0,0|1,1,0]=4 8128 B12R0.206 CCCNC(=S)NCCCCCO 445b51fa6f5b7ea6c8c5fa3eb690889a [0,2,0,0,0,0|1,1,0]=4 8129 B12R0.206 CCCNC(=S)NCCCCOC f13ef17b88f3b7c2b3ab7e8c799a388a [0,2,0,0,0,0|1,1,0]=4 8130 B12R0.206 CCCNC(=S)NCCCCSC f0baa817d70ac086e9e8e15c777875ef [0,2,0,0,0,0|1,1,0]=4 8131 B12R0.206 CCCNC(=S)NCCCOCC e50c0a0c978593a8f8c3c4bc5bbe505b [0,2,0,0,0,0|1,1,0]=4 8132 B12R0.206 CCCNC(=S)NCCOCCC 9a8cbde6aed64e3fbe7586418a00e0e3 [0,2,0,0,0,0|1,1,0]=4 8133 B12R0.206 CCCNCCCC(=O)NCCC b3989e6e752d16b37af92ec59dbde35e [0,2,0,0,0,0|1,0,0]=3 8134 B12R0.206 CCCOC(=O)CCOC/C=C/Cl 2607cda40629cda4e999627edc6ea7f5 [0,2,0,0,0,0|0,0,2]=4 8135 B12R0.206 CCCOC(=O)CCOC/C=C\Cl bf15ba8b45feac09eb32a778dcf8a1d2 [0,2,0,0,0,0|0,0,2]=4 8136 B12R0.206 CCCOC(=O)CCOCCC#N 86f7e1f9fdfa543840e1469f81d2dece [0,2,0,0,0,0|0,0,1]=3 8137 B12R0.206 CCCOC(=O)CCOCCC=O d7af702114cd5f1efd14f2ff20851478 [0,2,0,0,0,0|0,0,1]=3 8138 B12R0.206 CCCOC(=O)CCOCCCF 59c320dac474ec2811161e66e2464e17 [0,2,0,0,0,0|0,0,0]=2 8139 B12R0.206 CCCOC(=O)CCOCCCS df5e25595ce3867540563719c60661ae [0,2,0,0,0,0|0,0,0]=2 8140 B12R0.206 CCCOC(=O)CCOCCOC 7d8b07772216d464006195a1995cf433 [0,2,0,0,0,0|0,0,0]=2 8141 B12R0.206 CCCOC(=O)CCOCCSC 43393629d1c19e33dd16ab0a5b691755 [0,2,0,0,0,0|0,0,0]=2 8142 B12R0.206 CCCOC(=O)CCOCOCC e96b1f0233aac9513065515ff95e9fbb [0,2,0,0,0,0|0,0,0]=2 8143 B12R0.206 CCCOC(=O)CNCC#CCO e4161ec27bb39328f59ca6ad4db354aa [0,2,0,0,0,0|0,0,2]=4 8144 B12R0.206 CCCOC(=O)CNCCCC#N d5aaa22e3121cecf826aea8d7cb6a4fe [0,2,0,0,0,0|0,0,1]=3 8145 B12R0.206 CCCOC(=O)CNCCCCCl 45124241f08a9fc598ed39bd0c8c5fcd [0,2,0,0,0,0|0,0,0]=2 8146 B12R0.206 CCCOC(=O)CNCCCCO 22ae123d3c65c6c95d71f7b1ecad0bd7 [0,2,0,0,0,0|0,0,0]=2 8147 B12R0.206 CCCOC(=O)CNCCCCS cd5a830a215bf4ab5f9696b39be26218 [0,2,0,0,0,0|0,0,0]=2 8148 B12R0.206 CCCOC(=O)CNCCCOC 369fb59c7286eb1404e186af1ece60a7 [0,2,0,0,0,0|0,0,0]=2 8149 B12R0.206 CCCOC(=O)CNCCCSC a1284ac40db9278ad53c7b780c9b1311 [0,2,0,0,0,0|0,0,0]=2 8150 B12R0.206 CCCOC(=O)CNCCOCC 498ef4fd4a133dde7f23ecde8a14227a [0,2,0,0,0,0|0,0,0]=2 8151 B12R0.206 CCCOC(=O)CNCCSCC 66d7f73a4cc276f938121e64e38aa544 [0,2,0,0,0,0|0,0,0]=2 8152 B12R0.206 CCCOC(=O)COCCCC#N 1d1141b15206cbb0b9d9df7d6e7ad0db [0,2,0,0,0,0|0,0,1]=3 8153 B12R0.206 CCCOC(=O)COCCCC=O 6e0985d45248bad87d7b72c4aa390c27 [0,2,0,0,0,0|0,0,1]=3 8154 B12R0.206 CCCOC(=O)COCCCCF c96c9c870dbd0d200fe7d90a4f625f99 [0,2,0,0,0,0|0,0,0]=2 8155 B12R0.206 CCCOC(=O)COCCCCS 90eaabb4e8b7deca2ef25ad6d664554b [0,2,0,0,0,0|0,0,0]=2 8156 B12R0.206 CCCOC(=O)COCCCOC 114b77280af3929272a16e8b43f72bb1 [0,2,0,0,0,0|0,0,0]=2 8157 B12R0.206 CCCOC(=O)COCCCSC 3af9e40c6758f83423fcf56581d905f0 [0,2,0,0,0,0|0,0,0]=2 8158 B12R0.206 CCCOC(=O)COCCNC=O 081f26de26a6e186c7dc829cddf14cd2 [0,2,0,0,0,0|1,0,1]=4 8159 B12R0.206 CCCOC(=O)COCCOC=O ead71020140c4e7c2df9a0c50d27cf25 [0,2,0,0,0,0|1,0,1]=4 8160 B12R0.206 CCCOC(=O)COCCOCC 9e89e3c3bac026b79da1a8c44252376c [0,2,0,0,0,0|0,0,0]=2 8161 B12R0.206 CCCOC(=O)COCCSCC 23f30dca08bdf145f9f32c210829965b [0,2,0,0,0,0|0,0,0]=2 8162 B12R0.206 CCCOC(=O)OCNCCC#N 6f2e1de7572c7e34af226cc3ed96e6ef [0,2,0,0,0,0|1,0,1]=4 8163 B12R0.206 CCCOC(=O)OCNCCCCl 7bb6bd08b4e0e8b3a7867d17047dac28 [0,2,0,0,0,0|1,0,0]=3 8164 B12R0.206 CCCOC(=O)OCNCCCO 642e33d09b2da3a6be58e56a0c5ea870 [0,2,0,0,0,0|1,0,0]=3 8165 B12R0.206 CCCOC(=O)OCNCCOC ee45e6859617993e2ec8182850f0357b [0,2,0,0,0,0|1,0,0]=3 8166 B12R0.206 CCCOC(=O)OCNCCON 506645d22edace0a38ff0c46788d7b42 [0,2,0,0,0,0|2,0,0]=4 8167 B12R0.206 CCCOC(=O)OCNCCSC 5e1b4972b6b67d6f1146aee01d14fe96 [0,2,0,0,0,0|1,0,0]=3 8168 B12R0.206 CCCOC(=O)OCOCCC#N 37fc8ee5179e64a622bab304e91647c6 [0,2,0,0,0,0|1,0,1]=4 8169 B12R0.206 CCCOC(=O)OCOCCC=O 839353848d8a6d358627ebbbae55fd43 [0,2,0,0,0,0|1,0,1]=4 8170 B12R0.206 CCCOC(=O)OCOCCCF 61d6de8f87f9cf6815d7c9a1c4f71ab8 [0,2,0,0,0,0|1,0,0]=3 8171 B12R0.206 CCCOC(=O)OCOCCCS ea19e0ee2b154c918efdcbf4620bbde0 [0,2,0,0,0,0|1,0,0]=3 8172 B12R0.206 CCCOC(=O)OCOCCOC 4533308de982d03fce87bd28a54ffa5c [0,2,0,0,0,0|1,0,0]=3 8173 B12R0.206 CCCOC(=O)OCOCCSC 51b2676dc872400c33bef2e593c14f3a [0,2,0,0,0,0|1,0,0]=3 8174 B12R0.206 CCCOCCNC(=O)CCCF dc5a48f08ca6357a67b4ac99f8f2198d [0,2,0,0,0,0|2,0,0]=4 8175 B12R0.206 CCCOCCNC(=O)CCCS b32d77f2830975559988ddb2e181f686 [0,2,0,0,0,0|2,0,0]=4 8176 B12R0.206 CCCOCCNC(=O)CCOC 9ef45dfe14d53154c9b4ae5291ccc7cf [0,2,0,0,0,0|2,0,0]=4 8177 B12R0.206 CCCOCCNC(=O)CCSC a1a72933c38d4fbf2bf13bd69a5128b5 [0,2,0,0,0,0|2,0,0]=4 8178 B12R0.206 CCCOCCNC(=O)COCC 2aee6b126539cc9ff72436117d573816 [0,2,0,0,0,0|2,0,0]=4 8179 B12R0.206 CCCOCCNC(=O)CSCC b56bde388ef4f750117394d9220222ce [0,2,0,0,0,0|2,0,0]=4 8180 B12R0.206 CCCOCCNC(=O)NCCF aac7cb1cbe5617bab25a39aa1828c19e [0,2,0,0,0,0|2,0,0]=4 8181 B12R0.206 CCCOCCNC(=O)NCCN 2e249dac0fa6614a864fa260ea6aec2b [0,2,0,0,0,0|2,0,0]=4 8182 B12R0.206 CCCOCCNC(=O)NCCO 60abfd48f936c746340a8e1344941d2b [0,2,0,0,0,0|2,0,0]=4 8183 B12R0.206 CCCOCCNC(=O)NCCS 3c3d9bbafa9882901603f224155636f6 [0,2,0,0,0,0|2,0,0]=4 8184 B12R0.206 CCOCC(=O)NCCCCCCl b06604fd9514fdcf70e8e9606bf0b24a [0,2,0,0,0,0|2,0,0]=4 8185 B12R0.206 CCOCC(=O)NCCCCCO bbee7340672399548a33b418263e51c3 [0,2,0,0,0,0|2,0,0]=4 8186 B12R0.206 CCOCC(=O)NCCCCOC a75ad6578b872d4f30eb77f0f84fc278 [0,2,0,0,0,0|2,0,0]=4 8187 B12R0.206 CCOCC(=O)NCCCCSC dce29b0bd575db726919525da2e46ca5 [0,2,0,0,0,0|2,0,0]=4 8188 B12R0.206 CCOCCCCC(=O)NCCBr 3bae439d51f869de9612a780a934e2a4 [0,2,0,0,0,0|2,0,0]=4 8189 B12R0.206 CCOCCCCC(=O)NCCF 64004a00af9fe8dcbb173ccb789ecb85 [0,2,0,0,0,0|2,0,0]=4 8190 B12R0.206 CCOCCCCC(=O)NCCI c728ea5925f280850c1b315cfc66f681 [0,2,0,0,0,0|2,0,0]=4 8191 B12R0.206 CCOCCCCC(=O)NCCO 338104cc3c9eb29c7607d49d5e72a65a [0,2,0,0,0,0|2,0,0]=4 8192 B12R0.206 CCOCCCCC(=O)NCCS 966ea7ad6c11b4ea6f5bee1b504c5c6f [0,2,0,0,0,0|2,0,0]=4 8193 B12R0.206 CCOCCCNC(=O)CCCF b7c8891201c1e9b495a01de5d354e12d [0,2,0,0,0,0|2,0,0]=4 8194 B12R0.206 CCOCCCNC(=O)CCCS ac183174555220d933ff57ff91e858a0 [0,2,0,0,0,0|2,0,0]=4 8195 B12R0.206 CCOCCCNC(=O)CCOC 4c679ef267eccebcc7ff027fb681e972 [0,2,0,0,0,0|2,0,0]=4 8196 B12R0.206 CCOCCCNC(=O)CCSC 9680e4c55e1adb37fcd81bf772481581 [0,2,0,0,0,0|2,0,0]=4 8197 B12R0.206 CCOCCCNC(=O)COCC 11952c318e7c8d69a9517c642900d017 [0,2,0,0,0,0|2,0,0]=4 8198 B12R0.206 CCOCCCNC(=O)CSCC 834ff0f7868123758683db4a0f7cba0a [0,2,0,0,0,0|2,0,0]=4 8199 B12R0.206 CCOCCCNC(=O)NCCF 7d9532f104fd9ae6aa4b154051a22e1b [0,2,0,0,0,0|2,0,0]=4 8200 B12R0.206 CCOCCCNC(=O)NCCN cd41e7f7351cbc8ce5d6bba7e5edb657 [0,2,0,0,0,0|2,0,0]=4 8201 B12R0.206 CCOCCCNC(=O)NCCO 264def496230eebe5550cbad83ec6044 [0,2,0,0,0,0|2,0,0]=4 8202 B12R0.206 CCOCCCNC(=O)NCCS b7569f6d5fd0f34da7a6effd9c781002 [0,2,0,0,0,0|2,0,0]=4 8203 B12R0.206 CCOCCNCC(=O)CCSC 26a2431f538bb30088e8bc187adc1703 [0,2,0,0,0,0|2,0,0]=4 8204 B12R0.206 CCOCCNCC(=O)NCCO b1a523d51467c9a54a9aeddb9ff967bc [0,2,0,0,0,0|2,0,0]=4 8205 B12R0.206 CCOCCOCC(=O)CCSC dcb6bef635dc88faf72afad3ea9747f1 [0,2,0,0,0,0|2,0,0]=4 8206 B12R0.206 CCSCC(=O)NCCCCCCl bd70d06825fad57ad301eae44941f802 [0,2,0,0,0,0|2,0,0]=4 8207 B12R0.206 CCSCC(=O)NCCCCCO a6271136f0da7dde95e957f78ed48b73 [0,2,0,0,0,0|2,0,0]=4 8208 B12R0.206 CCSCC(=O)NCCCCOC cb2c3d1512e87b9a4e830cb306eec465 [0,2,0,0,0,0|2,0,0]=4 8209 B12R0.206 CCSCC(=O)NCCCCSC 19d93a44d33f3f64927b7f3716b4e6d7 [0,2,0,0,0,0|2,0,0]=4 8210 B12R0.206 CCSCCNCC(=O)CCSC 6dbe5b22ad5d4883aa31297472cbedcb [0,2,0,0,0,0|2,0,0]=4 8211 B12R0.206 CCSCCNCC(=O)NCCO 3115c3deee6517c6de0d46187c17e5eb [0,2,0,0,0,0|2,0,0]=4 8212 B12R0.206 CCSCCOCC(=O)CCSC dce40ba8d89ea72322a28facfa5ba09c [0,2,0,0,0,0|2,0,0]=4 8213 B12R0.206 COCCC(=O)NCCCCCCl d4cdfb966c2192618599415da7156c16 [0,2,0,0,0,0|2,0,0]=4 8214 B12R0.206 COCCC(=O)NCCCCCO 499bff9f059a4e192e1acd1978967440 [0,2,0,0,0,0|2,0,0]=4 8215 B12R0.206 COCCC(=O)NCCCCSC 824f25fdb226cc8962b57df9576b629e [0,2,0,0,0,0|2,0,0]=4 8216 B12R0.206 COCCCCCC(=O)NCCBr 4209f75b112e962bcd7153d89a9b116f [0,2,0,0,0,0|2,0,0]=4 8217 B12R0.206 COCCCCCC(=O)NCCF c84e52b019de35b473bb100f07c2ec9f [0,2,0,0,0,0|2,0,0]=4 8218 B12R0.206 COCCCCCC(=O)NCCI f171326a21d4344acf2e734aee783550 [0,2,0,0,0,0|2,0,0]=4 8219 B12R0.206 COCCCCCC(=O)NCCO 0d47c2b7de9f30a10159948ee55487aa [0,2,0,0,0,0|2,0,0]=4 8220 B12R0.206 COCCCCCC(=O)NCCS 4a462384bd3128f34c621fcb7cbd4115 [0,2,0,0,0,0|2,0,0]=4 8221 B12R0.206 COCCCCNC(=O)CCCF 2aae8aeb8673ab0d81a4812b1ae64612 [0,2,0,0,0,0|2,0,0]=4 8222 B12R0.206 COCCCCNC(=O)CCCS 630bd13edd3538bd7a4a179670f57ab2 [0,2,0,0,0,0|2,0,0]=4 8223 B12R0.206 COCCCCNC(=O)CCOC c1311a074c8f6ef84e40ed5ffbb0bded [0,2,0,0,0,0|2,0,0]=4 8224 B12R0.206 COCCCCNC(=O)CCSC 1b0e15e166c843778941a903c5ed8f31 [0,2,0,0,0,0|2,0,0]=4 8225 B12R0.206 COCCCCNC(=O)NCCF 8d3f4b1520b33273793960d82c7f8fff [0,2,0,0,0,0|2,0,0]=4 8226 B12R0.206 COCCCCNC(=O)NCCN 58aff469ad1dccae3991a6f00973cf38 [0,2,0,0,0,0|2,0,0]=4 8227 B12R0.206 COCCCCNC(=O)NCCO 59473b0f6251d9f3e6e0ada026dff12b [0,2,0,0,0,0|2,0,0]=4 8228 B12R0.206 COCCCCNC(=O)NCCS 91ec058e46da259b16c66dfe8f49728a [0,2,0,0,0,0|2,0,0]=4 8229 B12R0.206 COCCCNCC(=O)CCSC 8a3180b93e3e8a999c7235b3456aa8cb [0,2,0,0,0,0|2,0,0]=4 8230 B12R0.206 COCCCNCC(=O)NCCO 587df49b8090b6625803ce5b219c1d47 [0,2,0,0,0,0|2,0,0]=4 8231 B12R0.206 COCCCOCC(=O)CCSC ee048571c7dc4734da7d275bc079abf5 [0,2,0,0,0,0|2,0,0]=4 8232 B12R0.206 COCCOCCC(=O)NCCBr 2fad298c3e2ebfe00fe5e31b9881bae2 [0,2,0,0,0,0|2,0,0]=4 8233 B12R0.206 COCCOCCC(=O)NCCF ce6a4246fa91f22bc4c939816c29564f [0,2,0,0,0,0|2,0,0]=4 8234 B12R0.206 COCCOCCC(=O)NCCI 4790d4b80170994126e9b016c1b17f57 [0,2,0,0,0,0|2,0,0]=4 8235 B12R0.206 COCCOCCC(=O)NCCO 200c884fe98f55e2424addae46f6db5d [0,2,0,0,0,0|2,0,0]=4 8236 B12R0.206 COCCOCCC(=O)NCCS a1a174c6ff5e949b713b795c9fbce32c [0,2,0,0,0,0|2,0,0]=4 8237 B12R0.206 CSCCC(=O)CNCCCCCl c28fe48db208dd271df3fb5dff23a314 [0,2,0,0,0,0|2,0,0]=4 8238 B12R0.206 CSCCC(=O)CNCCCCO d07b7561e13bf7273ebcfe973bef6998 [0,2,0,0,0,0|2,0,0]=4 8239 B12R0.206 CSCCC(=O)CNCCCCS 3010b726bc6f94fca4bd7b67a93d095b [0,2,0,0,0,0|2,0,0]=4 8240 B12R0.206 CSCCC(=O)COCCCCF d11ddbc5d2e685e8e37fe724ffecf1a7 [0,2,0,0,0,0|2,0,0]=4 8241 B12R0.206 CSCCC(=O)COCCCCS 91d4401b78490fe11e501dfee0ae64d2 [0,2,0,0,0,0|2,0,0]=4 8242 B12R0.206 CSCCC(=O)NCCCCCCl 9c7b20e7bd3e3d93789bccffc2983428 [0,2,0,0,0,0|2,0,0]=4 8243 B12R0.206 CSCCC(=O)NCCCCCO 07fac50a534e664fca659dc46519c4fb [0,2,0,0,0,0|2,0,0]=4 8244 B12R0.206 CSCCCCNC(=O)CCCF dc97f2e785a7cba2f5e20c3e4b7af8a7 [0,2,0,0,0,0|2,0,0]=4 8245 B12R0.206 CSCCCCNC(=O)CCCS 754d1fbc1be236a132868e63423e83c1 [0,2,0,0,0,0|2,0,0]=4 8246 B12R0.206 CSCCCCNC(=O)CCSC b467793c0045061e3693e195b769accc [0,2,0,0,0,0|2,0,0]=4 8247 B12R0.206 CSCCCCNC(=O)NCCF d32ad1977ac0b6608535dca9f0ba007d [0,2,0,0,0,0|2,0,0]=4 8248 B12R0.206 CSCCCCNC(=O)NCCN 4686a21045a4169b8302364c7506c2df [0,2,0,0,0,0|2,0,0]=4 8249 B12R0.206 CSCCCCNC(=O)NCCO 3389ddc64c96e3dfb83db2c04be11461 [0,2,0,0,0,0|2,0,0]=4 8250 B12R0.206 CSCCCCNC(=O)NCCS f769a8e574d82f3d9dea7254b3cd4887 [0,2,0,0,0,0|2,0,0]=4 8251 B12R0.206 CSCCCNCC(=O)CCSC 3df8753b910fb59d495defd51bb12ebb [0,2,0,0,0,0|2,0,0]=4 8252 B12R0.206 CSCCCNCC(=O)NCCO d92d032e863f27beeabe7e70404ef3d8 [0,2,0,0,0,0|2,0,0]=4 8253 B12R0.206 CSCCCOCC(=O)CCSC 153df029f4fbfc3ab4bb026158a58d3d [0,2,0,0,0,0|2,0,0]=4 8254 B12R0.206 NCCCCCNC(=O)NCCF e7b285b38af6f4578adeaa7e3439e80e [0,2,0,0,0,0|2,0,0]=4 8255 B12R0.206 NCCCCCNC(=O)NCCN 345879b3cdb8c33bba80aab12218fe76 [0,2,0,0,0,0|2,0,0]=4 8256 B12R0.206 NCCCCCNC(=O)NCCO cfb2ea46086ad135e73f4b7b3d4dc825 [0,2,0,0,0,0|2,0,0]=4 8257 B12R0.206 NCCCCCNC(=O)NCCS 441cffa766e191685e8ca8476a4048b5 [0,2,0,0,0,0|2,0,0]=4 8258 B12R0.206 NCCNC(=O)NCCCCCO 6cc97fa5a2c4453d7804817fc617b566 [0,2,0,0,0,0|2,0,0]=4 8259 B12R0.206 O=C(CCCCCCF)NCCBr 216e6224eb305e261185bc8cecd10f9f [0,2,0,0,0,0|2,0,0]=4 8260 B12R0.206 O=C(CCCCCCF)NCCF e64f2d76e985254a554e66498d3555bf [0,2,0,0,0,0|2,0,0]=4 8261 B12R0.206 O=C(CCCCCCF)NCCI ebb0914ec79239a64d13891854445a71 [0,2,0,0,0,0|2,0,0]=4 8262 B12R0.206 O=C(CCCCCCF)NCCO 5a5f2ada65ad0cea3e70d10d92ad237a [0,2,0,0,0,0|2,0,0]=4 8263 B12R0.206 O=C(CCCCCCF)NCCS bd197ae6f236851a243c303938cb74b6 [0,2,0,0,0,0|2,0,0]=4 8264 B12R0.206 O=C(CCCCCCO)NCCBr 3e4e47794909e2969e5fd4361c8f5d49 [0,2,0,0,0,0|2,0,0]=4 8265 B12R0.206 O=C(CCCCCCO)NCCF 60f86e103ddbffff9ec8dcbf282de3f3 [0,2,0,0,0,0|2,0,0]=4 8266 B12R0.206 O=C(CCCCCCO)NCCI bcb66c169f829790d2ea5e740d6df3d2 [0,2,0,0,0,0|2,0,0]=4 8267 B12R0.206 O=C(CCCCCCO)NCCO 8cc85d436d401405585b434ca54943c3 [0,2,0,0,0,0|2,0,0]=4 8268 B12R0.206 O=C(CCCCCCO)NCCS 24710eb62f1a4bf767b4d73236b45e86 [0,2,0,0,0,0|2,0,0]=4 8269 B12R0.206 O=C(CCCCCCS)NCCBr 9241e463c73ca5d6e2f4f47d70dae1fd [0,2,0,0,0,0|2,0,0]=4 8270 B12R0.206 O=C(CCCCCCS)NCCF bc1057b361b82ebece9c4c25ac88c6ab [0,2,0,0,0,0|2,0,0]=4 8271 B12R0.206 O=C(CCCCCCS)NCCI b36f2fbaa2a3ec32556b860bb92ebcee [0,2,0,0,0,0|2,0,0]=4 8272 B12R0.206 O=C(CCCCCCS)NCCO 79bcce4ca7e18712d55f2951b74e3aa6 [0,2,0,0,0,0|2,0,0]=4 8273 B12R0.206 O=C(CCCCCCS)NCCS 9fdb6cd2ea3ee0317f7fbe24b8dc459f [0,2,0,0,0,0|2,0,0]=4 8274 B12R0.206 O=C(CCCF)NCCCCCCl bb53c6e128db6c08fdaa872db4411656 [0,2,0,0,0,0|2,0,0]=4 8275 B12R0.206 O=C(CCCF)NCCCCCO 8e61121d4c27bde03a14f7b304f4d946 [0,2,0,0,0,0|2,0,0]=4 8276 B12R0.206 O=C(CCCS)NCCCCCCl 92d94c83ee196df8450a59d093032b24 [0,2,0,0,0,0|2,0,0]=4 8277 B12R0.206 O=C(CCCS)NCCCCCO 8c3fe224ab90d4d687b3e1d0bd0dbda3 [0,2,0,0,0,0|2,0,0]=4 8278 B12R0.206 O=C(CNCCCCF)NCCO d4c05dc0726f177952bb4fdc5dac17ff [0,2,0,0,0,0|2,0,0]=4 8279 B12R0.206 O=C(CNCCCCO)NCCO c819da124a029bbd55b527b6ab951297 [0,2,0,0,0,0|2,0,0]=4 8280 B12R0.206 O=C(NCCF)NCCCCCO 94285596b31ff2c92789daea594b1e25 [0,2,0,0,0,0|2,0,0]=4 8281 B12R0.206 O=C(NCCO)NCCCCCO c2ec66660fca0e74a4b92c93dd0dc177 [0,2,0,0,0,0|2,0,0]=4 8282 B12R0.206 O=C(NCCS)NCCCCCO 13f95288d06e602f65e1e78538a3594d [0,2,0,0,0,0|2,0,0]=4 8283 B12R0.206 O=CCCCCCC(=O)NCCBr ccf465121b1c07da0a541bca38faa9c4 [0,2,0,0,0,0|2,0,0]=4 8284 B12R0.206 O=CCCCCCC(=O)NCCF b430418a5657452c1b54ca5d4025649d [0,2,0,0,0,0|2,0,0]=4 8285 B12R0.206 O=CCCCCCC(=O)NCCI d7482a34041b6d31300c264be4795f34 [0,2,0,0,0,0|2,0,0]=4 8286 B12R0.206 O=CCCCCCC(=O)NCCO 98692c2f8779266de9125df8c868aaf7 [0,2,0,0,0,0|2,0,0]=4 8287 B12R0.206 O=CCCCCCC(=O)NCCS 41361a0799b5c3810be817396cd94cfb [0,2,0,0,0,0|2,0,0]=4 8288 B12R0.117 C#CC(CCCCC)OCCCC 1fb1afc2430ab6065678096e8c143c42 [0,2,0,0,0,0|1,0,1]=4 8289 B12R0.117 C#CC(CCCCC)OCCCF 97c1ed18a70ba3d05228c2b6d30efea9 [0,2,0,0,0,0|1,0,1]=4 8290 B12R0.117 C#CC(CCCCC)OCCCS 47e2e221e3183d8d6d05f0fdfb9f0239 [0,2,0,0,0,0|1,0,1]=4 8291 B12R0.117 C#CC(CCCCC)OCCOC ac88871db1e2a1f912c47d60db48c04c [0,2,0,0,0,0|1,0,1]=4 8292 B12R0.117 C#CC(CCCCC)OCCSC 79672d1b320838620e6dc6e6212578f2 [0,2,0,0,0,0|1,0,1]=4 8293 B12R0.117 C#CC(CCCCC)OCOCC 3ca893ee84e38bde8827043bf93d27a2 [0,2,0,0,0,0|1,0,1]=4 8294 B12R0.117 C#C[C@H](CCCCC)OCCCC da6df7e85137721a9e4e5765719c063b [0,2,0,0,0,0|1,0,1]=4 8295 B12R0.117 C#C[C@H](CCCCC)OCCCF 2778be14cf60f57f85b21d5690e3f0f6 [0,2,0,0,0,0|1,0,1]=4 8296 B12R0.117 C#C[C@H](CCCCC)OCCCS 8ee02211c46905dc7d6b3179dce5d0eb [0,2,0,0,0,0|1,0,1]=4 8297 B12R0.117 C#C[C@H](CCCCC)OCCOC ad4a6ec374a7988c0af16a641fc7cc13 [0,2,0,0,0,0|1,0,1]=4 8298 B12R0.117 C#C[C@H](CCCCC)OCCSC fd6982c4a59643b92a4116c554a1bf13 [0,2,0,0,0,0|1,0,1]=4 8299 B12R0.117 C#C[C@H](CCCCC)OCOCC b91e463f95453bf6d6af8835c71f551e [0,2,0,0,0,0|1,0,1]=4 8300 B12R0.117 C=CC(CCCCC)OCCCC c5fcef726526bf49b145ae9f1704156a [0,2,0,0,0,0|1,0,1]=4 8301 B12R0.117 C=CC(CCCCC)OCCCF fb51d26718d8aae33c74f2579865f6d0 [0,2,0,0,0,0|1,0,1]=4 8302 B12R0.117 C=CC(CCCCC)OCCCS a56a55365c32d5dd18051ebdca1fcafc [0,2,0,0,0,0|1,0,1]=4 8303 B12R0.117 C=CC(CCCCC)OCCOC e7fcdfee53e8118d6bece9d6e9e2749f [0,2,0,0,0,0|1,0,1]=4 8304 B12R0.117 C=CC(CCCCC)OCCSC c18c25fd0a7ef314daa63d5fb53a5b57 [0,2,0,0,0,0|1,0,1]=4 8305 B12R0.117 C=CC(CCCCC)OCOCC 0f67c01e7dc58a1a9598b584c15f634f [0,2,0,0,0,0|1,0,1]=4 8306 B12R0.117 C=C[C@H](CCCCC)OCCCC ed33096be96ae9d3600c777894eabc6c [0,2,0,0,0,0|1,0,1]=4 8307 B12R0.117 C=C[C@H](CCCCC)OCCCF 40785c13399e7dfcc649d3e602650772 [0,2,0,0,0,0|1,0,1]=4 8308 B12R0.117 C=C[C@H](CCCCC)OCCCS 2958ed1181d822f30cc974ab96c86643 [0,2,0,0,0,0|1,0,1]=4 8309 B12R0.117 C=C[C@H](CCCCC)OCCOC b0ba20039b3e79b42445a4a9ab6c00f0 [0,2,0,0,0,0|1,0,1]=4 8310 B12R0.117 C=C[C@H](CCCCC)OCCSC e3f6f8359511d6681bb26b89f56d010a [0,2,0,0,0,0|1,0,1]=4 8311 B12R0.117 C=C[C@H](CCCCC)OCOCC 99058594ff392a0888c24000d1421680 [0,2,0,0,0,0|1,0,1]=4 8312 B12R0.117 CCCCCC(CC)COCCC a342a7c07d604e406ba4a1e84322dffa [0,2,0,0,0,0|1,0,1]=4 8313 B12R0.117 CCCCCC(CC)OCCCC d284b901ee4c1414c80b60e11b487ef6 [0,2,0,0,0,0|1,0,1]=4 8314 B12R0.117 CCCCCC(CC)OCCCF 8c6e73ceffcfc5d39e423ea17e38c308 [0,2,0,0,0,0|1,0,1]=4 8315 B12R0.117 CCCCCC(CC)OCCCS 371eecc08b0e72cd62f38e2fe2422e18 [0,2,0,0,0,0|1,0,1]=4 8316 B12R0.117 CCCCCC(CC)OCCOC 23a3d4abce6949b1826182692344e2d1 [0,2,0,0,0,0|1,0,1]=4 8317 B12R0.117 CCCCCC(CC)OCCSC f78ba51f54a02cc6952601cac99f3bff [0,2,0,0,0,0|1,0,1]=4 8318 B12R0.117 CCCCCC(CC)OCOCC decd605bdb243d427e207358b3175cd9 [0,2,0,0,0,0|1,0,1]=4 8319 B12R0.117 CCCCCN(C=O)CCCCC fd8a9985f96064d714bea09ab5ee031f [0,2,0,0,0,0|2,0,0]=4 8320 B12R0.117 CCCCC[C@H](CC)OCCCC 0a597214935a674064d66af155dfd172 [0,2,0,0,0,0|1,0,1]=4 8321 B12R0.117 CCCCC[C@H](CC)OCCCF cf136e7c63c093377cd06aa586213cd6 [0,2,0,0,0,0|1,0,1]=4 8322 B12R0.117 CCCCC[C@H](CC)OCCCS cf14a23330d20c1953c722038c457cfc [0,2,0,0,0,0|1,0,1]=4 8323 B12R0.117 CCCCC[C@H](CC)OCCOC d10badbb66085819cc1fcdc688216408 [0,2,0,0,0,0|1,0,1]=4 8324 B12R0.117 CCCCC[C@H](CC)OCCSC 46f1bff9d5c4b5a75f667e6ad319bc01 [0,2,0,0,0,0|1,0,1]=4 8325 B12R0.117 CCCCC[C@H](CC)OCOCC c858afb0ff89c0e948ddffb19616f8c4 [0,2,0,0,0,0|1,0,1]=4 8326 B12R0.233 C#CCCNC(=O)CCCC(C)C 106f3fb2d21f38f2d6e6dae137b29014 [0,2,0,0,0,0|1,0,1]=4 8327 B12R0.233 C=C(Br)COCC(=O)CCCCC d3dfeee87dbd3395995cfc9f21b0e015 [0,2,0,0,0,0|0,0,2]=4 8328 B12R0.233 C=C(C)CCCC(=O)NCCCC e6bc46d2353b9894ad5923ae37f08234 [0,2,0,0,0,0|1,0,1]=4 8329 B12R0.233 C=C(C)CCCC(=O)NCCCCl 4a3ae86df0992147685255a294e1a750 [0,2,0,0,0,0|1,0,1]=4 8330 B12R0.233 C=C(C)CCCC(=O)NCCCO 009632558e22042416fa35137d5a7955 [0,2,0,0,0,0|1,0,1]=4 8331 B12R0.233 C=C(C)CCCC(=O)NCCOC a4f69f3a758793b922539d4bb59c4939 [0,2,0,0,0,0|1,0,1]=4 8332 B12R0.233 C=C(C)CCCC(=O)NCCSC 930e8e77b99f21cce2f6f8c427dfc166 [0,2,0,0,0,0|1,0,1]=4 8333 B12R0.233 C=C(C)CCNC(=O)CCCCC 4c544fc7400f1f883a37b81a1bb75a5d [0,2,0,0,0,0|1,0,0]=3 8334 B12R0.233 C=C(C)CCNC(=O)CCCCF 00045e99de022246a5825bf677f1a0e4 [0,2,0,0,0,0|2,0,0]=4 8335 B12R0.233 C=C(C)CCNC(=O)CCCCO 911d3ae76e4ed8b6d6272239dc0532d1 [0,2,0,0,0,0|2,0,0]=4 8336 B12R0.233 C=C(C)CCNC(=O)CCCCS 2f0fdf756d7001336066207c043ef3bf [0,2,0,0,0,0|2,0,0]=4 8337 B12R0.233 C=C(C)CCNC(=O)CCCOC a8e65013b61e33c2fdb3622459118712 [0,2,0,0,0,0|2,0,0]=4 8338 B12R0.233 C=C(C)CCNC(=O)CCCSC 49e55677ee2a18e56cc2275d8c79521b [0,2,0,0,0,0|2,0,0]=4 8339 B12R0.233 C=C(C)CCNC(=O)CCOCC 587f2a812535673ddb823ed911046a6f [0,2,0,0,0,0|2,0,0]=4 8340 B12R0.233 C=C(C)CCNC(=O)CCSCC 0c83454d4525e9182031563a008eaf61 [0,2,0,0,0,0|2,0,0]=4 8341 B12R0.233 C=C(C)CCNC(=O)COCCC 67363e2e1db5e93d5cd512ffce0e1668 [0,2,0,0,0,0|1,0,1]=4 8342 B12R0.233 C=C(C)CCNC(=O)CSCCC bb22831299a567f55793f075c6b9a0a4 [0,2,0,0,0,0|2,0,0]=4 8343 B12R0.233 C=C(C)CCNC(=O)NCCCC 724302a00607f526eb761305e09f033b [0,2,0,0,0,0|2,0,0]=4 8344 B12R0.233 C=C(C)CCOC(C)CCCCC 2438f845345f1eda423c2ed340b482e5 [0,2,0,0,0,0|1,0,1]=4 8345 B12R0.233 C=C(C)CCO[C@@H](C)CCCCC c4731d5080d962ab01b0e5f9fecf5c59 [0,2,0,0,0,0|1,0,1]=4 8346 B12R0.233 C=C(C)CCO[C@H](C)CCCCC 383341a6a16f8dcf0d4ea5f6a231a77e [0,2,0,0,0,0|1,0,1]=4 8347 B12R0.233 C=C(C)CNCC(=O)CCCCC 54f26377585b9266f11a3f626ea47487 [0,2,0,0,0,0|1,0,1]=4 8348 B12R0.233 C=C(C)CNCC(=O)OCCCC 71575c7d8746dd7cee504ee0b5e8589f [0,2,0,0,0,0|1,0,1]=4 8349 B12R0.233 C=C(C)CNCC(=O)OCCOC ea71c6d7a152769429adfb04286552d1 [0,2,0,0,0,0|1,0,1]=4 8350 B12R0.233 C=C(C)COCC(=O)CCCCC 75d93c93d35431c5a491791be6f76c4d [0,2,0,0,0,0|0,0,1]=3 8351 B12R0.233 C=C(C)COCC(=O)NCCCC 42dd22453a25d823749e143da1f3bccd [0,2,0,0,0,0|1,0,1]=4 8352 B12R0.233 C=C(C)COCC(=O)OCCCC 71baf002e6f03dc3cc39c98252534eed [0,2,0,0,0,0|1,0,1]=4 8353 B12R0.233 C=C(C)COCC(=O)OCCOC 6a9a315b93d88d58227bd551a1a3cc53 [0,2,0,0,0,0|1,0,1]=4 8354 B12R0.233 C=C(Cl)COCC(=O)CCCCC beedfb80790d7ae5e108405b04995317 [0,2,0,0,0,0|0,0,2]=4 8355 B12R0.233 C=C(F)COCC(=O)CCCCC f64cc82686ceaa162af2587ed1f1b763 [0,2,0,0,0,0|0,0,2]=4 8356 B12R0.233 C=C(I)COCC(=O)CCCCC 97381d3181627f41b0161e9d3e8363df [0,2,0,0,0,0|0,0,2]=4 8357 B12R0.233 C=CCCNC(=O)CCCC(C)C 07e74e1cde2a44152ff6f7e4453a022e [0,2,0,0,0,0|1,0,1]=4 8358 B12R0.233 CC#CCNC(=O)CCCC(C)C 5c02f1b3297f4daf3839203793d8c57e [0,2,0,0,0,0|1,0,1]=4 8359 B12R0.233 CC(=O)CCCC(=O)NCCCCl b48172c5e6a512acb8d8560ef7acd96f [0,2,0,0,0,0|1,0,1]=4 8360 B12R0.233 CC(=O)CCCC(=O)NCCCO fb67ce91a0c7779eabadd8911b38d5ff [0,2,0,0,0,0|1,0,1]=4 8361 B12R0.233 CC(C)CCCC(=O)NCCC#N e29a710d2dca9fc1905a844248f50152 [0,2,0,0,0,0|1,0,1]=4 8362 B12R0.233 CC(C)CCCC(=O)NCCCCl 88762c39ad265d299882b063f61fbad1 [0,2,0,0,0,0|1,0,0]=3 8363 B12R0.233 CC(C)CCCC(=O)NCCCO c20f612ce356641c28a2adb62f9dd742 [0,2,0,0,0,0|1,0,0]=3 8364 B12R0.233 CC(C)CCCC(=O)NCCON 8842ca458e64a71c8fd649f0120136bc [0,2,0,0,0,0|2,0,0]=4 8365 B12R0.233 CC(C)CCCC(=O)OCNC#N fe91f130f9b666557adde55b81792c77 [0,2,0,0,0,0|1,0,1]=4 8366 B12R0.233 CC(C)CCCC(C)OCCCF ae8f610252d24c9fcb6da1be19d3f40d [0,2,0,0,0,0|1,0,1]=4 8367 B12R0.233 CC(C)CCCC(C)OCCCS 113b4d0ae80433eb3074e4b09e43542f [0,2,0,0,0,0|1,0,1]=4 8368 B12R0.233 CC(C)CCNC(=O)CCCCF bc0e19aaf411e10d31980935b61ede78 [0,2,0,0,0,0|2,0,0]=4 8369 B12R0.233 CC(C)CCNC(=O)CCCCO 37aef05490c0471e10b9d8e2fc1e95ee [0,2,0,0,0,0|2,0,0]=4 8370 B12R0.233 CC(C)CCNC(=O)CCCCS 8b7408ccc876b2a039fdbc34216209be [0,2,0,0,0,0|2,0,0]=4 8371 B12R0.233 CC(C)CCNC(=O)COCCF 0726752135094a3a788e71a50f80a248 [0,2,0,0,0,0|2,0,0]=4 8372 B12R0.233 CC(C)CCNC(=O)COCCO d115bc061278485f5307dd35c8ba38e7 [0,2,0,0,0,0|2,0,0]=4 8373 B12R0.233 CC(C)CCNC(=O)COCCS 41d391ef074fdf259fdd26ea80580e1d [0,2,0,0,0,0|2,0,0]=4 8374 B12R0.233 CC(C)CCNC(=O)NCCCN a9a48d7ae345604821049565e5d00207 [0,2,0,0,0,0|2,0,0]=4 8375 B12R0.233 CC(C)CCNC(=O)NCCCO ff89a5acf7cc382904838a43707e944d [0,2,0,0,0,0|2,0,0]=4 8376 B12R0.233 CC(C)COCC(=O)NCCCCl 6f6d9d9ab57a29bd39f78357453d0ab3 [0,2,0,0,0,0|2,0,0]=4 8377 B12R0.233 CC(C)COCC(=O)NCCCO 989e8c7ca974bcdcaa61fbf03e9f0ba8 [0,2,0,0,0,0|2,0,0]=4 8378 B12R0.233 CC(C)OCCC(=O)NCCCCl b92eec2c388745a78c95b658455c9881 [0,2,0,0,0,0|2,0,0]=4 8379 B12R0.233 CC(C)OCCC(=O)NCCCO 28f807e02b92daafdbcc95512b2857c9 [0,2,0,0,0,0|2,0,0]=4 8380 B12R0.233 CC(C)SCCC(=O)NCCCCl a52953c4de744108292faeaaf04d9737 [0,2,0,0,0,0|2,0,0]=4 8381 B12R0.233 CC(C)SCCC(=O)NCCCO 3a441f308f6eec645c716b7d5142f402 [0,2,0,0,0,0|2,0,0]=4 8382 B12R0.233 CC(O)CCNC(=O)CCCCF c6b91d36c62c0a43ee1f2a8025d44419 [0,2,0,0,0,0|2,0,0]=4 8383 B12R0.233 CC(O)CCNC(=O)CCCCO fc96ba5d1d490fb10314450eee30c14d [0,2,0,0,0,0|2,0,0]=4 8384 B12R0.233 CC(O)CCNC(=O)CCCCS 553e3ed68e6b9537662e3b1106bbd8ec [0,2,0,0,0,0|2,0,0]=4 8385 B12R0.233 CC(O)CCNC(=O)COCCO 323c2175ccff18152afe6d5dc9d5dc54 [0,2,0,0,0,0|2,0,0]=4 8386 B12R0.233 CC(O)CCNC(=O)COCCS 43d5372f189c3c9368fa49e6d9384205 [0,2,0,0,0,0|2,0,0]=4 8387 B12R0.233 CC(O)CCNC(=O)NCCCN 6b3de715bc4691278f4d6432200a2ab1 [0,2,0,0,0,0|2,0,0]=4 8388 B12R0.233 CC(O)CCNC(=O)NCCCO eb27376ea903d991866191d29e48a552 [0,2,0,0,0,0|2,0,0]=4 8389 B12R0.233 CC=CCNC(=O)CCCC(C)C 32e591bb8a0f1a5a95a20282da2c5114 [0,2,0,0,0,0|1,0,1]=4 8390 B12R0.233 CCC/C=C/C(=O)NCCC(C)C 9e2c9b0fc08bafa0ba641acd055c9ac4 [0,2,0,0,0,0|2,0,0]=4 8391 B12R0.233 CCC/C=C/C(=O)NCCC(C)O a58113306e10e74efca9707310fe7330 [0,2,0,0,0,0|2,0,0]=4 8392 B12R0.233 CCC/C=C/C(=O)NCC[C@@H](C)O 6e939d298c85788de88a39b7696d316b [0,2,0,0,0,0|2,0,0]=4 8393 B12R0.233 CCC/C=C/C(=O)NCC[C@H](C)O f76dc1f187e930fd9c52c6ec6dd97261 [0,2,0,0,0,0|2,0,0]=4 8394 B12R0.233 CCCC#CC(=O)NCCC(C)C aba0541a3a32ebe01d71423d34605e06 [0,2,0,0,0,0|2,0,0]=4 8395 B12R0.233 CCCC#CC(=O)NCCC(C)O c9879d47b0b68ea588fc0cb9e92ab2a6 [0,2,0,0,0,0|2,0,0]=4 8396 B12R0.233 CCCC#CC(=O)NCC[C@@H](C)O 4cc3a0dca068c1fc31d26acf766ee45a [0,2,0,0,0,0|2,0,0]=4 8397 B12R0.233 CCCC#CC(=O)NCC[C@H](C)O 9a14843e46f1846c57dbd876c15ff852 [0,2,0,0,0,0|2,0,0]=4 8398 B12R0.233 CCCC=CC(=O)NCCC(C)C 9eca056cc6659f52d393388f9c73c926 [0,2,0,0,0,0|2,0,0]=4 8399 B12R0.233 CCCC=CC(=O)NCCC(C)O 0302c3f40f16d79a119656288bcf39b7 [0,2,0,0,0,0|2,0,0]=4 8400 B12R0.233 CCCC=CC(=O)NCC[C@@H](C)O 52dc7c00e608c664654afa54a9cbd952 [0,2,0,0,0,0|2,0,0]=4 8401 B12R0.233 CCCC=CC(=O)NCC[C@H](C)O 0b539eddac77bd29f7550bc109ddc571 [0,2,0,0,0,0|2,0,0]=4 8402 B12R0.233 CCCCCC(=O)CNCC(=O)C 6979803c352a182dc7cf83a7eb55fc36 [0,2,0,0,0,0|1,0,1]=4 8403 B12R0.233 CCCCCC(=O)CNCC(C)C 2f8ffa9b1e7428d9610d9c9792423e52 [0,2,0,0,0,0|1,0,0]=3 8404 B12R0.233 CCCCCC(=O)CNCC(C)O 012939746f6c712e197753ac51a73d9d [0,2,0,0,0,0|1,0,0]=3 8405 B12R0.233 CCCCCC(=O)CNCC(F)F 50baff42ca9da3379e884070ffe122b7 [0,2,0,0,0,0|2,0,0]=4 8406 B12R0.233 CCCCCC(=O)CNC[C@@H](C)O 11934f2fa4def43b1c8c12b6e829769d [0,2,0,0,0,0|1,0,0]=3 8407 B12R0.233 CCCCCC(=O)CNC[C@H](C)O ba9723e47ea22a6cb62220419ddd73bb [0,2,0,0,0,0|1,0,0]=3 8408 B12R0.233 CCCCCC(=O)COCC(=O)C ed72604290244ef2364f88d4acd732a8 [0,2,0,0,0,0|0,0,1]=3 8409 B12R0.233 CCCCCC(=O)COCC(=O)N 53ab8d245cf077d2c985a7623e67da9c [0,2,0,0,0,0|1,0,1]=4 8410 B12R0.233 CCCCCC(=O)COCC(=S)N b7e34d8f5b61a94f15922c060204d3da [0,2,0,0,0,0|1,0,1]=4 8411 B12R0.233 CCCCCC(=O)COCC(C)C 27a79f1baef076d63996803cc7e04320 [0,2,0,0,0,0|0,0,0]=2 8412 B12R0.233 CCCCCC(=O)COCC(C)F 07c33e7926fc3f18be8b324331a95be7 [0,2,0,0,0,0|0,0,0]=2 8413 B12R0.233 CCCCCC(=O)COCC(C)S a1bdb1347817d41c37ec8c262f65572a [0,2,0,0,0,0|0,0,0]=2 8414 B12R0.233 CCCCCC(=O)COCC(F)F 404f7ceb62c76d82c3f2723e1efa583f [0,2,0,0,0,0|1,0,0]=3 8415 B12R0.233 CCCCCC(=O)COCS(=O)O e3da4712ad4f99716888e341dffb62c1 [0,2,0,0,0,0|2,0,0]=4 8416 B12R0.233 CCCCCC(=O)COC[C@@H](C)F a11d35a37c461d9d94e44d6538df4622 [0,2,0,0,0,0|0,0,0]=2 8417 B12R0.233 CCCCCC(=O)COC[C@H](C)F 13fd6134054a0b7442b429e1b0e42b07 [0,2,0,0,0,0|0,0,0]=2 8418 B12R0.233 CCCCCC(=O)NCC=C(C)C 79e08e6cd98533468effaaf11c1c632b [0,2,0,0,0,0|1,0,1]=4 8419 B12R0.233 CCCCCC(=O)NCCC(=O)N 524c5fd100384fcb881aa249de13183e [0,2,0,0,0,0|1,0,1]=4 8420 B12R0.233 CCCCCC(=O)NCCC(=S)N 182ee178fefdbc3d439d644ee9f96527 [0,2,0,0,0,0|1,0,1]=4 8421 B12R0.233 CCCCCC(=O)NCCC(C)C de5d4775851c3f556e0a37cd69bd6694 [0,2,0,0,0,0|1,0,0]=3 8422 B12R0.233 CCCCCC(=O)NCCC(C)O 7f60771b66ae1bec642b09c0c06b499c [0,2,0,0,0,0|1,0,0]=3 8423 B12R0.233 CCCCCC(=O)NCCC(F)F 227f61f2a8885031cdf422f4ab1f0514 [0,2,0,0,0,0|1,0,0]=3 8424 B12R0.233 CCCCCC(=O)NCCN(C)C e3528ee47645cff7ade846a5a12c3ed5 [0,2,0,0,0,0|1,0,0]=3 8425 B12R0.233 CCCCCC(=O)NCCS(=O)C ae92b5a907bcc8053fad1c7ceababc2f [0,2,0,0,0,0|1,0,0]=3 8426 B12R0.233 CCCCCC(=O)NCCS(=O)O 54eec11e5513c33cae3ca42cfe9a88f4 [0,2,0,0,0,0|2,0,0]=4 8427 B12R0.233 CCCCCC(=O)NCC[C@@H](C)O f61ba65d8dcacaf44bfbb83aa992ca7d [0,2,0,0,0,0|1,0,0]=3 8428 B12R0.233 CCCCCC(=O)NCC[C@H](C)O c876e519826877ab888e09489622daa0 [0,2,0,0,0,0|1,0,0]=3 8429 B12R0.233 CCCCCC(=O)OCOC(C)C 90c7ba95c11a934d21db25600c8d1a97 [0,2,0,0,0,0|0,0,0]=2 8430 B12R0.233 CCCCCC(C)COCC(C)C 4213359448123f51d56b792ddcbbd57d [0,2,0,0,0,0|1,0,1]=4 8431 B12R0.233 CCCCCC(C)OCCC(=O)C 49212f27a69ad4babeadaa822182164c [0,2,0,0,0,0|1,0,1]=4 8432 B12R0.233 CCCCCC(C)OCCC(C)C c52701f546739edbc5422405b5075256 [0,2,0,0,0,0|1,0,1]=4 8433 B12R0.233 CCCCCC(C)OCCC(F)F 127e4701095b661fb45fe91393ea6b85 [0,2,0,0,0,0|1,0,1]=4 8434 B12R0.233 CCCCCC(C)OCCN(C)C 339bb6f086d32968db555b2a2fd922d4 [0,2,0,0,0,0|1,0,1]=4 8435 B12R0.233 CCCCCC(C)OCCS(=O)C a28f85c40aa4985b5faead7afa3ce21c [0,2,0,0,0,0|1,0,1]=4 8436 B12R0.233 CCCCCC(C)OCOC(C)C 8171ecca13377b30a6d0ab81989940ed [0,2,0,0,0,0|1,0,1]=4 8437 B12R0.233 CCCCC[C@@H](C)OCCC(=O)C 1e961630be852b4f9db98793735eca13 [0,2,0,0,0,0|1,0,1]=4 8438 B12R0.233 CCCCC[C@@H](C)OCCC(C)C b605bfe2311a91cb1ab8ad3b09e7b3bc [0,2,0,0,0,0|1,0,1]=4 8439 B12R0.233 CCCCC[C@@H](C)OCCN(C)C 0f5b82b371ff79fce453a35f039a7867 [0,2,0,0,0,0|1,0,1]=4 8440 B12R0.233 CCCCC[C@@H](C)OCCS(=O)C 2154d947aaea8c06c10de2ff7a562b56 [0,2,0,0,0,0|1,0,1]=4 8441 B12R0.233 CCCCC[C@@H](C)OCOC(C)C 44ac6a70b56b0bf677af8794d73db56a [0,2,0,0,0,0|1,0,1]=4 8442 B12R0.233 CCCCC[C@H](C)OCCC(=O)C cf1bce5f8772a5ffce7117f2be93cad3 [0,2,0,0,0,0|1,0,1]=4 8443 B12R0.233 CCCCC[C@H](C)OCCC(C)C 1fbf45b04ff7ed87d7ca616d67fccaff [0,2,0,0,0,0|1,0,1]=4 8444 B12R0.233 CCCCC[C@H](C)OCCC(F)F d69d84a94da5d2645aa09e6ac0508ab0 [0,2,0,0,0,0|1,0,1]=4 8445 B12R0.233 CCCCC[C@H](C)OCCN(C)C ab36cd51c1aeb99ffe445a3f7b0d1e81 [0,2,0,0,0,0|1,0,1]=4 8446 B12R0.233 CCCCC[C@H](C)OCCS(=O)C d8691ff9001f6146b9bdd4c7ba86349b [0,2,0,0,0,0|1,0,1]=4 8447 B12R0.233 CCCCC[C@H](C)OCOC(C)C a49b3b416b1c04cb2b74b16070f7b832 [0,2,0,0,0,0|1,0,1]=4 8448 B12R0.233 CCCCNC(=O)/C=C/CC(C)C 4c1cdaee1f0b84576ac43e4e774010e6 [0,2,0,0,0,0|2,0,0]=4 8449 B12R0.233 CCCCNC(=O)CCCC(=O)C a358c740f127bd9f5a9a662256d126a5 [0,2,0,0,0,0|1,0,1]=4 8450 B12R0.233 CCCCNC(=O)CCCC(C)C 0965007a9c047a85020048af373a262d [0,2,0,0,0,0|1,0,0]=3 8451 B12R0.233 CCCCNC(=O)CCCN(C)C 94b6d3bbc88655c0e134ff208518b1ea [0,2,0,0,0,0|2,0,0]=4 8452 B12R0.233 CCCCNC(=O)CCOC(C)C 64a466e693c8d5e9be5d02fa3d238246 [0,2,0,0,0,0|2,0,0]=4 8453 B12R0.233 CCCCNC(=O)CCSC(C)C e64f717443aa5b8af4509f8138fe793d [0,2,0,0,0,0|2,0,0]=4 8454 B12R0.233 CCCCNC(=O)CNCC(C)C 43b513730af4549e4a2644555575af12 [0,2,0,0,0,0|2,0,0]=4 8455 B12R0.233 CCCCNC(=O)CNCC(C)O fedb07fd06ba48869b195512e0f97c3f [0,2,0,0,0,0|2,0,0]=4 8456 B12R0.233 CCCCNC(=O)CNC[C@@H](C)O cea4ede5db59d5d7d4192f5688f43aa9 [0,2,0,0,0,0|2,0,0]=4 8457 B12R0.233 CCCCNC(=O)CNC[C@H](C)O 447af2429a13602dc09eaa5c06e4bb6b [0,2,0,0,0,0|2,0,0]=4 8458 B12R0.233 CCCCNC(=O)COCC(=O)C 3c61f0505afc8b95283985e41d925d03 [0,2,0,0,0,0|1,0,1]=4 8459 B12R0.233 CCCCNC(=O)COCC(C)C 6deb7b6201689d1dd5e9a7d407985ef9 [0,2,0,0,0,0|1,0,0]=3 8460 B12R0.233 CCCCNC(=O)COCC(C)F fa2485bf0de623b0b32ba37b7b11a258 [0,2,0,0,0,0|1,0,0]=3 8461 B12R0.233 CCCCNC(=O)COCC(C)S aa48fba88aeb9924ac67d036b796745c [0,2,0,0,0,0|1,0,0]=3 8462 B12R0.233 CCCCNC(=O)COCC(F)F c3b2b1be1534131d82ee4399619e93cd [0,2,0,0,0,0|2,0,0]=4 8463 B12R0.233 CCCCNC(=O)COC[C@@H](C)F e5bbc52afa5b7c32a78206b15a2a36c5 [0,2,0,0,0,0|1,0,0]=3 8464 B12R0.233 CCCCNC(=O)COC[C@H](C)F deee1bb7185efba3137bf6c375f20aa6 [0,2,0,0,0,0|1,0,0]=3 8465 B12R0.233 CCCCNC(=O)NCCC(C)C 0d4b76b405ba08e28ac6933883b83adf [0,2,0,0,0,0|2,0,0]=4 8466 B12R0.233 CCCCNC(=O)NCCC(C)O 8e5661c4799481cb779586081058d0ed [0,2,0,0,0,0|2,0,0]=4 8467 B12R0.233 CCCCNC(=O)NCCC(F)F e30a16e23c2fe922df1a6255ebcb7c5a [0,2,0,0,0,0|2,0,0]=4 8468 B12R0.233 CCCCNC(=O)NCCN(C)C 01459eb6c81a99c9e0b84c693553a10e [0,2,0,0,0,0|2,0,0]=4 8469 B12R0.233 CCCCNC(=O)NCCS(=O)C 472600e17eb1b057ec64c339cc16dfdd [0,2,0,0,0,0|2,0,0]=4 8470 B12R0.233 CCCCNC(=O)NCC[C@@H](C)O 78144d3107e1577bb145768ea57329e1 [0,2,0,0,0,0|2,0,0]=4 8471 B12R0.233 CCCCNC(=O)NCC[C@H](C)O 28ceddf3670b7e60886667a11de28c9b [0,2,0,0,0,0|2,0,0]=4 8472 B12R0.233 CCCCOC(=O)CNCC(=O)C 1cd03b620c809b35920be409ffaee740 [0,2,0,0,0,0|1,0,1]=4 8473 B12R0.233 CCCCOC(=O)CNCC(C)C 18ee55af0f5e4989b08d6d06dff65834 [0,2,0,0,0,0|1,0,0]=3 8474 B12R0.233 CCCCOC(=O)CNCC(C)O e31095043326ff1f034c6d97b8a36176 [0,2,0,0,0,0|1,0,0]=3 8475 B12R0.233 CCCCOC(=O)CNCC(F)F 55b14be4af9208062487383cfab525f7 [0,2,0,0,0,0|2,0,0]=4 8476 B12R0.233 CCCCOC(=O)CNC[C@@H](C)O a60b467e49e79ebbd8201726798bd9ed [0,2,0,0,0,0|1,0,0]=3 8477 B12R0.233 CCCCOC(=O)CNC[C@H](C)O a3e068166a55bd53eb4370905e132015 [0,2,0,0,0,0|1,0,0]=3 8478 B12R0.233 CCCCOC(=O)COCC(=O)C 879f6758145a709d89fc01d012a61790 [0,2,0,0,0,0|1,0,1]=4 8479 B12R0.233 CCCCOC(=O)COCC(C)C 2b79ec7d20e1e6de673410cca3ca7180 [0,2,0,0,0,0|1,0,0]=3 8480 B12R0.233 CCCCOC(=O)COCC(C)F 2ee0c43a6a4983bfd92aed42ec3ab0ed [0,2,0,0,0,0|1,0,0]=3 8481 B12R0.233 CCCCOC(=O)COCC(C)S fcf8725913a2d8f95bbe8918650f0db6 [0,2,0,0,0,0|1,0,0]=3 8482 B12R0.233 CCCCOC(=O)COCC(F)F bf6b1c5ddbad2344a4858dd413abfdd2 [0,2,0,0,0,0|2,0,0]=4 8483 B12R0.233 CCCCOC(=O)COCN(C)C 53bf82baec54a60b2d682319dd1a3100 [0,2,0,0,0,0|2,0,0]=4 8484 B12R0.233 CCCCOC(=O)COC[C@@H](C)F 5d7105f32b79d1bed23f4cceddf8694b [0,2,0,0,0,0|1,0,0]=3 8485 B12R0.233 CCCCOC(=O)COC[C@H](C)F 1cd3abb55ed43bac78c45e479ae8fabf [0,2,0,0,0,0|1,0,0]=3 8486 B12R0.233 CCCCOC(=O)OCOC(C)C 8cccdd920479090c478f3560e8ca657e [0,2,0,0,0,0|1,0,0]=3 8487 B12R0.233 CCCCOC(C)CCCC(C)C 8330c766083d32e3e679f7fe02d88b09 [0,2,0,0,0,0|1,0,1]=4 8488 B12R0.233 CCCNCC(=O)NCCC(C)C 4c6729a39c4bb8f3b3ed46607e6d781b [0,2,0,0,0,0|2,0,0]=4 8489 B12R0.233 CCCOCC(=O)NCCC(C)C 9f3040ada95e987a25a60d091b7ee155 [0,2,0,0,0,0|1,0,0]=3 8490 B12R0.233 CCCOCC(=O)NCCC(C)O ad3f2c49e83a2bfc5474f1a9c9282295 [0,2,0,0,0,0|1,0,0]=3 8491 B12R0.233 CCCOCC(=O)NCCC(F)F 5ed4f8fb168721b43fd395528f13e5fc [0,2,0,0,0,0|2,0,0]=4 8492 B12R0.233 CCCOCC(=O)NCCN(C)C 5b73d387835cbab7e95d2f805685109f [0,2,0,0,0,0|2,0,0]=4 8493 B12R0.233 CCCOCC(=O)NCCS(=O)C a6cf9a2e2a7c5c4d85cb483a3ca51605 [0,2,0,0,0,0|2,0,0]=4 8494 B12R0.233 CCCOCC(=O)NCC[C@@H](C)O f67869fd04a7f96ae43e9cee97ae3ce9 [0,2,0,0,0,0|1,0,0]=3 8495 B12R0.233 CCCOCC(=O)NCC[C@H](C)O 3118ed4f273c513d65cbac6bef4aaaa6 [0,2,0,0,0,0|1,0,0]=3 8496 B12R0.233 CCCSCC(=O)NCCC(C)C 24e8fe4a60f6ee2d5f4357fbf4c2332c [0,2,0,0,0,0|1,1,0]=4 8497 B12R0.233 CCCSCC(=O)NCCC(C)O e7acda73f9a77b9ebd64703f898404d7 [0,2,0,0,0,0|1,1,0]=4 8498 B12R0.233 CCCSCC(=O)NCCC(F)F 4387f6880cf06c805e3b9353334d1c07 [0,2,0,0,0,0|2,0,0]=4 8499 B12R0.233 CCCSCC(=O)NCCN(C)C 37082b4e15b2e73c5cef553e3cb8d339 [0,2,0,0,0,0|2,0,0]=4 8500 B12R0.233 CCCSCC(=O)NCCS(=O)C ffd99da409ed81bf5bd8cfd3c4d6e3c9 [0,2,0,0,0,0|2,0,0]=4 8501 B12R0.233 CCCSCC(=O)NCC[C@@H](C)O 5ee2981a70455c8b37a5188490b182d0 [0,2,0,0,0,0|1,1,0]=4 8502 B12R0.233 CCCSCC(=O)NCC[C@H](C)O 8ccdfd7fcd9776ac001fa5bd6926bec0 [0,2,0,0,0,0|1,1,0]=4 8503 B12R0.233 CCOC/C=C(\C)/CCCC(C)C a95aa8b84cfed5a75294efb32aaba1c0 [0,2,0,0,0,0|2,0,0]=4 8504 B12R0.233 CCOCCC(=O)NCCC(C)C 6af07abbb3e20b7f03d7eded7e846581 [0,2,0,0,0,0|2,0,0]=4 8505 B12R0.233 CCOCCC(=O)NCCC(C)O 779ea8a6c5cee2c4bcc3f75e8227c326 [0,2,0,0,0,0|2,0,0]=4 8506 B12R0.233 CCOCCC(=O)NCCC(F)F 78de777f886a8b195e09e4cba76bf9f6 [0,2,0,0,0,0|2,0,0]=4 8507 B12R0.233 CCOCCC(=O)NCCN(C)C 093e35c33373fd7ed9b08e781c5fcca9 [0,2,0,0,0,0|2,0,0]=4 8508 B12R0.233 CCOCCC(=O)NCCS(=O)C f9f2276920449153edd36c47abe8b5ac [0,2,0,0,0,0|2,0,0]=4 8509 B12R0.233 CCOCCC(=O)NCC[C@@H](C)O 85b3309015541d5b28d97b3336b92e63 [0,2,0,0,0,0|2,0,0]=4 8510 B12R0.233 CCOCCC(=O)NCC[C@H](C)O f8b2075d522488f08aa96a4c8ca0af72 [0,2,0,0,0,0|2,0,0]=4 8511 B12R0.233 CCSCCC(=O)NCCC(C)C 213cc1d924c0e9194a1330d78bd891fe [0,2,0,0,0,0|2,0,0]=4 8512 B12R0.233 CCSCCC(=O)NCCC(C)O e40ab069d458728608bb81d31c928380 [0,2,0,0,0,0|2,0,0]=4 8513 B12R0.233 CCSCCC(=O)NCCC(F)F 340b983db4e594bdb53d45bdc8deb82f [0,2,0,0,0,0|2,0,0]=4 8514 B12R0.233 CCSCCC(=O)NCCN(C)C 51153a982401114700fd3edeb26be517 [0,2,0,0,0,0|2,0,0]=4 8515 B12R0.233 CCSCCC(=O)NCCS(=O)C 5cbe373265844f61562fbe349215532b [0,2,0,0,0,0|2,0,0]=4 8516 B12R0.233 CCSCCC(=O)NCC[C@@H](C)O 4768ec63e576cb2a1eb46363ab96bf4a [0,2,0,0,0,0|2,0,0]=4 8517 B12R0.233 CCSCCC(=O)NCC[C@H](C)O f4db411571c27ae32e6b108f445ccd38 [0,2,0,0,0,0|2,0,0]=4 8518 B12R0.233 CN(C)CCCC(=O)NCCCCl 229fdfd35f0b70238a9735542b09a5e3 [0,2,0,0,0,0|2,0,0]=4 8519 B12R0.233 CN(C)CCCC(=O)NCCCO 235109ebfde1185be6cc0d75efff4e33 [0,2,0,0,0,0|2,0,0]=4 8520 B12R0.233 CN(C)CCNC(=O)CCCCF 941ca64a37f51e3539ea672958bb567f [0,2,0,0,0,0|2,0,0]=4 8521 B12R0.233 CN(C)CCNC(=O)CCCCO df12d993f13cefcf259f0f88261928fe [0,2,0,0,0,0|2,0,0]=4 8522 B12R0.233 CN(C)CCNC(=O)CCCCS 3f78cfe1d94635f1543a87c00893408d [0,2,0,0,0,0|2,0,0]=4 8523 B12R0.233 COCCCC(=O)NCCC(C)C 073e9422ca46ccf64126e3e1f16edd8c [0,2,0,0,0,0|2,0,0]=4 8524 B12R0.233 COCCCC(=O)NCCC(C)O 1a8949da1b7f88ba3660bfd31df0701d [0,2,0,0,0,0|2,0,0]=4 8525 B12R0.233 COCCCC(=O)NCCC(F)F 5022613498c5184ddfd3da06e9d797b3 [0,2,0,0,0,0|2,0,0]=4 8526 B12R0.233 COCCCC(=O)NCCN(C)C 6aa830f37aa664fafe70f78ced0e14c4 [0,2,0,0,0,0|2,0,0]=4 8527 B12R0.233 COCCCC(=O)NCCS(=O)C 0c414090669fb73f4476b0193ef04c7e [0,2,0,0,0,0|2,0,0]=4 8528 B12R0.233 COCCCC(=O)NCC[C@@H](C)O 1a0fa5cb47deb2c60cd05f6fc65bbe16 [0,2,0,0,0,0|2,0,0]=4 8529 B12R0.233 COCCCC(=O)NCC[C@H](C)O c806fc4dc7aeeb15c88bc45bbac897d3 [0,2,0,0,0,0|2,0,0]=4 8530 B12R0.233 COCCNC(=O)CCCC(=O)C a5eebd38795fe25014a1c179cf05c363 [0,2,0,0,0,0|1,0,1]=4 8531 B12R0.233 COCCNC(=O)CCCC(C)C 9d5331a5406a618142dafc16193236d4 [0,2,0,0,0,0|1,0,0]=3 8532 B12R0.233 COCCNC(=O)CCCN(C)C 9c9d9db952095f01ae83d77eb731cf54 [0,2,0,0,0,0|2,0,0]=4 8533 B12R0.233 COCCNC(=O)CCOC(C)C 80f101909398e7626269cb015383dd5b [0,2,0,0,0,0|2,0,0]=4 8534 B12R0.233 COCCNC(=O)CCSC(C)C 982e62334da99cc5162b0a575e83130a [0,2,0,0,0,0|2,0,0]=4 8535 B12R0.233 COCCNC(=O)CNCC(C)C 72150697976b4e4bf442cc2c6b5f232f [0,2,0,0,0,0|2,0,0]=4 8536 B12R0.233 COCCNC(=O)CNCC(C)O 51e1ce1b6b93d3e933c79c4bdf578504 [0,2,0,0,0,0|2,0,0]=4 8537 B12R0.233 COCCNC(=O)CNC[C@@H](C)O af9ed96c09ca13e0ac6b256dee61e7fb [0,2,0,0,0,0|2,0,0]=4 8538 B12R0.233 COCCNC(=O)CNC[C@H](C)O 3f105d81e848946d6dfca4ba24195304 [0,2,0,0,0,0|2,0,0]=4 8539 B12R0.233 COCCNC(=O)COCC(C)C 8b7b5c34925bcf19d3d69f004d956045 [0,2,0,0,0,0|2,0,0]=4 8540 B12R0.233 COCCNC(=O)COCC(C)F dd48cc953e7962b3fba673930976cf68 [0,2,0,0,0,0|2,0,0]=4 8541 B12R0.233 COCCNC(=O)COCC(C)S 1cea8729e7092ed9eaffeeb2e43fb1ee [0,2,0,0,0,0|2,0,0]=4 8542 B12R0.233 COCCNC(=O)COC[C@@H](C)F de0dc3a3d62097de2b91925481aeb80b [0,2,0,0,0,0|2,0,0]=4 8543 B12R0.233 COCCNC(=O)COC[C@H](C)F 40215f8e6e76c75b2f724b32be7ae734 [0,2,0,0,0,0|2,0,0]=4 8544 B12R0.233 COCCNC(=O)NCCC(C)C 9a87504c4fb83966f8b36a2c5b2fa6b8 [0,2,0,0,0,0|2,0,0]=4 8545 B12R0.233 COCCNC(=O)NCCC(C)O 82318fa6658e7173a0ba1fbed55b825d [0,2,0,0,0,0|2,0,0]=4 8546 B12R0.233 COCCNC(=O)NCC[C@@H](C)O 1b99a3565376f15dbdd23d55fe3b94e0 [0,2,0,0,0,0|2,0,0]=4 8547 B12R0.233 COCCNC(=O)NCC[C@H](C)O 45822785e2a487967a1f97c3f7ff7e41 [0,2,0,0,0,0|2,0,0]=4 8548 B12R0.233 COCCOC(=O)CNCC(=O)C 1cf6db21a5296230385f08ed0cda6752 [0,2,0,0,0,0|1,0,1]=4 8549 B12R0.233 COCCOC(=O)CNCC(C)C 5e0b6daf7642b58115ffa12751e9a31e [0,2,0,0,0,0|1,0,0]=3 8550 B12R0.233 COCCOC(=O)CNCC(C)O 403ccb8bc21f1e4a21cdd0d93bea22b6 [0,2,0,0,0,0|1,0,0]=3 8551 B12R0.233 COCCOC(=O)CNCC(F)F 41852b2b361eaae939ec87f04c09bbd4 [0,2,0,0,0,0|2,0,0]=4 8552 B12R0.233 COCCOC(=O)CNC[C@@H](C)O 6e997708311c132bad15731479d47ffe [0,2,0,0,0,0|1,0,0]=3 8553 B12R0.233 COCCOC(=O)CNC[C@H](C)O 6cba00acf94b88dfc82734a0a0afb4d3 [0,2,0,0,0,0|1,0,0]=3 8554 B12R0.233 COCCOC(=O)COCC(=O)C cf5fb8dab507083a8249b1fcb4f193de [0,2,0,0,0,0|1,0,1]=4 8555 B12R0.233 COCCOC(=O)COCC(C)C d5c7c21f859ca32c21d012b34200fbe4 [0,2,0,0,0,0|1,0,0]=3 8556 B12R0.233 COCCOC(=O)COCC(C)F 48adb5d99162bd90ab9331d35d5fba4c [0,2,0,0,0,0|1,0,0]=3 8557 B12R0.233 COCCOC(=O)COCC(C)S 471a8d713cddec73eac1027061c44215 [0,2,0,0,0,0|1,0,0]=3 8558 B12R0.233 COCCOC(=O)COCC(F)F 34b4103ff72d49c21cd18d5e77410d55 [0,2,0,0,0,0|2,0,0]=4 8559 B12R0.233 COCCOC(=O)COC[C@@H](C)F bf041f617d557f15ac1f80e7d2926df7 [0,2,0,0,0,0|1,0,0]=3 8560 B12R0.233 COCCOC(=O)COC[C@H](C)F d9cd8f6e5105182d0e5f793412ef7a08 [0,2,0,0,0,0|1,0,0]=3 8561 B12R0.233 COCCOC(C)CCCC(C)C 0d929250b6a3b88298d262b55ebd048b [0,2,0,0,0,0|1,0,1]=4 8562 B12R0.233 COCOCC(=O)NCCC(C)C 8a944cf1bb4d0676b2b634cfb6e0dc69 [0,2,0,0,0,0|2,0,0]=4 8563 B12R0.233 CS(=O)CCNC(=O)CCCCF 574a5f64db9b8a4bb7f714ca9703db06 [0,2,0,0,0,0|2,0,0]=4 8564 B12R0.233 CS(=O)CCNC(=O)CCCCO 9b57e7b1db8429a52f9ed0ef970fb319 [0,2,0,0,0,0|2,0,0]=4 8565 B12R0.233 CS(=O)CCNC(=O)CCCCS 9932e6c6d67a721c0a1fcce248b064bf [0,2,0,0,0,0|2,0,0]=4 8566 B12R0.233 CSCCCC(=O)NCCC(C)C 4b5d5b3409ce52118b06bb4af80cc6f1 [0,2,0,0,0,0|2,0,0]=4 8567 B12R0.233 CSCCCC(=O)NCCC(C)O de6ff54ef59b83861bf253a1578b5980 [0,2,0,0,0,0|2,0,0]=4 8568 B12R0.233 CSCCCC(=O)NCCC(F)F 2e3ef159268498dcc501e9282919f2be [0,2,0,0,0,0|2,0,0]=4 8569 B12R0.233 CSCCCC(=O)NCCN(C)C d44178e5171040d08863d901947b2d19 [0,2,0,0,0,0|2,0,0]=4 8570 B12R0.233 CSCCCC(=O)NCCS(=O)C 2e379896ee7d2e7f590ad11b185fcf9e [0,2,0,0,0,0|2,0,0]=4 8571 B12R0.233 CSCCCC(=O)NCC[C@@H](C)O 45e436cbb52e40656a978a83fb7ce47b [0,2,0,0,0,0|2,0,0]=4 8572 B12R0.233 CSCCCC(=O)NCC[C@H](C)O e16c879f2c235e4d9cf5d14b16b4ffd9 [0,2,0,0,0,0|2,0,0]=4 8573 B12R0.233 CSCCNC(=O)CCCC(=O)C d3863d12e934e01f32f92222df461e3a [0,2,0,0,0,0|1,0,1]=4 8574 B12R0.233 CSCCNC(=O)CCCC(C)C a0e2d6a236574048a00b2020e11c8f86 [0,2,0,0,0,0|1,0,0]=3 8575 B12R0.233 CSCCNC(=O)CCCN(C)C d5a24f0713c6e0f8e9235b6e97079e20 [0,2,0,0,0,0|2,0,0]=4 8576 B12R0.233 CSCCNC(=O)CCOC(C)C e33f893c76a4cf057d5db0baf9cc5c88 [0,2,0,0,0,0|2,0,0]=4 8577 B12R0.233 CSCCNC(=O)CCSC(C)C 1c6460e8fb2946300403040e113603aa [0,2,0,0,0,0|2,0,0]=4 8578 B12R0.233 CSCCNC(=O)COCC(C)C 0270ba33bdc323a42eade3deba5252a3 [0,2,0,0,0,0|2,0,0]=4 8579 B12R0.233 CSCCNC(=O)NCCC(C)C b0c1104c39c5c76f238018dfe7214498 [0,2,0,0,0,0|2,0,0]=4 8580 B12R0.233 CSCCNC(=O)NCCC(C)O 2923a10681a4285100a63a6e7903947a [0,2,0,0,0,0|2,0,0]=4 8581 B12R0.233 CSCCNC(=O)NCC[C@@H](C)O acbf1f05eae44ef48818f2fe7d7c51fc [0,2,0,0,0,0|2,0,0]=4 8582 B12R0.233 CSCCNC(=O)NCC[C@H](C)O db62c43310d694df02a67e3f2e036c91 [0,2,0,0,0,0|2,0,0]=4 8583 B12R0.233 CSCCOC(C)CCCC(C)C 3b3465352ddef3e4e18da56287391d23 [0,2,0,0,0,0|1,0,1]=4 8584 B12R0.233 C[C@@H](O)CCNC(=O)CCCCF 052111f53ea44694adf27c25f96fb287 [0,2,0,0,0,0|2,0,0]=4 8585 B12R0.233 C[C@@H](O)CCNC(=O)CCCCO 57c70db0a9df69fc17d68739b1e8fc90 [0,2,0,0,0,0|2,0,0]=4 8586 B12R0.233 C[C@@H](O)CCNC(=O)CCCCS 5d49fbeb2ff588cb9bd569051128c5e5 [0,2,0,0,0,0|2,0,0]=4 8587 B12R0.233 C[C@@H](O)CCNC(=O)COCCO 3389f035a8030a3564ba544ce6293ee3 [0,2,0,0,0,0|2,0,0]=4 8588 B12R0.233 C[C@@H](O)CCNC(=O)COCCS 7d21fc08ace771c5ea27119222d2846c [0,2,0,0,0,0|2,0,0]=4 8589 B12R0.233 C[C@@H](O)CCNC(=O)NCCCN 24d205ae1506a5f5365ccd07085641ef [0,2,0,0,0,0|2,0,0]=4 8590 B12R0.233 C[C@@H](O)CCNC(=O)NCCCO 0089ca314d468a9f1a4e898c848f81e4 [0,2,0,0,0,0|2,0,0]=4 8591 B12R0.233 C[C@H](O)CCNC(=O)CCCCF 137bc9fb5f9f424b50bc64cd96c2f069 [0,2,0,0,0,0|2,0,0]=4 8592 B12R0.233 C[C@H](O)CCNC(=O)CCCCO 3b9dc55dd1087997e2b6aa917b2c78d9 [0,2,0,0,0,0|2,0,0]=4 8593 B12R0.233 C[C@H](O)CCNC(=O)CCCCS 53973a03515d1da5c3a3a7a033c533d0 [0,2,0,0,0,0|2,0,0]=4 8594 B12R0.233 C[C@H](O)CCNC(=O)COCCO d693f5a35a2c67162de7502dfc5336f8 [0,2,0,0,0,0|2,0,0]=4 8595 B12R0.233 C[C@H](O)CCNC(=O)COCCS 5ba008ba1e78a3a0f4b409f1dfb672f4 [0,2,0,0,0,0|2,0,0]=4 8596 B12R0.233 C[C@H](O)CCNC(=O)NCCCN 555f01fd8b74762d9fc3f3c706ccc2ba [0,2,0,0,0,0|2,0,0]=4 8597 B12R0.233 C[C@H](O)CCNC(=O)NCCCO 987b69e5424b1a055a5a319f56eb8479 [0,2,0,0,0,0|2,0,0]=4 8598 B12R0.233 O=C(CCCCF)NCCC(F)F 32483bf5ecb240053a7872bb0198c68b [0,2,0,0,0,0|2,0,0]=4 8599 B12R0.233 O=C(CCCCO)NCCC(F)F 91daf0cc9056e974f0cf0f3b7489ad31 [0,2,0,0,0,0|2,0,0]=4 8600 B12R0.233 O=C(CCCCS)NCCC(F)F 3a245f94499a15d8825d2273653e5b08 [0,2,0,0,0,0|2,0,0]=4 8601 B12R0.54 C=C(C)CCCC(=O)N(C)CCC 4acd4a32b396930a99f1f73dd3ed2618 [0,2,0,0,0,0|1,0,1]=4 8602 B12R0.54 C=C(CCC)C(=O)NCCC(C)C 802d3ad2a6d5a944a22f414f9c7fbf8d [0,2,0,0,0,0|2,0,0]=4 8603 B12R0.54 C=C(CCC)C(=O)NCCC(C)O e62d5476727756c30fccd0ede6afcb78 [0,2,0,0,0,0|2,0,0]=4 8604 B12R0.54 C=C(CCC)C(=O)NCC[C@@H](C)O a3f70310d941077ca059af18cedfb89f [0,2,0,0,0,0|2,0,0]=4 8605 B12R0.54 C=C(CCC)C(=O)NCC[C@H](C)O 51a328e0fc8fff2ed9ef6c4b63d33ae3 [0,2,0,0,0,0|2,0,0]=4 8606 B12R0.54 CC(C)CCCC(=O)N(C)CCF fb3d54940b4c389da73b82b42e1d2490 [0,2,0,0,0,0|2,0,0]=4 8607 B12R0.54 CC(C)CCCC(=O)N(C)CCO 437617ff3acc32cb61ee55e4e7064d26 [0,2,0,0,0,0|2,0,0]=4 8608 B12R0.54 CCCC(=O)C(=O)NCCC(C)C 80c117f31127e42888087206a3f6ae55 [0,2,0,0,0,0|2,0,0]=4 8609 B12R0.54 CCCC(=O)C(=O)NCCC(C)O 322acc277823e80a025934f322d5a776 [0,2,0,0,0,0|2,0,0]=4 8610 B12R0.54 CCCC(=O)C(=O)NCC[C@@H](C)O 59793354d079ffec2c6c471c19d46857 [0,2,0,0,0,0|2,0,0]=4 8611 B12R0.54 CCCC(=O)C(=O)NCC[C@H](C)O bbef738340f5e10d3ade96583fef06a3 [0,2,0,0,0,0|2,0,0]=4 8612 B12R0.54 CCCC(O)C(=O)NCCC(C)C f2d02d2d825d49c666f1a4abfcbed112 [0,2,0,0,0,0|2,0,0]=4 8613 B12R0.54 CCCC(O)C(=O)NCCC(C)O 87018bd8b861d7348f996938b9b89177 [0,2,0,0,0,0|2,0,0]=4 8614 B12R0.54 CCCC(O)C(=O)NCC[C@@H](C)O dd48c41a2334b3ffc8a9b3e0800e92dc [0,2,0,0,0,0|2,0,0]=4 8615 B12R0.54 CCCC(O)C(=O)NCC[C@H](C)O 4b7026c52c08cde35814eaddf0eb13f3 [0,2,0,0,0,0|2,0,0]=4 8616 B12R0.54 CCCN(C)C(=O)CCCC(=O)C 110ca339fe363eb5ba23534a9c4db215 [0,2,0,0,0,0|1,0,1]=4 8617 B12R0.54 CCCN(C)C(=O)CCCC(C)C 9f1bd75c5da7ff4fcf8ca006a381019b [0,2,0,0,0,0|1,0,0]=3 8618 B12R0.54 CCCN(C)C(=O)CCCN(C)C 86f982f36ebac1798df074baa1a5a993 [0,2,0,0,0,0|2,0,0]=4 8619 B12R0.54 CCCN(C)C(=O)CCOC(C)C 7680164da1b49e71f7d871269f86a00e [0,2,0,0,0,0|2,0,0]=4 8620 B12R0.54 CCCN(C)C(=O)CCSC(C)C b02aebfccee7625fcbd1dada43e762b8 [0,2,0,0,0,0|2,0,0]=4 8621 B12R0.54 CCCN(C)C(=O)COCC(C)C e5e1111a4e0f07da8c7f7628f9388ecc [0,2,0,0,0,0|2,0,0]=4 8622 B12R0.54 CCCN(C)C(=O)NCCC(C)C beca23cdbbef970d9ee4ca78170ab045 [0,2,0,0,0,0|2,0,0]=4 8623 B12R0.54 CCCN(C)C(=O)NCCC(C)O b936686ecc8c9f37ed4db30156620b2f [0,2,0,0,0,0|2,0,0]=4 8624 B12R0.54 CCCN(C)C(=O)NCC[C@@H](C)O f32d76f2865113dcf791640217348e3f [0,2,0,0,0,0|2,0,0]=4 8625 B12R0.54 CCCN(C)C(=O)NCC[C@H](C)O c7999f18caa8ca5d4184a42abaee2539 [0,2,0,0,0,0|2,0,0]=4 8626 B12R0.54 CCC[C@@H](O)C(=O)NCCC(C)C 9c673a06526fa517f0310e50cafeb4bf [0,2,0,0,0,0|2,0,0]=4 8627 B12R0.54 CCC[C@@H](O)C(=O)NCCC(C)O 9da071f18dc226d0c5b9907a138981e9 [0,2,0,0,0,0|2,0,0]=4 8628 B12R0.54 CCC[C@@H](O)C(=O)NCC[C@@H](C)O c568ccecd60447b60714df037b60c5ae [0,2,0,0,0,0|2,0,0]=4 8629 B12R0.54 CCC[C@@H](O)C(=O)NCC[C@H](C)O 814b7202bd6b9b81ee15f57703f132e5 [0,2,0,0,0,0|2,0,0]=4 8630 B12R0.54 CCC[C@H](O)C(=O)NCCC(C)C ed15419f6f3b12e1d4f0b54dab135aa6 [0,2,0,0,0,0|2,0,0]=4 8631 B12R0.54 CCC[C@H](O)C(=O)NCCC(C)O ced5139f93f34f61d47458deb9d3e47e [0,2,0,0,0,0|2,0,0]=4 8632 B12R0.54 CCC[C@H](O)C(=O)NCC[C@@H](C)O a4f75185870f6008b9a4a12c3d73a7d9 [0,2,0,0,0,0|2,0,0]=4 8633 B12R0.54 CCC[C@H](O)C(=O)NCC[C@H](C)O 7d4a1f600901513edfc09cb1db6a22f3 [0,2,0,0,0,0|2,0,0]=4 8634 B12R0.104 CC(C)(C)CCCC(=O)NCCBr d0d84f78162bfd1f35bc7a8dc5b0a8e4 [0,2,0,0,0,0|2,0,0]=4 8635 B12R0.104 CC(C)(C)CCCC(=O)NCCF 1194996d7efb992d46006ae533e2b436 [0,2,0,0,0,0|2,0,0]=4 8636 B12R0.104 CC(C)(C)CCCC(=O)NCCI 4e707dc822d043271e435a37e4829eeb [0,2,0,0,0,0|2,0,0]=4 8637 B12R0.104 CC(C)(C)CCCC(=O)NCCO f976ce60815705cf2f6974b61b557c72 [0,2,0,0,0,0|2,0,0]=4 8638 B12R0.104 CC(C)(C)CCCC(=O)NCCS c1f03c6bd2e84e48ee5a14fb358c7edc [0,2,0,0,0,0|2,0,0]=4 8639 B12R0.104 CCCCC(=O)NCCC(C)(C)C 8e6dffd29741883ce8f4dcb95c8d277f [0,2,0,0,0,0|2,0,0]=4 8640 B12R0.104 CCCCC(=O)NCCC(C)(C)F ad9ee3259e036e8ad00b63393992966b [0,2,0,0,0,0|2,0,0]=4 8641 B12R0.104 CCCCC(=O)NCCC(C)(C)O d05e834bc82331bd296007c9a6bcc3b7 [0,2,0,0,0,0|2,0,0]=4 8642 B12R0.104 CCCNC(=O)CCCC(C)(C)C 73d9549b08b5df5c2e137a54b93119cd [0,2,0,0,0,0|1,0,0]=3 8643 B12R0.104 CCCNC(=O)CCCC(F)(F)F 1d2530be4389cea1c271bb8eb17b1003 [0,2,0,0,0,0|2,0,0]=4 8644 B12R0.104 CCCNC(=O)CCCS(=O)(=O)C 51ec45eedb5ed126d2bb2a1b1e69e492 [0,2,0,0,0,0|2,0,0]=4 8645 B12R0.104 CCCNC(=O)CCOC(C)(C)C cad11008a1c3f28438cf17c7db49f857 [0,2,0,0,0,0|2,0,0]=4 8646 B12R0.104 CCCNC(=O)CNCC(C)(C)C 41b48602543bcfa31b81179d52584b38 [0,2,0,0,0,0|2,0,0]=4 8647 B12R0.104 CCCNC(=O)CNCC(C)(C)F 544af66e43eaec1132a109f61a820949 [0,2,0,0,0,0|2,0,0]=4 8648 B12R0.104 CCCNC(=O)CNCC(C)(C)O a744314275aa09f5443e69b90424c37a [0,2,0,0,0,0|2,0,0]=4 8649 B12R0.104 CCCNC(=O)CNCC(C)(F)F 14780c6fd5793b16c1e927ed61b1b9f8 [0,2,0,0,0,0|2,0,0]=4 8650 B12R0.104 CCCNC(=O)COCC(C)(C)Br 4a935745fbf5ad8c1c1b52f749c97551 [0,2,0,0,0,0|2,0,0]=4 8651 B12R0.104 CCCNC(=O)COCC(C)(C)C 90173d95aadc4448bb9fc935c98fb2fb [0,2,0,0,0,0|2,0,0]=4 8652 B12R0.104 CCCNC(=O)COCC(C)(C)F de7db411763303cd701db63e107a5df6 [0,2,0,0,0,0|2,0,0]=4 8653 B12R0.104 CCCNC(=O)COCC(C)(C)S f81a7beb7406a70c0391aea52130e052 [0,2,0,0,0,0|2,0,0]=4 8654 B12R0.104 CCCNC(=O)NCCC(C)(C)C c3faaf72158c59335ad13b13f99fa87e [0,2,0,0,0,0|2,0,0]=4 8655 B12R0.104 CCCNC(=O)NCCC(C)(C)F 98ffb628fe3649fd60d244d14bc74712 [0,2,0,0,0,0|2,0,0]=4 8656 B12R0.104 CCCNC(=O)NCCC(C)(C)O 484e2eab6624695368aacfce57280b06 [0,2,0,0,0,0|2,0,0]=4 8657 B12R0.104 CCCOC(=O)CNCC(C)(C)C 128ef33e258e1bf5b298ecc7ccdc2b5b [0,2,0,0,0,0|1,0,0]=3 8658 B12R0.104 CCCOC(=O)CNCC(C)(C)O e67b6a882ba6b1973e686afcec640dd5 [0,2,0,0,0,0|1,0,0]=3 8659 B12R0.104 CCCOC(=O)CNCC(C)(F)F 8f1b5a9d40dacb2ee70e15bea8038c7f [0,2,0,0,0,0|1,0,0]=3 8660 B12R0.104 CCCOC(=O)CNCC(F)(F)F e15e33081a7436ff4457c4f1ea8377a9 [0,2,0,0,0,0|2,0,0]=4 8661 B12R0.104 CCCOC(=O)COCC(C)(C)Br 92741a9edf60ff82f181fb66ef1fa177 [0,2,0,0,0,0|1,0,0]=3 8662 B12R0.104 CCCOC(=O)COCC(C)(C)C be1017212be04f93d4e997a4ca85c53b [0,2,0,0,0,0|1,0,0]=3 8663 B12R0.104 CCCOC(=O)COCC(C)(C)F 40279b9787ff40a1e1f3e56e517fa853 [0,2,0,0,0,0|1,0,0]=3 8664 B12R0.104 CCCOC(=O)COCC(C)(C)S 9d942e26619578c338cde1e522e1a28f [0,2,0,0,0,0|1,0,0]=3 8665 B12R0.104 CCCOC(=O)COCC(C)(F)F c9a231cbdc74065b1bb1ea46da08f3f7 [0,2,0,0,0,0|1,0,0]=3 8666 B12R0.104 CCCOC(=O)COCC(F)(F)Br 30ad8630e1fa79671ffca0ff276e533e [0,2,0,0,0,0|2,0,0]=4 8667 B12R0.104 CCCOC(=O)COCC(F)(F)Cl 561b663be68d2144a20be46a4c973e72 [0,2,0,0,0,0|2,0,0]=4 8668 B12R0.104 CCCOC(=O)COCC(F)(F)F d8d5900ba96edc22654045ef0ac4ff7b [0,2,0,0,0,0|2,0,0]=4 8669 B12R0.104 CCCOC(=O)OCNC(C)(C)C ac614d6a665c5df24f0bccb149ff7946 [0,2,0,0,0,0|2,0,0]=4 8670 B12R0.240 C=C(C)CCCC(=O)NC(C)CC 35a4123c9c80ac7e4c0b151eb3ad6cdd [0,2,0,0,0,0|1,0,1]=4 8671 B12R0.240 C=C(C)CCCC(=O)N[C@@H](C)CC d6c8724e6b49ecc8dc6d8f8415f762f8 [0,2,0,0,0,0|1,0,1]=4 8672 B12R0.240 C=C(C)CCCC(=O)N[C@H](C)CC db6197de01e93c4a7c18ce469598afcb [0,2,0,0,0,0|1,0,1]=4 8673 B12R0.240 CC(C)CCCC(=O)NC(C)CO a2867e5ed5c6e38db650991d0339abb8 [0,2,0,0,0,0|2,0,0]=4 8674 B12R0.240 CC(C)CCCC(=O)N[C@@H](C)CO 50388998668d54f3657788b227125fef [0,2,0,0,0,0|2,0,0]=4 8675 B12R0.240 CC(C)CCCC(=O)N[C@H](C)CO cc87491e24f2a747410decb13ec26f8d [0,2,0,0,0,0|2,0,0]=4 8676 B12R0.240 CCC(C)CC(=O)NCCC(C)C 363bda787c82e38430cdfd6160c0f37e [0,2,0,0,0,0|2,0,0]=4 8677 B12R0.240 CCC(C)CC(=O)NCCC(C)O 9de94fd5da7247ce856de18bddca6091 [0,2,0,0,0,0|2,0,0]=4 8678 B12R0.240 CCC(C)CC(=O)NCC[C@@H](C)O 88505b086f5387a5d298be7629a22a6c [0,2,0,0,0,0|2,0,0]=4 8679 B12R0.240 CCC(C)CC(=O)NCC[C@H](C)O 07809e0f3ce2ecf820c0d6f907a6ffa7 [0,2,0,0,0,0|2,0,0]=4 8680 B12R0.240 CCC(C)NC(=O)CCCC(=O)C 88969783bb5751b2d6438d5187fbe00d [0,2,0,0,0,0|1,0,1]=4 8681 B12R0.240 CCC(C)NC(=O)CCCC(C)C 5c46b9abd8d3c4690183e064e8d2b8e4 [0,2,0,0,0,0|1,0,0]=3 8682 B12R0.240 CCC(C)NC(=O)CCCN(C)C a6620823235620316972406c900bf87a [0,2,0,0,0,0|2,0,0]=4 8683 B12R0.240 CCC(C)NC(=O)CCOC(C)C 14b3863ce31433ca1c343271ff126364 [0,2,0,0,0,0|2,0,0]=4 8684 B12R0.240 CCC(C)NC(=O)CCSC(C)C b1b72d73739d53a939faca77fb36448a [0,2,0,0,0,0|2,0,0]=4 8685 B12R0.240 CCC(C)NC(=O)CNCC(C)C 85f54c0151248ae1ead4dbdc7d10b147 [0,2,0,0,0,0|2,0,0]=4 8686 B12R0.240 CCC(C)NC(=O)CNCC(C)O 791e53aea9f30cae2af287cf2c1c52da [0,2,0,0,0,0|2,0,0]=4 8687 B12R0.240 CCC(C)NC(=O)CNC[C@@H](C)O c644760c361554c60f7c9ff672d6a319 [0,2,0,0,0,0|2,0,0]=4 8688 B12R0.240 CCC(C)NC(=O)CNC[C@H](C)O 5dddb96d08f1bf2cc5819328407bcd6e [0,2,0,0,0,0|2,0,0]=4 8689 B12R0.240 CCC(C)NC(=O)COCC(C)C 0ab975a2bfe7c41148d266841418aea9 [0,2,0,0,0,0|2,0,0]=4 8690 B12R0.240 CCC(C)NC(=O)COCC(C)F 605541e6527041b64feeb2bba8b00578 [0,2,0,0,0,0|2,0,0]=4 8691 B12R0.240 CCC(C)NC(=O)COCC(C)S 05c8dd063e4b76d35ea5a5665ebfbbe0 [0,2,0,0,0,0|2,0,0]=4 8692 B12R0.240 CCC(C)NC(=O)COC[C@@H](C)F 1405aef277575a1fe8ec98adba98d0ae [0,2,0,0,0,0|2,0,0]=4 8693 B12R0.240 CCC(C)NC(=O)COC[C@H](C)F 2a75bc51f2045076a1094336120aa635 [0,2,0,0,0,0|2,0,0]=4 8694 B12R0.240 CCC(C)NC(=O)NCCC(C)C 5919fb302c77d5f6608ba62015c189ea [0,2,0,0,0,0|2,0,0]=4 8695 B12R0.240 CCC(C)NC(=O)NCCC(C)O 31e1705dbf8a6ef0d71d772a28771bac [0,2,0,0,0,0|2,0,0]=4 8696 B12R0.240 CCC(C)NC(=O)NCC[C@@H](C)O b95e358520d96a1760f512aa7b3f2e9d [0,2,0,0,0,0|2,0,0]=4 8697 B12R0.240 CCC(C)NC(=O)NCC[C@H](C)O 7b89e72aa97c83df0aef9906f7200829 [0,2,0,0,0,0|2,0,0]=4 8698 B12R0.240 CCC(C)OC(C)CCCC(C)C fdfd07291790588431bf9218df66c79a [0,2,0,0,0,0|1,0,1]=4 8699 B12R0.240 CCC(O)CC(=O)NCCC(C)C b746bd521fdd2410c17fa7d5142f9e38 [0,2,0,0,0,0|2,0,0]=4 8700 B12R0.240 CCC(O)CC(=O)NCCC(C)O a71af93adfd5223bfe2fde72c146dce3 [0,2,0,0,0,0|2,0,0]=4 8701 B12R0.240 CCC(O)CC(=O)NCC[C@@H](C)O 6af42266caf10b83541a853d8b8b81a5 [0,2,0,0,0,0|2,0,0]=4 8702 B12R0.240 CCC(O)CC(=O)NCC[C@H](C)O 7c2437afb158cab90cd865d21e1afa88 [0,2,0,0,0,0|2,0,0]=4 8703 B12R0.240 CC[C@@H](C)CC(=O)NCCC(C)C 618d21b3322573c1759a22f456d76b1e [0,2,0,0,0,0|2,0,0]=4 8704 B12R0.240 CC[C@@H](C)CC(=O)NCCC(C)O c7b6b03a0cf1b1b4e0140180e9fb10e2 [0,2,0,0,0,0|2,0,0]=4 8705 B12R0.240 CC[C@@H](C)CC(=O)NCC[C@@H](C)O eff9a8273fada80307f89a80acbea2f8 [0,2,0,0,0,0|2,0,0]=4 8706 B12R0.240 CC[C@@H](C)CC(=O)NCC[C@H](C)O 0f5a4e74ddcdd2acb8168d7f0e8d23c0 [0,2,0,0,0,0|2,0,0]=4 8707 B12R0.240 CC[C@@H](C)NC(=O)CCCC(=O)C c4ea54d394fced82e1338df9f01cf273 [0,2,0,0,0,0|1,0,1]=4 8708 B12R0.240 CC[C@@H](C)NC(=O)CCCC(C)C 3d09344d4f3bc5a989940e29f130f2a5 [0,2,0,0,0,0|1,0,0]=3 8709 B12R0.240 CC[C@@H](C)NC(=O)CCCN(C)C 8ed71e8449eeaf9d9d4521eb09352fe3 [0,2,0,0,0,0|2,0,0]=4 8710 B12R0.240 CC[C@@H](C)NC(=O)CCOC(C)C f7a892c446162378a3d0c2b8b73633e0 [0,2,0,0,0,0|2,0,0]=4 8711 B12R0.240 CC[C@@H](C)NC(=O)CCSC(C)C c50671af67f464a973c3173432b17b56 [0,2,0,0,0,0|2,0,0]=4 8712 B12R0.240 CC[C@@H](C)NC(=O)COCC(C)C 43d0efd3b63cbed82930eb485916fe7d [0,2,0,0,0,0|2,0,0]=4 8713 B12R0.240 CC[C@@H](C)NC(=O)NCCC(C)C 546a53c737437564793bc27bcec9aeaa [0,2,0,0,0,0|2,0,0]=4 8714 B12R0.240 CC[C@@H](C)NC(=O)NCCC(C)O 9f0e55b4916c3aaf1f02de12d67f7a0f [0,2,0,0,0,0|2,0,0]=4 8715 B12R0.240 CC[C@@H](C)NC(=O)NCC[C@@H](C)O 446c0938b47bc8c2aec8b9d0b67e89ea [0,2,0,0,0,0|2,0,0]=4 8716 B12R0.240 CC[C@@H](C)NC(=O)NCC[C@H](C)O dcacaefb6a06fb61af835eb2d7c886a2 [0,2,0,0,0,0|2,0,0]=4 8717 B12R0.240 CC[C@@H](O)CC(=O)NCCC(C)C 4d980c4b8e69e63f6e97f4e9832f3008 [0,2,0,0,0,0|2,0,0]=4 8718 B12R0.240 CC[C@@H](O)CC(=O)NCCC(C)O fd67caeb7a5ae1151ca7005fb23efe14 [0,2,0,0,0,0|2,0,0]=4 8719 B12R0.240 CC[C@@H](O)CC(=O)NCC[C@@H](C)O 93d42c1116adaef2e0837b15bd3f3aab [0,2,0,0,0,0|2,0,0]=4 8720 B12R0.240 CC[C@@H](O)CC(=O)NCC[C@H](C)O 83959b8db108b44520a49780c16eed25 [0,2,0,0,0,0|2,0,0]=4 8721 B12R0.240 CC[C@H](C)CC(=O)NCCC(C)C eda7eff9f36c6642f5d88cab65471673 [0,2,0,0,0,0|2,0,0]=4 8722 B12R0.240 CC[C@H](C)CC(=O)NCCC(C)O d02ab4c796632c419615456153536b4e [0,2,0,0,0,0|2,0,0]=4 8723 B12R0.240 CC[C@H](C)CC(=O)NCC[C@@H](C)O cf2dbd2427713a41f7d0972b6a84506b [0,2,0,0,0,0|2,0,0]=4 8724 B12R0.240 CC[C@H](C)CC(=O)NCC[C@H](C)O 375c68ececb7ad79112f826254e2d8a0 [0,2,0,0,0,0|2,0,0]=4 8725 B12R0.240 CC[C@H](C)NC(=O)CCCC(=O)C cb40b49096d7ff70c6585cedf8639283 [0,2,0,0,0,0|1,0,1]=4 8726 B12R0.240 CC[C@H](C)NC(=O)CCCC(C)C 5bf9c1dddd905c2d397176f310d2fd02 [0,2,0,0,0,0|1,0,0]=3 8727 B12R0.240 CC[C@H](C)NC(=O)CCCN(C)C b6ebeeb186ff6ab176c910adca6c01a5 [0,2,0,0,0,0|2,0,0]=4 8728 B12R0.240 CC[C@H](C)NC(=O)CCOC(C)C 0089168509f529e9dd0f8d23315567e3 [0,2,0,0,0,0|2,0,0]=4 8729 B12R0.240 CC[C@H](C)NC(=O)CCSC(C)C ab452634f53f068f902b61ced497b3da [0,2,0,0,0,0|2,0,0]=4 8730 B12R0.240 CC[C@H](C)NC(=O)COCC(C)C 8ca4e14165acca8e28f3d6e879208b76 [0,2,0,0,0,0|2,0,0]=4 8731 B12R0.240 CC[C@H](C)NC(=O)NCCC(C)C 5fbb9a49d5ff5a3d1a4c7d8fe1389651 [0,2,0,0,0,0|2,0,0]=4 8732 B12R0.240 CC[C@H](C)NC(=O)NCCC(C)O 61a181b05907af958fe11fbf76c6b657 [0,2,0,0,0,0|2,0,0]=4 8733 B12R0.240 CC[C@H](C)NC(=O)NCC[C@@H](C)O ec0a3e6f4ac905bd30e987635150dd0f [0,2,0,0,0,0|2,0,0]=4 8734 B12R0.240 CC[C@H](C)NC(=O)NCC[C@H](C)O ce3cd8fef8bfc8e60e5d01086d0361c2 [0,2,0,0,0,0|2,0,0]=4 8735 B12R0.240 CC[C@H](O)CC(=O)NCCC(C)C af6c55281694b2ff715afc62a0e71d2d [0,2,0,0,0,0|2,0,0]=4 8736 B12R0.240 CC[C@H](O)CC(=O)NCCC(C)O e04dd26c2137efeb006dc3cd02266e53 [0,2,0,0,0,0|2,0,0]=4 8737 B12R0.240 CC[C@H](O)CC(=O)NCC[C@@H](C)O 42d787ad98cd3abaeb3ebc7ae4e565ba [0,2,0,0,0,0|2,0,0]=4 8738 B12R0.240 CC[C@H](O)CC(=O)NCC[C@H](C)O e3c638394ec0048f224de18f3d6149da [0,2,0,0,0,0|2,0,0]=4 8739 B12R0.118 C=C=CC(CCCCC)OCCC ac9345fce4f6341b9bc78b4d4e1abd0f [0,2,0,0,0,0|1,0,1]=4 8740 B12R0.118 C=CCC(CCCCC)OCCC 4ae106b003e56d87b742ec321168b1d8 [0,2,0,0,0,0|1,0,1]=4 8741 B12R0.118 CCCCCC(CCC)OCCC a58fb59e7ab541d08a21b2ed8870a7c5 [0,2,0,0,0,0|1,0,1]=4 8742 B12R0.118 CCCCCN(CC=O)CCCC be7a428bdbec030488b827eb9e8d425c [0,2,0,0,0,0|2,0,0]=4 8743 B12R0.126 C#CC(CCCCC)OC(C)CC 2bb95835255121c49e2b9d4b57c79b0a [0,2,0,0,0,0|1,0,1]=4 8744 B12R0.126 C#C[C@H](CCCCC)OC(C)CC e84e6fd64f65bb4d4af272c2def24348 [0,2,0,0,0,0|1,0,1]=4 8745 B12R0.126 C=CC(CCCCC)OC(C)CC c3f56ae823b8a0437eb481cef053d148 [0,2,0,0,0,0|1,0,1]=4 8746 B12R0.126 C=C[C@H](CCCCC)OC(C)CC 12fae11ae143e0d4e976dd80cb764878 [0,2,0,0,0,0|1,0,1]=4 8747 B12R0.126 CCCCCC(CC)OC(C)CC e435af51caa9f5ce2cbca8ec67ad4411 [0,2,0,0,0,0|1,0,1]=4 8748 B12R0.126 CCCCC[C@H](CC)OC(C)CC 63e8759f6f9abd062faf98f3d59343d9 [0,2,0,0,0,0|1,0,1]=4 8749 B12R0.244 CCCCCC(NCCC)C(=O)O 5c308b2f160543484df02573ec6dfce4 [0,2,0,0,0,0|1,0,1]=4 8750 B12R0.244 CCCCCC(OCCC)C(=O)O 3b45eaca2116c370410554533d97ded4 [0,2,0,0,0,0|0,0,1]=3 8751 B12R0.244 CCCCCC(OCCC)C(C)C 9937e2b50ea3ad37cd13d4df056127b8 [0,2,0,0,0,0|1,0,1]=4 8752 B12R0.244 CCCCCC(OCCF)C(=O)O b34f1f7afb97dd6e11cc776b63ff9cf0 [0,2,0,0,0,0|1,0,1]=4 8753 B12R0.244 CCCCCC(OCCS)C(=O)O 1de0d9e268234b8a3ce0c1f06cee6e92 [0,2,0,0,0,0|1,0,1]=4 8754 B12R0.244 CCCCCC(OCSC)C(=O)O 98dbd1be41211161e7e22c6cc1ce22be [0,2,0,0,0,0|1,0,1]=4 8755 B12R0.244 CCCCCN(CCCC)C(=O)C 1da719c6f3d1f104705be43276f164cc [0,2,0,0,0,0|2,0,0]=4 8756 B12R0.244 CCCCC[C@@H](NCCC)C(=O)O c686f91b7afaf0578f8ced107751410c [0,2,0,0,0,0|1,0,1]=4 8757 B12R0.244 CCCCC[C@H](NCCC)C(=O)O be2ed146442f2fbccc497ee35e02dc57 [0,2,0,0,0,0|1,0,1]=4 8758 B12R0.110 CCC(C)N(C)C(=O)CCCCF 62e761f64d10f789c1de6d6465a02f37 [0,2,0,0,0,0|2,0,0]=4 8759 B12R0.110 CCC(C)N(C)C(=O)CCCCO 830e060179a6230eab6176c0d3283563 [0,2,0,0,0,0|2,0,0]=4 8760 B12R0.110 CCC(C)N(C)C(=O)CCCCS 008fa090bee27eae2adf958777f2b793 [0,2,0,0,0,0|2,0,0]=4 8761 B12R0.110 CCC(C)N(C)C(=O)CCCOC ab3abd298b1c3880ff332a6952cf548c [0,2,0,0,0,0|2,0,0]=4 8762 B12R0.110 CCC(C)N(C)C(=O)CCCSC 2a735aaf315dd552311fc15e02c90da3 [0,2,0,0,0,0|2,0,0]=4 8763 B12R0.110 CCCCCC(=O)C(=O)N(C)CC 7cd74ccf1e5b3ac4d46644a24d9f55b2 [0,2,0,0,0,0|2,0,0]=4 8764 B12R0.110 CCCCCC(=O)N(C)C(C)CC 5957b112cc1629c8e98feaec9e3034ff [0,2,0,0,0,0|1,0,0]=3 8765 B12R0.110 CCCCCC(=O)N(C)C(C)CO 03c5401a5f916902d5d483dafff92c2a [0,2,0,0,0,0|2,0,0]=4 8766 B12R0.110 CCCCCC(=O)N(C)[C@@H](C)CO 1e014c421aa825ac575a7beb826237fd [0,2,0,0,0,0|2,0,0]=4 8767 B12R0.110 CCCCCC(=O)N(C)[C@H](C)CO 7cf2568f5d9440411b9fcdaa976faa26 [0,2,0,0,0,0|2,0,0]=4 8768 B12R0.110 CCCCNC(=O)C(=O)C(C)CC 02b08cd96d8a43ecdb7a4c574c677265 [0,2,0,0,0,0|2,0,0]=4 8769 B12R0.110 CCCCNC(=O)C(O)C(C)CC 0c9f8f2511bda02383905784a038f77f [0,2,0,0,0,0|2,0,0]=4 8770 B12R0.110 CCCCNC(=O)N(C)C(C)CC d1cb1d5712d28fab3c14aed34e8c9de4 [0,2,0,0,0,0|2,0,0]=4 8771 B12R0.110 CCCCNC(=O)[C@@H](O)[C@@H](C)CC 4df7f6dc69711db38eb51aa305ad0af1 [0,2,0,0,0,0|2,0,0]=4 8772 B12R0.110 CCCCNC(=O)[C@H](O)[C@@H](C)CC fb18f16a29495d4b471f8ed77f9e37c9 [0,2,0,0,0,0|2,0,0]=4 8773 B12R0.110 CCCCNC(=O)[C@H](O)[C@H](C)CC 0a3f6ee5c5e10aa271efb7e51bc297fa [0,2,0,0,0,0|2,0,0]=4 8774 B12R0.110 CCCOCC(=O)N(C)C(C)CC 9eaf1032d61797ba1ab4092d71f081e1 [0,2,0,0,0,0|2,0,0]=4 8775 B12R0.110 CCCSCC(=O)N(C)C(C)CC 2abfbd1b4d341d38958798050936f520 [0,2,0,0,0,0|2,0,0]=4 8776 B12R0.110 CCOCCC(=O)N(C)C(C)CC 36be6ff542d462a69dd0ea9f16ad9f86 [0,2,0,0,0,0|2,0,0]=4 8777 B12R0.110 CCSCCC(=O)N(C)C(C)CC a03b4b06be053b927e5ff01a2c5f1621 [0,2,0,0,0,0|2,0,0]=4 8778 B12R0.144 C#CC(CC)OC(C)CCCCC 198ed72a5204c81d491db05348118266 [0,2,0,0,0,0|1,0,1]=4 8779 B12R0.144 C#CC(CC)O[C@@H](C)CCCCC 4c104797b5f2591b4a62ecd0932341d5 [0,2,0,0,0,0|1,0,1]=4 8780 B12R0.144 C=CC(CC)OC(C)CCCCC da2fc76412107223088c13659b32837d [0,2,0,0,0,0|1,0,1]=4 8781 B12R0.144 C=CC(CC)O[C@@H](C)CCCCC d9c5af2381ee294222758c8306a60308 [0,2,0,0,0,0|1,0,1]=4 8782 B12R0.144 C=C[C@@H](CO)NC(=O)CCCCC 6e621645abd37b4d95b8376d66e9b08d [0,2,0,0,0,0|2,0,0]=4 8783 B12R0.144 CCC(CC)NC(=O)CCCCF 96ea5e0b50ef9ecb6624507e3d19b3b9 [0,2,0,0,0,0|2,0,0]=4 8784 B12R0.144 CCC(CC)NC(=O)CCCCO 08f51425834804196a862faba471ac67 [0,2,0,0,0,0|2,0,0]=4 8785 B12R0.144 CCC(CC)NC(=O)CCCCS 22e7802c4e5b7d463f8e83866827daa5 [0,2,0,0,0,0|2,0,0]=4 8786 B12R0.144 CCC(CC)NC(=O)CCCOC 31270c68c32042fe554e72534175e02c [0,2,0,0,0,0|2,0,0]=4 8787 B12R0.144 CCC(CC)NC(=O)CCCSC e51357007b62c978b867dbc75589b179 [0,2,0,0,0,0|2,0,0]=4 8788 B12R0.144 CCC(CO)NC(=O)CCCCF e3784a6c3ee384c56dfc62582517e791 [0,2,0,0,0,0|2,0,0]=4 8789 B12R0.144 CCC(CO)NC(=O)CCCCO 0619363c683ee5d13db2c0fc6bf97ca5 [0,2,0,0,0,0|2,0,0]=4 8790 B12R0.144 CCC(CO)NC(=O)CCCCS 1451a02a99b0950cd7c2115994e94f87 [0,2,0,0,0,0|2,0,0]=4 8791 B12R0.144 CCC(CO)NC(=O)CCCOC f73fb7e594d03d77ac490c8a4dee2684 [0,2,0,0,0,0|2,0,0]=4 8792 B12R0.144 CCC(CO)NC(=O)CCCSC 96da78eb1ef58bf2f9c155d351d6999a [0,2,0,0,0,0|2,0,0]=4 8793 B12R0.144 CCCCCC(=O)NC(CC)CC 4560bf4c98e2eee3ea7411ae44ef9ba3 [0,2,0,0,0,0|1,0,0]=3 8794 B12R0.144 CCCCCC(=O)NC(CC)CO ef351d93281d488bc598fb393e23382e [0,2,0,0,0,0|1,0,0]=3 8795 B12R0.144 CCCCCC(=O)NC(CO)CO 4b436099fc00a3f22a2f3387f09cf988 [0,2,0,0,0,0|2,0,0]=4 8796 B12R0.144 CCCCCC(=O)N[C@@H](CC)CO f35649b65bb90890beeceaed620e8d50 [0,2,0,0,0,0|1,0,0]=3 8797 B12R0.144 CCCCCC(=O)N[C@H](CC)CO bcdd1c5e98104c7ef578d401ce81a58c [0,2,0,0,0,0|1,0,0]=3 8798 B12R0.144 CCCCCC(C)OC(C#N)CC 248f4a41fe93dfa674982bb063cacbcc [0,2,0,0,0,0|1,0,1]=4 8799 B12R0.144 CCCCCC(C)OC(C=O)CC 944de94fecd3723a046529c26e53894f [0,2,0,0,0,0|1,0,1]=4 8800 B12R0.144 CCCCCC(C)OC(CC)CC b503fdd6e2ba09dfbedbc61373199d43 [0,2,0,0,0,0|1,0,1]=4 8801 B12R0.144 CCCCC[C@@H](C)OC(C=O)CC 5c6e3fe599d7cef96a0aad101460dc8d [0,2,0,0,0,0|1,0,1]=4 8802 B12R0.144 CCCCC[C@@H](C)OC(CC)CC ebcbacf1d7582c14f0e95cd1359a39c5 [0,2,0,0,0,0|1,0,1]=4 8803 B12R0.144 CCCCC[C@H](C)OC(C#N)CC eb1d21bf38a28f7d1a38c28fb209f6fc [0,2,0,0,0,0|1,0,1]=4 8804 B12R0.144 CCCCC[C@H](C)OC(C=O)CC 9f474155a76b9510b37b342b5f591eb0 [0,2,0,0,0,0|1,0,1]=4 8805 B12R0.144 CCCCC[C@H](C)OC(CC)CC c2f2aef9e4169079623e518b598fccc4 [0,2,0,0,0,0|1,0,1]=4 8806 B12R0.144 CCCCNC(=O)CC(CC)CC aa50bc4465c991ad1e87c96a2fff7b47 [0,2,0,0,0,0|2,0,0]=4 8807 B12R0.144 CCCCNC(=O)NC(CC)CC 51397b1812b9ddecb254fae08328ed5a [0,2,0,0,0,0|2,0,0]=4 8808 B12R0.144 CCCCNC(=O)NC(CC)CO 7930043266b92441a3e6b93459ae4e43 [0,2,0,0,0,0|2,0,0]=4 8809 B12R0.144 CCCCNC(=O)N[C@@H](CC)CO d7be716cbd9f41b82c3fcac2c630d7cc [0,2,0,0,0,0|2,0,0]=4 8810 B12R0.144 CCCCNC(=O)N[C@H](CC)CO 719ea5891c39bceebc4fd54830e2e0c6 [0,2,0,0,0,0|2,0,0]=4 8811 B12R0.144 CCCOCC(=O)NC(CC)CC 5d0be8495a07a3762338ae039000b01d [0,2,0,0,0,0|2,0,0]=4 8812 B12R0.144 CCCOCC(=O)NC(CC)CO b5a4392ab2552e87ed8386855666e1d2 [0,2,0,0,0,0|2,0,0]=4 8813 B12R0.144 CCCOCC(=O)N[C@@H](CC)CO 157ccf14b708dca84a9c7d5aa1b2f566 [0,2,0,0,0,0|2,0,0]=4 8814 B12R0.144 CCCOCC(=O)N[C@H](CC)CO 3f73695ab4473dee11d0226719057f06 [0,2,0,0,0,0|2,0,0]=4 8815 B12R0.144 CCCSCC(=O)NC(CC)CC 6a013e5beeb11b4b2b1abd697bb6ae8a [0,2,0,0,0,0|2,0,0]=4 8816 B12R0.144 CCCSCC(=O)NC(CC)CO 8e157ee1cf702c5aaec2ec54d90075b5 [0,2,0,0,0,0|2,0,0]=4 8817 B12R0.144 CCCSCC(=O)N[C@@H](CC)CO c9c3c217d115ad3ba26b31106118adde [0,2,0,0,0,0|2,0,0]=4 8818 B12R0.144 CCCSCC(=O)N[C@H](CC)CO 2628999148cb25c70ebb139186ed3433 [0,2,0,0,0,0|2,0,0]=4 8819 B12R0.144 CCOCCC(=O)NC(CC)CC 47de5d05b32e2f617dd1b87284fca6cd [0,2,0,0,0,0|2,0,0]=4 8820 B12R0.144 CCOCCC(=O)NC(CC)CO e48283fbe7379c44dceb0ab3ed81ae13 [0,2,0,0,0,0|2,0,0]=4 8821 B12R0.144 CCOCCC(=O)N[C@@H](CC)CO 4bf39515deb3b1879362adcb4a01c294 [0,2,0,0,0,0|2,0,0]=4 8822 B12R0.144 CCOCCC(=O)N[C@H](CC)CO 5e8fedbd1e817722bcc74463361fc083 [0,2,0,0,0,0|2,0,0]=4 8823 B12R0.144 CCSCCC(=O)NC(CC)CC f7a5efcd77d603747e695244dc523eab [0,2,0,0,0,0|2,0,0]=4 8824 B12R0.144 CCSCCC(=O)NC(CC)CO d9d0945f32eff13e9f55823add3c451d [0,2,0,0,0,0|2,0,0]=4 8825 B12R0.144 CCSCCC(=O)N[C@@H](CC)CO 2876d2a61f2a111c17dee2cba4e7b66b [0,2,0,0,0,0|2,0,0]=4 8826 B12R0.144 CCSCCC(=O)N[C@H](CC)CO a1798d2ad30355e9f57ef9efd2f65c4a [0,2,0,0,0,0|2,0,0]=4 8827 B12R0.144 CC[C@@H](CO)NC(=O)CCCCF 0c23c519e768fcd12e27da575bce47f1 [0,2,0,0,0,0|2,0,0]=4 8828 B12R0.144 CC[C@@H](CO)NC(=O)CCCCO af3bb3b4c789297f2ece7638f9c3963d [0,2,0,0,0,0|2,0,0]=4 8829 B12R0.144 CC[C@@H](CO)NC(=O)CCCCS 1322bee0cbbefeea99f2a1e08f69075c [0,2,0,0,0,0|2,0,0]=4 8830 B12R0.144 CC[C@@H](CO)NC(=O)CCCOC 9cd4b395856ef335be476381cd27d528 [0,2,0,0,0,0|2,0,0]=4 8831 B12R0.144 CC[C@@H](CO)NC(=O)CCCSC b584c0319e655eba024079bea83fdef1 [0,2,0,0,0,0|2,0,0]=4 8832 B12R0.144 CC[C@H](CO)NC(=O)CCCCF ecc8313c9fa8184e36af20d9c3dbf8e2 [0,2,0,0,0,0|2,0,0]=4 8833 B12R0.144 CC[C@H](CO)NC(=O)CCCCO 24bcb6567f28a2e83f216a583b41dca1 [0,2,0,0,0,0|2,0,0]=4 8834 B12R0.144 CC[C@H](CO)NC(=O)CCCCS 55210b757b8e2064e4980ad10ff32d0e [0,2,0,0,0,0|2,0,0]=4 8835 B12R0.144 CC[C@H](CO)NC(=O)CCCOC c6ef7aaad8851050f327accbec862fdb [0,2,0,0,0,0|2,0,0]=4 8836 B12R0.144 CC[C@H](CO)NC(=O)CCCSC 14bc32f4aa17784b96e3e381e9d8cb77 [0,2,0,0,0,0|2,0,0]=4 8837 B12R0.318 CCC(C)(C)NC(=O)CCCCF 29263433212771c7e4f66e23c522430e [0,2,0,0,0,0|2,0,0]=4 8838 B12R0.318 CCC(C)(C)NC(=O)CCCCO 7c728f8719bd061d119d033e04af3238 [0,2,0,0,0,0|2,0,0]=4 8839 B12R0.318 CCC(C)(C)NC(=O)CCCCS b02f75d41a82122ecf6fd866906e5a4f [0,2,0,0,0,0|2,0,0]=4 8840 B12R0.318 CCC(C)(C)NC(=O)CCCOC bbd4d79a22fda5f4abc018a90bf086f2 [0,2,0,0,0,0|2,0,0]=4 8841 B12R0.318 CCC(C)(C)NC(=O)CCCSC 0d3d2a509fdeb236437118b53154809f [0,2,0,0,0,0|2,0,0]=4 8842 B12R0.318 CCCCCC(=O)NC(C)(C)CC 989bf5c96de8d19012b5660cd2ce25d5 [0,2,0,0,0,0|1,0,0]=3 8843 B12R0.318 CCCCCC(=O)NC(C)(C)CF f4e1351d57cbcf461ebd65c1679358dc [0,2,0,0,0,0|2,0,0]=4 8844 B12R0.318 CCCCCC(=O)NC(C)(C)CO 63b449f101f766ca2ed4462f8fb9b8a1 [0,2,0,0,0,0|2,0,0]=4 8845 B12R0.318 CCCCNC(=O)CC(C)(C)CC 7c708dd5506104212368a805db7efc5d [0,2,0,0,0,0|2,0,0]=4 8846 B12R0.318 CCCCNC(=O)CC(C)(O)CC 860f582131695bc7e21361de667ef656 [0,2,0,0,0,0|2,0,0]=4 8847 B12R0.318 CCCCNC(=O)NC(C)(C)CC 2382c0caa1296deaff7e608ddad0ea47 [0,2,0,0,0,0|2,0,0]=4 8848 B12R0.318 CCCNCC(=O)NC(C)(C)CC 4c61561aa0ea78f3b0e854596ce282dc [0,2,0,0,0,0|2,0,0]=4 8849 B12R0.318 CCCOCC(=O)NC(C)(C)CC 7c6c1d645333de6b7b16c070d3bf9fba [0,2,0,0,0,0|2,0,0]=4 8850 B12R0.318 CCCSCC(=O)NC(C)(C)CC f68e1b443d0d667686caecb5df70a444 [0,2,0,0,0,0|2,0,0]=4 8851 B12R0.318 CCOCCC(=O)NC(C)(C)CC 5f2cd65f0f4fe8fc235cd05d82d1f942 [0,2,0,0,0,0|2,0,0]=4 8852 B12R0.318 CCSCCC(=O)NC(C)(C)CC 4e878cbdf06f0f8657fbf1d1f57c1159 [0,2,0,0,0,0|2,0,0]=4 8853 B12R0.109 CCCCCC(=O)N(CC)CCC a346b2d4c41475f738223922ab37a344 [0,2,0,0,0,0|1,0,0]=3 8854 B12R0.109 CCCCCC(=O)N(CC)CCCl 67506fa3503d99e33bfc8d5ea78d1183 [0,2,0,0,0,0|2,0,0]=4 8855 B12R0.109 CCCCCC(=O)N(CC)CCO 3170fb74de284fb46deebde2886cd073 [0,2,0,0,0,0|2,0,0]=4 8856 B12R0.109 CCCCCC(=O)N(CO)CCO 58d2d207f1b741e1efeae2673f9cbed4 [0,2,0,0,0,0|2,0,0]=4 8857 B12R0.109 CCCCNC(=O)N(CC)CCC 80c9e41767e98aaf6a52b0581aaa0103 [0,2,0,0,0,0|2,0,0]=4 8858 B12R0.109 CCCN(CC)C(=O)CCCCF dadf9d112e6aa37cf8c44d28228234c9 [0,2,0,0,0,0|2,0,0]=4 8859 B12R0.109 CCCN(CC)C(=O)CCCCO 0ed1c2cdad0fb85464b4aa31b150abb0 [0,2,0,0,0,0|2,0,0]=4 8860 B12R0.109 CCCN(CC)C(=O)CCCCS d2d91e37bff3d015eeade6e4ce6357ff [0,2,0,0,0,0|2,0,0]=4 8861 B12R0.109 CCCN(CC)C(=O)CCCOC b75c89aeac45261f61787533be1762d0 [0,2,0,0,0,0|2,0,0]=4 8862 B12R0.109 CCCN(CC)C(=O)CCCSC dd3f1752b483f0ca20cd44a499a8d925 [0,2,0,0,0,0|2,0,0]=4 8863 B12R0.109 CCCN(CC)C(=O)CCOCC 0a9454dc23a311d6514b4e2ce7d49193 [0,2,0,0,0,0|2,0,0]=4 8864 B12R0.109 CCCN(CC)C(=O)CCSCC e5301973b1287d480609d008be1aaebc [0,2,0,0,0,0|2,0,0]=4 8865 B12R0.109 CCCOCC(=O)N(CC)CCC a7508fb713e0595529c33222306d7a70 [0,2,0,0,0,0|2,0,0]=4 8866 B12R0.109 CCCSCC(=O)N(CC)CCC 73aa23e6cf5633cd9fd265933d7aa49e [0,2,0,0,0,0|2,0,0]=4 8867 B12R0.294 CCCCNC(=O)C(F)(F)CCC a52190381cc597a61d6481e8a291e880 [0,2,0,0,0,0|2,0,0]=4 8868 B10R1.10 CCCN1CCCC(=O)C1 7297bca07aecf137a110922d2e01ce93 [1,0,0,1,0,0|1,0,0]=3 8869 B10R1.10 CCCN1CCCC(C1)C 10722657823b505b789ed627a8c61fd8 [1,0,0,1,0,0|2,0,0]=4 8870 B10R1.10 CCCN1CCC[C@@H](C1)C 42accd0af676748aeef95475de04bd47 [1,0,0,1,0,0|2,0,0]=4 8871 B10R1.10 CCCN1CCC[C@H](C1)C 3fdfd8108804c0fcef74b387a8d79dff [1,0,0,1,0,0|2,0,0]=4 8872 B10R1.10 CCCN1CCNC(=O)C1 d8e989a714f7948a3d5167ce4cee8b3b [1,0,0,1,0,0|2,0,0]=4 8873 B10R1.10 CCCN1CCOC(=O)C1 32566a616273931864f84b8dc9e1db89 [1,0,0,1,0,0|1,0,0]=3 8874 B10R1.10 CCNC1CCNC(=O)C1 479099502481b0bb9404cd03f14296cc [1,0,0,1,0,0|2,0,0]=4 8875 B10R1.10 CCN[C@@H]1CCNC(=O)C1 9e0e4a482e7d76c713bd53a977e4018c [1,0,0,1,0,0|2,0,0]=4 8876 B10R1.10 CCN[C@H]1CCNC(=O)C1 8a31d87f498d620fd6d53bbabeec5703 [1,0,0,1,0,0|2,0,0]=4 8877 B10R1.10 CCOC1CCCC(=O)C1 7694e8ef5c808ba4dfd648fc2fdd5673 [1,0,0,1,0,0|1,0,0]=3 8878 B10R1.10 CCOC1CCCC(C1)C 05d0af7621eacccee87006fe3e417b13 [1,0,0,1,0,0|1,0,1]=4 8879 B10R1.10 CCOC1CCNC(=O)C1 d6924d66bc2960427a5aa83c3b834b70 [1,0,0,1,0,0|2,0,0]=4 8880 B10R1.10 CCO[C@@H]1CCC[C@@H](C1)C ce55d21559242a12587fb793cf17f8c8 [1,0,0,1,0,0|1,0,1]=4 8881 B10R1.10 CCO[C@@H]1CCNC(=O)C1 2becd24c03a17e28797b47c03861b891 [1,0,0,1,0,0|2,0,0]=4 8882 B10R1.10 CCO[C@H]1CCC[C@@H](C1)C 39c7f1f81843ee831419d80230008049 [1,0,0,1,0,0|1,0,1]=4 8883 B10R1.10 CCO[C@H]1CCC[C@H](C1)C c3bbffbe08f75b723c5a87fe9bd00adc [1,0,0,1,0,0|1,0,1]=4 8884 B10R1.10 CCO[C@H]1CCNC(=O)C1 0c306295dc6c1bac8cf8e49e072469f8 [1,0,0,1,0,0|2,0,0]=4 8885 B10R1.10 COCN1CCCC(=O)C1 317af02d006d13a065b06a81b628f169 [1,0,0,1,0,0|2,0,0]=4 8886 B10R1.10 COCN1CCOC(=O)C1 1f678b780528d8dd6ae8707466e83f96 [1,0,0,1,0,0|2,0,0]=4 8887 B10R1.10 CSCN1CCCC(=O)C1 b21514babe8d2894f6c60bd55dd61e0c [1,0,0,1,0,0|2,0,0]=4 8888 B10R1.10 CSCN1CCOC(=O)C1 ba931a4611f1eae2ed2dcd6a30007c61 [1,0,0,1,0,0|2,0,0]=4 8889 B10R1.10 O=C1CCCC(C1)OCF 3ef4074d9d8cde512776f61233cdd122 [1,0,0,1,0,0|2,0,0]=4 8890 B10R1.10 O=C1CCCN(C1)CCF df6897b009456e691cbb1a32e848f708 [1,0,0,1,0,0|2,0,0]=4 8891 B10R1.10 O=C1CCCN(C1)CCO 6865bbc1bbed842c379aefac569dc87d [1,0,0,1,0,0|2,0,0]=4 8892 B10R1.10 O=C1CCCN(C1)CCS d9f8fccd11178e50e7151700008525ca [1,0,0,1,0,0|2,0,0]=4 8893 B10R1.10 O=C1CN(CCO1)CCF 3203cb1562e696348ba1ee3b691431ea [1,0,0,1,0,0|2,0,0]=4 8894 B10R1.10 O=C1CN(CCO1)CCO b61cc9af051cfe4ea23a0c44d1e79e3f [1,0,0,1,0,0|2,0,0]=4 8895 B10R1.10 O=C1CN(CCO1)CCS 51d95f2a46cf96d74a6eaef127922c9e [1,0,0,1,0,0|2,0,0]=4 8896 B10R1.11 CCCC(=O)N1CCSC1 8dfd5ac124c54a6a084f595d8f226cbf [1,0,0,1,0,0|2,0,0]=4 8897 B10R1.11 CCCN(C)C1CCCC1 0ed89591a94fd8ca3423a47f6a75fa53 [1,0,0,1,0,0|2,0,0]=4 8898 B10R1.11 CCOC(C)C1CCCC1 9f8bbe0e5c53680547f06340e21e4464 [1,0,0,1,0,0|1,0,1]=4 8899 B10R1.29 CCCNC1CCCC1=O 92270db65b4e768bf74c060f3ddca1d2 [1,0,0,1,0,0|1,0,0]=3 8900 B10R1.29 CCCNC1CCNC1=O 826c3328fa4dd7dd5dd8c3d568a3408e [1,0,0,1,0,0|2,0,0]=4 8901 B10R1.29 CCCNC1CCSC1=O 2f88eaf0893fc5d79036a5fe5a76847c [1,0,0,1,0,0|1,1,0]=4 8902 B10R1.29 CCCN[C@@H]1CCNC1=O 881bee3ef919f2d395ee9f82cce415b2 [1,0,0,1,0,0|2,0,0]=4 8903 B10R1.29 CCCN[C@@H]1CCOC1=O 093e5b8bf1b7aee96a6d4b18a27dd8a3 [1,0,0,1,0,0|1,0,0]=3 8904 B10R1.29 CCCN[C@H]1CCNC1=O 28513bf65ca36f558ae2e34f11c0860c [1,0,0,1,0,0|2,0,0]=4 8905 B10R1.29 CCCN[C@H]1CCOC1=O 6fb700cd323815a8f11591a44ec6a9ee [1,0,0,1,0,0|1,0,0]=3 8906 B10R1.29 CCCOC1CCCC1=O 6b93fa99d3716532fe6b9fa26488dd4e [1,0,0,1,0,0|1,0,0]=3 8907 B10R1.29 CCCOC1CCNC1=O 53dd243a9f8f1e7eacf3fc4b0133cfbe [1,0,0,1,0,0|2,0,0]=4 8908 B10R1.29 CCCOC1CCOC1=O 81b1a44df3caf13a7904e6e1637022cc [1,0,0,1,0,0|1,0,0]=3 8909 B10R1.29 CCCO[C@@H]1CCNC1=O defea96294aac13f1e3bb47afec7acb5 [1,0,0,1,0,0|2,0,0]=4 8910 B10R1.29 CCCO[C@@H]1CCOC1=O a61cf9ea463c92a0de26354c56c59a42 [1,0,0,1,0,0|1,0,0]=3 8911 B10R1.29 CCCO[C@H]1CCNC1=O 0c65acf6b283fd1270fb0902388bc278 [1,0,0,1,0,0|2,0,0]=4 8912 B10R1.29 CCCO[C@H]1CCOC1=O 0ca8453d27df7ed3deef2a5f6389b306 [1,0,0,1,0,0|1,0,0]=3 8913 B10R1.29 CCNCC1CCNC1=O cfa18f78ea048520c0930de42321c56e [1,0,0,1,0,0|2,0,0]=4 8914 B10R1.29 CCOCC1CCCC1=O 4cec2785468e0a623009b869bd6f12fe [1,0,0,1,0,0|1,0,0]=3 8915 B10R1.29 CCOCC1CCNC1=O a7897437545e0e6eb8d60f714a585f46 [1,0,0,1,0,0|2,0,0]=4 8916 B10R1.29 CCOCN1CCCC1=O f60cc8131648e9114d88fd2170c106e5 [1,0,0,1,0,0|2,0,0]=4 8917 B10R1.29 COCN[C@@H]1CCOC1=O f59fcd74007bcd1d5cc732269819219f [1,0,0,1,0,0|2,0,0]=4 8918 B10R1.29 COCN[C@H]1CCOC1=O fd7bc00ec12dae14b5676db5b711c45d [1,0,0,1,0,0|2,0,0]=4 8919 B10R1.29 COCOC1CCCC1=O 99ae3d640fc5b5b82d50a7c2a08dc381 [1,0,0,1,0,0|2,0,0]=4 8920 B10R1.29 CSCN[C@@H]1CCOC1=O e33612666f7375193a5b091e62a82c44 [1,0,0,1,0,0|2,0,0]=4 8921 B10R1.29 CSCN[C@H]1CCOC1=O 6f470a401f898acd687d28b8feb595e6 [1,0,0,1,0,0|2,0,0]=4 8922 B10R1.29 CSCOC1CCCC1=O 78c5762b883610ef1d622e4151d61a47 [1,0,0,1,0,0|2,0,0]=4 8923 B10R1.29 CSCOC1CCOC1=O 2ea5a32db620f6dd026c8a7a1d68b7be [1,0,0,1,0,0|2,0,0]=4 8924 B10R1.29 CSCO[C@@H]1CCOC1=O 19ab7ee2a41d901357b74ccf35480889 [1,0,0,1,0,0|2,0,0]=4 8925 B10R1.29 CSCO[C@H]1CCOC1=O fb28601613dcc0a896af6ad7714b707e [1,0,0,1,0,0|2,0,0]=4 8926 B10R1.29 O=C1CCCC1COCF 2677f7e38192aa3f9766c71ca7874350 [1,0,0,1,0,0|2,0,0]=4 8927 B10R1.29 O=C1CCCC1NCCBr 290d3c72b0f0ece08be4b88910ed41af [1,0,0,1,0,0|2,0,0]=4 8928 B10R1.29 O=C1CCCC1NCCI bc8f7bd50f547f74fa5fcbb6da0febc5 [1,0,0,1,0,0|2,0,0]=4 8929 B10R1.29 O=C1CCCC1NCCO c0c0b931d9c69710892d72abef2c7869 [1,0,0,1,0,0|2,0,0]=4 8930 B10R1.29 O=C1CCCC1NCCS ced2dcba1c7d80e404bf89a0a611c948 [1,0,0,1,0,0|2,0,0]=4 8931 B10R1.29 O=C1CCCC1OCCF 0174d93134951fe7900bc47f43e53e9e [1,0,0,1,0,0|2,0,0]=4 8932 B10R1.29 O=C1CCCC1OCCS 8c0da7cd7435196cda6a567a58e043c9 [1,0,0,1,0,0|2,0,0]=4 8933 B10R1.29 O=C1OCCC1OCCF 2f26b64bceea269ab00e42c6164809dc [1,0,0,1,0,0|2,0,0]=4 8934 B10R1.29 O=C1OCCC1OCCS fadec888d4f8e158cd6e309d8a2f5d9b [1,0,0,1,0,0|2,0,0]=4 8935 B10R1.29 O=C1OCC[C@@H]1NCCF 163ef1d2d333bddc35dee0619137d8f7 [1,0,0,1,0,0|2,0,0]=4 8936 B10R1.29 O=C1OCC[C@@H]1NCCO f07e1cc332babcc8239cab6f5999e4fc [1,0,0,1,0,0|2,0,0]=4 8937 B10R1.29 O=C1OCC[C@@H]1NCCS 947b41ed7f833ffd75739a0b4c4ac19a [1,0,0,1,0,0|2,0,0]=4 8938 B10R1.29 O=C1OCC[C@@H]1OCCF 31bde0158d9faf2a8bf7be58ad8ff2d1 [1,0,0,1,0,0|2,0,0]=4 8939 B10R1.29 O=C1OCC[C@@H]1OCCS ded1a8227e4ffa5357eb0e4ce6a32103 [1,0,0,1,0,0|2,0,0]=4 8940 B10R1.29 O=C1OCC[C@H]1NCCF 3dbba06316584889dd603da60b99eaf9 [1,0,0,1,0,0|2,0,0]=4 8941 B10R1.29 O=C1OCC[C@H]1NCCO 40e6125077aaf4e7f5bb18567238ea28 [1,0,0,1,0,0|2,0,0]=4 8942 B10R1.29 O=C1OCC[C@H]1NCCS 72bf8b4b5b9a1f0e2606f4c4970c2fe5 [1,0,0,1,0,0|2,0,0]=4 8943 B10R1.29 O=C1OCC[C@H]1OCCF 8e93331531309f0794b208f05f0454df [1,0,0,1,0,0|2,0,0]=4 8944 B10R1.29 O=C1OCC[C@H]1OCCS 09f1f3b5fe055b17eb898bd092fac89f [1,0,0,1,0,0|2,0,0]=4 8945 B10R1.85 CCCN1CCCCCC1 c31af73aa7bf6b9621d3ff0411574bf1 [1,0,0,1,0,0|2,0,0]=4 8946 B10R1.85 CCOC1CCCCCC1 3ceaf49955c2e83c7e4ec278fd2e50f6 [1,0,0,1,0,0|1,0,1]=4 8947 B10R1.92 CCCC1CN(C1)CCC b24fc689e0e4959f4d575f8ec3c22bf3 [1,0,0,1,0,0|2,0,0]=4 8948 B10R1.96 CCCN1CCC(C1)CC 39fc165b999f2b86cbc1fa385cba5929 [1,0,0,1,0,0|2,0,0]=4 8949 B10R1.130 CCOC1CC(=O)NC1C bf022fe918ca4bc92884991a9ddc28b0 [1,0,0,1,0,0|2,0,0]=4 8950 B10R1.130 CCOC1OC(=O)CC1C 22b073b912a7a81eddef47f0e7d21a3e [1,0,0,1,0,0|2,0,0]=4 8951 B10R1.130 CCO[C@H]1CC(=O)N[C@H]1C 30ce4729af0f1c4b1d21e2ec1b5c2400 [1,0,0,1,0,0|2,0,0]=4 8952 B10R1.136 CC1CC1NC(=O)CCF 8ec1a58ea62a564ecbee3d9c8cb765dc [1,0,0,1,0,0|2,0,0]=4 8953 B10R1.136 CC1CC1NC(=O)CCO 561216ba61ce477c05dfefcfcf00d2c6 [1,0,0,1,0,0|2,0,0]=4 8954 B10R1.136 CC1CC1NC(=O)CCS ae45eb11c914e93c0c158a86e41ce277 [1,0,0,1,0,0|2,0,0]=4 8955 B10R1.136 CCCC(=O)NC1CC1C ee33d40872cf1582a3c6feb3e9e8aed2 [1,0,0,1,0,0|1,0,0]=3 8956 B10R1.136 CCCC(=O)N[C@@H]1C[C@H]1F 095211dfac9049bf9c1e338463eb5e32 [1,0,0,1,0,0|2,0,0]=4 8957 B10R1.136 CCCC(=O)N[C@H]1C[C@@H]1F 13cd51d9078ea1a8fc31f3b62a1eb321 [1,0,0,1,0,0|2,0,0]=4 8958 B10R1.136 CCCC(=O)N[C@H]1C[C@H]1F e547aaa2b2bee2648b09bb96d0029ddc [1,0,0,1,0,0|2,0,0]=4 8959 B10R1.136 COCC(=O)NC1CC1C 92f83d5d1381830a0ab0604683cc36e1 [1,0,0,1,0,0|2,0,0]=4 8960 B10R1.136 CSCC(=O)NC1CC1C ba2cf214c967d40cac19756dcf4eef0c [1,0,0,1,0,0|2,0,0]=4 8961 B10R1.137 CCCC(=O)CN1CCC1 24fe087184be8f9be6e072c76760aca2 [1,0,0,1,0,0|1,0,0]=3 8962 B10R1.137 CCCC(=O)NC1CCC1 b7b9c515753a161abcc35b56dc974d47 [1,0,0,1,0,0|1,0,0]=3 8963 B10R1.137 CCCC(=O)NC1COC1 d9cebcf9c5a1fd910bbc66cad4c36e4f [1,0,0,1,0,0|2,0,0]=4 8964 B10R1.137 CCCC(=S)OC1CCC1 19af20377097808ca4f4afecabaf05f6 [1,0,0,1,0,0|1,1,0]=4 8965 B10R1.137 CCCN(C)CC1CCC1 98ae063296f87529ad57907f7d59468c [1,0,0,1,0,0|2,0,0]=4 8966 B10R1.137 CCNC(=O)CN1CCC1 987ec787996776ffddf4a842a7579e35 [1,0,0,1,0,0|2,0,0]=4 8967 B10R1.137 CCOC(=O)CN1CCC1 c356c472b4a85b80a43b305b1358afd7 [1,0,0,1,0,0|1,0,0]=3 8968 B10R1.137 COCC(=O)NC1CCC1 021cc1760cef5fbbfdeea6c17d703021 [1,0,0,1,0,0|2,0,0]=4 8969 B10R1.137 CSCC(=O)NC1CCC1 7f7f08cd00dd009f2edce9608a21d002 [1,0,0,1,0,0|2,0,0]=4 8970 B10R1.137 O=C(CCF)NC1CCC1 6a895cb18deb8c45ebd3576b4b8e2b9a [1,0,0,1,0,0|2,0,0]=4 8971 B10R1.137 O=C(CCO)NC1CCC1 772bb70e8d7bbf8b62dfee48a2a3fc26 [1,0,0,1,0,0|2,0,0]=4 8972 B10R1.137 O=C(CCS)NC1CCC1 d9e451254376543d56ee834335d68a4b [1,0,0,1,0,0|2,0,0]=4 8973 B10R1.138 CCCC(=O)CNC1CC1 048d80387365d525195329babc27cce2 [1,0,0,1,0,0|1,0,0]=3 8974 B10R1.138 CCCC(=O)COC1CC1 438c7e34265a771a1084b127eefcabef [1,0,0,1,0,0|1,0,0]=3 8975 B10R1.138 CCCC(=O)NCC1CC1 69d46f73451a9cbf30af6f8f9e8feabc [1,0,0,1,0,0|1,0,0]=3 8976 B10R1.138 CCCC(=S)OCC1CC1 bbbadc8ebd81785f951589f1e9964807 [1,0,0,1,0,0|1,1,0]=4 8977 B10R1.138 CCCN(C)CCC1CC1 753b945c4335c9bcb246db5dd9addf66 [1,0,0,1,0,0|2,0,0]=4 8978 B10R1.138 CCNC(=O)CNC1CC1 bc8edd81f7045a2f9026adb22247a950 [1,0,0,1,0,0|2,0,0]=4 8979 B10R1.138 CCNC(=O)COC1CC1 319db39c794f5dd3740d89c7fd70cf52 [1,0,0,1,0,0|2,0,0]=4 8980 B10R1.138 CCOC(=O)CNC1CC1 f3927a7d3f33585867572e3ed85ec01b [1,0,0,1,0,0|1,0,0]=3 8981 B10R1.138 CCOC(=O)COC1CC1 27471410ec76d5e06beb747365918ac2 [1,0,0,1,0,0|1,0,0]=3 8982 B10R1.138 COCC(=O)CNC1CC1 7c852995be0fab6c6f04d5fad6817f98 [1,0,0,1,0,0|2,0,0]=4 8983 B10R1.138 COCC(=O)COC1CC1 1a0e4c36f1d154965565d207389e2045 [1,0,0,1,0,0|2,0,0]=4 8984 B10R1.138 COCC(=O)NCC1CC1 0cb863726a4cfb3f0d4077678e060c57 [1,0,0,1,0,0|2,0,0]=4 8985 B10R1.138 CSCC(=O)NCC1CC1 31c2e420572cb2c01592fbcc2f0785c6 [1,0,0,1,0,0|2,0,0]=4 8986 B10R1.138 O=C(CCF)NCC1CC1 e46f90bf74e57e315aa36dc9b5c200cc [1,0,0,1,0,0|2,0,0]=4 8987 B10R1.138 O=C(CCO)NCC1CC1 597cdf2a4a9a6bb1f280933977cf8ad5 [1,0,0,1,0,0|2,0,0]=4 8988 B10R1.138 O=C(CCS)NCC1CC1 4e5f728b0304c384365749f290226aca [1,0,0,1,0,0|2,0,0]=4 8989 B10R1.186 CCCCCN(C)C1CC1 652e3083e514a8b067154a46c321be50 [1,0,0,1,0,0|2,0,0]=4 8990 B10R1.186 CCCNCC(=O)C1CC1 58e5e8e925a365c978dc73e48d014f51 [1,0,0,1,0,0|1,0,0]=3 8991 B10R1.186 CCCOCC(=O)C1CC1 efdba3cbc9d794b929d4839adbce022d [1,0,0,1,0,0|1,0,0]=3 8992 B10R1.186 COCOCC(=O)C1CC1 57efd6a0ce6358596807f46dbc4dca83 [1,0,0,1,0,0|2,0,0]=4 8993 B10R1.186 CSCOCC(=O)C1CC1 8ded75b352070b6d2998f03d95b55a80 [1,0,0,1,0,0|2,0,0]=4 8994 B10R1.186 O=C(CNCCBr)C1CC1 f304296937bcc495c045fd206c0025d2 [1,0,0,1,0,0|2,0,0]=4 8995 B10R1.186 O=C(CNCCF)C1CC1 1cf995b18dd01b8fbaa5ded6bec662bf [1,0,0,1,0,0|2,0,0]=4 8996 B10R1.186 O=C(CNCCI)C1CC1 a2a9fb5900ad9c1b366fbc09aa2d1105 [1,0,0,1,0,0|2,0,0]=4 8997 B10R1.186 O=C(CNCCO)C1CC1 4706609f0ede4cf476847ff112e0a069 [1,0,0,1,0,0|2,0,0]=4 8998 B10R1.186 O=C(CNCCS)C1CC1 922d306a524f31788b297f4f940abbb6 [1,0,0,1,0,0|2,0,0]=4 8999 B10R1.186 O=C(COCCF)C1CC1 76a74a3cf13e1b48a36fe06a1f7d2796 [1,0,0,1,0,0|2,0,0]=4 9000 B10R1.186 O=C(COCCS)C1CC1 08ad02ce2022050c60a0a08179dcb281 [1,0,0,1,0,0|2,0,0]=4 9001 B10R1.197 CCN1CCCC(=O)CC1 43ab575eb7387d1676c90286c1ea0c74 [1,0,0,1,0,0|1,0,0]=3 9002 B10R1.197 CCN1CCNC(=O)CC1 c00fc63757fc4a565477a63f60a2605b [1,0,0,1,0,0|2,0,0]=4 9003 B10R1.197 O=C1CCCN(CC1)CF 7556829700c0b08f447855e4809ddc05 [1,0,0,1,0,0|2,0,0]=4 9004 B10R1.197 O=C1CCCN(CC1)CO 0872ce793b88f95873340dc0aee0cac1 [1,0,0,1,0,0|2,0,0]=4 9005 B10R1.4 CCNC1CCCNC1=O 2611d2046d7c302d155fa2575da996cf [1,0,0,1,0,0|2,0,0]=4 9006 B10R1.4 CCN[C@@H]1CCCNC1=O cc017d9a7d93a52deca7f6d6027f7b45 [1,0,0,1,0,0|2,0,0]=4 9007 B10R1.4 CCN[C@H]1CCCNC1=O b5bc0fce4a04ce1c92ba3448cfe5c3bb [1,0,0,1,0,0|2,0,0]=4 9008 B10R1.4 CCOC1CCCCC1=O 507ef4f19e89191dc15f42fb27f687ef [1,0,0,1,0,0|2,0,0]=4 9009 B10R1.4 CCOC1CCCNC1=O d77b412772c0bf6233d2065933079649 [1,0,0,1,0,0|2,0,0]=4 9010 B10R1.4 CCOC1CCCOC1=O d4265b269bf6c6ab661ef37336fd46b1 [1,0,0,1,0,0|1,0,0]=3 9011 B10R1.4 CCO[C@@H]1CCCNC1=O 425707dc065418b7f6f48728d932be31 [1,0,0,1,0,0|2,0,0]=4 9012 B10R1.4 CCO[C@H]1CCCNC1=O 03374b88ae99bfae5d66eeefabf3b11e [1,0,0,1,0,0|2,0,0]=4 9013 B10R1.4 O=C1OCCCC1OCF f9fa5b1f733f20ac404f1515fd8b666d [1,0,0,1,0,0|2,0,0]=4 9014 B10R1.16 CCCOC1CCC(C1)C 4c3271bf295e1e813aee802c80b0bc80 [1,0,0,1,0,0|1,0,1]=4 9015 B10R1.17 CCCOC1CCCCC1 a5977ebc84c522370a3bc5745fd0df69 [1,0,0,1,0,0|1,0,1]=4 9016 B10R1.17 CCCOC1CCCCO1 e032b365203d5e61206393eed2791d41 [1,0,0,1,0,0|0,0,2]=4 9017 B10R1.17 CCOCC1=CCCCO1 9b88db47ec50600d4096afa558db8c24 [1,0,0,1,0,0|2,0,0]=4 9018 B10R1.30 CCN1CC(=O)NCC1C 5d3ef9320a404fa74540da48e92ed823 [1,0,0,1,0,0|2,0,0]=4 9019 B10R1.30 CCN1CC(=O)NC[C@@H]1C 801e297755e1037bac07c3c33e73eb5c [1,0,0,1,0,0|2,0,0]=4 9020 B10R1.30 CCN1CC(=O)NC[C@H]1C 3a77f88312708bef1a80d56339b93d2a [1,0,0,1,0,0|2,0,0]=4 9021 B10R1.162 CCN1CCCNC(=O)C1 7f847c2e24a9fed6454900cb01e9e0cc [1,0,0,1,0,0|2,0,0]=4 9022 B10R1.178 CCCCC(=O)N1CCC1 76a96efe2676e0597d9ebd0960272666 [1,0,0,1,0,0|1,0,0]=3 9023 B10R1.178 CCCNC(=O)C1CCO1 7b82c236c6fdbed2f701804d57998a11 [1,0,0,1,0,0|2,0,0]=4 9024 B10R1.178 CCCNC(=O)N1CCC1 be9870ab38798310d645daddfa0fd563 [1,0,0,1,0,0|2,0,0]=4 9025 B10R1.178 CCCNC(=O)[C@@H]1CCO1 544dc00ad90e0e4a4cab910249e9b158 [1,0,0,1,0,0|2,0,0]=4 9026 B10R1.178 CCCNC(=O)[C@H]1CCO1 ff6230e0456004a53c0ee3c40f56d10f [1,0,0,1,0,0|2,0,0]=4 9027 B10R1.178 CCCOC(C)C1CCC1 f0c972a1d44bebf428d0032f8c7f5acc [1,0,0,1,0,0|1,0,1]=4 9028 B10R1.178 CCCO[C@@H](C)C1CCC1 1cffd57c350c6b1ffd10bfef7eb65780 [1,0,0,1,0,0|1,0,1]=4 9029 B10R1.178 CCOCC(=O)N1CCC1 9bc2270be90494bb26e08328b904d97f [1,0,0,1,0,0|2,0,0]=4 9030 B10R1.178 CCSCC(=O)N1CCC1 6398bdfbe005586623ba6b5d90e22ebc [1,0,0,1,0,0|2,0,0]=4 9031 B10R1.178 COCCC(=O)N1CCC1 11397bd2d0446b8d37ddbbbb0a5a97f5 [1,0,0,1,0,0|2,0,0]=4 9032 B10R1.178 CSCCC(=O)N1CCC1 9e41359337d50744af0443cea79586d5 [1,0,0,1,0,0|2,0,0]=4 9033 B10R1.178 O=C(CCCF)N1CCC1 fc27acb0ee6a1dcf182270d849f73d7a [1,0,0,1,0,0|2,0,0]=4 9034 B10R1.178 O=C(CCCS)N1CCC1 e06afacbd7c453cac2693cdfbb8e44ab [1,0,0,1,0,0|2,0,0]=4 9035 B10R1.180 CCCCC(=O)NC1CC1 05f83bf4442819284e968a7929beffb1 [1,0,0,1,0,0|1,0,0]=3 9036 B10R1.180 CCCCC(C)OC1CC1 ccdeebf7fe7e2cc0f399aae4a98e3084 [1,0,0,1,0,0|1,0,1]=4 9037 B10R1.180 CCCC[C@@H](C)OC1CC1 2d5dd57dc38bc6a1c66d3dbe69ba70a0 [1,0,0,1,0,0|1,0,1]=4 9038 B10R1.180 CCCC[C@H](C)OC1CC1 96a39daa952c06e6254427444ee11362 [1,0,0,1,0,0|1,0,1]=4 9039 B10R1.180 CCCNC(=O)CC1CC1 7515b65002f1f30e75e9efeffeaf4d30 [1,0,0,1,0,0|1,0,0]=3 9040 B10R1.180 CCCNC(=O)NC1CC1 2d741d9ae67f83b9806e55354c6f440b [1,0,0,1,0,0|2,0,0]=4 9041 B10R1.180 CCCOC(C)CC1CC1 6107c498143f3f089df15a92bc97b6f7 [1,0,0,1,0,0|1,0,1]=4 9042 B10R1.180 CCNCC(=O)NC1CC1 2723b3910e732f6f2082e4d35b94f5ec [1,0,0,1,0,0|2,0,0]=4 9043 B10R1.180 CCOCC(=O)NC1CC1 ec9813d6a12486fc463259c83fb4a631 [1,0,0,1,0,0|2,0,0]=4 9044 B10R1.180 CCSCC(=O)NC1CC1 e626488d3ec168d32ee3823b3e26c202 [1,0,0,1,0,0|2,0,0]=4 9045 B10R1.180 COCCC(=O)NC1CC1 ad4e67f53f07de2277db747113df0e1e [1,0,0,1,0,0|2,0,0]=4 9046 B10R1.180 CSCCC(=O)NC1CC1 2cc5b092bb4b3847b9822738d2f37f09 [1,0,0,1,0,0|2,0,0]=4 9047 B10R1.180 O=C(CC1CC1)NCCBr b246d2c9001342406d608d713010d309 [1,0,0,1,0,0|2,0,0]=4 9048 B10R1.180 O=C(CC1CC1)NCCF a4afbc64d53820bf5ef81d0476a2c857 [1,0,0,1,0,0|2,0,0]=4 9049 B10R1.180 O=C(CC1CC1)NCCI c5f561da5c17df25ffb14bc26330864f [1,0,0,1,0,0|2,0,0]=4 9050 B10R1.180 O=C(CC1CC1)NCCO 17810c2b99aeda0fe4fc66d57ea7c438 [1,0,0,1,0,0|2,0,0]=4 9051 B10R1.180 O=C(CC1CC1)NCCS b25eb708ef18fa750a2b387e01fc96e9 [1,0,0,1,0,0|2,0,0]=4 9052 B10R1.180 O=C(CCCF)NC1CC1 71bdca7301a4f5ab99f262ab0f0094e3 [1,0,0,1,0,0|2,0,0]=4 9053 B10R1.180 O=C(CCCS)NC1CC1 3394e480ee23d695f19b31d412cf8462 [1,0,0,1,0,0|2,0,0]=4 9054 B10R1.5 CCCN1CCCC1CC b4b0b71eb87b0e5c5b11c4f43e6364dd [1,0,0,1,0,0|1,0,1]=4 9055 B10R1.5 CCCN1CCC[C@H]1CC 164c574647f66fa76056c22fa9f81e14 [1,0,0,1,0,0|1,0,1]=4 9056 B10R1.12 CCCCN1CCC1CC 77c853fd321136b7c9e7a8ba4faf6b9c [1,0,0,1,0,0|2,0,0]=4 9057 B10R1.37 CCCCN[C@@H]1CC[C@H]1C 03586e5023e37af0f65660ae51b966b4 [1,0,0,1,0,0|2,0,0]=4 9058 B10R1.37 CCCCN[C@H]1CC[C@H]1C 35fbf4a27f4eee1a45186737a97871a9 [1,0,0,1,0,0|2,0,0]=4 9059 B10R1.37 CCCOCC1CCC1F 697653372bf1337640f1ca546825663c [1,0,0,1,0,0|1,0,1]=4 9060 B10R1.37 CCCOCC1CCN1C c0b8cb4b86a91b1a4ec0e1cbc16653b9 [1,0,0,1,0,0|1,0,1]=4 9061 B10R1.37 CCCOC[C@@H]1CCN1C 177b83a7085df995eb9aaa9b7ee5c770 [1,0,0,1,0,0|1,0,1]=4 9062 B10R1.37 CCCOC[C@H]1CCN1C de4ef9a69702ee15812a2a026c5112cd [1,0,0,1,0,0|1,0,1]=4 9063 B10R1.56 CCCCCNC1CC1C c5ac0064d3aa8f0cf62cda7dc95367eb [1,0,0,1,0,0|2,0,0]=4 9064 B10R1.56 CCCCOCC1CC1C 76dca24a45b0211a32b89fd0da7d3d49 [1,0,0,1,0,0|2,0,0]=4 9065 B10R1.56 CCCCOC[C@@H]1C[C@@H]1C 3d265a80cae5744f6b90eee155c1997f [1,0,0,1,0,0|2,0,0]=4 9066 B10R1.56 CCCCOC[C@@H]1C[C@H]1C b5a95c5a449f0e8559d0b59df572755a [1,0,0,1,0,0|2,0,0]=4 9067 B10R1.56 CCCCOC[C@H]1C[C@@H]1C b5c4a716f2aeb88529724d8ef1b39cb0 [1,0,0,1,0,0|2,0,0]=4 9068 B10R1.57 CCC/C=C/CN1CCC1 5313d1bb52c3fb704ee65287dd02cef8 [1,0,0,1,0,0|2,0,0]=4 9069 B10R1.57 CCC/C=C\CN1CCC1 af2b2567868c83d06a48f3b4ddef0c6c [1,0,0,1,0,0|2,0,0]=4 9070 B10R1.57 CCCCCCN1CCC1 24f62fbe257d33928ef7858f5b1507f5 [1,0,0,1,0,0|1,0,1]=4 9071 B10R1.57 CCCCCNC1CCC1 28480527ffd8e6cfb2715857f45f5b7a [1,0,0,1,0,0|2,0,0]=4 9072 B10R1.57 CCCCCOC1CCC1 3dce260891d9b053b1d353f59c75b3f5 [1,0,0,1,0,0|2,0,0]=4 9073 B10R1.57 CCCCNCC1CCC1 ed82d5554de84453073bf2aad874c9dc [1,0,0,1,0,0|2,0,0]=4 9074 B10R1.57 CCCCOCC1CCC1 5b12e9583ebc250a12846b15aad69667 [1,0,0,1,0,0|2,0,0]=4 9075 B10R1.57 CCCNCCC1CCC1 821cbc3d0f3452bcc144b54501230d23 [1,0,0,1,0,0|1,0,1]=4 9076 B10R1.57 CCCOCCC1CCC1 27d4ec58adb426de0fb4e6f9d28b96df [1,0,0,1,0,0|0,0,1]=3 9077 B10R1.57 CCCOCCC1CCO1 937d1e7de0e13baf1e017f90bf59a776 [1,0,0,1,0,0|1,0,1]=4 9078 B10R1.57 CCCOCCC1COC1 839229b3a1548b1ded322ef74e7511b5 [1,0,0,1,0,0|1,0,1]=4 9079 B10R1.57 CCCOCCN1CCC1 d0e70921049478013e4056472fdd9475 [1,0,0,1,0,0|1,0,1]=4 9080 B10R1.57 CCCOCC[C@@H]1CCO1 c3ea0ec00b8446852ba0c1ccb44458a7 [1,0,0,1,0,0|1,0,1]=4 9081 B10R1.57 CCCOCC[C@H]1CCO1 c845c5604b361907273be45fa8ac305d [1,0,0,1,0,0|1,0,1]=4 9082 B10R1.57 COCOCCC1CCC1 faa8ca5e0fb0c324804d25faa761e087 [1,0,0,1,0,0|1,0,1]=4 9083 B10R1.57 CSCOCCC1CCC1 bfb9da16dfd3858f6d5107d7fcbba8fd [1,0,0,1,0,0|1,0,1]=4 9084 B10R1.57 FCCOCCC1CCC1 1bdb069f84cb39cb903ce4a858d8eab2 [1,0,0,1,0,0|1,0,1]=4 9085 B10R1.57 SCCOCCC1CCC1 29eedd91650659d9078f4b5a4c695f47 [1,0,0,1,0,0|1,0,1]=4 9086 B10R1.177 CCC/C=C/CNC1CC1 edb58d59572674cb67aefb973557902b [1,0,0,1,0,0|2,0,0]=4 9087 B10R1.177 CCC/C=C/COC1CC1 382f23974dd20a1518d1f00f5271a1ab [1,0,0,1,0,0|2,0,0]=4 9088 B10R1.177 CCC/C=C\CNC1CC1 c2380d1bc1589aa650cdc38b2c2b9d7a [1,0,0,1,0,0|2,0,0]=4 9089 B10R1.177 CCC/C=C\COC1CC1 1d9efd858c0dc4ab1aa7d3712bee0f52 [1,0,0,1,0,0|2,0,0]=4 9090 B10R1.177 CCCCCCNC1CC1 15262c9b6550fe6d109c4c2cb7eeb757 [1,0,0,1,0,0|1,0,1]=4 9091 B10R1.177 CCCCCCOC1CC1 b55afc5464381312d620e6cbb95bdd86 [1,0,0,1,0,0|0,0,1]=3 9092 B10R1.177 CCCCCNCC1CC1 34d61cada598947f49b9ab85a2931c34 [1,0,0,1,0,0|2,0,0]=4 9093 B10R1.177 CCCCCOCC1CC1 29148006b57e8432404409499e87f3fd [1,0,0,1,0,0|2,0,0]=4 9094 B10R1.177 CCCCNCCC1CC1 158c02666a48abc7fe9ea46078bf1036 [1,0,0,1,0,0|2,0,0]=4 9095 B10R1.177 CCCCOCCC1CC1 ec58c6ee84426d7d0244452963d49311 [1,0,0,1,0,0|2,0,0]=4 9096 B10R1.177 CCCCOCOC1CC1 ceec6acd9a089fc281edfe61886983a1 [1,0,0,1,0,0|1,0,1]=4 9097 B10R1.177 CCCNCCOC1CC1 59b26a455797b634b7dab02d300c7e08 [1,0,0,1,0,0|1,0,1]=4 9098 B10R1.177 CCCOC/C=C/C1CC1 f1a04d2684a151cba0b084c72b434f40 [1,0,0,1,0,0|2,0,0]=4 9099 B10R1.177 CCCOCCCC1CC1 e0007007b99d583354fd403d2e374709 [1,0,0,1,0,0|0,0,1]=3 9100 B10R1.177 CCCOCCNC1CC1 cab635b0622596f86bf5c545847467ee [1,0,0,1,0,0|1,0,1]=4 9101 B10R1.177 CCCOCCOC1CC1 fc634e782e1550ceec5c7a5a852d22c1 [1,0,0,1,0,0|1,0,1]=4 9102 B10R1.177 CCCSCCOC1CC1 56f2f830e86c165dbda22d71a4d0618d [1,0,0,1,0,0|1,0,1]=4 9103 B10R1.177 CCOCCCOC1CC1 a181e9e72139dc13dbf0b00953d1b7ff [1,0,0,1,0,0|1,0,1]=4 9104 B10R1.177 CCSCCCOC1CC1 ecbb978545b97bb91da25995c00af722 [1,0,0,1,0,0|1,0,1]=4 9105 B10R1.177 COCCCCOC1CC1 efe38084a2b4f5d5b38942d88504cb71 [1,0,0,1,0,0|1,0,1]=4 9106 B10R1.177 COCOCCCC1CC1 d5e50b76edadd5f8ab48d44fa4dbd78f [1,0,0,1,0,0|1,0,1]=4 9107 B10R1.177 CSCCCCOC1CC1 2ead97622c601b93107d897f3bddc620 [1,0,0,1,0,0|1,0,1]=4 9108 B10R1.177 CSCOCCCC1CC1 0479104e519398cbacdc3961a9e85197 [1,0,0,1,0,0|1,0,1]=4 9109 B10R1.177 FCCCCCOC1CC1 2ea529e7e1880128ad6f6508626c8df1 [1,0,0,1,0,0|1,0,1]=4 9110 B10R1.177 FCCOCCCC1CC1 4db4d5c5e9e2f4e1a22e88987cd19cd7 [1,0,0,1,0,0|1,0,1]=4 9111 B10R1.177 SCCOCCCC1CC1 c84eed186a2e3ed430e0cca5a0eb568d [1,0,0,1,0,0|1,0,1]=4 9112 B12R1.53 CC/C=C/C(=O)NC1CCCC1 393284ab45f2e29df9e94568e31c02a5 [0,1,0,1,0,0|1,0,1]=4 9113 B12R1.53 CC/C=C\C(=O)NC1CCCC1 f65ac714b5af12ce3fcb0a3ab2c8f0fd [0,1,0,1,0,0|1,0,1]=4 9114 B12R1.53 CCC#CC(=O)NC1CCCC1 b0701aa1bbe6e67138607f4cc49729c5 [0,1,0,1,0,0|1,0,1]=4 9115 B12R1.53 CCC=CC(=O)NC1CCCC1 cf24c8fe0ebe3fcdfcca6304842e550d [0,1,0,1,0,0|1,0,1]=4 9116 B12R1.53 CCCCC(=O)NC1CCCC1 ffe0944aa7dffceb8b72efd3831dfd91 [0,1,0,1,0,0|1,0,0]=3 9117 B12R1.53 CCCCC(=O)NC1CCOC1 1e674d26de54780cb9628df6d4fb4e31 [0,1,0,1,0,0|2,0,0]=4 9118 B12R1.53 CCCCC(=O)NC1CCSC1 8d2892d72c79b4f9d447384de9033c10 [0,1,0,1,0,0|2,0,0]=4 9119 B12R1.53 CCCCC(=O)N[C@@H]1CCOC1 8c781642c4110288eee66bf3ddb78c79 [0,1,0,1,0,0|2,0,0]=4 9120 B12R1.53 CCCCC(=O)N[C@H]1CCOC1 aba5d341347845e888fc9699ad516b66 [0,1,0,1,0,0|2,0,0]=4 9121 B12R1.53 CCCNC(=O)CC1=CCCC1 192bb91b2e37d96be798e8c0440b1413 [0,1,0,1,0,0|1,0,1]=4 9122 B12R1.53 CCCNC(=O)CC1C=CCC1 729a8d23531ba68737f77f0040980056 [0,1,0,1,0,0|1,0,1]=4 9123 B12R1.53 CCCNC(=O)CC1CCCC1 e2db722e161f5a6705dabff4a3660970 [0,1,0,1,0,0|1,0,0]=3 9124 B12R1.53 CCCNC(=O)CC1CCCO1 3ce660ea97277a712a32cfa9245739b7 [0,1,0,1,0,0|1,0,0]=3 9125 B12R1.53 CCCNC(=O)CC1CCOC1 73e22aa3e36aebb1981c82dbcd0401b5 [0,1,0,1,0,0|1,0,0]=3 9126 B12R1.53 CCCNC(=O)CN1CCCC1 0fc3e48f70324a5110c0e2a6b1fccd34 [0,1,0,1,0,0|1,0,0]=3 9127 B12R1.53 CCCNC(=O)CN1CCSC1 5e6d70ca26863e6c7deca6560e2619fc [0,1,0,1,0,0|2,0,0]=4 9128 B12R1.53 CCCNC(=O)C[C@@H]1CCOC1 0d0cee8990f2d6c42b75b80b0c0594e9 [0,1,0,1,0,0|1,0,0]=3 9129 B12R1.53 CCCNC(=O)C[C@H]1CCOC1 e79db39f5360816a3f02fc793591ec8a [0,1,0,1,0,0|1,0,0]=3 9130 B12R1.53 CCCNC(=O)NC1CCCC1 8f8b6c4035a44fe9f12be3eaa97cb298 [0,1,0,1,0,0|1,0,0]=3 9131 B12R1.53 CCCNC(=O)NC1CCOC1 39da7dc88e7c82d9c32145638305858e [0,1,0,1,0,0|2,0,0]=4 9132 B12R1.53 CCCNC(=O)NC1CCSC1 c9bb03b2c0a08f636ac12d7a6c1a87fc [0,1,0,1,0,0|2,0,0]=4 9133 B12R1.53 CCCNC(=O)N[C@@H]1CCOC1 febbb4df7741d58f0b361734145d83db [0,1,0,1,0,0|2,0,0]=4 9134 B12R1.53 CCCNC(=O)N[C@H]1CCOC1 77f27d46a455a93f646db59e4fcdd063 [0,1,0,1,0,0|2,0,0]=4 9135 B12R1.53 CCCNC(=S)NC1CCCC1 71e85e95c8a896b5eec6224640ee3c45 [0,1,0,1,0,0|1,1,0]=4 9136 B12R1.53 CCCOC(=O)CN1CC=CC1 184ab06d2053d923ac6c73e19032afc3 [0,1,0,1,0,0|0,0,2]=4 9137 B12R1.53 CCCOC(=O)CN1CCSC1 842f7cf6d5f40cf983787fdd2edb3570 [0,1,0,1,0,0|1,0,0]=3 9138 B12R1.53 CCCOC(C)CN1CCCC1 581a95cf7b2f8dd5672554c22301470d [0,1,0,1,0,0|1,0,1]=4 9139 B12R1.53 CCCO[C@@H](C)CN1CCCC1 79bff72285ff99591ec857bbe329a857 [0,1,0,1,0,0|1,0,1]=4 9140 B12R1.53 CCCO[C@H](C)CN1CCCC1 be285e96cc0c9d1b550fba467258b0a5 [0,1,0,1,0,0|1,0,1]=4 9141 B12R1.53 CCNCC(=O)NC1CCCC1 c7e7ee4b637d9ceebaec014347604d32 [0,1,0,1,0,0|2,0,0]=4 9142 B12R1.53 CCNCC(=O)OC1CCCC1 51ab5c2281a6d5777297a8ad97e1e293 [0,1,0,1,0,0|2,0,0]=4 9143 B12R1.53 CCOCC(=O)NC1CCCC1 913ee9b2e481626823742d824933108a [0,1,0,1,0,0|2,0,0]=4 9144 B12R1.53 CCSCC(=O)NC1CCCC1 a5e8aaf50f13e61d824c4551fe2f52f4 [0,1,0,1,0,0|2,0,0]=4 9145 B12R1.53 COCCC(=O)NC1CCCC1 0335f0bedde6a8c40f7e26561a2c664c [0,1,0,1,0,0|2,0,0]=4 9146 B12R1.53 CSCCC(=O)NC1CCCC1 f1242f45ed51f12d20fe65676e5715ec [0,1,0,1,0,0|2,0,0]=4 9147 B12R1.53 NCCNC(=O)NC1CCCC1 92cbd451f7109cfccb1162dff74b787a [0,1,0,1,0,0|2,0,0]=4 9148 B12R1.53 O=C(CC1CCCC1)NCCBr ccb1db97a0f14f3a1b44fbf161c34e51 [0,1,0,1,0,0|2,0,0]=4 9149 B12R1.53 O=C(CC1CCCC1)NCCF f6304bd17f396a263286c8554a300144 [0,1,0,1,0,0|2,0,0]=4 9150 B12R1.53 O=C(CC1CCCC1)NCCI fa5b02dc92d74ebfcfd35916dfdc9661 [0,1,0,1,0,0|2,0,0]=4 9151 B12R1.53 O=C(CC1CCCC1)NCCO 45fd9144278c987c73d7d55e50839566 [0,1,0,1,0,0|2,0,0]=4 9152 B12R1.53 O=C(CC1CCCC1)NCCS ba1fb195e80d072920053e52922ed663 [0,1,0,1,0,0|2,0,0]=4 9153 B12R1.53 O=C(CC1CCCO1)NCCBr 9d32e3aa00e7cb5acbcde90c2f4b8039 [0,1,0,1,0,0|2,0,0]=4 9154 B12R1.53 O=C(CC1CCCO1)NCCF 6d05bf461017750ce3cab01edde45152 [0,1,0,1,0,0|2,0,0]=4 9155 B12R1.53 O=C(CC1CCCO1)NCCI 88eb2ca223f81ab66e089b129cf82a70 [0,1,0,1,0,0|2,0,0]=4 9156 B12R1.53 O=C(CC1CCCO1)NCCO 84b0202952da27bfec5bdbe774ba8168 [0,1,0,1,0,0|2,0,0]=4 9157 B12R1.53 O=C(CC1CCCO1)NCCS eb1ea4db0eca7fa0195a2ce0ab3213e4 [0,1,0,1,0,0|2,0,0]=4 9158 B12R1.53 O=C(CC1CCOC1)NCCBr 0b36aa8fc46d413142d6f9b190744f3d [0,1,0,1,0,0|2,0,0]=4 9159 B12R1.53 O=C(CC1CCOC1)NCCF b37d5f64f7df295068bafc2ccf233af5 [0,1,0,1,0,0|2,0,0]=4 9160 B12R1.53 O=C(CC1CCOC1)NCCI 33117ae3ba803bcc1aa037f9dce2b3aa [0,1,0,1,0,0|2,0,0]=4 9161 B12R1.53 O=C(CC1CCOC1)NCCO edd1fff76db44386bda6802aec51b29b [0,1,0,1,0,0|2,0,0]=4 9162 B12R1.53 O=C(CC1CCOC1)NCCS 4f44d5baff3b37ad9145b12f475bbe70 [0,1,0,1,0,0|2,0,0]=4 9163 B12R1.53 O=C(CCCF)NC1CCCC1 651b9c06994a670449b6094450396130 [0,1,0,1,0,0|2,0,0]=4 9164 B12R1.53 O=C(CCCS)NC1CCCC1 653565880c416b77feffcd134d259a60 [0,1,0,1,0,0|2,0,0]=4 9165 B12R1.53 O=C(CN1CCCC1)NCCBr 99d7126b4e5f851b4d19c1715714ecf6 [0,1,0,1,0,0|2,0,0]=4 9166 B12R1.53 O=C(CN1CCCC1)NCCF c127c6279a90eeeb9f68cc77def58cca [0,1,0,1,0,0|2,0,0]=4 9167 B12R1.53 O=C(CN1CCCC1)NCCI 515336a4f36f1a9a629458ad4f0ba725 [0,1,0,1,0,0|2,0,0]=4 9168 B12R1.53 O=C(CN1CCCC1)NCCO e6918c7f953122fb316c240336a15cd0 [0,1,0,1,0,0|2,0,0]=4 9169 B12R1.53 O=C(CN1CCCC1)NCCS d985446ce53069e3f6621486c5f5cd22 [0,1,0,1,0,0|2,0,0]=4 9170 B12R1.53 O=C(C[C@@H]1CCOC1)NCCBr ef7c12dee1692068051fd040af53b757 [0,1,0,1,0,0|2,0,0]=4 9171 B12R1.53 O=C(C[C@@H]1CCOC1)NCCF e6af740b5afeb19c9ddc9bfd559ff8ad [0,1,0,1,0,0|2,0,0]=4 9172 B12R1.53 O=C(C[C@@H]1CCOC1)NCCI 4bcbc92da447eea64ef82109cf50c6ed [0,1,0,1,0,0|2,0,0]=4 9173 B12R1.53 O=C(C[C@@H]1CCOC1)NCCO 36c058e738a143aa26f04082a1833376 [0,1,0,1,0,0|2,0,0]=4 9174 B12R1.53 O=C(C[C@@H]1CCOC1)NCCS 706484bd4f436527732a2edcfbc25917 [0,1,0,1,0,0|2,0,0]=4 9175 B12R1.53 O=C(C[C@H]1CCOC1)NCCBr 2418b57dae2d828b518811a954153515 [0,1,0,1,0,0|2,0,0]=4 9176 B12R1.53 O=C(C[C@H]1CCOC1)NCCF 447e53674ba7694a6c81993414c84a19 [0,1,0,1,0,0|2,0,0]=4 9177 B12R1.53 O=C(C[C@H]1CCOC1)NCCI 16f71a6b03e93a6e23ef67a077d2440e [0,1,0,1,0,0|2,0,0]=4 9178 B12R1.53 O=C(C[C@H]1CCOC1)NCCO 1f053769c96aa682918be8827104b182 [0,1,0,1,0,0|2,0,0]=4 9179 B12R1.53 O=C(C[C@H]1CCOC1)NCCS dabe8b4b92e392363a02480cf0aa0e2e [0,1,0,1,0,0|2,0,0]=4 9180 B12R1.53 O=C(NCCF)NC1CCCC1 8bbba981c983f56eb913ed94109e578d [0,1,0,1,0,0|2,0,0]=4 9181 B12R1.53 O=C(NCCO)NC1CCCC1 4041b34c585e24b7b451fefc9458f91c [0,1,0,1,0,0|2,0,0]=4 9182 B12R1.53 O=C(NCCS)NC1CCCC1 36eb4d593a7eb4be4e597b42de52c5b5 [0,1,0,1,0,0|2,0,0]=4 9183 B12R1.100 CCCOC1CC(CC(C1)C)C d9ac85435c66fe36a26f93ca676f3f6c [0,1,0,1,0,0|1,0,1]=4 9184 B12R1.100 CCCO[C@@H]1C[C@@H](C[C@@H](C1)C)C 687b8994d7d1cc29773f66d3ed1a21c6 [0,1,0,1,0,0|1,0,1]=4 9185 B12R1.321 CCCCN1CCCNC(=O)C1 74edd50be96c8d10b1a9ab85b7ecdb76 [0,1,0,1,0,0|1,0,0]=3 9186 B12R1.321 CCCCN1CCCOC(C1)C 4f806c4589a7ac3e025c7e9002f47bec [0,1,0,1,0,0|1,0,1]=4 9187 B12R1.321 CCCOC1CCCNC(=O)C1 613b246a29a98fa233a4b20d966fc3f9 [0,1,0,1,0,0|1,0,0]=3 9188 B12R1.321 CCOCC1CCCCC(=O)N1 837f1b31b3c4f97e4560e55cd1cb9fa1 [0,1,0,1,0,0|2,0,0]=4 9189 B12R1.321 CCOCN1CCCNC(=O)C1 55ad5e8c9cf25cd8f62b21af9aab9789 [0,1,0,1,0,0|2,0,0]=4 9190 B12R1.321 COCCN1CCCNC(=O)C1 1b6e23d1cac5af605316090cc917fead [0,1,0,1,0,0|2,0,0]=4 9191 B12R1.321 COCOC1CCCNC(=O)C1 f47758734685efec492abdb2dfdddcd7 [0,1,0,1,0,0|2,0,0]=4 9192 B12R1.321 CSCCN1CCCNC(=O)C1 8a0518b9b4ae44222c1421262008740c [0,1,0,1,0,0|2,0,0]=4 9193 B12R1.321 CSCOC1CCCNC(=O)C1 59aa54e16308800ed49163125eeb2019 [0,1,0,1,0,0|2,0,0]=4 9194 B12R1.321 O=C1CC(CCCN1)OCCF baff132e04f9483b67c77eb9f7b4aa0f [0,1,0,1,0,0|2,0,0]=4 9195 B12R1.321 O=C1CC(CCCN1)OCCS 03a58e75ab35b431c8bc052b0f3b5642 [0,1,0,1,0,0|2,0,0]=4 9196 B12R1.321 O=C1CN(CCCN1)CCCF c9b0e7dcc8591787912f8118ad74473a [0,1,0,1,0,0|2,0,0]=4 9197 B12R1.321 O=C1CN(CCCN1)CCCO d4ca48674cae8fbf50f3516c73eac6c4 [0,1,0,1,0,0|2,0,0]=4 9198 B12R1.321 O=C1CN(CCCN1)CCCS 5ca2c0e3e0eed4c96f324643725b5656 [0,1,0,1,0,0|2,0,0]=4 9199 B12R1.340 CCCOC1CCN(C1)CCC a50c484680a7c915b0dd4ab848c75310 [0,1,0,1,0,0|1,0,1]=4 9200 B12R1.340 CCCO[C@@H]1CCN(C1)CCC a2a02d170b8efd55691871883568b1d8 [0,1,0,1,0,0|1,0,1]=4 9201 B12R1.340 CCCO[C@H]1CCN(C1)CCC 249a399f7bcf4a381bf9ea1738a124a2 [0,1,0,1,0,0|1,0,1]=4 9202 B12R1.460 CC/C=C/C(=O)N1CCCC1C e81646c1f1a56013df6bf04031b42854 [0,1,0,1,0,0|1,0,1]=4 9203 B12R1.460 CC/C=C/C(=O)N1CCC[C@@H]1C 6d626cadebb4d7fc273a8a170c4749fc [0,1,0,1,0,0|1,0,1]=4 9204 B12R1.460 CC/C=C/C(=O)N1CCC[C@H]1C d35c103b5406240ce606880a7fdf9932 [0,1,0,1,0,0|1,0,1]=4 9205 B12R1.460 CC/C=C\C(=O)N1CCCC1C 901d2f4196b3ffebaa05d02e9660c60e [0,1,0,1,0,0|1,0,1]=4 9206 B12R1.460 CC/C=C\C(=O)N1CCC[C@@H]1C 4a99dfae052a3aaa73d5620c7505137b [0,1,0,1,0,0|1,0,1]=4 9207 B12R1.460 CC/C=C\C(=O)N1CCC[C@H]1C 7ba6a6697bb64c1de0689192454f19a5 [0,1,0,1,0,0|1,0,1]=4 9208 B12R1.460 CC1CCCN1C(=O)CCCF ab6185dbce78370c134fcf8989278135 [0,1,0,1,0,0|2,0,0]=4 9209 B12R1.460 CC1CCCN1C(=O)CCCS 216d8bf6b539f6f8ecfb9fd3a6c60345 [0,1,0,1,0,0|2,0,0]=4 9210 B12R1.460 CC1CCCN1C(=O)NCCF bd3d9ef974a0d6ffea256f073269c68e [0,1,0,1,0,0|2,0,0]=4 9211 B12R1.460 CC1CCCN1C(=O)NCCN 41b294aba64fc2f66ed67f2c6442d916 [0,1,0,1,0,0|2,0,0]=4 9212 B12R1.460 CC1CCCN1C(=O)NCCO 53a3e18e559ca68ce98e2c6ec1230d15 [0,1,0,1,0,0|2,0,0]=4 9213 B12R1.460 CC1CCCN1C(=O)NCCS 3634bab29571b1583e80e9bf6cbfa328 [0,1,0,1,0,0|2,0,0]=4 9214 B12R1.460 CCC#CC(=O)N1CCCC1C 4b45e5c5a6637bd2e18a64e0d58bc033 [0,1,0,1,0,0|1,0,1]=4 9215 B12R1.460 CCC#CC(=O)N1CCC[C@@H]1C 00cd931d1f6e11e54468b8448a21d874 [0,1,0,1,0,0|1,0,1]=4 9216 B12R1.460 CCC#CC(=O)N1CCC[C@H]1C ecb1c62954b7561c0c0869cc02ae7878 [0,1,0,1,0,0|1,0,1]=4 9217 B12R1.460 CCC=CC(=O)N1CCCC1C 5291beeb801efac51f7768c85ef354b1 [0,1,0,1,0,0|1,0,1]=4 9218 B12R1.460 CCC=CC(=O)N1CCC[C@@H]1C 5da4e4af3913a5ec7c24fa3be9b69646 [0,1,0,1,0,0|1,0,1]=4 9219 B12R1.460 CCC=CC(=O)N1CCC[C@H]1C 72f867dd1dacb31afd050aa389f06152 [0,1,0,1,0,0|1,0,1]=4 9220 B12R1.460 CCCCC(=O)N1CCCC1C 0e685beda1e3f942c1d396019f13eace [0,1,0,1,0,0|1,0,0]=3 9221 B12R1.460 CCCCC(=O)N1CCCC1O 0519c6dc3e1f2cbaad46ba1a29f9881a [0,1,0,1,0,0|2,0,0]=4 9222 B12R1.460 CCCCC(=O)N1CCC[C@@H]1C ff6830781dd2398e65d557bbf6a92b09 [0,1,0,1,0,0|1,0,0]=3 9223 B12R1.460 CCCCC(=O)N1CCC[C@H]1C 7cd825f92b5fd2c2a80cf77f89d0bab0 [0,1,0,1,0,0|1,0,0]=3 9224 B12R1.460 CCCCC(=O)N1CCSC1C 1ae6f8361645ff8d730e43bba70e450c [0,1,0,1,0,0|2,0,0]=4 9225 B12R1.460 CCCNC(=O)C1CCCN1C e5eaa0f70eaab942c96834eae738e91b [0,1,0,1,0,0|1,0,0]=3 9226 B12R1.460 CCCNC(=O)N1CCCC1C 844df2919cece1d86154827cd7e43c96 [0,1,0,1,0,0|1,0,0]=3 9227 B12R1.460 CCCNC(=O)N1CCCC1O 18e47abb292009e38d60a5b97eac42b9 [0,1,0,1,0,0|2,0,0]=4 9228 B12R1.460 CCCNC(=O)N1CCC[C@@H]1C 630c34c023f854eada20222af90cc48c [0,1,0,1,0,0|1,0,0]=3 9229 B12R1.460 CCCNC(=O)N1CCC[C@H]1C 0237f4914670e20b33420173e8ef224d [0,1,0,1,0,0|1,0,0]=3 9230 B12R1.460 CCCNC(=O)N1CCSC1C 13a4162847556cb39c512cc014bad15e [0,1,0,1,0,0|2,0,0]=4 9231 B12R1.460 CCCNC(=O)[C@@H]1CCCN1C e12fae9457ba300a33db96f0cbd08a91 [0,1,0,1,0,0|1,0,0]=3 9232 B12R1.460 CCCNC(=O)[C@@H]1CSCN1C f6bef4176c10fa47a1fd8d07e1d221db [0,1,0,1,0,0|2,0,0]=4 9233 B12R1.460 CCCNC(=O)[C@H]1CCCN1C c2e98d6feb989eca873cc8b21b29fc0d [0,1,0,1,0,0|1,0,0]=3 9234 B12R1.460 CCCNC(=S)N1CCCC1C 670d992885cda2874e900e9d44ba2274 [0,1,0,1,0,0|1,1,0]=4 9235 B12R1.460 CCCNC(=S)N1CCC[C@@H]1C a52bacd956360bd7aa3698c0629474f9 [0,1,0,1,0,0|1,1,0]=4 9236 B12R1.460 CCCNC(=S)N1CCC[C@H]1C a884c5cb913d574f0e84a7d4cb6ad11c [0,1,0,1,0,0|1,1,0]=4 9237 B12R1.460 CCCOC(C)[C@@H]1CCCN1C 5513bb7d637e96909ec613aaeb51724c [0,1,0,1,0,0|1,0,1]=4 9238 B12R1.460 CCCO[C@@H](C)[C@@H]1CCCN1C dc64753195ec43f2f57bb4fe19f7987e [0,1,0,1,0,0|1,0,1]=4 9239 B12R1.460 CCNCC(=O)N1CCCC1C 1108bc4d6ea5005f0b939a6919d63e8c [0,1,0,1,0,0|2,0,0]=4 9240 B12R1.460 CCOCC(=O)N1CCCC1C 6575dedda585200bbc49b8e5d9ade6ad [0,1,0,1,0,0|2,0,0]=4 9241 B12R1.460 CCOCC(=O)N1CCC[C@@H]1C cd3692267d7fb548028365e56d7d038b [0,1,0,1,0,0|2,0,0]=4 9242 B12R1.460 CCOCC(=O)N1CCC[C@H]1C 57ba7a4a65b45fd9086748d440eea047 [0,1,0,1,0,0|2,0,0]=4 9243 B12R1.460 CCSCC(=O)N1CCCC1C 137a784b3549a4361929a5d4ce56dc5b [0,1,0,1,0,0|2,0,0]=4 9244 B12R1.460 CCSCC(=O)N1CCC[C@@H]1C ed9ed244f0d776a4272fea6e092f329d [0,1,0,1,0,0|2,0,0]=4 9245 B12R1.460 CCSCC(=O)N1CCC[C@H]1C c835a31328341f7ef3ebca0e35084f15 [0,1,0,1,0,0|2,0,0]=4 9246 B12R1.460 CN1CCCC1C(=O)NCCF ef522aefbc381e18965e03828c610df8 [0,1,0,1,0,0|2,0,0]=4 9247 B12R1.460 CN1CCCC1C(=O)NCCI a9eb466b690bc9a237c911c2e669f922 [0,1,0,1,0,0|2,0,0]=4 9248 B12R1.460 CN1CCCC1C(=O)NCCO 4c1524cb6e7c0abfb315c23dfdb34fa2 [0,1,0,1,0,0|2,0,0]=4 9249 B12R1.460 CN1CCCC1C(=O)NCCS b39f4629dc9e7b74f266c08e724698e8 [0,1,0,1,0,0|2,0,0]=4 9250 B12R1.460 CN1CCC[C@@H]1C(=O)NCCF 4cd9e65f871535cd65f3ed8daf8f87e9 [0,1,0,1,0,0|2,0,0]=4 9251 B12R1.460 CN1CCC[C@@H]1C(=O)NCCI 7f363c53af4b3cc786da9ee553466a8f [0,1,0,1,0,0|2,0,0]=4 9252 B12R1.460 CN1CCC[C@@H]1C(=O)NCCO ce91cda544683d0906ee23f154e37771 [0,1,0,1,0,0|2,0,0]=4 9253 B12R1.460 CN1CCC[C@@H]1C(=O)NCCS bd5a806a7b2677f8f517903f6efa92bb [0,1,0,1,0,0|2,0,0]=4 9254 B12R1.460 CN1CCC[C@H]1C(=O)NCCF dafe0e6c5d0db2a01ace8f0e2989b877 [0,1,0,1,0,0|2,0,0]=4 9255 B12R1.460 CN1CCC[C@H]1C(=O)NCCI 2b2b35e6be0066ec118039683138f2f4 [0,1,0,1,0,0|2,0,0]=4 9256 B12R1.460 CN1CCC[C@H]1C(=O)NCCO 8ea9aec82b6704786aeadbc3a564dbd0 [0,1,0,1,0,0|2,0,0]=4 9257 B12R1.460 CN1CCC[C@H]1C(=O)NCCS ce9b45353df599e1af0966df21d6fe2a [0,1,0,1,0,0|2,0,0]=4 9258 B12R1.460 COCCC(=O)N1CCCC1C 9fca8a8929e8d737f32521a1e12e7fa5 [0,1,0,1,0,0|2,0,0]=4 9259 B12R1.460 COCCC(=O)N1CCC[C@@H]1C 18dc3b9f9854495e6f5a24f08362e7ca [0,1,0,1,0,0|2,0,0]=4 9260 B12R1.460 COCCC(=O)N1CCC[C@H]1C 77c2d2e07158215d855793764fe00eb5 [0,1,0,1,0,0|2,0,0]=4 9261 B12R1.460 CSCCC(=O)N1CCCC1C 8265eaf594237d46cc8268ee3b2ea656 [0,1,0,1,0,0|2,0,0]=4 9262 B12R1.460 CSCCC(=O)N1CCC[C@@H]1C 6bd66ecefa54f19b6ccd57c8bb64c3c2 [0,1,0,1,0,0|2,0,0]=4 9263 B12R1.460 CSCCC(=O)N1CCC[C@H]1C d1dfad48503d4cabdd963f0a3f900972 [0,1,0,1,0,0|2,0,0]=4 9264 B12R1.460 C[C@@H]1CCCN1C(=O)CCCF 91cc078ed9b1c92a33990ecfccf53d8e [0,1,0,1,0,0|2,0,0]=4 9265 B12R1.460 C[C@@H]1CCCN1C(=O)CCCS b659ec4ae84bf20c9c4d23ab97a5c736 [0,1,0,1,0,0|2,0,0]=4 9266 B12R1.460 C[C@@H]1CCCN1C(=O)NCCF aac6afc031714d6caf6f69fd02eaee3c [0,1,0,1,0,0|2,0,0]=4 9267 B12R1.460 C[C@@H]1CCCN1C(=O)NCCN feeb00c3bdd139d3e430f728bba3b2be [0,1,0,1,0,0|2,0,0]=4 9268 B12R1.460 C[C@@H]1CCCN1C(=O)NCCO c0b3d16d8c7d94113348f0b2e78aae89 [0,1,0,1,0,0|2,0,0]=4 9269 B12R1.460 C[C@@H]1CCCN1C(=O)NCCS 92cd013e8ee9bce80cd5cf42e8d19cc6 [0,1,0,1,0,0|2,0,0]=4 9270 B12R1.460 C[C@H]1CCCN1C(=O)CCCF 9082733a9f6516dc729a4e763b28f68b [0,1,0,1,0,0|2,0,0]=4 9271 B12R1.460 C[C@H]1CCCN1C(=O)CCCS 40fee837f16560c90e34f16bfcf67b14 [0,1,0,1,0,0|2,0,0]=4 9272 B12R1.460 C[C@H]1CCCN1C(=O)NCCF 0f099a5fe18119c28919639df9999c4e [0,1,0,1,0,0|2,0,0]=4 9273 B12R1.460 C[C@H]1CCCN1C(=O)NCCN 96fc3f599bb7de7e3bc73dc4f65bec8e [0,1,0,1,0,0|2,0,0]=4 9274 B12R1.460 C[C@H]1CCCN1C(=O)NCCO 47ff76f9e525d6a07eec70c7504ae53b [0,1,0,1,0,0|2,0,0]=4 9275 B12R1.460 C[C@H]1CCCN1C(=O)NCCS c7682df529e3fbcd0785a0ab045e9683 [0,1,0,1,0,0|2,0,0]=4 9276 B12R1.462 CC1CC(C1)CC(=O)NCCBr dc5ef97d720b21461755faf68ed9053c [0,1,0,1,0,0|2,0,0]=4 9277 B12R1.462 CC1CC(C1)CC(=O)NCCF f53b0a45035a3ffde689034879b58fd1 [0,1,0,1,0,0|2,0,0]=4 9278 B12R1.462 CC1CC(C1)CC(=O)NCCI 6bf9f8a2175bc2cbe297617286bf54b9 [0,1,0,1,0,0|2,0,0]=4 9279 B12R1.462 CC1CC(C1)CC(=O)NCCO ee566ebab8ddc4b5e2589daf7521f9b6 [0,1,0,1,0,0|2,0,0]=4 9280 B12R1.462 CC1CC(C1)CC(=O)NCCS 6dae1d945b7302c108c914741546b244 [0,1,0,1,0,0|2,0,0]=4 9281 B12R1.462 CCCCC(=O)NC1CC(C1)F f25cb3543497587550e1dbf1254326b9 [0,1,0,1,0,0|2,0,0]=4 9282 B12R1.462 CCCCC(=O)NC1CC(C1)O c2ff1aca4c31c37f7097bf1189d3b589 [0,1,0,1,0,0|2,0,0]=4 9283 B12R1.462 CCCCC(=O)N[C@H]1C[C@@H](C1)F 4b53cab308e68ef040be8035c3d8f6b8 [0,1,0,1,0,0|2,0,0]=4 9284 B12R1.462 CCCCC(=O)N[C@H]1C[C@@H](C1)O 9bd700fd7cc248d32caff96653767ad3 [0,1,0,1,0,0|2,0,0]=4 9285 B12R1.462 CCCCC(=O)N[C@H]1C[C@H](C1)F 730a3e66f7ef64d6466983269e9e1d51 [0,1,0,1,0,0|2,0,0]=4 9286 B12R1.462 CCCCC(=O)N[C@H]1C[C@H](C1)O ed8f10c82e1ae520bc716c7f16681854 [0,1,0,1,0,0|2,0,0]=4 9287 B12R1.462 CCCNC(=O)CC1CC(=O)C1 9f83bed3f09de9cbd786beb27ff17a78 [0,1,0,1,0,0|1,0,1]=4 9288 B12R1.462 CCCNC(=O)CC1CC(C1)C 605afeabdb9e07adacabbf27b66f325a [0,1,0,1,0,0|1,0,0]=3 9289 B12R1.462 CCCNC(=O)CN1CC(C1)F 6d506ffdcbdef7a26ae8a8db98fc9003 [0,1,0,1,0,0|2,0,0]=4 9290 B12R1.462 CCCNC(=O)CN1CC(C1)O d681ea2ebf8595ace18d2a82aeb5ecac [0,1,0,1,0,0|2,0,0]=4 9291 B12R1.462 CCCNC(=O)C[C@H]1C[C@@H](C1)F 1cefea136fe35aa86ed69e70405fc813 [0,1,0,1,0,0|1,0,0]=3 9292 B12R1.462 CCCNC(=O)C[C@H]1C[C@@H](C1)O 38920259f365d12e32d1415322f9194d [0,1,0,1,0,0|1,0,0]=3 9293 B12R1.462 CCCNC(=O)C[C@H]1C[C@H](C1)O b0381dceb3f056ec8083a4aa306b9774 [0,1,0,1,0,0|1,0,0]=3 9294 B12R1.462 CCCNC(=O)NC1CC(C1)F 4dd9780548bde5b7c5bf9c67036168a8 [0,1,0,1,0,0|2,0,0]=4 9295 B12R1.462 CCCNC(=O)NC1CC(C1)N bd1e651c4339b709acbd915557fbfc23 [0,1,0,1,0,0|2,0,0]=4 9296 B12R1.462 CCCNC(=O)NC1CC(C1)O 8e7f28c41f1dce9122dda2f3d56545c0 [0,1,0,1,0,0|2,0,0]=4 9297 B12R1.462 CCCNC(=O)N[C@H]1C[C@@H](C1)F d002b608813f477760aeaa47f8b242af [0,1,0,1,0,0|2,0,0]=4 9298 B12R1.462 CCCNC(=O)N[C@H]1C[C@@H](C1)N bbda223051f6df8362b68e8e65a11ad8 [0,1,0,1,0,0|2,0,0]=4 9299 B12R1.462 CCCNC(=O)N[C@H]1C[C@@H](C1)O 679d47cf45ef744bed892fef4a5a5356 [0,1,0,1,0,0|2,0,0]=4 9300 B12R1.462 CCCNC(=O)N[C@H]1C[C@H](C1)F 7df4f0ac943e322a2c9d037c91dcc560 [0,1,0,1,0,0|2,0,0]=4 9301 B12R1.462 CCCNC(=O)N[C@H]1C[C@H](C1)O f915e3c4224c9f3aa6321a0df2cadcb1 [0,1,0,1,0,0|2,0,0]=4 9302 B12R1.462 CCCOC(=O)CN1CC(C1)F 765630fc66ded2ca6aff42cafdd2714e [0,1,0,1,0,0|1,0,0]=3 9303 B12R1.462 CCCOC(=O)CN1CC(C1)O cc01219c6696941755a26afb2a5406d9 [0,1,0,1,0,0|1,0,0]=3 9304 B12R1.462 O=C(C[C@H]1C[C@@H](C1)F)NCCBr 75eb0388ad7db84b835b23c91bb2abc4 [0,1,0,1,0,0|2,0,0]=4 9305 B12R1.462 O=C(C[C@H]1C[C@@H](C1)F)NCCF 961ea181ee0012384534fbd7a453143b [0,1,0,1,0,0|2,0,0]=4 9306 B12R1.462 O=C(C[C@H]1C[C@@H](C1)F)NCCI 6e77614817b45ec7ff806e1aac2f9823 [0,1,0,1,0,0|2,0,0]=4 9307 B12R1.462 O=C(C[C@H]1C[C@@H](C1)F)NCCO fdd14c2ff241ed83f3ce96794fc5d83f [0,1,0,1,0,0|2,0,0]=4 9308 B12R1.462 O=C(C[C@H]1C[C@@H](C1)F)NCCS e05aea3dd9b0c06882d619db01bb2451 [0,1,0,1,0,0|2,0,0]=4 9309 B12R1.462 O=C(C[C@H]1C[C@@H](C1)O)NCCBr b444d8dd70a8872f209095058453412c [0,1,0,1,0,0|2,0,0]=4 9310 B12R1.462 O=C(C[C@H]1C[C@@H](C1)O)NCCF b5e748cf9f25ae28ad8341ddb5ea50d2 [0,1,0,1,0,0|2,0,0]=4 9311 B12R1.462 O=C(C[C@H]1C[C@@H](C1)O)NCCI 8bc357fa090daceb3921bbfc174b9619 [0,1,0,1,0,0|2,0,0]=4 9312 B12R1.462 O=C(C[C@H]1C[C@@H](C1)O)NCCO 7b637c7221ba209da6c807c7b2a26bc3 [0,1,0,1,0,0|2,0,0]=4 9313 B12R1.462 O=C(C[C@H]1C[C@@H](C1)O)NCCS 18d1fa8ccf416c15c93668d96036e0a1 [0,1,0,1,0,0|2,0,0]=4 9314 B12R1.462 O=C(C[C@H]1C[C@H](C1)O)NCCBr fc11b4ca5cc2a33b1d6430c9a4b9a1bf [0,1,0,1,0,0|2,0,0]=4 9315 B12R1.462 O=C(C[C@H]1C[C@H](C1)O)NCCF 5ca137971f146ad25689c8e82a3330e1 [0,1,0,1,0,0|2,0,0]=4 9316 B12R1.462 O=C(C[C@H]1C[C@H](C1)O)NCCI 8068b7a8a35a0e80d5346832627f4586 [0,1,0,1,0,0|2,0,0]=4 9317 B12R1.462 O=C(C[C@H]1C[C@H](C1)O)NCCO 8114e0e57c4a6616f075a53c8c7fe7c3 [0,1,0,1,0,0|2,0,0]=4 9318 B12R1.462 O=C(C[C@H]1C[C@H](C1)O)NCCS 5e2a59a0909ba825309f1a7f1eb5f4f5 [0,1,0,1,0,0|2,0,0]=4 9319 B12R1.466 CCC1CC1CC(=O)NCCBr 30a7fe90817968442fdf68c709da5bdd [0,1,0,1,0,0|2,0,0]=4 9320 B12R1.466 CCC1CC1CC(=O)NCCF efa46cd94d49daa4680c19efb41fcdad [0,1,0,1,0,0|2,0,0]=4 9321 B12R1.466 CCC1CC1CC(=O)NCCI ed48647627fb17af287a7c4983e20ac3 [0,1,0,1,0,0|2,0,0]=4 9322 B12R1.466 CCC1CC1CC(=O)NCCO d301529b5ee446536437891766b7c357 [0,1,0,1,0,0|2,0,0]=4 9323 B12R1.466 CCC1CC1CC(=O)NCCS 563d65edc379de6d896fc40683bf4b6d [0,1,0,1,0,0|2,0,0]=4 9324 B12R1.466 CCCCC(=O)N[C@@H]1C[C@@H]1OC 6a0b1d0441195b066279d8848557052e [0,1,0,1,0,0|2,0,0]=4 9325 B12R1.466 CCCCC(=O)N[C@@H]1C[C@H]1CO cc2e481e9b57fe68ba950c477bf074f3 [0,1,0,1,0,0|2,0,0]=4 9326 B12R1.466 CCCCC(=O)N[C@H]1C[C@@H]1CO 5717f33d4130561bfbdcb408a7c15ea6 [0,1,0,1,0,0|2,0,0]=4 9327 B12R1.466 CCCCC(=O)N[C@H]1C[C@H]1CO b179cab7f7a3eef8404795dd65992bb2 [0,1,0,1,0,0|2,0,0]=4 9328 B12R1.466 CCCNC(=O)CC1CC1CC a79fe7cf3061965e7dfd07a8c3be8357 [0,1,0,1,0,0|1,0,0]=3 9329 B12R1.466 CCCNC(=O)N[C@@H]1C[C@@H]1OC cb259f9ede7ec45e416005ba3c6301bb [0,1,0,1,0,0|2,0,0]=4 9330 B12R1.466 CCCNC(=O)N[C@@H]1C[C@H]1CO 26c585a1d035d4497a9c19c1c4c4fac0 [0,1,0,1,0,0|2,0,0]=4 9331 B12R1.466 CCCNC(=O)N[C@H]1C[C@@H]1CO a67e067c1ef3d582c777292c44eb528d [0,1,0,1,0,0|2,0,0]=4 9332 B12R1.466 CCCNC(=O)N[C@H]1C[C@H]1CO 2e29de6ad2077c43fba1854460ef4c45 [0,1,0,1,0,0|2,0,0]=4 9333 B12R1.519 C=C(CCC)CC(=O)N1CCC1 c27e66a0da9af8e615fee8da34ddf391 [0,1,0,1,0,0|1,0,1]=4 9334 B12R1.519 CCCC(=O)CC(=O)N1CCC1 d847c7f9720dd44fe41ecf89488d9431 [0,1,0,1,0,0|1,0,1]=4 9335 B12R1.519 CCCC(C)CC(=O)N1CCC1 dc65e792c5838a3965a333dd09936f42 [0,1,0,1,0,0|1,0,0]=3 9336 B12R1.519 CCCC(C)NC(=O)N1CCC1 ce26ba4651639d3b5d596030b31ea6bf [0,1,0,1,0,0|2,0,0]=4 9337 B12R1.519 CCCC(O)CC(=O)N1CCC1 051c07ad906e220f8ca81027edfba94f [0,1,0,1,0,0|1,0,0]=3 9338 B12R1.519 CCCN(C)CC(=O)C1CCC1 212a5444179f907e56ff5c8b5fbe225c [0,1,0,1,0,0|2,0,0]=4 9339 B12R1.519 CCCN(C)CC(=O)N1CCC1 faa050e17dcde9367b9ffb6f97e772f1 [0,1,0,1,0,0|2,0,0]=4 9340 B12R1.519 CCCS(=O)CC(=O)N1CCC1 9db538ee07e8ff1efdb06fb9ff963631 [0,1,0,1,0,0|2,0,0]=4 9341 B12R1.519 CCC[C@H](C)NC(=O)N1CCC1 a49caf6aff143e6cc1ae02402b394415 [0,1,0,1,0,0|2,0,0]=4 9342 B12R1.519 CCSC(C)CC(=O)N1CCC1 646b93d42e57fa8e8a8841d4ac05b34d [0,1,0,1,0,0|2,0,0]=4 9343 B12R1.519 COCC(C)CC(=O)N1CCC1 011047730b411e211f29d773e12ff00a [0,1,0,1,0,0|2,0,0]=4 9344 B12R1.521 C=C(CCC)CC(=O)NC1CC1 42fbc1226a5dcd4840084819bb9e9d90 [0,1,0,1,0,0|1,0,1]=4 9345 B12R1.521 CCCC(=O)CC(=O)NC1CC1 d7dc3c4fa26ade7e345b1d32e3fdd40e [0,1,0,1,0,0|1,0,1]=4 9346 B12R1.521 CCCC(C)CC(=O)NC1CC1 1887f6dfd10a62dc86646eb04323a483 [0,1,0,1,0,0|1,0,0]=3 9347 B12R1.521 CCCC(C)CC(C)OC1CC1 0618a15f727d458039c60616bfff9f3e [0,1,0,1,0,0|1,0,1]=4 9348 B12R1.521 CCCC(C)NC(=O)CC1CC1 2684af2f99de003e4090ee2d4346a65f [0,1,0,1,0,0|2,0,0]=4 9349 B12R1.521 CCCC(C)NC(=O)NC1CC1 48bb7341c9040d6a220e78116a96eefe [0,1,0,1,0,0|2,0,0]=4 9350 B12R1.521 CCCC(O)CC(=O)NC1CC1 cda25d26a4c0081111c2942451bf551c [0,1,0,1,0,0|1,0,0]=3 9351 B12R1.521 CCCN(C)CC(=O)NC1CC1 392ba455a78674bc9a3b0b7e37f5ff33 [0,1,0,1,0,0|2,0,0]=4 9352 B12R1.521 CCCS(=O)CC(=O)NC1CC1 08fbcae1f1f420c391fb2d0bdb66971e [0,1,0,1,0,0|2,0,0]=4 9353 B12R1.521 CCC[C@H](C)NC(=O)CC1CC1 3c490c6ad81d347361133dbf7b121143 [0,1,0,1,0,0|2,0,0]=4 9354 B12R1.521 CCC[C@H](C)NC(=O)NC1CC1 0c24f209fc2dc599d0d3be663c975bb3 [0,1,0,1,0,0|2,0,0]=4 9355 B12R1.521 CCSC(C)CC(=O)NC1CC1 0e9020a419368d4d271a1a2628abb5e0 [0,1,0,1,0,0|2,0,0]=4 9356 B12R1.521 COCC(C)CC(=O)NC1CC1 ecfed3c5c0d03119dbecd6a9c8c041f3 [0,1,0,1,0,0|2,0,0]=4 9357 B12R1.841 CC(CC(=O)NCCBr)C1CC1 7fd769445c07ec4fb60c8f8b7ec958b6 [0,1,0,1,0,0|2,0,0]=4 9358 B12R1.841 CC(CC(=O)NCCF)C1CC1 ed26d5e5b55b8485869fd22d1df99fe6 [0,1,0,1,0,0|2,0,0]=4 9359 B12R1.841 CC(CC(=O)NCCI)C1CC1 8714c4fe1fc4e1e28e4d6050b6e1c7ed [0,1,0,1,0,0|2,0,0]=4 9360 B12R1.841 CC(CC(=O)NCCO)C1CC1 ab9956e4415871024bba1bebf32efe1e [0,1,0,1,0,0|2,0,0]=4 9361 B12R1.841 CC(CC(=O)NCCS)C1CC1 26489675ee7e9c4db1ce80dc8da08cf7 [0,1,0,1,0,0|2,0,0]=4 9362 B12R1.841 CCCCC(=O)N[C@@H](C)C1CC1 65b6fd7041833bd344baa4d4cda96676 [0,1,0,1,0,0|2,0,0]=4 9363 B12R1.841 CCCCC(=O)N[C@H](C)C1CC1 98aed1d5eeffd20b2fd3dda3dbaab34d [0,1,0,1,0,0|2,0,0]=4 9364 B12R1.841 CCCNC(=O)CC(C)C1CC1 085a3ec1dccb066bc7ca944f9dec75d8 [0,1,0,1,0,0|1,0,0]=3 9365 B12R1.841 CCCNC(=O)CC(O)C1CC1 51622168f031059d693fb83ac2fe9d50 [0,1,0,1,0,0|1,0,0]=3 9366 B12R1.841 CCCNC(=O)CN(C)C1CC1 c697161890166cea9371178902704573 [0,1,0,1,0,0|2,0,0]=4 9367 B12R1.841 CCCNC(=O)N[C@@H](C)C1CC1 99616e0faaec8b9b2a3eb8d058afd50b [0,1,0,1,0,0|2,0,0]=4 9368 B12R1.841 CCCNC(=O)N[C@H](C)C1CC1 a59a41c43c237ce34dce8acc18fcd488 [0,1,0,1,0,0|2,0,0]=4 9369 B12R1.841 CCCOC(=O)CN(C)C1CC1 9e9aab63eac7a1cd8712d0d94d16c26a [0,1,0,1,0,0|1,0,0]=3 9370 B12R1.841 O=C(CC(O)C1CC1)NCCBr d4efc27abd06bfb091b72e218e646975 [0,1,0,1,0,0|2,0,0]=4 9371 B12R1.841 O=C(CC(O)C1CC1)NCCF 46921aa8effe0715c3f2a517c1814147 [0,1,0,1,0,0|2,0,0]=4 9372 B12R1.841 O=C(CC(O)C1CC1)NCCI 9980f94c4026d81d4dab71987eebe4e6 [0,1,0,1,0,0|2,0,0]=4 9373 B12R1.841 O=C(CC(O)C1CC1)NCCO f442372ed30b4ac255571545f3275678 [0,1,0,1,0,0|2,0,0]=4 9374 B12R1.841 O=C(CC(O)C1CC1)NCCS 82088d58d04c32c96d3c17c0c8e6e29d [0,1,0,1,0,0|2,0,0]=4 9375 B12R1.1155 CCCN1C[C@H](CC1=O)OCC cf312d16989cfeb02705469cbe6e4e4e [0,1,0,1,0,0|2,0,0]=4 9376 B12R1.2031 CCCCC(=O)N1C(CC1C)C 800e08ea69ed64e00b53309adfba894d [0,1,0,1,0,0|2,0,0]=4 9377 B12R1.2031 CCCCC(=O)N1[C@@H](C[C@@H]1C)C 5da540991535451ffd97af038300a6f6 [0,1,0,1,0,0|2,0,0]=4 9378 B12R1.2031 CCCCC(=O)N1[C@@H](C[C@H]1C)C cec38939a9ad74aa940b281941ca9bda [0,1,0,1,0,0|2,0,0]=4 9379 B12R1.2031 CCCCC(=O)N1[C@H](C[C@@H]1C)C c131d60407909d1558e8f2f4e39d8c19 [0,1,0,1,0,0|2,0,0]=4 9380 B12R1.2031 CCCNC(=O)N1C(CC1C)C e104cfdbd1285d0a497c8e9928f16096 [0,1,0,1,0,0|2,0,0]=4 9381 B12R1.2031 CCCNC(=O)N1[C@@H](C[C@@H]1C)C 893eedb70d07608b76fde140eb2ecfcb [0,1,0,1,0,0|2,0,0]=4 9382 B12R1.2031 CCCNC(=O)N1[C@@H](C[C@H]1C)C 89343d30735a3aeaf2216c59e4aaf4df [0,1,0,1,0,0|2,0,0]=4 9383 B12R1.2031 CCCNC(=O)N1[C@H](C[C@@H]1C)C 716347545693d2fb12face8ab21d2cce [0,1,0,1,0,0|2,0,0]=4 9384 B12R1.2031 CCCNC(=O)[C@@H]1[C@@H](CN1C)C 19af8e20e273dc0708fab7c6507d5d5d [0,1,0,1,0,0|2,0,0]=4 9385 B12R1.2044 CC1(CCC1)CC(=O)NCCBr bb9f63eca12ebfa885284802c71786df [0,1,0,1,0,0|2,0,0]=4 9386 B12R1.2044 CC1(CCC1)CC(=O)NCCF 3d2f1be50832e431e5c760274882426d [0,1,0,1,0,0|2,0,0]=4 9387 B12R1.2044 CC1(CCC1)CC(=O)NCCI cff5e6da881a0f5b81ec5bcbc5ced12b [0,1,0,1,0,0|2,0,0]=4 9388 B12R1.2044 CC1(CCC1)CC(=O)NCCO ecede3199d725b4da7512b331a485822 [0,1,0,1,0,0|2,0,0]=4 9389 B12R1.2044 CC1(CCC1)CC(=O)NCCS 7bf12d5903a2040c1199f45eb28d89c4 [0,1,0,1,0,0|2,0,0]=4 9390 B12R1.2044 CCCCC(=O)NC1(CCC1)C c2801fc0eaffad1b280584c4a52a3b1e [0,1,0,1,0,0|2,0,0]=4 9391 B12R1.2044 CCCNC(=O)CC1(CCC1)C 9ce236f50ee61cece35ab50d94707768 [0,1,0,1,0,0|1,0,0]=3 9392 B12R1.2044 CCCNC(=O)CC1(CCC1)O 1e13d23986bc0a6819421fb4b73aa030 [0,1,0,1,0,0|1,0,0]=3 9393 B12R1.2044 CCCNC(=O)CC1(CSC1)O 521bd4866f686324b2f26c27b993cefc [0,1,0,1,0,0|2,0,0]=4 9394 B12R1.2044 CCCNC(=O)NC1(CCC1)C 578d0a66f39a2a97826e9859257ee2cc [0,1,0,1,0,0|2,0,0]=4 9395 B12R1.2044 O=C(CC1(CCC1)O)NCCF 6943977014bc3ff0f2e8526460845417 [0,1,0,1,0,0|2,0,0]=4 9396 B12R1.2044 O=C(CC1(CCC1)O)NCCI e2c688e70afd04bca6bd340cf3b178b6 [0,1,0,1,0,0|2,0,0]=4 9397 B12R1.2044 O=C(CC1(CCC1)O)NCCO 35f98893fdd33214dd12bfaa8dcea3a6 [0,1,0,1,0,0|2,0,0]=4 9398 B12R1.2044 O=C(CC1(CCC1)O)NCCS aad687976222e257d351daca598df882 [0,1,0,1,0,0|2,0,0]=4 9399 B12R1.18 C#CCOC1CCCCCC1=O ada0fe1641180911fd463d44d9af2803 [0,1,0,1,0,0|0,0,2]=4 9400 B12R1.18 C=CCOC1CCCCCC1=O b3cb880d8f9d9adc37f80c4ed40c84b7 [0,1,0,1,0,0|0,0,2]=4 9401 B12R1.18 CCCNC1CCCCCC1=O f3f393887363398b7fbe92d37dd3e1fa [0,1,0,1,0,0|1,0,0]=3 9402 B12R1.18 CCCNC1CCCCNC1=O 5d0e2872b61eb3c2267a59c55f8742c4 [0,1,0,1,0,0|2,0,0]=4 9403 B12R1.18 CCCN[C@@H]1CCCCNC1=O 8fcecb64fa38650420280a7152151968 [0,1,0,1,0,0|2,0,0]=4 9404 B12R1.18 CCCN[C@H]1CCCCNC1=O b31e0a64a7315e1106bc7fd59e79b4a3 [0,1,0,1,0,0|2,0,0]=4 9405 B12R1.18 CCCOC1CCCCCC1=O 4ba42e6fd237c418e07f214d26aae088 [0,1,0,1,0,0|0,0,0]=2 9406 B12R1.18 CCCOC1CCCCNC1=O 84e533f3c33adce4300be5f475cea46e [0,1,0,1,0,0|1,0,0]=3 9407 B12R1.18 CCOCN1CCCCCC1=O e87528f86aa0ece4ca14e3461284ca9e [0,1,0,1,0,0|1,0,0]=3 9408 B12R1.18 COCOC1CCCCCC1=O 10fecf3c88b91d89befb9b81f738b984 [0,1,0,1,0,0|1,0,0]=3 9409 B12R1.18 COCOC1CCCCNC1=O c16c5b28852f255d71146a865a41b042 [0,1,0,1,0,0|2,0,0]=4 9410 B12R1.18 CSCOC1CCCCCC1=O d39e9fc8fb79a3e3963500dccc28099f [0,1,0,1,0,0|1,0,0]=3 9411 B12R1.18 N#CCOC1CCCCCC1=O 5bbac00af645a6a1037db090b2b59d74 [0,1,0,1,0,0|1,0,1]=4 9412 B12R1.18 O=C1CCCCCC1NCCI 34940666d4eebc8a7253549595a8e8bc [0,1,0,1,0,0|2,0,0]=4 9413 B12R1.18 O=C1CCCCCC1NCCO 6beeb3978b5a99290a2455388689137a [0,1,0,1,0,0|2,0,0]=4 9414 B12R1.18 O=C1CCCCCC1NCCS d449417aca75bbcd9e53a5784b706c12 [0,1,0,1,0,0|2,0,0]=4 9415 B12R1.18 O=C1CCCCCC1OCCF 0380f61176c2937d4ddefb5b274a6b0d [0,1,0,1,0,0|1,0,0]=3 9416 B12R1.18 O=C1CCCCCC1OCCS d0fc6788b006a9e800a1a34a31a9c831 [0,1,0,1,0,0|1,0,0]=3 9417 B12R1.18 O=C1CCCCCN1COCF 25d4ba68c6a9fa6539fce6e1f0dd7f29 [0,1,0,1,0,0|2,0,0]=4 9418 B12R1.18 O=C1NCCCCC1OCCF 6458722d00820951bd14307ae9e8b8d9 [0,1,0,1,0,0|2,0,0]=4 9419 B12R1.18 O=C1NCCCCC1OCCS 3e9cdcaeff1a1bc5f738970286586a10 [0,1,0,1,0,0|2,0,0]=4 9420 B12R1.18 O=CCOC1CCCCCC1=O 3d54da6f35fa8c64507e26a04e44d0d7 [0,1,0,1,0,0|1,0,1]=4 9421 B12R1.29 CC1CCC(O1)C(=O)NCCBr 710c24cd75d6c3893c64f7988ddb59ab [0,1,0,1,0,0|2,0,0]=4 9422 B12R1.29 CC1CCC(O1)C(=O)NCCF 35e16cd5e02ac9a8339b9a45d40d3b42 [0,1,0,1,0,0|2,0,0]=4 9423 B12R1.29 CC1CCC(O1)C(=O)NCCI eabb039cb115c2bdbd0523c2a87c4e70 [0,1,0,1,0,0|2,0,0]=4 9424 B12R1.29 CC1CCC(O1)C(=O)NCCO cec9c70fa5dbec1948837507e07c0af8 [0,1,0,1,0,0|2,0,0]=4 9425 B12R1.29 CC1CCC(O1)C(=O)NCCS f33e12fc720a0739e913b3e02b9d2565 [0,1,0,1,0,0|2,0,0]=4 9426 B12R1.29 CCCCC(=O)N1CCC(C1)C c257c3330cf49e7452fa3de4e949faa6 [0,1,0,1,0,0|2,0,0]=4 9427 B12R1.29 CCCCC(=O)N1CCC(C1)F 7dc04bd7ef9264880f80a7f2072b2ca8 [0,1,0,1,0,0|2,0,0]=4 9428 B12R1.29 CCCCC(=O)N1CCC(C1)O 32663d4db24ce25a8ed0f7ec14c007e0 [0,1,0,1,0,0|2,0,0]=4 9429 B12R1.29 CCCCC(=O)N1CC[C@@H](C1)F e03324ea5e32ac34f32c44c5f75d2048 [0,1,0,1,0,0|2,0,0]=4 9430 B12R1.29 CCCCC(=O)N1CC[C@@H](C1)O b235a48636cfa4c032bdef66197bdff8 [0,1,0,1,0,0|2,0,0]=4 9431 B12R1.29 CCCCC(=O)N1CC[C@H](C1)F d04688083f80cec1da5c17ab5ea6edf0 [0,1,0,1,0,0|2,0,0]=4 9432 B12R1.29 CCCCC(=O)N1CC[C@H](C1)O f221194f3ffe64864eed3fb81fc45c05 [0,1,0,1,0,0|2,0,0]=4 9433 B12R1.29 CCCNC(=O)C1CCC(O1)C 90ec765d72a726007bc179abb84be4fe [0,1,0,1,0,0|1,0,0]=3 9434 B12R1.29 CCCNC(=O)N1CCC(C1)C c7fa1f33e5ee3a291d104b0d6ed8f0cc [0,1,0,1,0,0|2,0,0]=4 9435 B12R1.29 CCCNC(=O)N1CCC(C1)F 72eb28e7659bd0272c337f3c9338e902 [0,1,0,1,0,0|2,0,0]=4 9436 B12R1.29 CCCNC(=O)N1CCC(C1)O 9d1b3613e83561f2ae8dbc1f4a2e85be [0,1,0,1,0,0|2,0,0]=4 9437 B12R1.29 CCCNC(=O)N1CC[C@@H](C1)F 5202a1ea240651974e5423b1dfc33bb6 [0,1,0,1,0,0|2,0,0]=4 9438 B12R1.29 CCCNC(=O)N1CC[C@@H](C1)O 849e11b7f584f4da7e9d61ae702803e2 [0,1,0,1,0,0|2,0,0]=4 9439 B12R1.29 CCCNC(=O)N1CC[C@H](C1)F 577ca18afce34a46a975bf95520ad5a6 [0,1,0,1,0,0|2,0,0]=4 9440 B12R1.29 CCCNC(=O)N1CC[C@H](C1)O d65e7c1657f711b8ba9bc03cea016fbd [0,1,0,1,0,0|2,0,0]=4 9441 B12R1.29 CCCNC(=O)[C@H]1CC[C@H](O1)C 47266b8d96ca902d9ae519cf91837304 [0,1,0,1,0,0|1,0,0]=3 9442 B12R1.29 C[C@@H]1CC[C@@H](O1)C(=O)NCCBr ca29566bc9bb4cfdd8acd6d6160bd119 [0,1,0,1,0,0|2,0,0]=4 9443 B12R1.29 C[C@@H]1CC[C@@H](O1)C(=O)NCCF 127c48851e38884d3bd6c3d11cc24aa5 [0,1,0,1,0,0|2,0,0]=4 9444 B12R1.29 C[C@@H]1CC[C@@H](O1)C(=O)NCCI a0e6e0d05202f7a7f3af6f29d0f86bf9 [0,1,0,1,0,0|2,0,0]=4 9445 B12R1.29 C[C@@H]1CC[C@@H](O1)C(=O)NCCO c6e9cada8c4fa606cd4d9477e8f53606 [0,1,0,1,0,0|2,0,0]=4 9446 B12R1.29 C[C@@H]1CC[C@@H](O1)C(=O)NCCS 30e50262c67cc84fcbc422f0ab6bb850 [0,1,0,1,0,0|2,0,0]=4 9447 B12R1.30 CCCCC(=O)N1CCCOC1 ce3794332b339de548d738dc24db5d87 [0,1,0,1,0,0|2,0,0]=4 9448 B12R1.30 CCCCC(=O)N1CCCSC1 7a6f1fe3b5f331aa757887c41f70621a [0,1,0,1,0,0|2,0,0]=4 9449 B12R1.30 CCCCC(=O)N1CCOCC1 d7c3947703a9973f25e7aaa74a3642c8 [0,1,0,1,0,0|2,0,0]=4 9450 B12R1.30 CCCCC(=O)N1CCSCC1 8749c8419fb5e70aad6376250fccc329 [0,1,0,1,0,0|2,0,0]=4 9451 B12R1.30 CCCNC(=O)C1=CCCCC1 f4f51dde6c8fa18072a07f09127f0543 [0,1,0,1,0,0|1,0,1]=4 9452 B12R1.30 CCCNC(=O)C1CCCCO1 0c161c07d478c4e32dc5c8861268d51b [0,1,0,1,0,0|1,0,0]=3 9453 B12R1.30 CCCNC(=O)C1COCCO1 244436c1c4a63e9e8c68e8ae7c38737c [0,1,0,1,0,0|2,0,0]=4 9454 B12R1.30 CCCNC(=O)C1SCCCS1 e9f18e98e0f0c64c54100cfae1fe5989 [0,1,0,1,0,0|2,0,0]=4 9455 B12R1.30 CCCNC(=O)N1CCCOC1 1d4829260f46ba916be40541216b469d [0,1,0,1,0,0|2,0,0]=4 9456 B12R1.30 CCCNC(=O)N1CCCSC1 ae1d0e1c3c9c3dbd81d7d71e79ada996 [0,1,0,1,0,0|2,0,0]=4 9457 B12R1.30 CCCNC(=O)N1CCNCC1 87854c11d1ec0882997f330576b35dd2 [0,1,0,1,0,0|2,0,0]=4 9458 B12R1.30 CCCNC(=O)N1CCOCC1 de4b39e72a78afe48588bf6c8ac3734a [0,1,0,1,0,0|2,0,0]=4 9459 B12R1.30 CCCNC(=O)N1CCSCC1 74c6eef83e0adbc3538e79d2fd28b786 [0,1,0,1,0,0|2,0,0]=4 9460 B12R1.30 CCCNC(=O)[C@@H]1CCCCO1 2e71d3dee9a822bae4ffcf9caff29cd9 [0,1,0,1,0,0|1,0,0]=3 9461 B12R1.30 CCCNC(=O)[C@@H]1COCCO1 e09b0898e654df39110f23654f4e4100 [0,1,0,1,0,0|2,0,0]=4 9462 B12R1.30 CCCNC(=O)[C@H]1CCCCO1 27cbda1972c229c77114ea6ed41a1a07 [0,1,0,1,0,0|1,0,0]=3 9463 B12R1.30 CCCNC(=O)[C@H]1COCCO1 4527c6f6d2f60db082a34d44964f3f66 [0,1,0,1,0,0|2,0,0]=4 9464 B12R1.30 CCCOC(C)C1CCCCC1 3b83792a9b182be1769028e8da363795 [0,1,0,1,0,0|1,0,1]=4 9465 B12R1.30 CCCOC(C)C1CCOCC1 aa00fcf337baf607353e562ed7aa7f29 [0,1,0,1,0,0|1,0,1]=4 9466 B12R1.30 CCCO[C@@H](C)C1CCCCC1 9aa507c9cec4ec077a51b5298f76d146 [0,1,0,1,0,0|1,0,1]=4 9467 B12R1.30 CCCO[C@@H](C)C1CCOCC1 b828c13d639f689ab962fa686e7fd274 [0,1,0,1,0,0|1,0,1]=4 9468 B12R1.30 CCCO[C@H](C)C1CCCCC1 f4790aff7958929565772ba8f9cf2e67 [0,1,0,1,0,0|1,0,1]=4 9469 B12R1.30 CCCO[C@H](C)C1CCOCC1 cfd5fb01abfebbf5754eb41445e259ef [0,1,0,1,0,0|1,0,1]=4 9470 B12R1.30 CCNCC(=O)N1CCCCC1 0561846c07ebf42a7f20a9597f71d06c [0,1,0,1,0,0|2,0,0]=4 9471 B12R1.30 CCOCC(=O)C1CCCCC1 a83b9201d8f85007fb6a83ca17e5ed02 [0,1,0,1,0,0|2,0,0]=4 9472 B12R1.30 CCOCC(=O)N1CCCCC1 bbc4759a1c48ad6c286d52f607f446a6 [0,1,0,1,0,0|2,0,0]=4 9473 B12R1.30 O=C(NCCBr)C1CCCCO1 5e97f1b1f3e8ad17928ce262c5a917dd [0,1,0,1,0,0|2,0,0]=4 9474 B12R1.30 O=C(NCCBr)[C@@H]1CCCCO1 f6782adedf1d2869a785f3501ee97d93 [0,1,0,1,0,0|2,0,0]=4 9475 B12R1.30 O=C(NCCBr)[C@H]1CCCCO1 1b8bae975fa4e1fafd87854a9fdafd31 [0,1,0,1,0,0|2,0,0]=4 9476 B12R1.30 O=C(NCCF)C1CCCCO1 55cdf13d2a5c777145e83d900a90c83c [0,1,0,1,0,0|2,0,0]=4 9477 B12R1.30 O=C(NCCF)[C@@H]1CCCCO1 c793ba75c88dc6ed3f758d6d495b9e94 [0,1,0,1,0,0|2,0,0]=4 9478 B12R1.30 O=C(NCCF)[C@H]1CCCCO1 2158956e14dd3229994d364c8056c92c [0,1,0,1,0,0|2,0,0]=4 9479 B12R1.30 O=C(NCCI)C1CCCCO1 681b1416bd10a7c7d95b833026f69ffd [0,1,0,1,0,0|2,0,0]=4 9480 B12R1.30 O=C(NCCI)[C@@H]1CCCCO1 16c116b5e9a22cd3c6c7727649ba5990 [0,1,0,1,0,0|2,0,0]=4 9481 B12R1.30 O=C(NCCI)[C@H]1CCCCO1 97956ced3b7b37159726556aae5e6edc [0,1,0,1,0,0|2,0,0]=4 9482 B12R1.30 O=C(NCCO)C1CCCCO1 4aca1479fc004ac2f4efb73d9e29b459 [0,1,0,1,0,0|2,0,0]=4 9483 B12R1.30 O=C(NCCO)[C@@H]1CCCCO1 521a203f5f75c936b9c4ceade39b7e13 [0,1,0,1,0,0|2,0,0]=4 9484 B12R1.30 O=C(NCCO)[C@H]1CCCCO1 0674f16c4f7d6904f2137aa880128ab5 [0,1,0,1,0,0|2,0,0]=4 9485 B12R1.30 O=C(NCCS)C1CCCCO1 efee17a4b54623e85a5ba92827896490 [0,1,0,1,0,0|2,0,0]=4 9486 B12R1.30 O=C(NCCS)[C@@H]1CCCCO1 a2c2c43bfd44288e72999a46f44c0741 [0,1,0,1,0,0|2,0,0]=4 9487 B12R1.30 O=C(NCCS)[C@H]1CCCCO1 680a783015d8110ebb953d616b7ebbe3 [0,1,0,1,0,0|2,0,0]=4 9488 B12R1.374 CC1CNC(=O)CN1CCCF 022ed169d6bcb0e0d7dab8f96f4948c9 [0,1,0,1,0,0|2,0,0]=4 9489 B12R1.374 CC1CNC(=O)CN1CCCO 06fd3ad21599ea15553e374ff4e67c77 [0,1,0,1,0,0|2,0,0]=4 9490 B12R1.374 CC1CNC(=O)CN1CCCS 15c16ad8b050d92f2280056101db53fb [0,1,0,1,0,0|2,0,0]=4 9491 B12R1.374 CCCCN1CC(=O)NCC1C a9a20581ac0c123f3e36d41377dcbf51 [0,1,0,1,0,0|1,0,0]=3 9492 B12R1.374 CCCCN1CC(=O)NC[C@@H]1C bcae977c45c37418f71a1a064fe39e24 [0,1,0,1,0,0|1,0,0]=3 9493 B12R1.374 CCCCN1CC(=O)NC[C@H]1C 61c58fd04412dfa7166b025173011f1c [0,1,0,1,0,0|1,0,0]=3 9494 B12R1.374 CCCCN1CC(OCC1C)C af4f0787d2402c4d5377d09e729a106d [0,1,0,1,0,0|1,0,1]=4 9495 B12R1.374 CCCCN1C[C@@H](OC[C@@H]1C)C 0c414d1e2530f5ca2eecb6372e12368a [0,1,0,1,0,0|1,0,1]=4 9496 B12R1.374 CCCCN1C[C@@H](OC[C@H]1C)C de3993033f78d0e16f03b760ed4279d8 [0,1,0,1,0,0|1,0,1]=4 9497 B12R1.374 CCCCN1C[C@H](OC[C@@H]1C)C 0906bb99c7ff74395f9719c44c2e70b8 [0,1,0,1,0,0|1,0,1]=4 9498 B12R1.374 CCCCN1C[C@H](OC[C@H]1C)C 16f663ef4e0b4fa6a4eaada1abb8dab0 [0,1,0,1,0,0|1,0,1]=4 9499 B12R1.374 CCCOC1CC(CCC1C)C 0d606390509f95f77ec44b312b5c77c2 [0,1,0,1,0,0|1,0,1]=4 9500 B12R1.374 CCOCN1CC(=O)NCC1C f60259ad753af89829f4e945dfe62c78 [0,1,0,1,0,0|2,0,0]=4 9501 B12R1.374 CCOCN1CC(=O)NC[C@@H]1C 6af1904144982d12549d9d19e89767a1 [0,1,0,1,0,0|2,0,0]=4 9502 B12R1.374 CCOCN1CC(=O)NC[C@H]1C 5a664550db2dcd6957ec859b1d9a7a67 [0,1,0,1,0,0|2,0,0]=4 9503 B12R1.374 COCCN1CC(=O)NCC1C 4e6dd3862b7cb5ff57ec7d8c7891a1d6 [0,1,0,1,0,0|2,0,0]=4 9504 B12R1.374 COCCN1CC(=O)NC[C@@H]1C ffda1c2f5f8af37e4ca721d2d9492bc1 [0,1,0,1,0,0|2,0,0]=4 9505 B12R1.374 COCCN1CC(=O)NC[C@H]1C 67824172594a4884f03d55e036eef0df [0,1,0,1,0,0|2,0,0]=4 9506 B12R1.374 CSCCN1CC(=O)NCC1C d578a4cab4ac3084c50bb58c0f8e5350 [0,1,0,1,0,0|2,0,0]=4 9507 B12R1.374 CSCCN1CC(=O)NC[C@@H]1C 92e71a89dd080e5af8c96f1751d4a932 [0,1,0,1,0,0|2,0,0]=4 9508 B12R1.374 CSCCN1CC(=O)NC[C@H]1C a4f9c32430f0f2bb3abe4079cc689957 [0,1,0,1,0,0|2,0,0]=4 9509 B12R1.374 C[C@@H]1CNC(=O)CN1CCCF f72b51a58e2d8f95703adb1919a38ecc [0,1,0,1,0,0|2,0,0]=4 9510 B12R1.374 C[C@@H]1CNC(=O)CN1CCCO 53f98ecb22e3571168516a997890fdf5 [0,1,0,1,0,0|2,0,0]=4 9511 B12R1.374 C[C@@H]1CNC(=O)CN1CCCS aa626f670c8fd539927764940eee3d87 [0,1,0,1,0,0|2,0,0]=4 9512 B12R1.374 C[C@H]1CNC(=O)CN1CCCF 4e332f9250b68b6d9efc423c464fac2a [0,1,0,1,0,0|2,0,0]=4 9513 B12R1.374 C[C@H]1CNC(=O)CN1CCCO 50e130317c261c30af58f39b9571cbb8 [0,1,0,1,0,0|2,0,0]=4 9514 B12R1.374 C[C@H]1CNC(=O)CN1CCCS aaac6942920f2b0c2a25ea37526f9606 [0,1,0,1,0,0|2,0,0]=4 9515 B12R1.497 CCCN1[C@@H](CNC(=O)[C@H]1C)C 0ccf32cbe69eb71327f6b4d5bffb233c [0,1,0,1,0,0|2,0,0]=4 9516 B12R1.497 CCCN1[C@H](CNC(=O)[C@@H]1C)C eb210cd326e069e2b3c96c7b6d77bd4b [0,1,0,1,0,0|2,0,0]=4 9517 B12R1.912 CCCCC(=O)C(=O)N1CCC1 e72f64c263bfcc2e3f3fd2696b880a6b [0,1,0,1,0,0|1,0,1]=4 9518 B12R1.912 CCCCC(=O)N(C)C1CCC1 38409ad0f0a08fafdfe4137c882a0496 [0,1,0,1,0,0|2,0,0]=4 9519 B12R1.912 CCCCC(O)C(=O)N1CCC1 ddcb0dad005bd84f5a4592e9e7117d1a [0,1,0,1,0,0|1,0,0]=3 9520 B12R1.912 CCCC[C@@H](O)C(=O)N1CCC1 fd784a2879ebcbfe95809a79c16cd17f [0,1,0,1,0,0|1,0,0]=3 9521 B12R1.912 CCCC[C@H](O)C(=O)N1CCC1 f70fd9578b3f1d4e13c10a18b53cc39d [0,1,0,1,0,0|1,0,0]=3 9522 B12R1.912 CCCNC(=O)C(=O)C1CCC1 0479937dd5693df8131c798d65dba3bc [0,1,0,1,0,0|1,0,1]=4 9523 B12R1.912 CCCNC(=O)C(C)N1CCC1 eb16624e50920a5fa3b2f7c7f8b320de [0,1,0,1,0,0|2,0,0]=4 9524 B12R1.912 CCCNC(=O)C(F)C1CCC1 88e1ac24c4a3fedf63680a0c91388ed5 [0,1,0,1,0,0|1,0,0]=3 9525 B12R1.912 CCCNC(=O)C(O)C1CCC1 e3592733153b0c057cc6fc96c931978c [0,1,0,1,0,0|1,0,0]=3 9526 B12R1.912 CCCNC(=O)N(C)C1CCC1 ff8ba7f0ed95eb75227b9f59aee41435 [0,1,0,1,0,0|2,0,0]=4 9527 B12R1.912 CCCNC(=O)[C@H](O)C1CCC1 9c4eb20f1d2587833b7864e2678fc1c3 [0,1,0,1,0,0|1,0,0]=3 9528 B12R1.912 CCCNC(C)C(=O)N1CCC1 3c4888721b92c850865edad4e785a31a [0,1,0,1,0,0|2,0,0]=4 9529 B12R1.912 CCCOC(=O)C(C)N1CCC1 7712f8fcac10530b9927ac2106805018 [0,1,0,1,0,0|1,0,0]=3 9530 B12R1.912 CCCOC(C)C(=O)N1CCC1 36457627834095311713c14209e5b238 [0,1,0,1,0,0|2,0,0]=4 9531 B12R1.912 CSCCC(O)C(=O)N1CCC1 3f7784b25f7fd83e00710c51b2dcb9aa [0,1,0,1,0,0|2,0,0]=4 9532 B12R1.912 O=C(NCCBr)C(F)C1CCC1 2088f6c1356364e3a9c1a112f11adf58 [0,1,0,1,0,0|2,0,0]=4 9533 B12R1.912 O=C(NCCBr)C(O)C1CCC1 594b83f1d3d53848e9fe0aa73468ba3b [0,1,0,1,0,0|2,0,0]=4 9534 B12R1.912 O=C(NCCBr)[C@H](O)C1CCC1 96b33630a991a909171e554e64d7709d [0,1,0,1,0,0|2,0,0]=4 9535 B12R1.912 O=C(NCCF)C(F)C1CCC1 f236aee195f3549c9a0d8c45b83eb594 [0,1,0,1,0,0|2,0,0]=4 9536 B12R1.912 O=C(NCCF)C(O)C1CCC1 a0040aff31b270a3a01921c0d5aff005 [0,1,0,1,0,0|2,0,0]=4 9537 B12R1.912 O=C(NCCF)[C@H](O)C1CCC1 b312a395feb40f62f27a85e3d4ba7733 [0,1,0,1,0,0|2,0,0]=4 9538 B12R1.912 O=C(NCCI)C(F)C1CCC1 30fe8c4189be1d9ff22b78a59f1d5d3d [0,1,0,1,0,0|2,0,0]=4 9539 B12R1.912 O=C(NCCI)C(O)C1CCC1 e2edca06b419596399a81ceb7dea60b6 [0,1,0,1,0,0|2,0,0]=4 9540 B12R1.912 O=C(NCCI)[C@H](O)C1CCC1 b0f621c8396fed40eb22a4c18ac6bba1 [0,1,0,1,0,0|2,0,0]=4 9541 B12R1.912 O=C(NCCO)C(F)C1CCC1 87ed1b49a533e797a3559848cd6a6aca [0,1,0,1,0,0|2,0,0]=4 9542 B12R1.912 O=C(NCCO)C(O)C1CCC1 0392b6a9875fd73b5ce57ee6fef00f62 [0,1,0,1,0,0|2,0,0]=4 9543 B12R1.912 O=C(NCCO)[C@H](O)C1CCC1 85e2414dc6e4c50f7f71a14156839055 [0,1,0,1,0,0|2,0,0]=4 9544 B12R1.912 O=C(NCCS)C(F)C1CCC1 bd471cd9108c50c22fbd58bcfced3ee3 [0,1,0,1,0,0|2,0,0]=4 9545 B12R1.912 O=C(NCCS)C(O)C1CCC1 d5d847409e0124695d7e8c4a9b621bfe [0,1,0,1,0,0|2,0,0]=4 9546 B12R1.912 O=C(NCCS)[C@H](O)C1CCC1 6e80caade5f85ecf48423df8bd436d9c [0,1,0,1,0,0|2,0,0]=4 9547 B12R1.914 CCCCC(=O)C(=O)NC1CC1 46b684740df5a97a551d169e322b9e49 [0,1,0,1,0,0|1,0,1]=4 9548 B12R1.914 CCCCC(=O)N(C)CC1CC1 8a63fa2acdeab0a3531c8df426672f35 [0,1,0,1,0,0|2,0,0]=4 9549 B12R1.914 CCCCC(O)C(=O)NC1CC1 95048491804cb77fe6001d5a7c4eacff [0,1,0,1,0,0|1,0,0]=3 9550 B12R1.914 CCCCN(C)C(=O)CC1CC1 57512a4b816c4860a5bb0958e19eff23 [0,1,0,1,0,0|2,0,0]=4 9551 B12R1.914 CCCCN(C)C(=O)NC1CC1 4f34ee3da5263532326349e13d67ffc5 [0,1,0,1,0,0|2,0,0]=4 9552 B12R1.914 CCCC[C@@H](O)C(=O)NC1CC1 3ac5fb4d6f1a357f5d3f083d338940d5 [0,1,0,1,0,0|1,0,0]=3 9553 B12R1.914 CCCC[C@H](O)C(=O)NC1CC1 9633ced88afd84eb9e0a28f2cfd7d6f4 [0,1,0,1,0,0|1,0,0]=3 9554 B12R1.914 CCCNC(=O)C(=O)CC1CC1 5e745bf682358469626842aea65a86d7 [0,1,0,1,0,0|1,0,1]=4 9555 B12R1.914 CCCNC(=O)C(C)NC1CC1 e636753d060e7169b4397ef2a7de6a7e [0,1,0,1,0,0|2,0,0]=4 9556 B12R1.914 CCCNC(=O)C(C)OC1CC1 8f1bc708e6f7366e90c8ec0ad8df3ae3 [0,1,0,1,0,0|2,0,0]=4 9557 B12R1.914 CCCNC(=O)C(O)CC1CC1 08d0c759108af9e1bb64e6e199f4b352 [0,1,0,1,0,0|1,0,0]=3 9558 B12R1.914 CCCNC(=O)N(C)CC1CC1 4085a8046834da3ab7a0271378a2ec7f [0,1,0,1,0,0|2,0,0]=4 9559 B12R1.914 CCCNC(=O)[C@@H](O)CC1CC1 dcb65c731a43583278f188f79d167732 [0,1,0,1,0,0|1,0,0]=3 9560 B12R1.914 CCCNC(=O)[C@H](O)CC1CC1 3d261ff49760a68986e507e44ed4938a [0,1,0,1,0,0|1,0,0]=3 9561 B12R1.914 CCCNC(C)C(=O)NC1CC1 ff636801e24a8859baa8a01ca1061d73 [0,1,0,1,0,0|2,0,0]=4 9562 B12R1.914 CCCOC(=O)C(C)NC1CC1 3aa3f947e3106e7ea455192f15537017 [0,1,0,1,0,0|1,0,0]=3 9563 B12R1.914 CCCOC(=O)C(C)OC1CC1 6de7e793ea2343b3d1e9c894b8913632 [0,1,0,1,0,0|1,0,0]=3 9564 B12R1.914 CCCOC(=O)[C@H](C)NC1CC1 bd03163c4b47bbe644c427f881339f3d [0,1,0,1,0,0|1,0,0]=3 9565 B12R1.914 CCCOC(=O)[C@H](C)OC1CC1 2e5cb28f4381cf79f742a82fcca9fe26 [0,1,0,1,0,0|1,0,0]=3 9566 B12R1.914 CCCOC(C)C(=O)NC1CC1 ca743f31de88475d6a6303a23bed8670 [0,1,0,1,0,0|2,0,0]=4 9567 B12R1.914 CSCCC(O)C(=O)NC1CC1 29be5c888e464756a2dc59b6703b256d [0,1,0,1,0,0|2,0,0]=4 9568 B12R1.914 O=C(NCCBr)C(O)CC1CC1 0a9fc757c397b44d48cb1620fdceb99b [0,1,0,1,0,0|2,0,0]=4 9569 B12R1.914 O=C(NCCBr)[C@@H](O)CC1CC1 f10659d9311889222131da13652d7c0f [0,1,0,1,0,0|2,0,0]=4 9570 B12R1.914 O=C(NCCBr)[C@H](O)CC1CC1 936484df12e0816b4b6cb1fb0d68479c [0,1,0,1,0,0|2,0,0]=4 9571 B12R1.914 O=C(NCCF)C(O)CC1CC1 183417dd1170101df4983f0737799b35 [0,1,0,1,0,0|2,0,0]=4 9572 B12R1.914 O=C(NCCF)[C@@H](O)CC1CC1 5fa9629946aa3dfe0d7d260f0c61125d [0,1,0,1,0,0|2,0,0]=4 9573 B12R1.914 O=C(NCCF)[C@H](O)CC1CC1 a24905369156a8d4358e099ac1d991ae [0,1,0,1,0,0|2,0,0]=4 9574 B12R1.914 O=C(NCCI)C(O)CC1CC1 42fb154725e603bb89992070a87e541f [0,1,0,1,0,0|2,0,0]=4 9575 B12R1.914 O=C(NCCI)[C@@H](O)CC1CC1 9d5a6fad0e3071c21ada93156ce04e47 [0,1,0,1,0,0|2,0,0]=4 9576 B12R1.914 O=C(NCCI)[C@H](O)CC1CC1 978c05227175507acafb49595df5f90b [0,1,0,1,0,0|2,0,0]=4 9577 B12R1.914 O=C(NCCO)C(O)CC1CC1 9f004ef2a69075c80a51d74825a7cf58 [0,1,0,1,0,0|2,0,0]=4 9578 B12R1.914 O=C(NCCO)[C@@H](O)CC1CC1 7f84eb6349e04dcf6ac6e7991df895ff [0,1,0,1,0,0|2,0,0]=4 9579 B12R1.914 O=C(NCCO)[C@H](O)CC1CC1 9328692ea62388db20fd30388066b853 [0,1,0,1,0,0|2,0,0]=4 9580 B12R1.914 O=C(NCCS)C(O)CC1CC1 e4dbed11ce4829a20d321c77f6f01496 [0,1,0,1,0,0|2,0,0]=4 9581 B12R1.914 O=C(NCCS)[C@@H](O)CC1CC1 12fe530c4647d6d1c8e2a9499aa1e750 [0,1,0,1,0,0|2,0,0]=4 9582 B12R1.914 O=C(NCCS)[C@H](O)CC1CC1 fa1a42748bd9466d1cf9fe146ab9ff0b [0,1,0,1,0,0|2,0,0]=4 9583 B12R1.1442 CCCN1CCCNC(=O)[C@@H]1C 388bcc75d8c6722e97fc4d0c83b9ba5b [0,1,0,1,0,0|2,0,0]=4 9584 B12R1.1442 CCCN1CCCNC(=O)[C@H]1C 112db9078133dfc1de5a3093d29d1f1f [0,1,0,1,0,0|2,0,0]=4 9585 B12R1.2025 CCCCC(=O)N1CC(C1)CC b03cdab0d6f9cf77e37cb8403b4ac608 [0,1,0,1,0,0|2,0,0]=4 9586 B12R1.2025 CCCNC(=O)N1CC(C1)CC 25f8805d718761b9bd7b1f39c7353ff8 [0,1,0,1,0,0|2,0,0]=4 9587 B12R1.54 CC(C)CNC(=O)C1CCCO1 2c846e8b62a4b561175beb1ef6e477a1 [0,1,0,1,0,0|2,0,0]=4 9588 B12R1.54 CC(C)CNC(=O)C1CCCS1 f892ac123dcce153287321492067849f [0,1,0,1,0,0|2,0,0]=4 9589 B12R1.54 CC(C)CNC(=O)[C@@H]1CCCO1 b0ef6040f96e109dfa4be8155f39c34e [0,1,0,1,0,0|2,0,0]=4 9590 B12R1.54 CC(C)CNC(=O)[C@H]1CCCO1 8e2a08b4b0a3f58c75e4e64124a7bde4 [0,1,0,1,0,0|2,0,0]=4 9591 B12R1.54 CC(C)COC(C)C1CCCC1 7e91bd1643a513ae6c3de06e37bf4a4e [0,1,0,1,0,0|1,0,1]=4 9592 B12R1.54 CC(C)OCC(=O)C1CCCC1 f8ecd9016e47e4f1d42b00fc59d8ba70 [0,1,0,1,0,0|2,0,0]=4 9593 B12R1.54 CC(O)CNC(=O)C1CCCO1 18bedb78531403e72605797f08719382 [0,1,0,1,0,0|2,0,0]=4 9594 B12R1.54 CC(O)CNC(=O)C1CCCS1 9e08c3f67e460e1e9a66f0cb0273f0ba [0,1,0,1,0,0|2,0,0]=4 9595 B12R1.54 CC(O)CNC(=O)[C@@H]1CCCO1 c3d03595fb8ba01a2e41ac084a6eb473 [0,1,0,1,0,0|2,0,0]=4 9596 B12R1.54 CC(O)CNC(=O)[C@H]1CCCO1 6b09ed04f1866dcd9706e6d478237498 [0,1,0,1,0,0|2,0,0]=4 9597 B12R1.54 C[C@@H](O)CNC(=O)C1CCCO1 0b160c1cd9691554cac96cccf26d7636 [0,1,0,1,0,0|2,0,0]=4 9598 B12R1.54 C[C@@H](O)CNC(=O)C1CCCS1 3bbff4c269303f3b7113e85b688a87ce [0,1,0,1,0,0|2,0,0]=4 9599 B12R1.54 C[C@@H](O)CNC(=O)[C@@H]1CCCO1 e5ffb6659b83f17dc19cbba17ccc8bc3 [0,1,0,1,0,0|2,0,0]=4 9600 B12R1.54 C[C@@H](O)CNC(=O)[C@H]1CCCO1 01d700d05fa5dfb2aa9d5f34be24d6bb [0,1,0,1,0,0|2,0,0]=4 9601 B12R1.54 C[C@H](O)CNC(=O)C1CCCO1 1b469472e7cbbef73d87916de2f3280b [0,1,0,1,0,0|2,0,0]=4 9602 B12R1.54 C[C@H](O)CNC(=O)C1CCCS1 c77f4b1af8d1d29b47d174578b9b544a [0,1,0,1,0,0|2,0,0]=4 9603 B12R1.54 C[C@H](O)CNC(=O)[C@@H]1CCCO1 20b0dbdb976eb377edc90bd04b82c1d5 [0,1,0,1,0,0|2,0,0]=4 9604 B12R1.54 C[C@H](O)CNC(=O)[C@H]1CCCO1 fadec8158afbbd046293debac699f8fa [0,1,0,1,0,0|2,0,0]=4 9605 B12R1.147 CC(C)CCC(=O)NC1CC1C 0f459374d657e2f80c469ba83c1fa1b6 [0,1,0,1,0,0|2,0,0]=4 9606 B12R1.147 CC(C)CNC(=O)NC1CC1C a47e9ba7fbb5b3bf0cf30761c3354b6a [0,1,0,1,0,0|2,0,0]=4 9607 B12R1.147 CC(O)CCC(=O)NC1CC1C c2fa6e9ba39ce69bd31fd4dfd769a721 [0,1,0,1,0,0|2,0,0]=4 9608 B12R1.147 CC(O)CNC(=O)NC1CC1C d9291f66652bbae3b43a6eedf96fb364 [0,1,0,1,0,0|2,0,0]=4 9609 B12R1.147 CC(S)CCC(=O)NC1CC1C 80e4444f5aab3a4b928f43fe1dd85a2d [0,1,0,1,0,0|2,0,0]=4 9610 B12R1.147 CC1CC1NC(=O)CC[C@H](C)S 9ef8a873c77610723ef9a7d157148b87 [0,1,0,1,0,0|2,0,0]=4 9611 B12R1.147 CC1CC1NC(=O)NC[C@@H](C)O 8220a64b53fa853ea4d670646e5ff218 [0,1,0,1,0,0|2,0,0]=4 9612 B12R1.147 CC1CC1NC(=O)NC[C@H](C)O 8411ab561215dd98c3b494a40441bfe6 [0,1,0,1,0,0|2,0,0]=4 9613 B12R1.210 CC(C)OC1CCCCCC1=O e8749d0499541b300a5f19045d30e787 [0,1,0,1,0,0|2,0,0]=4 9614 B12R1.226 CC(C)COC1CCCC(C1)C b643bc958e7b035192abd9bee5245613 [0,1,0,1,0,0|1,0,1]=4 9615 B12R1.226 CC(C)CO[C@@H]1CCC[C@@H](C1)C 386cc7c5c8fb6ad640bd44497b7c7047 [0,1,0,1,0,0|1,0,1]=4 9616 B12R1.226 CC(C)CO[C@H]1CCC[C@@H](C1)C dd960dc72c40b51ffff9d689ad1710b9 [0,1,0,1,0,0|1,0,1]=4 9617 B12R1.226 CC(C)CO[C@H]1CCC[C@H](C1)C 05f2cc12d0a1712fff02d64889488e51 [0,1,0,1,0,0|1,0,1]=4 9618 B12R1.230 CC(C)CNC(=O)C1CCN1C 5c18ae64043c82060c050572ea8b870f [0,1,0,1,0,0|2,0,0]=4 9619 B12R1.230 CC(C)CNC(=O)[C@@H]1CCN1C 633a47be3d21cb219d95a354bf8e7bc8 [0,1,0,1,0,0|2,0,0]=4 9620 B12R1.230 CC(C)CNC(=O)[C@H]1CCN1C 952d582ffc17c3eb37b2f4181df5f61f [0,1,0,1,0,0|2,0,0]=4 9621 B12R1.230 CC(O)CNC(=O)C1CCN1C e95bf9935ffe5f39a860d77337d616ac [0,1,0,1,0,0|2,0,0]=4 9622 B12R1.230 CC(O)CNC(=O)[C@@H]1CCN1C 27fd67518bd684eb0c8ce10a7d9a16df [0,1,0,1,0,0|2,0,0]=4 9623 B12R1.230 CC(O)CNC(=O)[C@H]1CCN1C 308e274e8a94fa4928a5231b5c59a569 [0,1,0,1,0,0|2,0,0]=4 9624 B12R1.230 C[C@@H](O)CNC(=O)C1CCN1C c8d3079a95e5169ecbbcac2298656eb9 [0,1,0,1,0,0|2,0,0]=4 9625 B12R1.230 C[C@@H](O)CNC(=O)[C@@H]1CCN1C eec6368bb706927b70b0769b8ca67c9b [0,1,0,1,0,0|2,0,0]=4 9626 B12R1.230 C[C@@H](O)CNC(=O)[C@H]1CCN1C ff78fe16e008b462ba3fec3e90b4581c [0,1,0,1,0,0|2,0,0]=4 9627 B12R1.230 C[C@H](O)CNC(=O)C1CCN1C 82ab82e8fa6a3ace6b9706670479022b [0,1,0,1,0,0|2,0,0]=4 9628 B12R1.230 C[C@H](O)CNC(=O)[C@@H]1CCN1C d14acf0df58ce407b466f901c0ce3d3f [0,1,0,1,0,0|2,0,0]=4 9629 B12R1.230 C[C@H](O)CNC(=O)[C@H]1CCN1C 3ca3ea12882fde100c85dc582cf2aebc [0,1,0,1,0,0|2,0,0]=4 9630 B12R1.276 CCO[C@@H]1CC(=O)N[C@H]1C(C)C 7c5f7ca3452e06208a5ba2d66681dd0f [0,1,0,1,0,0|2,0,0]=4 9631 B12R1.482 CC1CC1NC(=O)CCCCF efc25c2d41b2a39abed167ef0e3ad175 [0,1,0,1,0,0|2,0,0]=4 9632 B12R1.482 CC1CC1NC(=O)CCCCO 6f30558c045efd2bc4b4a397af08c3a7 [0,1,0,1,0,0|2,0,0]=4 9633 B12R1.482 CC1CC1NC(=O)CCCCS a123b7903009f050db8ab516f0bde3c2 [0,1,0,1,0,0|2,0,0]=4 9634 B12R1.482 CC1CC1NC(=O)COCCO a67bbdcb577c68bd06c06515337eeed5 [0,1,0,1,0,0|2,0,0]=4 9635 B12R1.482 CC1CC1NC(=O)COCCS cdb44ad409052797fbd7196c895e12a4 [0,1,0,1,0,0|2,0,0]=4 9636 B12R1.482 CC1CC1NC(=O)NCCCN 1b26bf3e9d5a1cb01eaf0f548d28760b [0,1,0,1,0,0|2,0,0]=4 9637 B12R1.482 CC1CC1NC(=O)NCCCO c6bba24d336cf45fe08e7ea0ef6e401d [0,1,0,1,0,0|2,0,0]=4 9638 B12R1.482 CCC/C=C/C(=O)NC1CC1C 535246ea7949561dd0efa70ef9e2eb3a [0,1,0,1,0,0|2,0,0]=4 9639 B12R1.482 CCCC#CC(=O)NC1CC1C caedca7fa438eff7b0cbfc3f3a2071fc [0,1,0,1,0,0|2,0,0]=4 9640 B12R1.482 CCCC=CC(=O)NC1CC1C 4bba84ead753fb1b6eb843239acc18a8 [0,1,0,1,0,0|2,0,0]=4 9641 B12R1.482 CCCCCC(=O)NC1CC1C 332f655a4ce910e2ea1b213a16e0af4e [0,1,0,1,0,0|1,0,0]=3 9642 B12R1.482 CCCCCC(=O)N[C@@H]1C[C@H]1F 32b1cb37f5826486297b628954c0daef [0,1,0,1,0,0|1,0,0]=3 9643 B12R1.482 CCCCCC(=O)N[C@H]1C[C@@H]1F 7b7696bd5e236a3b239b691a7af9280c [0,1,0,1,0,0|1,0,0]=3 9644 B12R1.482 CCCCCC(=O)N[C@H]1C[C@H]1F caffda0317e8119799482505b431c550 [0,1,0,1,0,0|1,0,0]=3 9645 B12R1.482 CCCCNC(=O)NC1CC1C c134c64dcf0f66543a9fe85cc5eb9f04 [0,1,0,1,0,0|2,0,0]=4 9646 B12R1.482 CCCCNC(=O)NC1CC1N 0c680c843fc6a5f6523442156a6e8529 [0,1,0,1,0,0|2,0,0]=4 9647 B12R1.482 CCCCNC(=O)N[C@@H]1C[C@H]1F 9f470fe23815044bb2898d67daef74bf [0,1,0,1,0,0|2,0,0]=4 9648 B12R1.482 CCCCNC(=O)N[C@H]1C[C@@H]1F cc18ca7af3cb28e5db85a153e1f61263 [0,1,0,1,0,0|2,0,0]=4 9649 B12R1.482 CCCCNC(=O)N[C@H]1C[C@H]1F b2457a6a11a3236af0eab1195f0db3bc [0,1,0,1,0,0|2,0,0]=4 9650 B12R1.482 CCCCNC(=O)N[C@H]1C[C@H]1N 8d1f8b444194449236b6ad0017f24f5c [0,1,0,1,0,0|2,0,0]=4 9651 B12R1.482 CCCOCC(=O)NC1CC1C a18cc69ed84507e2a9075d59a752f75d [0,1,0,1,0,0|1,0,0]=3 9652 B12R1.482 CCCOCC(=O)N[C@@H]1C[C@H]1F 14e62a6eae95ba8421c49271ec856ba3 [0,1,0,1,0,0|2,0,0]=4 9653 B12R1.482 CCCOCC(=O)N[C@H]1C[C@@H]1F 825ecc6a56acfd5b473bf53e1d6b6ed1 [0,1,0,1,0,0|2,0,0]=4 9654 B12R1.482 CCCOCC(=O)N[C@H]1C[C@H]1F ce0e6f102e5f6764a398ba8fcd96cec6 [0,1,0,1,0,0|2,0,0]=4 9655 B12R1.482 CCCSCC(=O)NC1CC1C 379c3a8ffaca40fd9f9842c824ceac77 [0,1,0,1,0,0|1,1,0]=4 9656 B12R1.482 CCCSCC(=O)N[C@@H]1C[C@H]1F 4aa91570d67e17e113d06eb62b523a29 [0,1,0,1,0,0|2,0,0]=4 9657 B12R1.482 CCCSCC(=O)N[C@H]1C[C@@H]1F e9ca46238f02366f2ce723ecedff8753 [0,1,0,1,0,0|2,0,0]=4 9658 B12R1.482 CCCSCC(=O)N[C@H]1C[C@H]1F c45b2d5c276979417ac5a532d1ee6dbf [0,1,0,1,0,0|2,0,0]=4 9659 B12R1.482 CCOCCC(=O)NC1CC1C 5122e7b76b8a661f3707a5ff9dc21e20 [0,1,0,1,0,0|2,0,0]=4 9660 B12R1.482 CCOCCC(=O)N[C@@H]1C[C@H]1F 497c513d4b833481186bf79159cbe1ed [0,1,0,1,0,0|2,0,0]=4 9661 B12R1.482 CCOCCC(=O)N[C@H]1C[C@@H]1F aec6872bb2ab9369ba43e5e825a032c2 [0,1,0,1,0,0|2,0,0]=4 9662 B12R1.482 CCOCCC(=O)N[C@H]1C[C@H]1F eec0c4cc5689b3aaf8cdcf65bab9050a [0,1,0,1,0,0|2,0,0]=4 9663 B12R1.482 CCSCCC(=O)NC1CC1C 6e39ae03e616469a0fda5200b999c823 [0,1,0,1,0,0|2,0,0]=4 9664 B12R1.482 CCSCCC(=O)N[C@@H]1C[C@H]1F b7fd47e21e960ac1215b34693e943127 [0,1,0,1,0,0|2,0,0]=4 9665 B12R1.482 CCSCCC(=O)N[C@H]1C[C@@H]1F 4398f5b582c1dd6e2318fcd5fbd95f3d [0,1,0,1,0,0|2,0,0]=4 9666 B12R1.482 CCSCCC(=O)N[C@H]1C[C@H]1F f7d5c3dfba09d8601b529fcea9ec2d04 [0,1,0,1,0,0|2,0,0]=4 9667 B12R1.482 COCCCC(=O)NC1CC1C 2217fe55359fad40d679db6c4c9b9e38 [0,1,0,1,0,0|2,0,0]=4 9668 B12R1.482 COCCCC(=O)N[C@@H]1C[C@H]1F afd3d2767e510012c5e62e71dfb9560c [0,1,0,1,0,0|2,0,0]=4 9669 B12R1.482 COCCCC(=O)N[C@H]1C[C@@H]1F d3d12490e910e30ee260b549b68ef0d0 [0,1,0,1,0,0|2,0,0]=4 9670 B12R1.482 COCCCC(=O)N[C@H]1C[C@H]1F 9ef5a3b87680fd76897bef5f1720d8e9 [0,1,0,1,0,0|2,0,0]=4 9671 B12R1.482 COCCNC(=O)NC1CC1C a5e18d854855654da6fce2dadf4ec664 [0,1,0,1,0,0|2,0,0]=4 9672 B12R1.482 CSCCCC(=O)NC1CC1C e20f59092650414adf8aa3ad87d6ec22 [0,1,0,1,0,0|2,0,0]=4 9673 B12R1.482 CSCCCC(=O)N[C@@H]1C[C@H]1F 0456bf7e687ba3486a5ce4abac201861 [0,1,0,1,0,0|2,0,0]=4 9674 B12R1.482 CSCCCC(=O)N[C@H]1C[C@@H]1F 472c87a39f47a0bddcf1d455d68f498b [0,1,0,1,0,0|2,0,0]=4 9675 B12R1.482 CSCCCC(=O)N[C@H]1C[C@H]1F 8df7bc141ffb66f9f722f254dae53abe [0,1,0,1,0,0|2,0,0]=4 9676 B12R1.482 CSCCNC(=O)NC1CC1C 8bddac466fb190e84a1fda93c9ae17fa [0,1,0,1,0,0|2,0,0]=4 9677 B12R1.482 O=C(CCCCF)N[C@@H]1C[C@H]1F 0139d50428a6f46b91ff5798994733ec [0,1,0,1,0,0|2,0,0]=4 9678 B12R1.482 O=C(CCCCF)N[C@H]1C[C@@H]1F e075b38e0b1ff4798184a1e05b731568 [0,1,0,1,0,0|2,0,0]=4 9679 B12R1.482 O=C(CCCCF)N[C@H]1C[C@H]1F 10a8e97d159512be3ce9a6a22bcd54a1 [0,1,0,1,0,0|2,0,0]=4 9680 B12R1.482 O=C(CCCCO)N[C@@H]1C[C@H]1F 4bc2e1041187f625adf3e72f9a36da44 [0,1,0,1,0,0|2,0,0]=4 9681 B12R1.482 O=C(CCCCO)N[C@H]1C[C@@H]1F 610e6f81f2c7665b5df80f3d49264187 [0,1,0,1,0,0|2,0,0]=4 9682 B12R1.482 O=C(CCCCO)N[C@H]1C[C@H]1F 0839312c285f2d8a7d1dec7ca4b5fc98 [0,1,0,1,0,0|2,0,0]=4 9683 B12R1.482 O=C(CCCCS)N[C@@H]1C[C@H]1F 64cbf78d893fe2cd548c67906412aa06 [0,1,0,1,0,0|2,0,0]=4 9684 B12R1.482 O=C(CCCCS)N[C@H]1C[C@@H]1F ccd9555b44bd6406848e3f62e138eb41 [0,1,0,1,0,0|2,0,0]=4 9685 B12R1.482 O=C(CCCCS)N[C@H]1C[C@H]1F ecfd629a97bd166327ef3e0d04ac2cc9 [0,1,0,1,0,0|2,0,0]=4 9686 B12R1.484 C#CCCNC(=O)CCC1CC1 3afca1483bc0d7573b0dcaca37bea6d0 [0,1,0,1,0,0|1,0,1]=4 9687 B12R1.484 C=CCCNC(=O)CCC1CC1 8208fe2740c1b7b74d17c91054a923af [0,1,0,1,0,0|1,0,1]=4 9688 B12R1.484 CC=CCNC(=O)CCC1CC1 f646e7cfb69a46a07f8ed8f5a52a9e0f [0,1,0,1,0,0|1,0,1]=4 9689 B12R1.484 CCC/C=C/C(=O)NCC1CC1 119093bca7228f4c62cb2a2ddad24ef7 [0,1,0,1,0,0|2,0,0]=4 9690 B12R1.484 CCCC#CC(=O)NCC1CC1 dc7cd81522ec7a9e7bfe0ee5fad996ee [0,1,0,1,0,0|2,0,0]=4 9691 B12R1.484 CCCC=CC(=O)NCC1CC1 72129edeb7164271206ad3d1ed8a8cd3 [0,1,0,1,0,0|2,0,0]=4 9692 B12R1.484 CCCCCC(=O)CNC1CC1 708c028641513d6869fe0e4f8c93b0b3 [0,1,0,1,0,0|1,0,0]=3 9693 B12R1.484 CCCCCC(=O)COC1CC1 fb8677d6d94f42282dcce3488f7c32e8 [0,1,0,1,0,0|0,0,0]=2 9694 B12R1.484 CCCCCC(=O)NCC1CC1 27f201255ce8dc0cf2b109c12b431482 [0,1,0,1,0,0|1,0,0]=3 9695 B12R1.484 CCCCCC(C)COC1CC1 7b456bcde909fc34dfdaf91da34505b1 [0,1,0,1,0,0|1,0,1]=4 9696 B12R1.484 CCCCCC(C)OCC1CC1 f83ed240a332dac70796e42b248bfd3d [0,1,0,1,0,0|1,0,1]=4 9697 B12R1.484 CCCCC[C@@H](C)OCC1CC1 19007ce4891856efec9a3be016256c18 [0,1,0,1,0,0|1,0,1]=4 9698 B12R1.484 CCCCC[C@H](C)OCC1CC1 cccf5163cb1b5ba2acd6947c86689b79 [0,1,0,1,0,0|1,0,1]=4 9699 B12R1.484 CCCCNC(=O)/C=C/C1CC1 50f2798b5ee6e6e4d32c2ac81f262c4a [0,1,0,1,0,0|2,0,0]=4 9700 B12R1.484 CCCCNC(=O)C#CC1CC1 d6ef8ab0ace5f41c3e42bbe2c2311d69 [0,1,0,1,0,0|2,0,0]=4 9701 B12R1.484 CCCCNC(=O)C=CC1CC1 0c74b844d61c9311e0fae0fe766942a3 [0,1,0,1,0,0|2,0,0]=4 9702 B12R1.484 CCCCNC(=O)CCC1CC1 e0913b625f9cae21ae4ee62277d94ae8 [0,1,0,1,0,0|1,0,0]=3 9703 B12R1.484 CCCCNC(=O)CNC1CC1 b2492aedaa2e5cd19c7387c4220b6e1f [0,1,0,1,0,0|2,0,0]=4 9704 B12R1.484 CCCCNC(=O)COC1CC1 61d6df746b0dfc44efacbf4906db0adc [0,1,0,1,0,0|1,0,0]=3 9705 B12R1.484 CCCCNC(=O)NCC1CC1 0ace663f934d4d76a88f59a7f48c5a5e [0,1,0,1,0,0|2,0,0]=4 9706 B12R1.484 CCCCOC(=O)CNC1CC1 14676389cbdeceda1823aad905659aca [0,1,0,1,0,0|1,0,0]=3 9707 B12R1.484 CCCCOC(=O)COC1CC1 d7da073463c44ea9ea2706aa9ba97961 [0,1,0,1,0,0|1,0,0]=3 9708 B12R1.484 CCCNCC(=O)NCC1CC1 8227348c07c4a00c9ddc70d267c92e78 [0,1,0,1,0,0|2,0,0]=4 9709 B12R1.484 CCCOCC(=O)NCC1CC1 8e292b52ba0bd0f33fb58950b44f3b98 [0,1,0,1,0,0|1,0,0]=3 9710 B12R1.484 CCCSCC(=O)NCC1CC1 e61fb2a75ceb77ca6b6002d1f836d4ef [0,1,0,1,0,0|1,1,0]=4 9711 B12R1.484 CCOCCC(=O)NCC1CC1 94ea4e432ed8f43558851d326c17c708 [0,1,0,1,0,0|2,0,0]=4 9712 B12R1.484 CCSCCC(=O)NCC1CC1 1156c4a24c7c133ea697ca5cd2e45abc [0,1,0,1,0,0|2,0,0]=4 9713 B12R1.484 COCCCC(=O)NCC1CC1 428cc8476fba60d7ce1342fd33368abe [0,1,0,1,0,0|2,0,0]=4 9714 B12R1.484 COCCNC(=O)CCC1CC1 d81288df119aad55c1b7e5b740982e2c [0,1,0,1,0,0|1,0,0]=3 9715 B12R1.484 COCCNC(=O)CNC1CC1 85844d92c9eb74965a6f4a12818997a6 [0,1,0,1,0,0|2,0,0]=4 9716 B12R1.484 COCCNC(=O)COC1CC1 3b88a8e94fd025678ee0e0905bc47765 [0,1,0,1,0,0|2,0,0]=4 9717 B12R1.484 COCCNC(=O)NCC1CC1 9529e7dfb895b86cd64572e958b4f52f [0,1,0,1,0,0|2,0,0]=4 9718 B12R1.484 COCCOC(=O)CNC1CC1 1aeef33ce9997641efa0a3be213f4d84 [0,1,0,1,0,0|1,0,0]=3 9719 B12R1.484 COCCOC(=O)COC1CC1 27772c86d2fe98b987b3e82c7f21e4db [0,1,0,1,0,0|1,0,0]=3 9720 B12R1.484 COCOCC(=O)NCC1CC1 46b523ea3ca9397230cdfafc4c94d693 [0,1,0,1,0,0|2,0,0]=4 9721 B12R1.484 CSCCCC(=O)NCC1CC1 592199fd6cd4c1eedf7c0e0349de71c9 [0,1,0,1,0,0|2,0,0]=4 9722 B12R1.484 CSCCNC(=O)CCC1CC1 c5ff3d3d0effc6232c3ee082f955d57d [0,1,0,1,0,0|1,0,0]=3 9723 B12R1.484 CSCCNC(=O)COC1CC1 9e9921965471a9b0dab3a9afe253b88d [0,1,0,1,0,0|2,0,0]=4 9724 B12R1.484 CSCCNC(=O)NCC1CC1 0842772f2250a7234c75e5a176e8e180 [0,1,0,1,0,0|2,0,0]=4 9725 B12R1.484 N#CCCNC(=O)CCC1CC1 e98a4b782eba30772eea4f536c184f27 [0,1,0,1,0,0|1,0,1]=4 9726 B12R1.484 NCCCNC(=O)NCC1CC1 73833523c0ca00e125dd83e7191f9dee [0,1,0,1,0,0|2,0,0]=4 9727 B12R1.484 NOCCNC(=O)CCC1CC1 e485ce73e1f610e0101305c52d3de0cd [0,1,0,1,0,0|2,0,0]=4 9728 B12R1.484 O=C(CCC1CC1)NCCCCl 7ea62a17fa0941f4558e2c3ea7e18fb9 [0,1,0,1,0,0|1,0,0]=3 9729 B12R1.484 O=C(CCC1CC1)NCCCO 8dbc2c402a6ed3834f07c078fa1bc6a0 [0,1,0,1,0,0|1,0,0]=3 9730 B12R1.484 O=C(CCCCF)NCC1CC1 e865f0d02a51e2b5e8186a8e784d8948 [0,1,0,1,0,0|2,0,0]=4 9731 B12R1.484 O=C(CCCCO)NCC1CC1 bf1625d66c0d6b9ce564313e4e7abe9c [0,1,0,1,0,0|2,0,0]=4 9732 B12R1.484 O=C(CCCCS)NCC1CC1 662d5cfdfc0e26c40cbef526ba1311b6 [0,1,0,1,0,0|2,0,0]=4 9733 B12R1.484 O=C(COC1CC1)NCCCCl e538e347ae1da446fd880a312dac87c0 [0,1,0,1,0,0|2,0,0]=4 9734 B12R1.484 O=C(COC1CC1)NCCCO 16fcad234fca984a1e07e2384c9dac8d [0,1,0,1,0,0|2,0,0]=4 9735 B12R1.484 O=C(COCCF)NCC1CC1 e1f569073e3f146a2cd387bf1ddee6e8 [0,1,0,1,0,0|2,0,0]=4 9736 B12R1.484 O=C(COCCO)NCC1CC1 0dc53107bb207c34bc8645cf84d174b7 [0,1,0,1,0,0|2,0,0]=4 9737 B12R1.484 O=C(COCCS)NCC1CC1 20d90b101661243af49eb1408930cab7 [0,1,0,1,0,0|2,0,0]=4 9738 B12R1.484 O=C(NCCCO)NCC1CC1 469a8d2e0f9206767b28f4a2a3323403 [0,1,0,1,0,0|2,0,0]=4 9739 B12R1.486 CCCCCC(=O)N1CC(C1)F 5d53127a33af5502c1a9e74bd6519e71 [0,1,0,1,0,0|1,0,0]=3 9740 B12R1.486 CCCCCC(=O)N1CC(C1)O 41ae37cbf9f4d33e6b04ac1a87dc6df6 [0,1,0,1,0,0|1,0,0]=3 9741 B12R1.486 CCCCNC(=O)C1=CC(C1)C ddebad24c1fc38a4baff84bb9f3ae8ea [0,1,0,1,0,0|2,0,0]=4 9742 B12R1.486 CCCCNC(=O)N1CC(C1)F 2768968f4bf81860fb8e3ccddc289d29 [0,1,0,1,0,0|2,0,0]=4 9743 B12R1.486 CCCCNC(=O)N1CC(C1)O 968ca7814e3a5ba07dc47a38ce90bb4f [0,1,0,1,0,0|2,0,0]=4 9744 B12R1.486 CCCNCC(=O)N1CC(C1)O 95ff41ed79acc7ced63489f62424ab17 [0,1,0,1,0,0|2,0,0]=4 9745 B12R1.486 CCCOCC(=O)N1CC(C1)F 8701c52812b500245be3edd11aac75bf [0,1,0,1,0,0|2,0,0]=4 9746 B12R1.486 CCCOCC(=O)N1CC(C1)O e1407bf158d2468c14894a1592d79f9a [0,1,0,1,0,0|2,0,0]=4 9747 B12R1.486 CCCSCC(=O)N1CC(C1)F 339fe2ccbe880256fdbff3038d89a9ef [0,1,0,1,0,0|2,0,0]=4 9748 B12R1.486 CCCSCC(=O)N1CC(C1)O 2e303ef95a5f2a80ac5369a6846ece71 [0,1,0,1,0,0|2,0,0]=4 9749 B12R1.486 CCOCCC(=O)N1CC(C1)F 30742502902321776a09506326591f6b [0,1,0,1,0,0|2,0,0]=4 9750 B12R1.486 CCOCCC(=O)N1CC(C1)O 219aba0739be4d6963c396c006987e63 [0,1,0,1,0,0|2,0,0]=4 9751 B12R1.486 CCSCCC(=O)N1CC(C1)F 682b0e661e0ffa673988b5454bf0f93d [0,1,0,1,0,0|2,0,0]=4 9752 B12R1.486 CCSCCC(=O)N1CC(C1)O a920e00afbbc78f8a66ca668a6a35ad2 [0,1,0,1,0,0|2,0,0]=4 9753 B12R1.486 COCCCC(=O)N1CC(C1)F 7887522823ed8b2ec98181fb6dffe300 [0,1,0,1,0,0|2,0,0]=4 9754 B12R1.486 COCCCC(=O)N1CC(C1)O d28a8c60a04206bc960d92dcb7e2033c [0,1,0,1,0,0|2,0,0]=4 9755 B12R1.486 CSCCCC(=O)N1CC(C1)F fa784b16a6edd00df6c74684091c64de [0,1,0,1,0,0|2,0,0]=4 9756 B12R1.486 CSCCCC(=O)N1CC(C1)O 53c264783b0118bb7ec1b0a8545f2cb4 [0,1,0,1,0,0|2,0,0]=4 9757 B12R1.486 O=C(CCCCF)N1CC(C1)F e0f3f11d060493feaacf953d6597a678 [0,1,0,1,0,0|2,0,0]=4 9758 B12R1.486 O=C(CCCCF)N1CC(C1)O c7c2335fa0636382195e99b5816bc94e [0,1,0,1,0,0|2,0,0]=4 9759 B12R1.486 O=C(CCCCO)N1CC(C1)F fc17e9b18cbbdf52652e8054c4c46680 [0,1,0,1,0,0|2,0,0]=4 9760 B12R1.486 O=C(CCCCO)N1CC(C1)O 9c2d8ec85be848ab55dbe0f64edb1e44 [0,1,0,1,0,0|2,0,0]=4 9761 B12R1.486 O=C(CCCCS)N1CC(C1)F fb80ec6cb4f7b5845a55432ae07f9945 [0,1,0,1,0,0|2,0,0]=4 9762 B12R1.486 O=C(CCCCS)N1CC(C1)O 7595b410773628a4cdafd875913c4700 [0,1,0,1,0,0|2,0,0]=4 9763 B12R1.551 C=C(C)CNC(=O)CC1CCC1 9ea3b1b00dfbb14b647892c8288ecfaa [0,1,0,1,0,0|1,0,1]=4 9764 B12R1.551 CC(=O)CNC(=O)CC1CCC1 43c048d58f14151a1374131535ef0da5 [0,1,0,1,0,0|1,0,1]=4 9765 B12R1.551 CC(C)CCC(=O)NC1CCC1 14a445f9ece045495fb51fcf618bfab6 [0,1,0,1,0,0|2,0,0]=4 9766 B12R1.551 CC(C)CNC(=O)CC1CCC1 3be85527414b8492c737d8451b7fdd92 [0,1,0,1,0,0|1,0,0]=3 9767 B12R1.551 CC(C)CNC(=O)CC1CCO1 89f21a716567f7d2b4ba4ec82ef39d34 [0,1,0,1,0,0|2,0,0]=4 9768 B12R1.551 CC(C)CNC(=O)CC1COC1 59f3fd00f2c2ffa76b8453a996cf4b85 [0,1,0,1,0,0|2,0,0]=4 9769 B12R1.551 CC(C)CNC(=O)CC1CSC1 12bcb10b4c8014d5514afb75f7ac4f70 [0,1,0,1,0,0|2,0,0]=4 9770 B12R1.551 CC(C)CNC(=O)CN1CCC1 4598f2d07cb2be82f1793b1b1ce5ed79 [0,1,0,1,0,0|2,0,0]=4 9771 B12R1.551 CC(C)CNC(=O)NC1CCC1 997cbed3b64e9f1d1121febb2a626d97 [0,1,0,1,0,0|2,0,0]=4 9772 B12R1.551 CC(O)CCC(=O)NC1CCC1 d67ea5d686399d59b0cc0070c8b576df [0,1,0,1,0,0|2,0,0]=4 9773 B12R1.551 CC(O)CNC(=O)CC1CCC1 275cf9b4e538bd6b24a160c87aa8bcfb [0,1,0,1,0,0|1,0,0]=3 9774 B12R1.551 CC(O)CNC(=O)CC1CCO1 993ab4668dbce13ae5a4978afbc8f4bd [0,1,0,1,0,0|2,0,0]=4 9775 B12R1.551 CC(O)CNC(=O)CC1COC1 12dd2b1757513c700e73cddece2b02d6 [0,1,0,1,0,0|2,0,0]=4 9776 B12R1.551 CC(O)CNC(=O)CC1CSC1 177243839c8cb9e1b16107b386faf93f [0,1,0,1,0,0|2,0,0]=4 9777 B12R1.551 CC(O)CNC(=O)CN1CCC1 5635a57f96e29692994d7381de4b17e1 [0,1,0,1,0,0|2,0,0]=4 9778 B12R1.551 CC(O)CNC(=O)NC1CCC1 2e8f6fd2b190b49950f0402f88273ac0 [0,1,0,1,0,0|2,0,0]=4 9779 B12R1.551 CC(S)CCC(=O)NC1CCC1 1179986e2af8d1d94bfbbb39e5788057 [0,1,0,1,0,0|2,0,0]=4 9780 B12R1.551 C[C@@H](O)CNC(=O)CC1CCC1 99844d592df36117773506bfff4e1897 [0,1,0,1,0,0|1,0,0]=3 9781 B12R1.551 C[C@@H](O)CNC(=O)CC1CCO1 192a67e9d4188d5708c330b17786c5c1 [0,1,0,1,0,0|2,0,0]=4 9782 B12R1.551 C[C@@H](O)CNC(=O)CC1COC1 4a67940cda12ca427017a939abbac02b [0,1,0,1,0,0|2,0,0]=4 9783 B12R1.551 C[C@@H](O)CNC(=O)CC1CSC1 246a63eaec08a3f60af6dca24fa71359 [0,1,0,1,0,0|2,0,0]=4 9784 B12R1.551 C[C@@H](O)CNC(=O)CN1CCC1 a13e54e0ff099aaa16e01aa06a298dac [0,1,0,1,0,0|2,0,0]=4 9785 B12R1.551 C[C@@H](O)CNC(=O)NC1CCC1 fb326b32acdc7d87295bd41d003d1830 [0,1,0,1,0,0|2,0,0]=4 9786 B12R1.551 C[C@H](O)CNC(=O)CC1CCC1 0727bce4b0c1619ca0ef893ec22678ec [0,1,0,1,0,0|1,0,0]=3 9787 B12R1.551 C[C@H](O)CNC(=O)CC1CCO1 f28de6cb8c8a081f4252e50bf3426274 [0,1,0,1,0,0|2,0,0]=4 9788 B12R1.551 C[C@H](O)CNC(=O)CC1COC1 67a62e8394a724f5e10ef690dca4e8dd [0,1,0,1,0,0|2,0,0]=4 9789 B12R1.551 C[C@H](O)CNC(=O)CC1CSC1 839341f254e80705e81b6ebdb6b3199a [0,1,0,1,0,0|2,0,0]=4 9790 B12R1.551 C[C@H](O)CNC(=O)CN1CCC1 f2acadf1e8d6ab372ce69c4ba5f81831 [0,1,0,1,0,0|2,0,0]=4 9791 B12R1.551 C[C@H](O)CNC(=O)NC1CCC1 a6a77382a2085bfb135394ccf7de8ddb [0,1,0,1,0,0|2,0,0]=4 9792 B12R1.551 C[C@H](S)CCC(=O)NC1CCC1 1108fbaac7b68586b6173bca83a7272e [0,1,0,1,0,0|2,0,0]=4 9793 B12R1.551 O=C(CC1CCC1)NCC(F)F 9db5ad031c947f5a068581d847022429 [0,1,0,1,0,0|2,0,0]=4 9794 B12R1.552 C=C(C)CNC(=O)CCC1CC1 2962965a40a032e436de104eb5ee279e [0,1,0,1,0,0|1,0,1]=4 9795 B12R1.552 CC(=O)CNC(=O)CCC1CC1 8c1c67b65d75dd5e1cb04b0518d1c286 [0,1,0,1,0,0|1,0,1]=4 9796 B12R1.552 CC(C)CCC(=O)NCC1CC1 43baf3cf8572214293c6eb34e6de214b [0,1,0,1,0,0|2,0,0]=4 9797 B12R1.552 CC(C)CNC(=O)CCC1CC1 54e6b9b36c1803e9f6c7ced1deee4e2d [0,1,0,1,0,0|1,0,0]=3 9798 B12R1.552 CC(C)CNC(=O)CNC1CC1 4c332a636ecc424082f81f7b922eb05a [0,1,0,1,0,0|2,0,0]=4 9799 B12R1.552 CC(C)CNC(=O)COC1CC1 1d556100c9513297b14af7213e1768cb [0,1,0,1,0,0|2,0,0]=4 9800 B12R1.552 CC(C)CNC(=O)NCC1CC1 ea88b8146f87a50394617814f4de8ce3 [0,1,0,1,0,0|2,0,0]=4 9801 B12R1.552 CC(O)CCC(=O)NCC1CC1 9021459bfec8cee0699e77a327615bd9 [0,1,0,1,0,0|2,0,0]=4 9802 B12R1.552 CC(O)CNC(=O)CCC1CC1 f7e28274aaa6490ab9e32cb5641d73ed [0,1,0,1,0,0|1,0,0]=3 9803 B12R1.552 CC(O)CNC(=O)COC1CC1 dfa0a31aee4a850e07904a125d146618 [0,1,0,1,0,0|2,0,0]=4 9804 B12R1.552 CC(O)CNC(=O)NCC1CC1 c1edf211ef9261a26471ab911d460392 [0,1,0,1,0,0|2,0,0]=4 9805 B12R1.552 CC(S)CCC(=O)NCC1CC1 8e5e9ab5bd680511930cc5e5d14c5ea2 [0,1,0,1,0,0|2,0,0]=4 9806 B12R1.552 C[C@@H](O)CNC(=O)CCC1CC1 019641c2ec7775d2f6c05edf305d2a57 [0,1,0,1,0,0|1,0,0]=3 9807 B12R1.552 C[C@@H](O)CNC(=O)COC1CC1 b6e5905ddc6f18bf9c5ee264ac3234e9 [0,1,0,1,0,0|2,0,0]=4 9808 B12R1.552 C[C@@H](O)CNC(=O)NCC1CC1 585370e4d37889000aaba7fe4b29829e [0,1,0,1,0,0|2,0,0]=4 9809 B12R1.552 C[C@H](O)CNC(=O)CCC1CC1 495ba0d9eeab509677aa565813c8c5a7 [0,1,0,1,0,0|1,0,0]=3 9810 B12R1.552 C[C@H](O)CNC(=O)COC1CC1 a01be39c7e1ceae7871b0b3c474c4775 [0,1,0,1,0,0|2,0,0]=4 9811 B12R1.552 C[C@H](O)CNC(=O)NCC1CC1 4df3327cc757564bd07b5e6b4109c9b1 [0,1,0,1,0,0|2,0,0]=4 9812 B12R1.552 C[C@H](S)CCC(=O)NCC1CC1 6317b1b5bb6e72b765dac0c9c74a1efe [0,1,0,1,0,0|2,0,0]=4 9813 B12R1.552 O=C(CCC1CC1)NCC(F)F 8bc5ed8336c86a7d166670a5c7050e0a [0,1,0,1,0,0|2,0,0]=4 9814 B12R1.804 CC1(COC(=O)C1OCCF)C f758b6d82d93a71217d909901c7b243d [0,1,0,1,0,0|2,0,0]=4 9815 B12R1.804 CC1(COC(=O)C1OCCS)C afbafd5048850b2aed2035b5afb9db0c [0,1,0,1,0,0|2,0,0]=4 9816 B12R1.804 CC1(COC(=O)[C@@H]1OCCF)C 87b5f4e6e1bf3d426271e38f93ff4b06 [0,1,0,1,0,0|2,0,0]=4 9817 B12R1.804 CC1(COC(=O)[C@@H]1OCCS)C d72dd1dc911b7b6f7c9e0d5734ec07ab [0,1,0,1,0,0|2,0,0]=4 9818 B12R1.804 CC1(COC(=O)[C@H]1OCCF)C 5b07113ec1386121f23bceb84185e1bb [0,1,0,1,0,0|2,0,0]=4 9819 B12R1.804 CC1(COC(=O)[C@H]1OCCS)C 7357068a4faca4031201f231b44498c8 [0,1,0,1,0,0|2,0,0]=4 9820 B12R1.804 CCCOC1C(=O)NCC1(C)C 402ac34f4da0be0b42cad8809a66f88c [0,1,0,1,0,0|2,0,0]=4 9821 B12R1.804 CCCOC1C(=O)OCC1(C)C 7da8610dbc1d19b86412c69c18f542b8 [0,1,0,1,0,0|1,0,0]=3 9822 B12R1.804 CCCO[C@@H]1C(=O)OCC1(C)C bd212f88b6eb287f4f8c416e98d85077 [0,1,0,1,0,0|1,0,0]=3 9823 B12R1.804 CCCO[C@H]1C(=O)OCC1(C)C 8c205a8d913c6d76173111ea85b88340 [0,1,0,1,0,0|1,0,0]=3 9824 B12R1.804 COCOC1C(=O)OCC1(C)C 8ef83c644fec50684cf89f83a4feaaf9 [0,1,0,1,0,0|2,0,0]=4 9825 B12R1.804 COCO[C@@H]1C(=O)OCC1(C)C a7eef0966faaa046ed4f88532da163b9 [0,1,0,1,0,0|2,0,0]=4 9826 B12R1.804 COCO[C@H]1C(=O)OCC1(C)C caadc1f4b0204ba5594ab7e60ac6660e [0,1,0,1,0,0|2,0,0]=4 9827 B12R1.804 CSCOC1C(=O)OCC1(C)C cfb953a2f528768825f418c689719489 [0,1,0,1,0,0|2,0,0]=4 9828 B12R1.804 CSCO[C@@H]1C(=O)OCC1(C)C 9894e5151ea0623b49a58045000c7ab3 [0,1,0,1,0,0|2,0,0]=4 9829 B12R1.804 CSCO[C@H]1C(=O)OCC1(C)C 34118f6f541d5102f12bd5308f730a44 [0,1,0,1,0,0|2,0,0]=4 9830 B12R1.1144 CCCN1CC(=O)NCC1(C)C ed1004559bd9c3db6be4b79806f4ca64 [0,1,0,1,0,0|2,0,0]=4 9831 B12R1.1343 CC(C)COC1CCCCCC1 a543c67eb61bd039825940a0b227907c [0,1,0,1,0,0|1,0,1]=4 9832 B12R1.1343 CC(F)COC1CCCCCC1 45e8eca45ee0f8bafeb19ea3ec15fa46 [0,1,0,1,0,0|1,0,1]=4 9833 B12R1.1343 CC(S)COC1CCCCCC1 516401eb92dadad2ac6ee52d3f144290 [0,1,0,1,0,0|1,0,1]=4 9834 B12R1.1343 C[C@@H](F)COC1CCCCCC1 3c4a1a6e8bdb03da8161a778f1973056 [0,1,0,1,0,0|1,0,1]=4 9835 B12R1.1343 C[C@H](F)COC1CCCCCC1 cb5d3cc911f4c2488eff8e7f8b8f1d9d [0,1,0,1,0,0|1,0,1]=4 9836 B12R1.2132 CC1(CN1C(=O)CCCCF)C 1cfb16c5c7f93184fedc8862d0317044 [0,1,0,1,0,0|2,0,0]=4 9837 B12R1.2132 CC1(CN1C(=O)CCCCO)C 34aa516fe4d51bc1abc54ca91dcce485 [0,1,0,1,0,0|2,0,0]=4 9838 B12R1.2132 CCCCNC(=O)N1CC1(C)C b5b50135c19d96a8a114fe2fef54b988 [0,1,0,1,0,0|2,0,0]=4 9839 B12R1.2132 CCCOCC(=O)N1CC1(C)C ccd21c722135a8a00ba0ea734dd199dd [0,1,0,1,0,0|2,0,0]=4 9840 B12R1.2132 CCCSCC(=O)N1CC1(C)C 806f3f9ffefdf769863aebacbf448539 [0,1,0,1,0,0|2,0,0]=4 9841 B12R1.2132 CCSCCC(=O)N1CC1(C)C 41c109435becfeddace1950325ffa01f [0,1,0,1,0,0|2,0,0]=4 9842 B12R1.27 CCC(C)OCC1=CCCCO1 1dc8587ab411bef769e8b14dd09bfe96 [0,1,0,1,0,0|2,0,0]=4 9843 B12R1.71 CCCOC1CCC(CC1)CC 473f1c47016220360fafaa4f16debb68 [0,1,0,1,0,0|1,0,1]=4 9844 B12R1.71 CCCO[C@H]1CC[C@@H](CC1)CC db3acae59f97049f285d20536a9e9968 [0,1,0,1,0,0|1,0,1]=4 9845 B12R1.71 CCCO[C@H]1CC[C@H](CC1)CC ba84eba593a5968beb546684010f8fc1 [0,1,0,1,0,0|1,0,1]=4 9846 B12R1.354 CCC(C)N1CC(=O)NCC1C 6ef327e4d2e692672b3d906e10e43a46 [0,1,0,1,0,0|2,0,0]=4 9847 B12R1.354 CCC(C)N1CC(=O)NC[C@@H]1C 2acd80f4c6206d7883b81dfdc4942720 [0,1,0,1,0,0|2,0,0]=4 9848 B12R1.354 CCC(C)N1CC(=O)NC[C@H]1C 5f9ae189e9c5c7b60aacb69ac878b9e7 [0,1,0,1,0,0|2,0,0]=4 9849 B12R1.371 CCC(C)NC1CCCCC1=O a82242618f5fee627b35573a1be964a1 [0,1,0,1,0,0|2,0,0]=4 9850 B12R1.371 CCC(C)NC1CCCNC1=O 567f9a9322429986630a6a4815534cd6 [0,1,0,1,0,0|2,0,0]=4 9851 B12R1.371 CCC(C)N[C@@H]1CCCNC1=O deacced294d6a2e120750d71eb2194e4 [0,1,0,1,0,0|2,0,0]=4 9852 B12R1.371 CCC(C)N[C@H]1CCCNC1=O 344b7207e68fb00a84ae549a655d1436 [0,1,0,1,0,0|2,0,0]=4 9853 B12R1.371 CCC(C)OC1CCCCC1=O f2ad8b0318815878195d7bbf0336a1cc [0,1,0,1,0,0|2,0,0]=4 9854 B12R1.371 CCC(C)OC1CCCNC1=O ce321827b5ebea49caac8caedc628165 [0,1,0,1,0,0|2,0,0]=4 9855 B12R1.371 CCC(C)OC1CCCOC1=O 513bf905e0720ff7589defe8a152ceb4 [0,1,0,1,0,0|1,0,0]=3 9856 B12R1.371 CCC(C)O[C@@H]1CCCNC1=O d423908edfbc383008132f33515dab74 [0,1,0,1,0,0|2,0,0]=4 9857 B12R1.371 CCC(C)O[C@H]1CCCNC1=O e007425d977e97c778f025e4e556946c [0,1,0,1,0,0|2,0,0]=4 9858 B12R1.371 CC[C@@H](C)NC1CCCCC1=O 4cbdc0a9146bd757dfce2f1da006d769 [0,1,0,1,0,0|2,0,0]=4 9859 B12R1.371 CC[C@@H](C)NC1CCCNC1=O 389d9cc6af3d56990c82e832acc2cc6e [0,1,0,1,0,0|2,0,0]=4 9860 B12R1.371 CC[C@H](C)NC1CCCCC1=O 0b3a85c7a2bd697835b94fc6374a6e5f [0,1,0,1,0,0|2,0,0]=4 9861 B12R1.371 CC[C@H](C)NC1CCCNC1=O 9cf32b8eda7664dc315e5671f792666a [0,1,0,1,0,0|2,0,0]=4 9862 B12R1.385 CCCOC1CCC(C(C1)C)C 40fffc64ff0c101d7831400c2a30d0e0 [0,1,0,1,0,0|1,0,1]=4 9863 B12R1.463 C=C(CNC1CCC1)OCOC 8209f4929b2e86fd61ad7c34cdbfa11e [0,1,0,1,0,0|2,0,0]=4 9864 B12R1.463 C=C(COC1CCC1)OCOC 3b6805716fd06213a4080c73cc1d47c4 [0,1,0,1,0,0|2,0,0]=4 9865 B12R1.463 C=CCOC(=O)CNC1CCC1 c49ca81f579460e9395d7c4f987954ed [0,1,0,1,0,0|0,0,2]=4 9866 B12R1.463 C=CCOC(=O)COC1CCC1 8a2be6cd4444d9ebbf37146b4fdd56dd [0,1,0,1,0,0|0,0,2]=4 9867 B12R1.463 CC/C=C/C(=O)NCC1CCC1 ce01aa70b5b09e482e89420fc78c3afc [0,1,0,1,0,0|1,0,1]=4 9868 B12R1.463 CC/C=C\C(=O)NCC1CCC1 d564b48c6000e143a9e1d48a73800a15 [0,1,0,1,0,0|1,0,1]=4 9869 B12R1.463 CCC#CC(=O)NCC1CCC1 af6ca909863377752354800e3cb87346 [0,1,0,1,0,0|1,0,1]=4 9870 B12R1.463 CCC=CC(=O)NCC1CCC1 a25507352476ae9c41f0a793337e89ec [0,1,0,1,0,0|1,0,1]=4 9871 B12R1.463 CCCCC(=O)NCC1CCC1 837d5edf6ff5895d223cac23d3f6a0b1 [0,1,0,1,0,0|1,0,0]=3 9872 B12R1.463 CCCCC(=O)NCC1CCO1 96b15e76e76b9d2796080949aec5b5f5 [0,1,0,1,0,0|2,0,0]=4 9873 B12R1.463 CCCCC(=O)NCC1COC1 94644e1eb3d2aa30cf9e3a2e748b046e [0,1,0,1,0,0|2,0,0]=4 9874 B12R1.463 CCCCC(=O)NC[C@@H]1CCO1 64196eeddbabe38738c525466f4abdc7 [0,1,0,1,0,0|2,0,0]=4 9875 B12R1.463 CCCCC(=O)NC[C@H]1CCO1 f9383e72ece39bd8abbc96006bf26b2a [0,1,0,1,0,0|2,0,0]=4 9876 B12R1.463 CCCCC(=O)OCN1CCC1 7cd2f5991bec06bfe0baf55a37c781bb [0,1,0,1,0,0|2,0,0]=4 9877 B12R1.463 CCCNC(=O)/C=C/C1CCC1 cb5a2a8d016374d71c7db71843aeb212 [0,1,0,1,0,0|1,0,1]=4 9878 B12R1.463 CCCNC(=O)C#CC1CCC1 d28e0316edf2762f3279d9fb83fa7a9c [0,1,0,1,0,0|1,0,1]=4 9879 B12R1.463 CCCNC(=O)CCC1CCC1 f7ae54913b0cc8af19a8869ec6035315 [0,1,0,1,0,0|1,0,0]=3 9880 B12R1.463 CCCNC(=O)CCN1CCC1 9526ecd4f4c1e265986277f9f00ee0a3 [0,1,0,1,0,0|1,0,0]=3 9881 B12R1.463 CCCNC(=O)CNC1CCC1 1419f69ccec43431a876dba7669067fc [0,1,0,1,0,0|1,0,0]=3 9882 B12R1.463 CCCNC(=O)CNC1COC1 1cb671f9dca0fcbe6bbf91370ed49f95 [0,1,0,1,0,0|2,0,0]=4 9883 B12R1.463 CCCNC(=O)COC1CCC1 7484a12ddf79c1a84d267f114383f169 [0,1,0,1,0,0|1,0,0]=3 9884 B12R1.463 CCCNC(=O)COC1COC1 2e5cd5c68ce80a221d13334ab2276daa [0,1,0,1,0,0|2,0,0]=4 9885 B12R1.463 CCCNC(=O)COC1CSC1 c96320ca3920aad06300261312dbb2b9 [0,1,0,1,0,0|2,0,0]=4 9886 B12R1.463 CCCNC(=O)NCC1CCC1 fd91800e3208c3383e3d240521b4f1a6 [0,1,0,1,0,0|1,0,0]=3 9887 B12R1.463 CCCNC(=O)NCC1CCO1 beaa1d4a6e9ba85ca8e708867d13ec41 [0,1,0,1,0,0|2,0,0]=4 9888 B12R1.463 CCCNC(=O)NCC1COC1 7a42ba3d27f018b9a071a6477eca2a11 [0,1,0,1,0,0|2,0,0]=4 9889 B12R1.463 CCCNC(=O)NC[C@@H]1CCO1 8db9326a2439d424641536aba5022789 [0,1,0,1,0,0|2,0,0]=4 9890 B12R1.463 CCCNC(=O)NC[C@H]1CCO1 303c16e042a7fa0ba380be55e30d8064 [0,1,0,1,0,0|2,0,0]=4 9891 B12R1.463 CCCNC(=S)NCC1CCC1 ffa585e3e675f3bcdbc00bf689cb5c0b [0,1,0,1,0,0|1,1,0]=4 9892 B12R1.463 CCCOC(=O)CNC1CCC1 ab05365432c9e3c6cab3825d1451d035 [0,1,0,1,0,0|0,0,0]=2 9893 B12R1.463 CCCOC(=O)CNC1COC1 dc0d303a36696602664dc4840c08e43a [0,1,0,1,0,0|1,0,0]=3 9894 B12R1.463 CCCOC(=O)COC1CCC1 9f45e0d46d80b29f8c56a8aa427424a0 [0,1,0,1,0,0|0,0,0]=2 9895 B12R1.463 CCCOC(=O)COC1COC1 7f7d0cbd5a4d1da5672a846247d44913 [0,1,0,1,0,0|1,0,0]=3 9896 B12R1.463 CCCOC(=O)COC1CSC1 3a5ca1203b5eebb5b60f357b2ae7c014 [0,1,0,1,0,0|1,0,0]=3 9897 B12R1.463 CCCOC(=O)OCN1CCC1 84d272c180577cdf42da980795300dbd [0,1,0,1,0,0|1,0,0]=3 9898 B12R1.463 CCOCC(=O)NCC1CCC1 700a844adc50861145381ee6f729872d [0,1,0,1,0,0|2,0,0]=4 9899 B12R1.463 CCSCC(=O)NCC1CCC1 af685950ba190867295854beff4ef052 [0,1,0,1,0,0|2,0,0]=4 9900 B12R1.463 COCCC(=O)NCC1CCC1 54fb2b1c86c709984bec93f34e879a5e [0,1,0,1,0,0|2,0,0]=4 9901 B12R1.463 CSCCC(=O)CNC1CCC1 655f0d2567959c07c26c34c5ede58f41 [0,1,0,1,0,0|2,0,0]=4 9902 B12R1.463 CSCCC(=O)COC1CCC1 910cdcdaf422702fb6552f2dae2449ce [0,1,0,1,0,0|2,0,0]=4 9903 B12R1.463 CSCCC(=O)NCC1CCC1 12ad1374010d1b24123ca9bb84411188 [0,1,0,1,0,0|2,0,0]=4 9904 B12R1.463 NCCNC(=O)NCC1CCC1 9a5d373e0a6a69b5293d2f9b674d07dd [0,1,0,1,0,0|2,0,0]=4 9905 B12R1.463 O=C(CCC1CCC1)NCCF 1b15c82c7fbc6b9d0971fded133aa300 [0,1,0,1,0,0|2,0,0]=4 9906 B12R1.463 O=C(CCC1CCC1)NCCI 05fec93410b72164ae03796a3fdf5a91 [0,1,0,1,0,0|2,0,0]=4 9907 B12R1.463 O=C(CCC1CCC1)NCCO 9071be662f83f8047256625a0301a127 [0,1,0,1,0,0|2,0,0]=4 9908 B12R1.463 O=C(CCC1CCC1)NCCS 4707699906dcd7791608b793df07b569 [0,1,0,1,0,0|2,0,0]=4 9909 B12R1.463 O=C(CCCF)NCC1CCC1 65962c60d03ac295113fc99693de6864 [0,1,0,1,0,0|2,0,0]=4 9910 B12R1.463 O=C(CCCS)NCC1CCC1 d2b3d084997776bef684affccaa9391c [0,1,0,1,0,0|2,0,0]=4 9911 B12R1.463 O=C(CCN1CCC1)NCCBr 517af0f992d33480c1bbab6c6d434b66 [0,1,0,1,0,0|2,0,0]=4 9912 B12R1.463 O=C(CCN1CCC1)NCCF bb3e83a0692f562fe8d7428e6fb0299e [0,1,0,1,0,0|2,0,0]=4 9913 B12R1.463 O=C(CCN1CCC1)NCCI 04753d01ef0a769d52bb20844a2dd518 [0,1,0,1,0,0|2,0,0]=4 9914 B12R1.463 O=C(CCN1CCC1)NCCO 7aec8e9f270a351344303eaa6fc0ed6b [0,1,0,1,0,0|2,0,0]=4 9915 B12R1.463 O=C(CCN1CCC1)NCCS 365bc1090818eb369e2790d0868688af [0,1,0,1,0,0|2,0,0]=4 9916 B12R1.463 O=C(CNC1CCC1)NCCO 25652099f176d34769232c539b994a9f [0,1,0,1,0,0|2,0,0]=4 9917 B12R1.463 O=C(COC1CCC1)NCCBr 7fff913dec851a722ace5d7c91c03368 [0,1,0,1,0,0|2,0,0]=4 9918 B12R1.463 O=C(COC1CCC1)NCCF 0e5c02344e93a5f14e2542f9514fa1e3 [0,1,0,1,0,0|2,0,0]=4 9919 B12R1.463 O=C(COC1CCC1)NCCI 02a9869a0a40218db9187f4d6eef7842 [0,1,0,1,0,0|2,0,0]=4 9920 B12R1.463 O=C(COC1CCC1)NCCO 6f53cd2b464de311448a6e92cf208770 [0,1,0,1,0,0|2,0,0]=4 9921 B12R1.463 O=C(COC1CCC1)NCCS 7154078b8cfdc7d85f19a955e11e32fa [0,1,0,1,0,0|2,0,0]=4 9922 B12R1.463 O=C(NCCF)NCC1CCC1 0b4c8bd93bcfc5bce43539be1f9253ff [0,1,0,1,0,0|2,0,0]=4 9923 B12R1.463 O=C(NCCO)NCC1CCC1 0de49e1d3bd35cf6230baee469b08a3c [0,1,0,1,0,0|2,0,0]=4 9924 B12R1.463 O=C(NCCS)NCC1CCC1 e068ad477c83ab3b47d700ab10101c06 [0,1,0,1,0,0|2,0,0]=4 9925 B12R1.549 C=C(CNC1CC1C)OCOC caca89c849bbf283f9eee6ccb6052cef [0,1,0,1,0,0|2,0,0]=4 9926 B12R1.549 C=CCOC(=O)CNC1CC1C 8efeb7591c4b2b062ec7276cea1e2c2c [0,1,0,1,0,0|0,0,2]=4 9927 B12R1.549 CCCNC(=O)CNC1CC1C b27568d99189466fd627a86076628613 [0,1,0,1,0,0|1,0,0]=3 9928 B12R1.549 CCCNC(=O)CN[C@@H]1C[C@H]1F 7a2ef79dc65b5c310fa945d253b7d998 [0,1,0,1,0,0|2,0,0]=4 9929 B12R1.549 CCCNC(=O)CN[C@H]1C[C@@H]1F 89b5214a402956729898ac68cbc1fd98 [0,1,0,1,0,0|2,0,0]=4 9930 B12R1.549 CCCNC(=O)CN[C@H]1C[C@H]1F bcffbea9d9042a151eb2f2e230a674c3 [0,1,0,1,0,0|2,0,0]=4 9931 B12R1.549 CCCOC(=O)CNC1CC1C e6686344ca051c7b1f0ddd710a94338c [0,1,0,1,0,0|0,0,0]=2 9932 B12R1.549 CCCOC(=O)CN[C@@H]1C[C@H]1F 2ece9c169b2fd5ab27beb9c97ef4dc5e [0,1,0,1,0,0|1,0,0]=3 9933 B12R1.549 CCCOC(=O)CN[C@H]1C[C@@H]1F b9974e6157f81ac071ae8c759bda2760 [0,1,0,1,0,0|1,0,0]=3 9934 B12R1.549 CCCOC(=O)CN[C@H]1C[C@H]1F 9fbcbf14064613e5c0d001f45b86d318 [0,1,0,1,0,0|1,0,0]=3 9935 B12R1.549 CSCCC(=O)CNC1CC1C 9c3983de61406433b774164e54096ca3 [0,1,0,1,0,0|2,0,0]=4 9936 B12R1.882 CC1(CC1)CCC(=O)NCCF 40d051ed6fb65d31a7ace262b02349cf [0,1,0,1,0,0|2,0,0]=4 9937 B12R1.882 CC1(CC1)CCC(=O)NCCI cd1fd2744ebb1433fe3738900a12400e [0,1,0,1,0,0|2,0,0]=4 9938 B12R1.882 CC1(CC1)CCC(=O)NCCO 4f47a5352f5b5ec50f9bc4ae944bba5d [0,1,0,1,0,0|2,0,0]=4 9939 B12R1.882 CC1(CC1)CCC(=O)NCCS 097985093610f48480b3afe4b2114452 [0,1,0,1,0,0|2,0,0]=4 9940 B12R1.882 CCCCC(=O)NCC1(CC1)F 36f212ef4185b75c613f2e70a726b908 [0,1,0,1,0,0|2,0,0]=4 9941 B12R1.882 CCCCC(=O)NCC1(CC1)O a9d5e62598371e4146d0c36369839533 [0,1,0,1,0,0|2,0,0]=4 9942 B12R1.882 CCCNC(=O)CCC1(CC1)C f6ef59389038cd91341759dc5636a7fb [0,1,0,1,0,0|1,0,0]=3 9943 B12R1.882 CCCNC(=O)CNC1(CC1)C e1b8ada1b2c40ad0c6dfb9d8f3a379ba [0,1,0,1,0,0|2,0,0]=4 9944 B12R1.882 CCCNC(=O)NCC1(CC1)F 7032c97d4a01e95e83818d2e011b8afe [0,1,0,1,0,0|2,0,0]=4 9945 B12R1.882 CCCNC(=O)NCC1(CC1)O e607506fa9ae462e64c872efe619c73d [0,1,0,1,0,0|2,0,0]=4 9946 B12R1.882 CCCOC(=O)CNC1(CC1)C 2138fe5bf4cb0960a5d76d32ef5ddb4d [0,1,0,1,0,0|1,0,0]=3 9947 B12R1.908 CCC(=O)CCC(=O)N1CCC1 ab3579ec208f301f072f8e4e11f3d1aa [0,1,0,1,0,0|1,0,1]=4 9948 B12R1.908 CCC(C)CCC(=O)N1CCC1 6611299165ddedcf091405747f4f2c46 [0,1,0,1,0,0|1,0,0]=3 9949 B12R1.908 CCC(C)CNC(=O)N1CCC1 2f4212a680b1906f5b7245854005f2ad [0,1,0,1,0,0|2,0,0]=4 9950 B12R1.908 CCC(C)NCC(=O)C1CCC1 bf8b90cf7a1373bb63417d98bfc5378b [0,1,0,1,0,0|2,0,0]=4 9951 B12R1.908 CCC(C)NCC(=O)N1CCC1 c6897a45048552d04c3b850d832424b0 [0,1,0,1,0,0|2,0,0]=4 9952 B12R1.908 CCC(C)OCC(=O)C1CCC1 69e1ebcaa187915b527964302f9f46ef [0,1,0,1,0,0|2,0,0]=4 9953 B12R1.908 CCC(C)OCC(=O)N1CCC1 6237caded697caa20ec5cc8ebde9924e [0,1,0,1,0,0|2,0,0]=4 9954 B12R1.908 CCC(O)CNC(=O)N1CCC1 02707219ea9d8c6a91e58ad08ef022f2 [0,1,0,1,0,0|2,0,0]=4 9955 B12R1.908 CCN(C)CCC(=O)N1CCC1 db9e0ab76f5464ab2229e01ef9de72a4 [0,1,0,1,0,0|2,0,0]=4 9956 B12R1.908 CCS(=O)CCC(=O)N1CCC1 ea611f6f0a3ed51d9d07ac01f3c89991 [0,1,0,1,0,0|2,0,0]=4 9957 B12R1.908 CC[C@@H](C)NCC(=O)C1CCC1 302c573e43d043288cd531ca4d110cec [0,1,0,1,0,0|2,0,0]=4 9958 B12R1.908 CC[C@@H](C)NCC(=O)N1CCC1 5b9eea0c5112cdfc90e5cec6baadf0e5 [0,1,0,1,0,0|2,0,0]=4 9959 B12R1.908 CC[C@@H](C)OCC(=O)C1CCC1 fd4d589ee2b8fa01cf86683ae1590782 [0,1,0,1,0,0|2,0,0]=4 9960 B12R1.908 CC[C@@H](C)OCC(=O)N1CCC1 364efd8b77102ca9a43a18061c4057e0 [0,1,0,1,0,0|2,0,0]=4 9961 B12R1.908 CC[C@@H](O)CNC(=O)N1CCC1 07b7b4e868b4cabe16a8d3b57d532d2c [0,1,0,1,0,0|2,0,0]=4 9962 B12R1.908 CC[C@H](C)CNC(=O)N1CCC1 110bb1581542e2bae2d9d97fd2c260c5 [0,1,0,1,0,0|2,0,0]=4 9963 B12R1.908 CC[C@H](C)NCC(=O)C1CCC1 35fbf6cda8ee447514dfc47ad2423b6c [0,1,0,1,0,0|2,0,0]=4 9964 B12R1.908 CC[C@H](C)NCC(=O)N1CCC1 7d4afc73a6d4389efa851921b3ce6b5b [0,1,0,1,0,0|2,0,0]=4 9965 B12R1.908 CC[C@H](C)OCC(=O)C1CCC1 bf7fa91194ace518a82e9e1f0695ee24 [0,1,0,1,0,0|2,0,0]=4 9966 B12R1.908 CC[C@H](C)OCC(=O)N1CCC1 ca590bf15fec4f1d44cbabf9c9f1b326 [0,1,0,1,0,0|2,0,0]=4 9967 B12R1.910 CCC(=O)CCC(=O)NC1CC1 f775d18129ed9d9da8ede0ec4469afe7 [0,1,0,1,0,0|1,0,1]=4 9968 B12R1.910 CCC(C)CCC(=O)NC1CC1 ae4e97e606dff4d57d4c5b63fc4b2d92 [0,1,0,1,0,0|1,0,0]=3 9969 B12R1.910 CCC(C)CCC(C)OC1CC1 774bb65d6089f928e4f604541a51cc5a [0,1,0,1,0,0|1,0,1]=4 9970 B12R1.910 CCC(C)CNC(=O)CC1CC1 ff83bd0875063a4da264905c76a36d89 [0,1,0,1,0,0|2,0,0]=4 9971 B12R1.910 CCC(C)CNC(=O)NC1CC1 848aeaf27ed56a62c5c16c003c703a84 [0,1,0,1,0,0|2,0,0]=4 9972 B12R1.910 CCC(C)NCC(=O)NC1CC1 6e9fbc852a61128341fe07d414a0c1f3 [0,1,0,1,0,0|2,0,0]=4 9973 B12R1.910 CCC(C)OCC(=O)NC1CC1 5b8340370801f703482b7d0d64db0720 [0,1,0,1,0,0|2,0,0]=4 9974 B12R1.910 CCC(O)CNC(=O)CC1CC1 53b8a155c51fd6e70521a8cb9c7f04d2 [0,1,0,1,0,0|2,0,0]=4 9975 B12R1.910 CCC(O)CNC(=O)NC1CC1 bb1945a86d7c66d80da39354d2444795 [0,1,0,1,0,0|2,0,0]=4 9976 B12R1.910 CCS(=O)CCC(=O)NC1CC1 a6aa706535deaaa1dcae029f8964ac30 [0,1,0,1,0,0|2,0,0]=4 9977 B12R1.910 CC[C@@H](C)NCC(=O)NC1CC1 11791c04d9af47583af59b1e2a43a3ff [0,1,0,1,0,0|2,0,0]=4 9978 B12R1.910 CC[C@@H](C)OCC(=O)NC1CC1 a807431fd03e93765a09ffce4dbcc96e [0,1,0,1,0,0|2,0,0]=4 9979 B12R1.910 CC[C@@H](O)CNC(=O)CC1CC1 9e7f9a16f3ebfe022c6577588b55022e [0,1,0,1,0,0|2,0,0]=4 9980 B12R1.910 CC[C@@H](O)CNC(=O)NC1CC1 e464261c45202e3252a41d3e7db95eea [0,1,0,1,0,0|2,0,0]=4 9981 B12R1.910 CC[C@H](C)CNC(=O)CC1CC1 f3f29708b0afbb067635ebaeb05f4f23 [0,1,0,1,0,0|2,0,0]=4 9982 B12R1.910 CC[C@H](C)CNC(=O)NC1CC1 6ac4b1067db12f0302413202c8465ed7 [0,1,0,1,0,0|2,0,0]=4 9983 B12R1.910 CC[C@H](C)NCC(=O)NC1CC1 b15dbe0284d6e335639aee81426f7d05 [0,1,0,1,0,0|2,0,0]=4 9984 B12R1.910 CC[C@H](C)OCC(=O)NC1CC1 917e3186e631e2ef1426ccb8d40d87b2 [0,1,0,1,0,0|2,0,0]=4 9985 B12R1.925 CC/C=C/C(=O)N[C@@H]1CC[C@H]1C abfcd3346c7c5d7a797c1824cd65e6d5 [0,1,0,1,0,0|1,0,1]=4 9986 B12R1.925 CC/C=C/C(=O)N[C@H]1CC[C@H]1C 21b937f5871a6739db0637828acda0d9 [0,1,0,1,0,0|1,0,1]=4 9987 B12R1.925 CC/C=C\C(=O)N[C@@H]1CC[C@H]1C 800ecbfc8dd45a1fb1263d50f4f147c3 [0,1,0,1,0,0|1,0,1]=4 9988 B12R1.925 CC/C=C\C(=O)N[C@H]1CC[C@H]1C 8238f851d5ac2ec683d18b2049b5e812 [0,1,0,1,0,0|1,0,1]=4 9989 B12R1.925 CCC#CC(=O)N[C@@H]1CC[C@H]1C 091055a2b3857a7d91b4c41282436e2b [0,1,0,1,0,0|1,0,1]=4 9990 B12R1.925 CCC#CC(=O)N[C@H]1CC[C@H]1C 1275a553cdd1254378c1856f0e0ad015 [0,1,0,1,0,0|1,0,1]=4 9991 B12R1.925 CCC=CC(=O)N[C@@H]1CC[C@H]1C 490693f71a07da1e238330f9c0491693 [0,1,0,1,0,0|1,0,1]=4 9992 B12R1.925 CCC=CC(=O)N[C@H]1CC[C@H]1C 18fe02735cfea12f0cc204ddc5166c54 [0,1,0,1,0,0|1,0,1]=4 9993 B12R1.925 CCCCC(=O)NC1CCC1F 25a3ee06a204ca503ff2467510ac3abd [0,1,0,1,0,0|2,0,0]=4 9994 B12R1.925 CCCCC(=O)NC1CCC1O 95e4e781f8c6809493739e4f94982ac7 [0,1,0,1,0,0|2,0,0]=4 9995 B12R1.925 CCCCC(=O)NC1COC1C 38c31418dc94c0889dc0b931a257658b [0,1,0,1,0,0|2,0,0]=4 9996 B12R1.925 CCCCC(=O)N[C@@H]1CC[C@@H]1O fd5806e49bcb42d753899bdbfb0d1aec [0,1,0,1,0,0|2,0,0]=4 9997 B12R1.925 CCCCC(=O)N[C@@H]1CC[C@H]1C 9265218896b27d4a1d2eb6a938d8aef1 [0,1,0,1,0,0|1,0,0]=3 9998 B12R1.925 CCCCC(=O)N[C@@H]1CC[C@H]1O 02778014a7860d39f9e2ced346f48026 [0,1,0,1,0,0|2,0,0]=4 9999 B12R1.925 CCCCC(=O)N[C@H]1CC[C@@H]1O d73c777a22ad74ec6498d959d5af2c83 [0,1,0,1,0,0|2,0,0]=4 10000 B12R1.925 CCCCC(=O)N[C@H]1CC[C@H]1C 02dfba1d0b3b135d627a156f11593eb2 [0,1,0,1,0,0|1,0,0]=3 10001 B12R1.925 CCCCC(=O)N[C@H]1CC[C@H]1O b13543e27352b53890795814af923c95 [0,1,0,1,0,0|2,0,0]=4 10002 B12R1.925 CCCNC(=O)NC1CCC1F 7e7bec52fd170aa340ee7dca708857e6 [0,1,0,1,0,0|2,0,0]=4 10003 B12R1.925 CCCNC(=O)NC1CCC1O 7c7a94fb62505fa2e853723b2d876d59 [0,1,0,1,0,0|2,0,0]=4 10004 B12R1.925 CCCNC(=O)NC1COC1C 82534550ceb50f89ed8011f0ce0bf33a [0,1,0,1,0,0|2,0,0]=4 10005 B12R1.925 CCCNC(=O)N[C@@H]1CC[C@@H]1O 98014c1f83844ca744b8a06147f871d3 [0,1,0,1,0,0|2,0,0]=4 10006 B12R1.925 CCCNC(=O)N[C@@H]1CC[C@H]1C 180c1c9ae7fe559fc155d1e4f2d8707d [0,1,0,1,0,0|1,0,0]=3 10007 B12R1.925 CCCNC(=O)N[C@@H]1CC[C@H]1O 180da0f7a4aee99f44307911043d2500 [0,1,0,1,0,0|2,0,0]=4 10008 B12R1.925 CCCNC(=O)N[C@H]1CC[C@@H]1O a8efcb59d1d5d366ab7c844286154aae [0,1,0,1,0,0|2,0,0]=4 10009 B12R1.925 CCCNC(=O)N[C@H]1CC[C@H]1C c46d4adaaaaccff2bc6b50bdb0637388 [0,1,0,1,0,0|1,0,0]=3 10010 B12R1.925 CCCNC(=O)N[C@H]1CC[C@H]1O 08af88519db7a5647a27e50b16ae5933 [0,1,0,1,0,0|2,0,0]=4 10011 B12R1.925 CCCNC(=S)N[C@@H]1CC[C@H]1C d8ab25d2db9b354bff32ed65db1e97c8 [0,1,0,1,0,0|1,1,0]=4 10012 B12R1.925 CCCNC(=S)N[C@H]1CC[C@H]1C b24d64403337fcd5e3ea51556f1fa59a [0,1,0,1,0,0|1,1,0]=4 10013 B12R1.925 CCOCC(=O)N[C@@H]1CC[C@H]1C 2b6eba6e49b937d993225df794881733 [0,1,0,1,0,0|2,0,0]=4 10014 B12R1.925 CCOCC(=O)N[C@H]1CC[C@H]1C 3c78ff6cb592dae865b2ee8891e2509b [0,1,0,1,0,0|2,0,0]=4 10015 B12R1.925 CCSCC(=O)N[C@@H]1CC[C@H]1C 387059758b111de8d9e79bbe8305ac22 [0,1,0,1,0,0|2,0,0]=4 10016 B12R1.925 CCSCC(=O)N[C@H]1CC[C@H]1C 7b1f4d33762f07b7264861e0150bd039 [0,1,0,1,0,0|2,0,0]=4 10017 B12R1.925 COCCC(=O)N[C@@H]1CC[C@H]1C 6342f9e6147fed09ad754c97712f36fd [0,1,0,1,0,0|2,0,0]=4 10018 B12R1.925 COCCC(=O)N[C@H]1CC[C@H]1C 76b951e63e6d687649af3040b7615cb9 [0,1,0,1,0,0|2,0,0]=4 10019 B12R1.925 CSCCC(=O)N[C@@H]1CC[C@H]1C 062d5ae64c3d7fc40fd9fddef805be30 [0,1,0,1,0,0|2,0,0]=4 10020 B12R1.925 CSCCC(=O)N[C@H]1CC[C@H]1C 9059c2608fdf85e24defc70062bdd935 [0,1,0,1,0,0|2,0,0]=4 10021 B12R1.925 C[C@@H]1CC[C@@H]1NC(=O)CCCF 11d8f778671c5f09fe63d5a9437cd179 [0,1,0,1,0,0|2,0,0]=4 10022 B12R1.925 C[C@@H]1CC[C@@H]1NC(=O)CCCS c739f8cf54c6ffb021a9d00f8d78950c [0,1,0,1,0,0|2,0,0]=4 10023 B12R1.925 C[C@@H]1CC[C@@H]1NC(=O)NCCF f4533259e8b5f955cc51c16d590320cb [0,1,0,1,0,0|2,0,0]=4 10024 B12R1.925 C[C@@H]1CC[C@@H]1NC(=O)NCCN c156c578be5c2024cd0ba85507e1c8ac [0,1,0,1,0,0|2,0,0]=4 10025 B12R1.925 C[C@@H]1CC[C@@H]1NC(=O)NCCO 337dcc5727a2fb92907cd71f58e90e34 [0,1,0,1,0,0|2,0,0]=4 10026 B12R1.925 C[C@@H]1CC[C@@H]1NC(=O)NCCS fe86c507a90177a193a094609ab1fda2 [0,1,0,1,0,0|2,0,0]=4 10027 B12R1.925 C[C@@H]1CC[C@H]1NC(=O)CCCF 1eb2ea81363acc613e5b45e90fe6db43 [0,1,0,1,0,0|2,0,0]=4 10028 B12R1.925 C[C@@H]1CC[C@H]1NC(=O)CCCS 0ad390fa446011e1555765e4f31bebc4 [0,1,0,1,0,0|2,0,0]=4 10029 B12R1.925 C[C@@H]1CC[C@H]1NC(=O)NCCF f52108610fcaf6387f9b387b78ef2584 [0,1,0,1,0,0|2,0,0]=4 10030 B12R1.925 C[C@@H]1CC[C@H]1NC(=O)NCCN c734a2a3e7c005c7a097f9c3242acce1 [0,1,0,1,0,0|2,0,0]=4 10031 B12R1.925 C[C@@H]1CC[C@H]1NC(=O)NCCO 094653cc6b5e3b716ea79cc45c9aa460 [0,1,0,1,0,0|2,0,0]=4 10032 B12R1.925 C[C@@H]1CC[C@H]1NC(=O)NCCS 36270f711014053fd44789be53d47c1f [0,1,0,1,0,0|2,0,0]=4 10033 B12R1.1657 CCC(C)N1CCCNC(=O)C1 7eead7227da9fa5bd550bc3e871db59f [0,1,0,1,0,0|2,0,0]=4 10034 B12R1.8 CCCCCNC1CCCCO1 a04a407ce82ef8b9e2f612b604deb88b [0,1,0,1,0,0|1,0,1]=4 10035 B12R1.8 CCCCCOC1CCCCO1 18b43ff403d614c1654f078f891c172f [0,1,0,1,0,0|1,0,1]=4 10036 B12R1.8 CCCCNCC1=CCCCC1 b4d155af4975f2e9fcaabfdf00dab43f [0,1,0,1,0,0|2,0,0]=4 10037 B12R1.8 CCCCNCC1CCCCO1 7cbced637fe63dc7e5e80033b72c2362 [0,1,0,1,0,0|1,0,1]=4 10038 B12R1.8 CCCCOCC1=CCCCC1 f2466a9e33bf8ba8f839c8a97177a46a [0,1,0,1,0,0|2,0,0]=4 10039 B12R1.8 CCCCOCC1=CCCCO1 02d51c2daa2c86596aea8a48e1133c57 [0,1,0,1,0,0|1,0,0]=3 10040 B12R1.8 CCCCOCC1CCCCO1 72dbea7faa92e3748970c338c0dcc673 [0,1,0,1,0,0|1,0,1]=4 10041 B12R1.8 CCCCOC[C@@H]1CCCCO1 2c2dc3fd5a9ad35708b0d1b6f4ca8c98 [0,1,0,1,0,0|1,0,1]=4 10042 B12R1.8 CCCCOC[C@H]1CCCCO1 b64af6b0b1b1d2a79193204a0cbd2ae0 [0,1,0,1,0,0|1,0,1]=4 10043 B12R1.8 CCCNCCC1=CCCCC1 042827e5ab130d6c8376131fdb5b1629 [0,1,0,1,0,0|2,0,0]=4 10044 B12R1.8 CCCNCCC1CCCCO1 54f25f2836d544bd4202b59511fb5069 [0,1,0,1,0,0|1,0,1]=4 10045 B12R1.8 CCCNCCN1CCCCO1 61e7cc63e384d55158a00ab844ec6170 [0,1,0,1,0,0|2,0,0]=4 10046 B12R1.8 CCCOCCC1CCCCO1 8760945c045ffc1b2a4d32669c550bf0 [0,1,0,1,0,0|1,0,1]=4 10047 B12R1.8 COCCOCC1=CCCCO1 c8c99977b51ad564cdf8c426c6b08e7b [0,1,0,1,0,0|2,0,0]=4 10048 B12R1.8 CSCCOCC1=CCCCO1 00ba8e134799b4300995896393c9126b [0,1,0,1,0,0|2,0,0]=4 10049 B12R1.8 FCCCOCC1=CCCCO1 e5094c7d3aed5a4aaaec54528b28b537 [0,1,0,1,0,0|2,0,0]=4 10050 B12R1.8 SCCCOCC1=CCCCO1 ee712b7398e05bafff388df4c16e6c0c [0,1,0,1,0,0|2,0,0]=4 10051 B12R1.52 CCNC1CCCCCNC1=O 35d9c8faa8a0d710ddfcdfd3e77dc296 [0,1,0,1,0,0|2,0,0]=4 10052 B12R1.112 CCCN1CCC(=O)CC1CO bde74919fdb49135e59b8afc4989089e [0,1,0,1,0,0|2,0,0]=4 10053 B12R1.267 C#CCCOC1CCCOC1=O 0c80efc3c9bbd7d5e8623a1275fc4ca5 [0,1,0,1,0,0|0,0,2]=4 10054 B12R1.267 C/C=C/COC1CCCOC1=O df9c7a5cf18535c21772ae193cf8cbc9 [0,1,0,1,0,0|0,0,2]=4 10055 B12R1.267 C/C=C\COC1CCCOC1=O a9f679bb09347a3d5da7359cf152e0e3 [0,1,0,1,0,0|0,0,2]=4 10056 B12R1.267 C=CCCOC1CCCOC1=O 7ef615afe9b195a5be239054b70e3243 [0,1,0,1,0,0|0,0,2]=4 10057 B12R1.267 CCCCNC1CCCCC1=O 1f579042bd80b775702b1968f3de84f9 [0,1,0,1,0,0|1,0,0]=3 10058 B12R1.267 CCCCNC1CCCNC1=O 6f6c04d97f3fd7977058d91729ee8f70 [0,1,0,1,0,0|1,0,0]=3 10059 B12R1.267 CCCCNC1COCCC1=O e5649830f76c94e2d558c5156f74e5de [0,1,0,1,0,0|2,0,0]=4 10060 B12R1.267 CCCCNC1SCCCC1=O 50a0dc54d781158a2afc89e7266fa0d9 [0,1,0,1,0,0|2,0,0]=4 10061 B12R1.267 CCCCN[C@@H]1CCCNC1=O c127b96155ec3f8c17c3c8d2163f9301 [0,1,0,1,0,0|1,0,0]=3 10062 B12R1.267 CCCCN[C@H]1CCCNC1=O 97ca393d914a8066b535888c78eba6be [0,1,0,1,0,0|1,0,0]=3 10063 B12R1.267 CCCCOC1CCCC=C1Br e656af5c8ae147c301934c07dab43e2d [0,1,0,1,0,0|2,0,0]=4 10064 B12R1.267 CCCCOC1CCCCC1=O 9b929e3937802070516da9a8db8ff919 [0,1,0,1,0,0|1,0,0]=3 10065 B12R1.267 CCCCOC1CCCNC1=O f1de504acf4b5c03ae5b5c371f6cca84 [0,1,0,1,0,0|1,0,0]=3 10066 B12R1.267 CCCCOC1CCCOC1=O 3402da1871c1610f2f40f0fcae99a420 [0,1,0,1,0,0|0,0,0]=2 10067 B12R1.267 CCCCOC1COCCC1=O 8ad9a2573a53d0662dfc914e3c4c08da [0,1,0,1,0,0|2,0,0]=4 10068 B12R1.267 CCCCOC1SCCCC1=O f62d3ad31bb3a8b634282fa795524049 [0,1,0,1,0,0|2,0,0]=4 10069 B12R1.267 CCCCO[C@@H]1CCCNC1=O 9e6bb672ef64e85cc9c62c1704a64664 [0,1,0,1,0,0|1,0,0]=3 10070 B12R1.267 CCCCO[C@H]1CCCNC1=O 329bc2a5413b0c8b071170b6c0bca00d [0,1,0,1,0,0|1,0,0]=3 10071 B12R1.267 CCCOCC1=CCCCC1=O 013e4c3a1c1f85272d4cf98d7a8f0a87 [0,1,0,1,0,0|2,0,0]=4 10072 B12R1.267 CCCOCC1CCCCC1=O 9b81379f43d6f65d7dc1849190a709dd [0,1,0,1,0,0|1,0,0]=3 10073 B12R1.267 CCCOCC1CCCNC1=O cb3247f75703373c7a8cf11e00c5cde5 [0,1,0,1,0,0|1,0,0]=3 10074 B12R1.267 CCNCCN1CCCCC1=O 5d8a64088887206cc5e551c98e9059dd [0,1,0,1,0,0|2,0,0]=4 10075 B12R1.267 CCOCNC1CCCNC1=O 57e2f24bbd85d3c3181a4f1c79ebd602 [0,1,0,1,0,0|2,0,0]=4 10076 B12R1.267 CCOCN[C@@H]1CCCNC1=O 0cfd21e6c6fe4b6e587e9d673fc993c4 [0,1,0,1,0,0|2,0,0]=4 10077 B12R1.267 CCOCN[C@H]1CCCNC1=O 773eab45b8a246e530dcd61625098cf4 [0,1,0,1,0,0|2,0,0]=4 10078 B12R1.267 CCOCOC1CCCNC1=O 6a63bdac465c5a2ab03b207b3e14fa55 [0,1,0,1,0,0|2,0,0]=4 10079 B12R1.267 CCOCO[C@@H]1CCCNC1=O ca84b54cc5846904998198c152e009d7 [0,1,0,1,0,0|2,0,0]=4 10080 B12R1.267 CCOCO[C@H]1CCCNC1=O 86cb001dfa31046e2a836d8ff61ca2e9 [0,1,0,1,0,0|2,0,0]=4 10081 B12R1.267 COCCNC1CCCCC1=O 6aa803245668498d3fa6a64011acee23 [0,1,0,1,0,0|2,0,0]=4 10082 B12R1.267 COCCNC1CCCNC1=O d9e975822fe537231c351388d6d46fe8 [0,1,0,1,0,0|2,0,0]=4 10083 B12R1.267 COCCN[C@@H]1CCCNC1=O 9fbf1085d719834f35d60ca0f150006d [0,1,0,1,0,0|2,0,0]=4 10084 B12R1.267 COCCN[C@H]1CCCNC1=O a4aa69e979a88646eb27c8e4c07b8e45 [0,1,0,1,0,0|2,0,0]=4 10085 B12R1.267 COCCOC1CCCCC1=O 525f79de9164cb5684d8087376d1b615 [0,1,0,1,0,0|2,0,0]=4 10086 B12R1.267 COCCOC1CCCNC1=O 60b54deaa8843694f2e836cd892c0ff0 [0,1,0,1,0,0|2,0,0]=4 10087 B12R1.267 COCCOC1CCCOC1=O 31d13b90f09c3b72f2004aa50e9cf467 [0,1,0,1,0,0|1,0,0]=3 10088 B12R1.267 COCCO[C@@H]1CCCNC1=O 2a6c67dd75758d3d5b8a90b11bf9002f [0,1,0,1,0,0|2,0,0]=4 10089 B12R1.267 COCCO[C@H]1CCCNC1=O 57ca0182c876b1d20adca15e66b91066 [0,1,0,1,0,0|2,0,0]=4 10090 B12R1.267 COCOCC1CCCCC1=O 78ea87cf065d1f5734f82b9413d0ab0b [0,1,0,1,0,0|2,0,0]=4 10091 B12R1.267 COCOCC1CCCNC1=O ec67d5307eb343b82ea1c62964be65d7 [0,1,0,1,0,0|2,0,0]=4 10092 B12R1.267 CSCCNC1CCCCC1=O 5dad08d8e4f15a0d2cb1621ea7d820dc [0,1,0,1,0,0|2,0,0]=4 10093 B12R1.267 CSCCNC1CCCNC1=O 67ada25ef070f4c4a37291729521ab1a [0,1,0,1,0,0|2,0,0]=4 10094 B12R1.267 CSCCN[C@@H]1CCCNC1=O 4c5c08220bfea3c017e536eec70ac121 [0,1,0,1,0,0|2,0,0]=4 10095 B12R1.267 CSCCN[C@H]1CCCNC1=O 7bab485695dd8e0fd22cc5f723afbe18 [0,1,0,1,0,0|2,0,0]=4 10096 B12R1.267 CSCCOC1CCCCC1=O 2d4ed50d45119dc03baadb1f40162720 [0,1,0,1,0,0|2,0,0]=4 10097 B12R1.267 CSCCOC1CCCNC1=O 83b6b50f4d7cdd4dc4ae82adb25930ac [0,1,0,1,0,0|2,0,0]=4 10098 B12R1.267 CSCCOC1CCCOC1=O ee1b5f9e88494c65a05748f157e6d958 [0,1,0,1,0,0|1,0,0]=3 10099 B12R1.267 CSCCO[C@@H]1CCCNC1=O e6e15fa843a1180a8adccde98000d183 [0,1,0,1,0,0|2,0,0]=4 10100 B12R1.267 CSCCO[C@H]1CCCNC1=O 44061747aaa4476a90a905a77131bfe4 [0,1,0,1,0,0|2,0,0]=4 10101 B12R1.267 CSCOCC1CCCCC1=O 4423c0139b8fd70abb32ca8233752883 [0,1,0,1,0,0|2,0,0]=4 10102 B12R1.267 CSCOCC1CCCNC1=O 5056b4b872ddbe801bd9d517a82670e0 [0,1,0,1,0,0|2,0,0]=4 10103 B12R1.267 N#CCCOC1CCCOC1=O 8dd22352b9641284b0eabe6820115dc1 [0,1,0,1,0,0|1,0,1]=4 10104 B12R1.267 O=C1CCCCC1COCCF 12cb187e6908d2c6d053a274d9d4c1e4 [0,1,0,1,0,0|2,0,0]=4 10105 B12R1.267 O=C1CCCCC1COCCS 41cab1101a50807fced8cc96619848cf [0,1,0,1,0,0|2,0,0]=4 10106 B12R1.267 O=C1CCCCC1NCCCCl e7b6f098a885ff327d7b0f7059ac5339 [0,1,0,1,0,0|2,0,0]=4 10107 B12R1.267 O=C1CCCCC1NCCCO c87c2bd7081591a2208fc549e711a3c4 [0,1,0,1,0,0|2,0,0]=4 10108 B12R1.267 O=C1CCCCC1OCCCF 5685b156b3d52fa940b753668721f4ab [0,1,0,1,0,0|2,0,0]=4 10109 B12R1.267 O=C1CCCCC1OCCCS d9ec412c3ff779af27190d49fd8f64ba [0,1,0,1,0,0|2,0,0]=4 10110 B12R1.267 O=C1NCCCC1COCCF 1eabdeacef569c496fa37a9df5593fab [0,1,0,1,0,0|2,0,0]=4 10111 B12R1.267 O=C1NCCCC1COCCS 0d6d5a6cb1949de9f1a0e8f223205c5b [0,1,0,1,0,0|2,0,0]=4 10112 B12R1.267 O=C1NCCCC1NCCCCl 0f6ade43b05b1786a5185460b784f955 [0,1,0,1,0,0|2,0,0]=4 10113 B12R1.267 O=C1NCCCC1NCCCF ac041cf42829e40085cc553fb0046c48 [0,1,0,1,0,0|2,0,0]=4 10114 B12R1.267 O=C1NCCCC1NCCCO 6ac1321eacfd8b791675dd0c6bc5c567 [0,1,0,1,0,0|2,0,0]=4 10115 B12R1.267 O=C1NCCCC1NCCCS 94125dd66150a0bd3dd9b4b64a070140 [0,1,0,1,0,0|2,0,0]=4 10116 B12R1.267 O=C1NCCCC1OCCCF c391d09e16e334da5c2106cf69b7d410 [0,1,0,1,0,0|2,0,0]=4 10117 B12R1.267 O=C1NCCCC1OCCCS 2b8f5dda802510f4554b0aba988ba488 [0,1,0,1,0,0|2,0,0]=4 10118 B12R1.267 O=C1NCCC[C@@H]1NCCCF 270fc1aa829c2df67154dbe5f3bdcb99 [0,1,0,1,0,0|2,0,0]=4 10119 B12R1.267 O=C1NCCC[C@@H]1NCCCO de7d0497c2c75e6ec6f4f4497b949098 [0,1,0,1,0,0|2,0,0]=4 10120 B12R1.267 O=C1NCCC[C@@H]1NCCCS 23a42005e2709cf4de340fbf48a6b524 [0,1,0,1,0,0|2,0,0]=4 10121 B12R1.267 O=C1NCCC[C@@H]1OCCCF 428fd29344ab2d996d7924bf06873994 [0,1,0,1,0,0|2,0,0]=4 10122 B12R1.267 O=C1NCCC[C@@H]1OCCCS ff41e9441adb45f09299681a8848331c [0,1,0,1,0,0|2,0,0]=4 10123 B12R1.267 O=C1NCCC[C@H]1NCCCF c78d87e5b16a2ce99b261cd0422f992e [0,1,0,1,0,0|2,0,0]=4 10124 B12R1.267 O=C1NCCC[C@H]1NCCCO f0e98986f8e48796d7ffc54aae941b2a [0,1,0,1,0,0|2,0,0]=4 10125 B12R1.267 O=C1NCCC[C@H]1NCCCS 20cd9c58592b364a5a1fa891067e1b9b [0,1,0,1,0,0|2,0,0]=4 10126 B12R1.267 O=C1NCCC[C@H]1OCCCF 91be455cc782808ef63f99bc6710b316 [0,1,0,1,0,0|2,0,0]=4 10127 B12R1.267 O=C1NCCC[C@H]1OCCCS b1edc52d7e473f35343636b7e98aabe6 [0,1,0,1,0,0|2,0,0]=4 10128 B12R1.267 O=C1OCCCC1OCCCF 274cec9db8c6f9ad44005fab41117eae [0,1,0,1,0,0|1,0,0]=3 10129 B12R1.267 O=C1OCCCC1OCCCS 9e3c2a8c541357ca9205a839d9c62efa [0,1,0,1,0,0|1,0,0]=3 10130 B12R1.267 O=CCCOC1CCCOC1=O 31494d627fbf199e677aa5e67775eb7f [0,1,0,1,0,0|1,0,1]=4 10131 B12R1.329 CCCOC1/C=C/CCCCC1 5a184e09a41e6cca14e64c2bbf13ef66 [0,1,0,1,0,0|1,0,1]=4 10132 B12R1.329 CCCOC1/C=C\CCCCC1 db9e9cf2a223625d884d7b358a0cded4 [0,1,0,1,0,0|1,0,1]=4 10133 B12R1.329 CCCOC1C=CCCCCC1 01492e28a3496f03bb3d3627ba51e6a4 [0,1,0,1,0,0|1,0,1]=4 10134 B12R1.329 CCCOC1CCCCCCC1 4a765fc44e8d60716ce20532dd38b6d4 [0,1,0,1,0,0|1,0,1]=4 10135 B12R1.329 CCCO[C@H]1/C=C/CCCCC1 f38de21c07b9ceeb7f2196b43d00aa23 [0,1,0,1,0,0|1,0,1]=4 10136 B12R1.329 CCCO[C@H]1/C=C\CCCCC1 45c44869e7071bc4813dcc90d2865d6b [0,1,0,1,0,0|1,0,1]=4 10137 B12R1.333 CCCCN1CC(C1)OCCC 50c3bf96d364f73423efd4b78be8b84c [0,1,0,1,0,0|1,0,1]=4 10138 B12R1.382 CCCOC1CCCC(C1)CC ff199cbd2cd5ef08928493137e7635d7 [0,1,0,1,0,0|1,0,1]=4 10139 B12R1.382 CCCOC1CCCC(C1)OC 7d9d189a6e58c1d16ce571419b26673b [0,1,0,1,0,0|1,0,1]=4 10140 B12R1.382 CCCOC1CCCN(C1)CC c92363374e0b085043505c42fddf7783 [0,1,0,1,0,0|1,0,1]=4 10141 B12R1.382 CCCO[C@H]1CCC[C@@H](C1)OC 536e4a569249cdb63ed8d1682d5238f9 [0,1,0,1,0,0|1,0,1]=4 10142 B12R1.382 CCCO[C@H]1CCC[C@H](C1)OC 4fd41c4bb333cddc19a7a9f12cf2be72 [0,1,0,1,0,0|1,0,1]=4 10143 B12R1.461 CC/C=C/C(=O)N1CCC1CC 70427b82f2b4407804895bc42e87a013 [0,1,0,1,0,0|1,0,1]=4 10144 B12R1.461 CC/C=C\C(=O)N1CCC1CC f85ca426973876f2b0029848132d58df [0,1,0,1,0,0|1,0,1]=4 10145 B12R1.461 CCC#CC(=O)N1CCC1CC 6573e9d405c05e223f870e328d95078d [0,1,0,1,0,0|1,0,1]=4 10146 B12R1.461 CCC1CCN1C(=O)CCCF 545c68695636a874e6d1079774b210bc [0,1,0,1,0,0|2,0,0]=4 10147 B12R1.461 CCC1CCN1C(=O)CCCS 7dc3b4450b1c7a0180825df975f227ed [0,1,0,1,0,0|2,0,0]=4 10148 B12R1.461 CCC1CCN1C(=O)CCOC f071146793c665de56f3df9a99a2b33c [0,1,0,1,0,0|2,0,0]=4 10149 B12R1.461 CCC1CCN1C(=O)CCSC dd3b1c7f25d6ba77ae9b1f99c66c8268 [0,1,0,1,0,0|2,0,0]=4 10150 B12R1.461 CCC1CCN1C(=O)NCCF e652519d537cd13ea747934597a65521 [0,1,0,1,0,0|2,0,0]=4 10151 B12R1.461 CCC1CCN1C(=O)NCCN 17da16bf26defc0a80211573b884d0c4 [0,1,0,1,0,0|2,0,0]=4 10152 B12R1.461 CCC1CCN1C(=O)NCCO 1a954a1810db150881b2a4d2b90b7492 [0,1,0,1,0,0|2,0,0]=4 10153 B12R1.461 CCC1CCN1C(=O)NCCS 40f134f7189b926a325708cc7edcc3db [0,1,0,1,0,0|2,0,0]=4 10154 B12R1.461 CCC=CC(=O)N1CCC1CC db4060805db57714166885a24e56490c [0,1,0,1,0,0|1,0,1]=4 10155 B12R1.461 CCCCC(=O)N1CCC1CC e4dad2be972f5b43fc5990bed70296fa [0,1,0,1,0,0|1,0,0]=3 10156 B12R1.461 CCCCC(=O)N1CCC1CO bc262518ef0f9a6692145a3ba6e8eb42 [0,1,0,1,0,0|2,0,0]=4 10157 B12R1.461 CCCCC(=O)N1CC[C@@H]1CO 612179204f3f36a2b4da3b95c469ffc6 [0,1,0,1,0,0|2,0,0]=4 10158 B12R1.461 CCCCC(=O)N1CC[C@H]1CO 2d7b27986f31b34e7ecaebe74119affa [0,1,0,1,0,0|2,0,0]=4 10159 B12R1.461 CCCNC(=O)N1CCC1CC 634d358c7d2b11a8327178ff0dcc1684 [0,1,0,1,0,0|1,0,0]=3 10160 B12R1.461 CCCNC(=O)N1CCC1CO a944b52c4123c2ef30319465a918ea53 [0,1,0,1,0,0|2,0,0]=4 10161 B12R1.461 CCCNC(=O)N1CC[C@@H]1CO 91b34b5123243f630d335653e3822b56 [0,1,0,1,0,0|2,0,0]=4 10162 B12R1.461 CCCNC(=O)N1CC[C@H]1CO 4077b1aae34124de04f38cd2d334ee93 [0,1,0,1,0,0|2,0,0]=4 10163 B12R1.461 CCCNC(=O)[C@@H]1CCN1CC dff3fb1c49bf60bed671a805f8872ec3 [0,1,0,1,0,0|1,0,0]=3 10164 B12R1.461 CCCNC(=S)N1CCC1CC 9c44a7dc6ee2503f99f9223c7a8756be [0,1,0,1,0,0|1,1,0]=4 10165 B12R1.461 CCN1CC[C@H]1C(=O)NCCF 2526d53d2b6ccb24cbf3c95570515f5f [0,1,0,1,0,0|2,0,0]=4 10166 B12R1.461 CCN1CC[C@H]1C(=O)NCCI 48d404b746ccbd4cbad97f05cea675d0 [0,1,0,1,0,0|2,0,0]=4 10167 B12R1.461 CCN1CC[C@H]1C(=O)NCCO 8cce2e6a4e05a29784a80631b82d0eba [0,1,0,1,0,0|2,0,0]=4 10168 B12R1.461 CCN1CC[C@H]1C(=O)NCCS 9efce279ed61fc0cbecbcb65a549d0b6 [0,1,0,1,0,0|2,0,0]=4 10169 B12R1.461 CCOCC(=O)N1CCC1CC fb27e999b8481382f02cb6899e9cd33d [0,1,0,1,0,0|2,0,0]=4 10170 B12R1.461 CCSCC(=O)N1CCC1CC b3c74384b7aeaf34d442822538d486d6 [0,1,0,1,0,0|2,0,0]=4 10171 B12R1.464 C=C(CNCC1CC1)OCOC 0411db03b15998ee95085b684f8a71ef [0,1,0,1,0,0|2,0,0]=4 10172 B12R1.464 C=C(COCC1CC1)OCOC eaf68174537bbd61faa049d268f8a27f [0,1,0,1,0,0|2,0,0]=4 10173 B12R1.464 C=CCOC(=O)CNCC1CC1 787eee502ae87d8631d532ff01e2c457 [0,1,0,1,0,0|0,0,2]=4 10174 B12R1.464 C=CCOC(=O)COCC1CC1 4ffdde6bdcbbab3ac2603d6998d4cc2a [0,1,0,1,0,0|0,0,2]=4 10175 B12R1.464 CC/C=C/C(=O)NCCC1CC1 0a01a6cb7d73f0172de7529d40696d94 [0,1,0,1,0,0|1,0,1]=4 10176 B12R1.464 CC/C=C\C(=O)NCCC1CC1 950560d23f81ce4c4bd6fa6e19ff8090 [0,1,0,1,0,0|1,0,1]=4 10177 B12R1.464 CCC#CC(=O)NCCC1CC1 3aaec3d70063dc068f66e2e59a5e0db2 [0,1,0,1,0,0|1,0,1]=4 10178 B12R1.464 CCC=CC(=O)NCCC1CC1 678f54cf44374fefe0de456fcd600ba1 [0,1,0,1,0,0|1,0,1]=4 10179 B12R1.464 CCCCC(=O)NCCC1CC1 ad968fdec4d052e5613d4ba300f20332 [0,1,0,1,0,0|1,0,0]=3 10180 B12R1.464 CCCCC(=O)NCCN1CC1 6d3dd88b5beb6dbcfd5a75043af0dcc0 [0,1,0,1,0,0|2,0,0]=4 10181 B12R1.464 CCCCC(=O)OCNC1CC1 32936cde5d52dbf687757e2724987d2d [0,1,0,1,0,0|2,0,0]=4 10182 B12R1.464 CCCCC(=O)OCOC1CC1 62f57097065184062c6371adddfab550 [0,1,0,1,0,0|2,0,0]=4 10183 B12R1.464 CCCNC(=O)CCCC1CC1 8632f5c4f2587a22796c49da1d1e8ad6 [0,1,0,1,0,0|1,0,0]=3 10184 B12R1.464 CCCNC(=O)CNCC1CC1 70c72426ee6673bba1a1ae4abe6325c3 [0,1,0,1,0,0|1,0,0]=3 10185 B12R1.464 CCCNC(=O)COCC1CC1 84047463bb0568e00124dd25005eb738 [0,1,0,1,0,0|1,0,0]=3 10186 B12R1.464 CCCNC(=O)CSCC1CC1 3b4bc72992c5700e31f5116538eb61ba [0,1,0,1,0,0|1,0,0]=3 10187 B12R1.464 CCCNC(=O)NCCC1CC1 1113f430506a1b577bbcc4ccdf8958ae [0,1,0,1,0,0|1,0,0]=3 10188 B12R1.464 CCCNC(=O)NCCN1CC1 552d46747516cbe3809f8fac04113a29 [0,1,0,1,0,0|2,0,0]=4 10189 B12R1.464 CCCNC(=S)NCCC1CC1 50d8a77c5e6a6b6ac4ffdade4621f95c [0,1,0,1,0,0|1,1,0]=4 10190 B12R1.464 CCCOC(=O)CCOC1CC1 dde870784c6580b27b49e36c42b4c02e [0,1,0,1,0,0|0,0,0]=2 10191 B12R1.464 CCCOC(=O)CNCC1CC1 dd0d6fb12c5ae2ba7aab15279765034a [0,1,0,1,0,0|0,0,0]=2 10192 B12R1.464 CCCOC(=O)COCC1CC1 79caba3dd96d33bd35e1d71408bcbc2b [0,1,0,1,0,0|0,0,0]=2 10193 B12R1.464 CCCOC(=O)OCNC1CC1 0c0d200df95cae8f991366d3339beb39 [0,1,0,1,0,0|1,0,0]=3 10194 B12R1.464 CCCOC(=O)OCOC1CC1 3514334f763ce30a34dbe30741258431 [0,1,0,1,0,0|1,0,0]=3 10195 B12R1.464 CCOCC(=O)NCCC1CC1 790bf9d4906cce0435c16db067677b43 [0,1,0,1,0,0|2,0,0]=4 10196 B12R1.464 CCSCC(=O)NCCC1CC1 496c03dbac218b11791df43d00bf3c61 [0,1,0,1,0,0|2,0,0]=4 10197 B12R1.464 COCCC(=O)NCCC1CC1 fb75db8a03d609761ea122e54b27e9f7 [0,1,0,1,0,0|2,0,0]=4 10198 B12R1.464 CSCCC(=O)CNCC1CC1 e0ba44d7a2adcd376e884e3d91116036 [0,1,0,1,0,0|2,0,0]=4 10199 B12R1.464 CSCCC(=O)COCC1CC1 b74faea54a6dbaa35706b79b62fc35b0 [0,1,0,1,0,0|2,0,0]=4 10200 B12R1.464 CSCCC(=O)NCCC1CC1 8f8e6b6de542e277e39c335c256cd0ce [0,1,0,1,0,0|2,0,0]=4 10201 B12R1.464 NCCNC(=O)NCCC1CC1 34e4e0c150c1139c9030ecb6b038c784 [0,1,0,1,0,0|2,0,0]=4 10202 B12R1.464 O=C(CCCC1CC1)NCCBr b9ec8f71f807df83cf2e4eb77ee19366 [0,1,0,1,0,0|2,0,0]=4 10203 B12R1.464 O=C(CCCC1CC1)NCCF 7b92784507f3ad87bdf7625602defae7 [0,1,0,1,0,0|2,0,0]=4 10204 B12R1.464 O=C(CCCC1CC1)NCCI 2ec40641acd63bd8bbd3a8a54bb852a1 [0,1,0,1,0,0|2,0,0]=4 10205 B12R1.464 O=C(CCCC1CC1)NCCO c85e8ab7a2a7575d98185cb827a323a5 [0,1,0,1,0,0|2,0,0]=4 10206 B12R1.464 O=C(CCCC1CC1)NCCS d7c7d560765bec0f458d791e14f98bf9 [0,1,0,1,0,0|2,0,0]=4 10207 B12R1.464 O=C(CCCF)NCCC1CC1 f19fb4c8e476d45adebc772af87ebc2d [0,1,0,1,0,0|2,0,0]=4 10208 B12R1.464 O=C(CCCS)NCCC1CC1 58ceaf1d8b33300e374d34ad0ad09f0e [0,1,0,1,0,0|2,0,0]=4 10209 B12R1.464 O=C(CNCC1CC1)NCCO 09b1733fc3d23d682ac10d74fc7bc7ce [0,1,0,1,0,0|2,0,0]=4 10210 B12R1.464 O=C(COCC1CC1)NCCBr 54fefc083c2ac19936877be2d66e5871 [0,1,0,1,0,0|2,0,0]=4 10211 B12R1.464 O=C(COCC1CC1)NCCF ab91d6aa51b7af50be5c0e9416ed7080 [0,1,0,1,0,0|2,0,0]=4 10212 B12R1.464 O=C(COCC1CC1)NCCI 7bdd2ae12c412248ff6da19990bd4671 [0,1,0,1,0,0|2,0,0]=4 10213 B12R1.464 O=C(COCC1CC1)NCCO dfca53c9a389f6d1a4ba1c7cba780b93 [0,1,0,1,0,0|2,0,0]=4 10214 B12R1.464 O=C(COCC1CC1)NCCS 35d0eafe59bb137e2a12bc714a6f31ca [0,1,0,1,0,0|2,0,0]=4 10215 B12R1.464 O=C(CSCC1CC1)NCCBr 42d63cd3f977c0d1a6de96dd9a7749b4 [0,1,0,1,0,0|2,0,0]=4 10216 B12R1.464 O=C(CSCC1CC1)NCCF 75c316e4219b0075a5150cd4c91d4adc [0,1,0,1,0,0|2,0,0]=4 10217 B12R1.464 O=C(CSCC1CC1)NCCI 313983ec25c59ebbc7b702e4fb7b99d2 [0,1,0,1,0,0|2,0,0]=4 10218 B12R1.464 O=C(CSCC1CC1)NCCO c9d96864d9bfe5297f745ae318659d8e [0,1,0,1,0,0|2,0,0]=4 10219 B12R1.464 O=C(CSCC1CC1)NCCS dc66334dc0126224c121eb55c2e8fc0b [0,1,0,1,0,0|2,0,0]=4 10220 B12R1.464 O=C(NCCF)NCCC1CC1 8a4e9fc1504361323a21ae106dcd0570 [0,1,0,1,0,0|2,0,0]=4 10221 B12R1.464 O=C(NCCO)NCCC1CC1 21115f0f495f05539d1d0e38c1582ec4 [0,1,0,1,0,0|2,0,0]=4 10222 B12R1.464 O=C(NCCS)NCCC1CC1 3df66a1da41d401727de47e040c928b3 [0,1,0,1,0,0|2,0,0]=4 10223 B12R1.561 C#CCCCCC(=O)N1CCC1 7d316ba0eedaa97b4298bba03c22bcc3 [0,1,0,1,0,0|1,0,1]=4 10224 B12R1.561 C/C=C/CCCC(=O)N1CCC1 ad51d8a8ee4f61e0d0a6de5fb969f302 [0,1,0,1,0,0|1,0,1]=4 10225 B12R1.561 C=CCCCCC(=O)N1CCC1 574abfb6eb80b4ebc2c14b39e6f83af1 [0,1,0,1,0,0|1,0,1]=4 10226 B12R1.561 CCC/C=C/CC(=O)N1CCC1 758cf2860351c418e1f4d2cf3a13e37a [0,1,0,1,0,0|1,0,1]=4 10227 B12R1.561 CCCC/C=C/C(=O)N1CCC1 69625ab765cb60885cad3b48261aac70 [0,1,0,1,0,0|1,0,1]=4 10228 B12R1.561 CCCCC#CC(=O)N1CCC1 1f0690b707a5256feb6451e0ff08c686 [0,1,0,1,0,0|1,0,1]=4 10229 B12R1.561 CCCCC=CC(=O)N1CCC1 e821d485d4b6a82abd5e635d142b8995 [0,1,0,1,0,0|1,0,1]=4 10230 B12R1.561 CCCCCCC(=O)N1CCC1 ec3a17393b3583fd2814dddf5a17342a [0,1,0,1,0,0|1,0,0]=3 10231 B12R1.561 CCCCCNC(=O)C1=CCC1 305b0e98d80709897bda56158ea16cd8 [0,1,0,1,0,0|1,0,1]=4 10232 B12R1.561 CCCCCNC(=O)C1CCO1 7d81fb77256371f22b927bca0d5b2333 [0,1,0,1,0,0|2,0,0]=4 10233 B12R1.561 CCCCCNC(=O)N1CCC1 a9eec914df33ad4afccb2b4b14aaf8a2 [0,1,0,1,0,0|1,0,0]=3 10234 B12R1.561 CCCCCNC(=O)[C@@H]1CCO1 45fa6cb2be358d053ae5b8104f37fc0c [0,1,0,1,0,0|2,0,0]=4 10235 B12R1.561 CCCCCNC(=O)[C@H]1CCO1 c1418d369da68a9720b0f4e2e5c94820 [0,1,0,1,0,0|2,0,0]=4 10236 B12R1.561 CCCCCNC(=S)N1CCC1 e18b6809642b80d16a6d42ce81120907 [0,1,0,1,0,0|1,1,0]=4 10237 B12R1.561 CCCCNCC(=O)C1CCC1 8986fd857f415a2d4341ff94ab394153 [0,1,0,1,0,0|1,0,0]=3 10238 B12R1.561 CCCCNCC(=O)N1CCC1 9fd74ce86624129007123515704ef923 [0,1,0,1,0,0|1,0,0]=3 10239 B12R1.561 CCCCOCC(=O)C1CCC1 483d1c3f1e1ce125691fede0e66ef43e [0,1,0,1,0,0|1,0,0]=3 10240 B12R1.561 CCCCOCC(=O)N1CCC1 8f1e01f50039219590e37963e10c495d [0,1,0,1,0,0|1,0,0]=3 10241 B12R1.561 CCCCSCC(=O)N1CCC1 993b4fe574685e50f6b591d34b65b907 [0,1,0,1,0,0|1,0,0]=3 10242 B12R1.561 CCCNCCC(=O)N1CCC1 9a113718a755ddd8bde03b750fa1dd83 [0,1,0,1,0,0|1,0,0]=3 10243 B12R1.561 CCCOCCC(=O)N1CCC1 f930d4f024c99e19bcdebb25e2481903 [0,1,0,1,0,0|1,0,0]=3 10244 B12R1.561 CCOCCNC(=O)N1CCC1 36259ecf42b63dd74fa28b8c8ad18992 [0,1,0,1,0,0|2,0,0]=4 10245 B12R1.561 CCSCCNC(=O)N1CCC1 ad73ac40e458eafa564db4d74746e1c0 [0,1,0,1,0,0|2,0,0]=4 10246 B12R1.561 COCCCNC(=O)N1CCC1 b100ff1781aa1be2d323bcad1dd62e31 [0,1,0,1,0,0|2,0,0]=4 10247 B12R1.561 COCCNCC(=O)C1CCC1 f2b09b6454d046536e6dd725316fc461 [0,1,0,1,0,0|2,0,0]=4 10248 B12R1.561 COCCNCC(=O)N1CCC1 49b4b795f49f0e7986f24291d81f65d2 [0,1,0,1,0,0|2,0,0]=4 10249 B12R1.561 COCCOCC(=O)C1CCC1 11abc02eb1ec8e43d90a89560e3aa948 [0,1,0,1,0,0|2,0,0]=4 10250 B12R1.561 COCCOCC(=O)N1CCC1 2e4c65998c6a505b3c02c01d294e9307 [0,1,0,1,0,0|2,0,0]=4 10251 B12R1.561 COCCSCC(=O)N1CCC1 5b4a91c99bc50fa79f2e74891811bb87 [0,1,0,1,0,0|2,0,0]=4 10252 B12R1.561 COCOCCC(=O)N1CCC1 965962e5dc3080650b74383738974b82 [0,1,0,1,0,0|2,0,0]=4 10253 B12R1.561 CSCCCNC(=O)N1CCC1 b96ed3bfb3231c458e09521780b4a50b [0,1,0,1,0,0|2,0,0]=4 10254 B12R1.561 CSCCNCC(=O)C1CCC1 be13e8ab1ff88393615e527512100c5b [0,1,0,1,0,0|2,0,0]=4 10255 B12R1.561 CSCCNCC(=O)N1CCC1 17b283525189987c3f64e0630aa7ae26 [0,1,0,1,0,0|2,0,0]=4 10256 B12R1.561 CSCCOCC(=O)C1CCC1 b629c550d03f41a389ee5aa41dd6d727 [0,1,0,1,0,0|2,0,0]=4 10257 B12R1.561 CSCCOCC(=O)N1CCC1 da538042402d9d181fb5cede45591224 [0,1,0,1,0,0|2,0,0]=4 10258 B12R1.561 CSSCCCC(=O)N1CCC1 cfc22fee543703ac6b6c59df97c26e31 [0,1,0,1,0,0|2,0,0]=4 10259 B12R1.561 NCCCCNC(=O)N1CCC1 f021a3f68c78ea2c47b916d6e5a3dd57 [0,1,0,1,0,0|2,0,0]=4 10260 B12R1.561 O=C(CCCCCF)N1CCC1 2b7a2525b64ed5e65414bf227607ff34 [0,1,0,1,0,0|1,0,0]=3 10261 B12R1.561 O=C(CCCCCO)N1CCC1 a2cdc7a78e9de84fb12ff3ef8e1149d7 [0,1,0,1,0,0|1,0,0]=3 10262 B12R1.561 O=C(CCCCCS)N1CCC1 5675a0e6858fcc7786aa4db20988cce3 [0,1,0,1,0,0|1,0,0]=3 10263 B12R1.561 O=C(CCNCCBr)N1CCC1 2bd3f799b37bd3d7afdabd2b05f7d91c [0,1,0,1,0,0|2,0,0]=4 10264 B12R1.561 O=C(CCNCCF)N1CCC1 b82597c1036d8c661c600a2056b36e43 [0,1,0,1,0,0|2,0,0]=4 10265 B12R1.561 O=C(CCNCCI)N1CCC1 1396faffd144f8f17edcc7874bbf9128 [0,1,0,1,0,0|2,0,0]=4 10266 B12R1.561 O=C(CCNCCO)N1CCC1 ebfb15c956a3941caee8186c621cd909 [0,1,0,1,0,0|2,0,0]=4 10267 B12R1.561 O=C(CCNCCS)N1CCC1 0598b587f96228e13cc1d2b7409f7940 [0,1,0,1,0,0|2,0,0]=4 10268 B12R1.561 O=C(CCOCCF)N1CCC1 b17d5124ad9b765504442fff4a84094b [0,1,0,1,0,0|2,0,0]=4 10269 B12R1.561 O=C(CCOCCO)N1CCC1 4dd41da5e56bfbd4328107d49b51eda0 [0,1,0,1,0,0|2,0,0]=4 10270 B12R1.561 O=C(CCOCCS)N1CCC1 3a75f90703d2d5f0d1d6d062ca17333e [0,1,0,1,0,0|2,0,0]=4 10271 B12R1.561 O=C(CNCCCCl)C1CCC1 9b584edad64d1c1d2bc754b447e55494 [0,1,0,1,0,0|2,0,0]=4 10272 B12R1.561 O=C(CNCCCCl)N1CCC1 54037f05f41c010f77985fe77d41a67b [0,1,0,1,0,0|2,0,0]=4 10273 B12R1.561 O=C(CNCCCO)C1CCC1 99d266b9f2bea85377d603397519de27 [0,1,0,1,0,0|2,0,0]=4 10274 B12R1.561 O=C(CNCCCO)N1CCC1 71454dc522474b7903aee02c6b29ecef [0,1,0,1,0,0|2,0,0]=4 10275 B12R1.561 O=C(COCCCF)C1CCC1 77d998d2f817b7a34fbefe203c69cc94 [0,1,0,1,0,0|2,0,0]=4 10276 B12R1.561 O=C(COCCCF)N1CCC1 9b4846a4f54145aa8fe44fb1cc3f01f3 [0,1,0,1,0,0|2,0,0]=4 10277 B12R1.561 O=C(COCCCS)C1CCC1 2a88a211a612e043c034769b815cd133 [0,1,0,1,0,0|2,0,0]=4 10278 B12R1.561 O=C(COCCCS)N1CCC1 e01e9bcf9fa7f6549681e11b27f50c64 [0,1,0,1,0,0|2,0,0]=4 10279 B12R1.561 O=C(NCCCCO)N1CCC1 ffe6f96adbbd6aa4c52aa2576d3ff9ed [0,1,0,1,0,0|2,0,0]=4 10280 B12R1.561 O=C(NCCCCS)N1CCC1 d9d34212a23bbab953470cdcdd341bec [0,1,0,1,0,0|2,0,0]=4 10281 B12R1.561 O=CCCCCC(=O)N1CCC1 09c70ef9f3582ca3efaed2f3bfa36319 [0,1,0,1,0,0|1,0,1]=4 10282 B12R1.563 C#CCCCCC(=O)NC1CC1 28d03c024e447bf7e3d991fce9909275 [0,1,0,1,0,0|1,0,1]=4 10283 B12R1.563 C/C=C/CCCC(=O)NC1CC1 3cb230e810c3724c8fe3c12b4cae0800 [0,1,0,1,0,0|1,0,1]=4 10284 B12R1.563 C=CCCCCC(=O)NC1CC1 4251542bb92aef3728257e020297072f [0,1,0,1,0,0|1,0,1]=4 10285 B12R1.563 CCC/C=C/CC(=O)NC1CC1 2b03f809978993763666b5245c1f2934 [0,1,0,1,0,0|1,0,1]=4 10286 B12R1.563 CCCC/C=C/C(=O)NC1CC1 3bfec8956c062f16d5453e0c103329b0 [0,1,0,1,0,0|1,0,1]=4 10287 B12R1.563 CCCCC#CC(=O)NC1CC1 4b4c506f6bf832d226946725bb956485 [0,1,0,1,0,0|1,0,1]=4 10288 B12R1.563 CCCCC=CC(=O)NC1CC1 2ad01696c15feea32a540d66a5a08d96 [0,1,0,1,0,0|1,0,1]=4 10289 B12R1.563 CCCCCCC(=O)NC1CC1 8b085195dc5e62d9ee90299f8c862df8 [0,1,0,1,0,0|1,0,0]=3 10290 B12R1.563 CCCCCCC(C)OC1CC1 9e8dd4177668f962e6e88b2ac808ea4e [0,1,0,1,0,0|1,0,1]=4 10291 B12R1.563 CCCCCC[C@@H](C)OC1CC1 dd4b3574de6fa1efa20d485ed615a046 [0,1,0,1,0,0|1,0,1]=4 10292 B12R1.563 CCCCCC[C@H](C)OC1CC1 8d3df25e229475ca775d04dcc6cd9848 [0,1,0,1,0,0|1,0,1]=4 10293 B12R1.563 CCCCCNC(=O)CC1CC1 f12e9579253eec36c1a8e6a252992cd3 [0,1,0,1,0,0|1,0,0]=3 10294 B12R1.563 CCCCCNC(=O)NC1CC1 aedf5c9ca0dd627855dbb88878c35908 [0,1,0,1,0,0|1,0,0]=3 10295 B12R1.563 CCCCCNC(=S)NC1CC1 c926a2f408c9d5681e590a53d906e92e [0,1,0,1,0,0|1,1,0]=4 10296 B12R1.563 CCCCNCC(=O)NC1CC1 24c2eb40ce967b8d9527a26127f96bcc [0,1,0,1,0,0|1,0,0]=3 10297 B12R1.563 CCCCOCC(=O)NC1CC1 59984acf48111c4becbfcfde27484d21 [0,1,0,1,0,0|1,0,0]=3 10298 B12R1.563 CCCCOCC(C)OC1CC1 c0942bf6e8284fd0cd9256721aa513b5 [0,1,0,1,0,0|1,0,1]=4 10299 B12R1.563 CCCCSCC(=O)NC1CC1 7b4dea0fb0d94450f2b6ffe573ebe040 [0,1,0,1,0,0|1,0,0]=3 10300 B12R1.563 CCCNCCC(=O)NC1CC1 39e5ab929fca277196ef52fd56ecc57f [0,1,0,1,0,0|1,0,0]=3 10301 B12R1.563 CCCOCCC(=O)NC1CC1 af3fc32544fdad6994d8ca5af65b0055 [0,1,0,1,0,0|1,0,0]=3 10302 B12R1.563 CCOCCCC(=O)NC1CC1 38a0a6b9058d992a51d2bbb189e43495 [0,1,0,1,0,0|1,0,0]=3 10303 B12R1.563 CCOCCNC(=O)CC1CC1 f10cff23095d64ac1d190866b3573260 [0,1,0,1,0,0|2,0,0]=4 10304 B12R1.563 CCOCCNC(=O)NC1CC1 4c76591804abe7792217aa7b462e2754 [0,1,0,1,0,0|2,0,0]=4 10305 B12R1.563 CCOCNCC(=O)NC1CC1 d1a4c4d5fe7738afc1c6424dcfdaed0d [0,1,0,1,0,0|2,0,0]=4 10306 B12R1.563 CCSCCNC(=O)CC1CC1 f5e6d1101c239ad906e3d373a656ee07 [0,1,0,1,0,0|2,0,0]=4 10307 B12R1.563 CCSCCNC(=O)NC1CC1 b0303dc3bb6e1847622cd904e22018cb [0,1,0,1,0,0|2,0,0]=4 10308 B12R1.563 COCCCNC(=O)CC1CC1 0701e527219abee9eaefe9b45391046d [0,1,0,1,0,0|2,0,0]=4 10309 B12R1.563 COCCCNC(=O)NC1CC1 f032622c91e514ac61f489b472bc5817 [0,1,0,1,0,0|2,0,0]=4 10310 B12R1.563 COCCNCC(=O)NC1CC1 6c393e1909acf1c7f514e3f72f5177f3 [0,1,0,1,0,0|2,0,0]=4 10311 B12R1.563 COCCOCC(=O)NC1CC1 5a00c144c32ac1b221cf48a21f14a424 [0,1,0,1,0,0|2,0,0]=4 10312 B12R1.563 COCCSCC(=O)NC1CC1 03901ce9b19f90de6aa6efb0451fa108 [0,1,0,1,0,0|2,0,0]=4 10313 B12R1.563 COCOCCC(=O)NC1CC1 337225a6259284e94c62a82832bd499a [0,1,0,1,0,0|2,0,0]=4 10314 B12R1.563 CSCCCNC(=O)CC1CC1 4f76abdc0a84cd35333146c0e1410587 [0,1,0,1,0,0|2,0,0]=4 10315 B12R1.563 CSCCCNC(=O)NC1CC1 dc47101a609146a67627fa77eff29fe5 [0,1,0,1,0,0|2,0,0]=4 10316 B12R1.563 CSCCNCC(=O)NC1CC1 216d727b4eb1988790a4477b8e6a1d33 [0,1,0,1,0,0|2,0,0]=4 10317 B12R1.563 CSCCOCC(=O)NC1CC1 78c0b88c4ea7629981d5bf9299b6739d [0,1,0,1,0,0|2,0,0]=4 10318 B12R1.563 CSSCCCC(=O)NC1CC1 98f804131d549417fdcf5b3a14425ae7 [0,1,0,1,0,0|2,0,0]=4 10319 B12R1.563 NCCCCNC(=O)NC1CC1 891b74e16765993a16840bf39c12d2d8 [0,1,0,1,0,0|2,0,0]=4 10320 B12R1.563 O=C(CC1CC1)NCCCCCl 9e4846ee73f8f058282957886845a136 [0,1,0,1,0,0|2,0,0]=4 10321 B12R1.563 O=C(CC1CC1)NCCCCO e647dee4db00ce9bab1d9c5252fac1e4 [0,1,0,1,0,0|2,0,0]=4 10322 B12R1.563 O=C(CC1CC1)NCCCCS c5cd69e97adaeea809e6cda5adcea3c9 [0,1,0,1,0,0|2,0,0]=4 10323 B12R1.563 O=C(CCCCCF)NC1CC1 ac39fad15b1db43f89a58fa73e96690d [0,1,0,1,0,0|1,0,0]=3 10324 B12R1.563 O=C(CCCCCO)NC1CC1 cdfb54e916bdfc8360ac829cdf5f65dc [0,1,0,1,0,0|1,0,0]=3 10325 B12R1.563 O=C(CCCCCS)NC1CC1 b94d6aadeed0cf85c0f11f651d56aff3 [0,1,0,1,0,0|1,0,0]=3 10326 B12R1.563 O=C(CCCOCF)NC1CC1 ffb68640b36aa2b371a12df0cd31c6d9 [0,1,0,1,0,0|2,0,0]=4 10327 B12R1.563 O=C(CCNCCF)NC1CC1 23b2974bbda06abec906d17bc99bfcaf [0,1,0,1,0,0|2,0,0]=4 10328 B12R1.563 O=C(CCNCCI)NC1CC1 5f95f2875b54bc22574002f756bdc957 [0,1,0,1,0,0|2,0,0]=4 10329 B12R1.563 O=C(CCNCCO)NC1CC1 8749743b3eda7e4c23942d2d4128c2cf [0,1,0,1,0,0|2,0,0]=4 10330 B12R1.563 O=C(CCNCCS)NC1CC1 a61a809758b4d768b8780d6c278eac64 [0,1,0,1,0,0|2,0,0]=4 10331 B12R1.563 O=C(CCOCCO)NC1CC1 fe7ca9da9c66c54dd13497743400b710 [0,1,0,1,0,0|2,0,0]=4 10332 B12R1.563 O=C(CCOCCS)NC1CC1 f09000b73b7073f2b5e2ce53682a0e25 [0,1,0,1,0,0|2,0,0]=4 10333 B12R1.563 O=C(CNCCCCl)NC1CC1 119e8928510a8a6b8ce5599505f58975 [0,1,0,1,0,0|2,0,0]=4 10334 B12R1.563 O=C(CNCCCF)NC1CC1 464ebf3aeac71346324b069a41a552b3 [0,1,0,1,0,0|2,0,0]=4 10335 B12R1.563 O=C(CNCCCO)NC1CC1 9a3ce05e57de3e3f09d96f5e2441b569 [0,1,0,1,0,0|2,0,0]=4 10336 B12R1.563 O=C(CNCCCS)NC1CC1 29e01f9068d5f8aae614cbf5f09db73f [0,1,0,1,0,0|2,0,0]=4 10337 B12R1.563 O=C(COCCCF)NC1CC1 b8fffc9e95f85dfe8c654d1995f74dc9 [0,1,0,1,0,0|2,0,0]=4 10338 B12R1.563 O=C(COCCCS)NC1CC1 dd29735630f27f53ab25000da2400a2d [0,1,0,1,0,0|2,0,0]=4 10339 B12R1.563 O=C(NCCCCO)NC1CC1 be37f4e14c7c51fc70c8ab63f2e02e61 [0,1,0,1,0,0|2,0,0]=4 10340 B12R1.563 O=C(NCCCCS)NC1CC1 998991ae0c9f9f7578e7a0af5b59259d [0,1,0,1,0,0|2,0,0]=4 10341 B12R1.563 O=CCCCCC(=O)NC1CC1 2cf1f5b2c4bdbe584b0157d89aec2585 [0,1,0,1,0,0|1,0,1]=4 10342 B12R1.567 CCCCN[C@@H]1C(=O)NC[C@H]1O aebb91a8e69dab07f6fef5e0ad33d698 [0,1,0,1,0,0|2,0,0]=4 10343 B12R1.567 CCCCOC1=C(COC1=O)C c62fa854eef2d6277e592ceab51526e4 [0,1,0,1,0,0|0,0,2]=4 10344 B12R1.1758 CCCCNCC1(CCCO1)C da8654ac598d6340d172c90620bdcc2d [0,1,0,1,0,0|1,0,1]=4 10345 B12R1.1758 CCCCOCC1(CCCO1)C 825c30acca247003b1e70c3479083041 [0,1,0,1,0,0|1,0,1]=4 10346 B12R1.28 CC1CCCC(C1)OCCCF 20e022334b9b6ccec250424539c6cd93 [0,1,0,1,0,0|1,0,1]=4 10347 B12R1.28 CC1CCCC(C1)OCCCS 7b17b7a7363647c5288cb61412321a2c [0,1,0,1,0,0|1,0,1]=4 10348 B12R1.28 CCCCOC1CCCC(C1)C b9f83489f977e221372b6c6bf7587cfc [0,1,0,1,0,0|1,0,1]=4 10349 B12R1.28 CCCCO[C@@H]1CCC[C@@H](C1)C d4fbe228b58fc307beff06cf6dc06498 [0,1,0,1,0,0|1,0,1]=4 10350 B12R1.28 CCCCO[C@H]1CCC[C@@H](C1)C 23f2cd09ac7f074cc53d0e5d8d8cbd3a [0,1,0,1,0,0|1,0,1]=4 10351 B12R1.28 CCCCO[C@H]1CCC[C@H](C1)C 19bcec12f12e2dd0bdff4b0d656516b7 [0,1,0,1,0,0|1,0,1]=4 10352 B12R1.28 CCCOCC1CCCC(C1)C 4c846832801db50ad0eb719c49bf75f3 [0,1,0,1,0,0|1,0,1]=4 10353 B12R1.28 CCOCOC1CCCC(C1)C ee2cd31748268ab21c2b3a1d501dd63f [0,1,0,1,0,0|1,0,1]=4 10354 B12R1.28 CCOCO[C@@H]1CCC[C@@H](C1)C 7b3f5548e9a50d705ee24fc89681382b [0,1,0,1,0,0|1,0,1]=4 10355 B12R1.28 CCOCO[C@H]1CCC[C@@H](C1)C 96c73f92628d308d73ea0c91381853ef [0,1,0,1,0,0|1,0,1]=4 10356 B12R1.28 CCOCO[C@H]1CCC[C@H](C1)C 559746bf29dee48d944c3826a24ee6d0 [0,1,0,1,0,0|1,0,1]=4 10357 B12R1.28 COCCOC1CCCC(C1)C c1e7b5a3ae57b08051c71a55b64e3085 [0,1,0,1,0,0|1,0,1]=4 10358 B12R1.28 COCCO[C@@H]1CCC[C@@H](C1)C e069d25dad4ff09f5dbb72d07bfb24cb [0,1,0,1,0,0|1,0,1]=4 10359 B12R1.28 COCCO[C@H]1CCC[C@@H](C1)C 1fbd5b7254618f5a0613b002f8f63953 [0,1,0,1,0,0|1,0,1]=4 10360 B12R1.28 COCCO[C@H]1CCC[C@H](C1)C 178990b6fdd00744430ccf8383e122d1 [0,1,0,1,0,0|1,0,1]=4 10361 B12R1.28 CSCCOC1CCCC(C1)C 3a5a998eed97ab23685fcedeb50d6a21 [0,1,0,1,0,0|1,0,1]=4 10362 B12R1.28 CSCCO[C@@H]1CCC[C@@H](C1)C 053314813bf239509ea17abbdf6e7add [0,1,0,1,0,0|1,0,1]=4 10363 B12R1.28 CSCCO[C@H]1CCC[C@@H](C1)C 762b90c3f619d909aa923f77f04c1ea1 [0,1,0,1,0,0|1,0,1]=4 10364 B12R1.28 CSCCO[C@H]1CCC[C@H](C1)C d42e1daad32bbb6104e1982adf97aea8 [0,1,0,1,0,0|1,0,1]=4 10365 B12R1.28 C[C@@H]1CCC[C@@H](C1)OCCCF 9c53ca013fd210262ca0b94220bb997c [0,1,0,1,0,0|1,0,1]=4 10366 B12R1.28 C[C@@H]1CCC[C@@H](C1)OCCCS 138de1eab0fbea681c2b8f330784c2fc [0,1,0,1,0,0|1,0,1]=4 10367 B12R1.28 C[C@H]1CCC[C@@H](C1)OCCCF fe174dd25d7be2d228cb280e4f42faa3 [0,1,0,1,0,0|1,0,1]=4 10368 B12R1.28 C[C@H]1CCC[C@@H](C1)OCCCS 2a345a07c92d87b28625f418fd5c2c1b [0,1,0,1,0,0|1,0,1]=4 10369 B12R1.28 C[C@H]1CCC[C@H](C1)OCCCF bed3edf03c5cde5cffb71e670d8f25a6 [0,1,0,1,0,0|1,0,1]=4 10370 B12R1.28 C[C@H]1CCC[C@H](C1)OCCCS 799159c7dac9d80c44d5fd04d90e3dc1 [0,1,0,1,0,0|1,0,1]=4 10371 B12R1.35 C#CCOCC(=O)C1CCCC1 87943443eee926fee1fbc925148b41bd [0,1,0,1,0,0|0,0,2]=4 10372 B12R1.35 C=CCOCC(=O)C1CCCC1 eea0ffc30ea3850eccfac4c75bccfe33 [0,1,0,1,0,0|0,0,2]=4 10373 B12R1.35 CC(OCCCF)C1CCCC1 64ae9d35c847c68ef87024c994c85449 [0,1,0,1,0,0|1,0,1]=4 10374 B12R1.35 CC(OCCCS)C1CCCC1 a0b0241d5b72161c5cfaf68bec1de619 [0,1,0,1,0,0|1,0,1]=4 10375 B12R1.35 CCCCCC(=O)N1CC=CC1 7f66938992139f5e64b457214364e2ea [0,1,0,1,0,0|1,0,1]=4 10376 B12R1.35 CCCCCC(=O)N1CCSC1 bf673f498d95e92d4c8214daa4fb9937 [0,1,0,1,0,0|1,0,0]=3 10377 B12R1.35 CCCCNC(=O)C1=CCCC1 f6687151d7ce721c87b19e34a0221c73 [0,1,0,1,0,0|2,0,0]=4 10378 B12R1.35 CCCCNC(=O)C1CCCO1 b5cd69c104bfef2cd816602799a14492 [0,1,0,1,0,0|1,0,0]=3 10379 B12R1.35 CCCCNC(=O)C1CCCS1 d2b121d8f6a712da9a5c68b0e53cbc01 [0,1,0,1,0,0|1,1,0]=4 10380 B12R1.35 CCCCNC(=O)N1CCNC1 e4f9ccedaaa871e24b969bc2992a505e [0,1,0,1,0,0|2,0,0]=4 10381 B12R1.35 CCCCNC(=O)N1CCSC1 23b7ef48d32c558f6272c2864e17ef76 [0,1,0,1,0,0|2,0,0]=4 10382 B12R1.35 CCCCNC(=O)[C@@H]1CCCO1 6ff9f2ba85c59d52bcce0f3a2739c2e7 [0,1,0,1,0,0|1,0,0]=3 10383 B12R1.35 CCCCNC(=O)[C@H]1CCCO1 1cb3dcccbb206ab072f65a6bed21c1b3 [0,1,0,1,0,0|1,0,0]=3 10384 B12R1.35 CCCCOC(C)C1CCCC1 acdebc8a53480c2fb4b305b963b6248c [0,1,0,1,0,0|1,0,1]=4 10385 B12R1.35 CCCNCC(=O)C1CCCC1 99df94bc2581b59a9713053c564f6a57 [0,1,0,1,0,0|1,0,0]=3 10386 B12R1.35 CCCNCC(=O)N1CCCC1 c522571f2251555e62af2f91686e0838 [0,1,0,1,0,0|2,0,0]=4 10387 B12R1.35 CCCOCC(=O)C1CCCC1 a2671c1b929ad6f40598dbac56dac40b [0,1,0,1,0,0|0,0,0]=2 10388 B12R1.35 CCCOCC(=O)N1CCCC1 ffbfc4536a36532fded6bdc80ddd450f [0,1,0,1,0,0|1,0,0]=3 10389 B12R1.35 CCCOCC(=O)N1CCSC1 63f302c578d397a4fdebe8ca2e34fce2 [0,1,0,1,0,0|2,0,0]=4 10390 B12R1.35 CCCSCC(=O)N1CCSC1 537d30ad927a043aed1c934cc840c062 [0,1,0,1,0,0|2,0,0]=4 10391 B12R1.35 CCNCCC(=O)N1CCCC1 2cd758a84073574dfc1dcf40b50158d7 [0,1,0,1,0,0|2,0,0]=4 10392 B12R1.35 CCOCCC(=O)N1CCSC1 d1ee47eaa170a81458922ccec74da594 [0,1,0,1,0,0|2,0,0]=4 10393 B12R1.35 CCOCOC(C)C1CCCC1 523ea6eb95e11864f938f26526066451 [0,1,0,1,0,0|1,0,1]=4 10394 B12R1.35 CCSCCC(=O)N1CCSC1 fab7fc4cf04f01120590c02fd4d97d04 [0,1,0,1,0,0|2,0,0]=4 10395 B12R1.35 COCCCC(=O)N1CCSC1 2f020b4b2d09da690ccd572e1d75cd93 [0,1,0,1,0,0|2,0,0]=4 10396 B12R1.35 COCCNC(=O)C1CCCO1 f036c4571303767de73084b157d9eea8 [0,1,0,1,0,0|2,0,0]=4 10397 B12R1.35 COCCNC(=O)C1CCCS1 b9150d46e4fdc48c776e65d49fb2222c [0,1,0,1,0,0|2,0,0]=4 10398 B12R1.35 COCCNC(=O)[C@@H]1CCCO1 d2572a76ecb31e55c5148e9519acce47 [0,1,0,1,0,0|2,0,0]=4 10399 B12R1.35 COCCNC(=O)[C@H]1CCCO1 f5d25df3981e3348ef1650b88f8473d9 [0,1,0,1,0,0|2,0,0]=4 10400 B12R1.35 COCCOC(C)C1CCCC1 c4434ce873ae5a6ddf90d67f325fa78c [0,1,0,1,0,0|1,0,1]=4 10401 B12R1.35 COCOCC(=O)C1CCCC1 933169fe8cb3924db30e6569d99f5a00 [0,1,0,1,0,0|1,0,0]=3 10402 B12R1.35 COCOCC(=O)N1CCCC1 3fa758e2701cb091ed27e7ec222a57d0 [0,1,0,1,0,0|2,0,0]=4 10403 B12R1.35 CSCCCC(=O)N1CCSC1 ed7f3c2e683e5be36c8a496dfedeee96 [0,1,0,1,0,0|2,0,0]=4 10404 B12R1.35 CSCCNC(=O)C1CCCO1 5a0d5bd24fb55f053e313b317ababd59 [0,1,0,1,0,0|2,0,0]=4 10405 B12R1.35 CSCCNC(=O)C1CCCS1 3f54c900bad3bc37a1fc356df6b1722c [0,1,0,1,0,0|2,0,0]=4 10406 B12R1.35 CSCCNC(=O)[C@@H]1CCCO1 bd5bc4ed4d39061a9f0cce1e782d86c6 [0,1,0,1,0,0|2,0,0]=4 10407 B12R1.35 CSCCNC(=O)[C@H]1CCCO1 f89ed9a40cb7c1fb96c5381d6ec2afef [0,1,0,1,0,0|2,0,0]=4 10408 B12R1.35 CSCCOC(C)C1CCCC1 dcc3b8a63e048df440d9a37ca1632529 [0,1,0,1,0,0|1,0,1]=4 10409 B12R1.35 CSCOCC(=O)C1CCCC1 f4f781c2f37b1cb4e6af2dc8822958ad [0,1,0,1,0,0|1,0,0]=3 10410 B12R1.35 CSCOCC(=O)N1CCCC1 f68edf51f91441b667e44f5d1b6cfa19 [0,1,0,1,0,0|2,0,0]=4 10411 B12R1.35 N#CCOCC(=O)C1CCCC1 950d1774fc82fc2a849c7fcef14ad812 [0,1,0,1,0,0|1,0,1]=4 10412 B12R1.35 N#CNCOC(=O)C1CCCC1 a2b937606f89cb876ec8b83ca00962f3 [0,1,0,1,0,0|1,0,1]=4 10413 B12R1.35 O=C(CCCCF)N1CCSC1 0024ccc3a6ff43192202509ea845b2f8 [0,1,0,1,0,0|2,0,0]=4 10414 B12R1.35 O=C(CCCCO)N1CCSC1 76f8214e13080cc559491c6b484b6ba4 [0,1,0,1,0,0|2,0,0]=4 10415 B12R1.35 O=C(CCCCS)N1CCSC1 9e0993dddad4bf1a3c75cbadeb4aa8ad [0,1,0,1,0,0|2,0,0]=4 10416 B12R1.35 O=C(CNCCBr)C1CCCC1 31817d6bbd79e532f48ab56913d0ea69 [0,1,0,1,0,0|2,0,0]=4 10417 B12R1.35 O=C(CNCCF)C1CCCC1 6b5e56894bcc70a34a49c9a08e5c4bec [0,1,0,1,0,0|2,0,0]=4 10418 B12R1.35 O=C(CNCCI)C1CCCC1 6734e93748f24febd4071a20b15d9670 [0,1,0,1,0,0|2,0,0]=4 10419 B12R1.35 O=C(CNCCO)C1CCCC1 d27db434c56e94757bb4fb81d9ee0881 [0,1,0,1,0,0|2,0,0]=4 10420 B12R1.35 O=C(CNCCS)C1CCCC1 08a73c192fc89f0d033a0ee2fc938c7f [0,1,0,1,0,0|2,0,0]=4 10421 B12R1.35 O=C(COCCF)C1CCCC1 09715344d5e5b7e8c6cc1a58dd10a11e [0,1,0,1,0,0|1,0,0]=3 10422 B12R1.35 O=C(COCCF)N1CCCC1 970a8f66bf089ddbbc8d8ac5c686e29f [0,1,0,1,0,0|2,0,0]=4 10423 B12R1.35 O=C(COCCS)C1CCCC1 3350a4f70449c2dde330ae2a72addf95 [0,1,0,1,0,0|1,0,0]=3 10424 B12R1.35 O=C(COCCS)N1CCCC1 551127909c1b802540748a0fcfd37969 [0,1,0,1,0,0|2,0,0]=4 10425 B12R1.35 O=C(NCCCCl)C1CCCO1 44e3b128637833fcc90c70812c5ca7ed [0,1,0,1,0,0|2,0,0]=4 10426 B12R1.35 O=C(NCCCCl)C1CCCS1 39647d27ca695a6d09e405f6b8b8bcce [0,1,0,1,0,0|2,0,0]=4 10427 B12R1.35 O=C(NCCCCl)[C@@H]1CCCO1 e93094615ae87d9db05410ae33a218f3 [0,1,0,1,0,0|2,0,0]=4 10428 B12R1.35 O=C(NCCCCl)[C@H]1CCCO1 8bf578406c44a1531f9e0d304ed908dc [0,1,0,1,0,0|2,0,0]=4 10429 B12R1.35 O=C(NCCCO)C1CCCO1 82497fb2912f785db9820abbc62b37a7 [0,1,0,1,0,0|2,0,0]=4 10430 B12R1.35 O=C(NCCCO)C1CCCS1 f498c020dd1679b997c045cf3afb1068 [0,1,0,1,0,0|2,0,0]=4 10431 B12R1.35 O=C(NCCCO)[C@@H]1CCCO1 825866dbe6595944349a4e76022ab5f6 [0,1,0,1,0,0|2,0,0]=4 10432 B12R1.35 O=C(NCCCO)[C@H]1CCCO1 04a4c2fd01ee42880f37d0b5b37ffa60 [0,1,0,1,0,0|2,0,0]=4 10433 B12R1.35 O=CCOCC(=O)C1CCCC1 7ad643365846e5b1751b1f89bad4cb9b [0,1,0,1,0,0|1,0,1]=4 10434 B12R1.273 CCCC1=C(OC(=O)C1)OCC 67704ad3a5a3c12c61d62caa27ab5b92 [0,1,0,1,0,0|0,0,2]=4 10435 B12R1.273 CCCC1=CC(=O)OC1OCC 6cd14bf8860978dac41bc4d8dd923860 [0,1,0,1,0,0|0,0,2]=4 10436 B12R1.483 C#CCCNC(=O)CC1CCC1 95b5ee8550234c587b16698e05f010fe [0,1,0,1,0,0|1,0,1]=4 10437 B12R1.483 C=CCCNC(=O)CC1CCC1 34dc08caabd8f872d25267ae01e4d08a [0,1,0,1,0,0|1,0,1]=4 10438 B12R1.483 CC=CCNC(=O)CC1CCC1 e45ba4278cc1cd56c3d95f6123e77efc [0,1,0,1,0,0|1,0,1]=4 10439 B12R1.483 CCC/C=C/C(=O)NC1CCC1 8957e7375019e4cc1a0760790447475c [0,1,0,1,0,0|2,0,0]=4 10440 B12R1.483 CCCC#CC(=O)NC1CCC1 9b7a8bd859531616b72134b4d59f1adf [0,1,0,1,0,0|2,0,0]=4 10441 B12R1.483 CCCC=CC(=O)NC1CCC1 eebb3597a200c05e759ed16ecd034a2a [0,1,0,1,0,0|2,0,0]=4 10442 B12R1.483 CCCCCC(=O)CN1CCC1 e11a3a2559a2b17e1c53fc752b1e115a [0,1,0,1,0,0|1,0,0]=3 10443 B12R1.483 CCCCCC(=O)NC1CCC1 81192d6990c1d8462b862edca38e4632 [0,1,0,1,0,0|1,0,0]=3 10444 B12R1.483 CCCCCC(=O)NC1COC1 22ac949294308950302c08a2588d769e [0,1,0,1,0,0|1,0,0]=3 10445 B12R1.483 CCCCCC(C)OC1CCC1 b0a08a29dba52d1c915843c165646b72 [0,1,0,1,0,0|1,0,1]=4 10446 B12R1.483 CCCCCC(C)OC1COC1 45452aa7dfc5c64b048e64ecc7219fbe [0,1,0,1,0,0|1,0,1]=4 10447 B12R1.483 CCCCCC(C)OC1CSC1 3ef751408285f5437e449a23749130d9 [0,1,0,1,0,0|1,0,1]=4 10448 B12R1.483 CCCCC[C@@H](C)OC1CCC1 3d39f275e25f4a458d9f3bcb64dc230e [0,1,0,1,0,0|1,0,1]=4 10449 B12R1.483 CCCCC[C@@H](C)OC1COC1 1b745023e082b13393fbd01c9225cdab [0,1,0,1,0,0|1,0,1]=4 10450 B12R1.483 CCCCC[C@H](C)OC1CCC1 cb1c78fd19e3274d53b5fbceaa0d5696 [0,1,0,1,0,0|1,0,1]=4 10451 B12R1.483 CCCCC[C@H](C)OC1COC1 9eecf3e5bd7c783a6006dca4289e4b1a [0,1,0,1,0,0|1,0,1]=4 10452 B12R1.483 CCCCC[C@H](C)OC1CSC1 ff30588472d2ad99f791c5ece06519df [0,1,0,1,0,0|1,0,1]=4 10453 B12R1.483 CCCCNC(=O)C=C1CCC1 6c7890c1f7f18bc1d3956f662c5da49e [0,1,0,1,0,0|2,0,0]=4 10454 B12R1.483 CCCCNC(=O)CC1CCC1 b2cbbbd361e95d1d6bf6f82d1b1092ea [0,1,0,1,0,0|1,0,0]=3 10455 B12R1.483 CCCCNC(=O)CC1CCO1 38cffbde75d94bf84312762de6ad9211 [0,1,0,1,0,0|2,0,0]=4 10456 B12R1.483 CCCCNC(=O)CC1COC1 3a7d143418eeacb0bb46dc5f6a5f5ada [0,1,0,1,0,0|2,0,0]=4 10457 B12R1.483 CCCCNC(=O)CC1CSC1 ccbb26ece4e1e33fd61c4c3175473907 [0,1,0,1,0,0|2,0,0]=4 10458 B12R1.483 CCCCNC(=O)CN1CCC1 3cd414237fb32c44e96603a9a69a7579 [0,1,0,1,0,0|2,0,0]=4 10459 B12R1.483 CCCCNC(=O)NC1CCC1 0112fdb224960e86698e6fffa79d5451 [0,1,0,1,0,0|2,0,0]=4 10460 B12R1.483 CCCCNC(=O)NC1COC1 b3ddf75afb41d4bff0be9bcd7210f77e [0,1,0,1,0,0|2,0,0]=4 10461 B12R1.483 CCCCOC(=O)CN1CCC1 74a635ffbbd9926eec166156a8d1d39a [0,1,0,1,0,0|1,0,0]=3 10462 B12R1.483 CCCNCC(=O)NC1CCC1 e2d191298287fbe2816ab9c70b64a3b4 [0,1,0,1,0,0|2,0,0]=4 10463 B12R1.483 CCCOCC(=O)NC1CCC1 b47074e8d74de5fa053f7cf0b587268b [0,1,0,1,0,0|1,0,0]=3 10464 B12R1.483 CCCOCC(=O)NC1COC1 845d76cd8b2979f0df2d95e588874a88 [0,1,0,1,0,0|2,0,0]=4 10465 B12R1.483 CCCSCC(=O)NC1CCC1 89b488f557d0daa8df8b24cbaba192b2 [0,1,0,1,0,0|1,1,0]=4 10466 B12R1.483 CCCSCC(=O)NC1COC1 643338d00f0b2e9bc4a53ce0d4c5e3f6 [0,1,0,1,0,0|2,0,0]=4 10467 B12R1.483 CCOCCC(=O)NC1CCC1 3d044516fb68a6f8f1cb98cb72a0a06c [0,1,0,1,0,0|2,0,0]=4 10468 B12R1.483 CCOCCC(=O)NC1COC1 91b9c1c79d304775a2086908ff5d973a [0,1,0,1,0,0|2,0,0]=4 10469 B12R1.483 CCSCCC(=O)NC1CCC1 fd88f14bfe4c6b355a08cbfa12abe2cd [0,1,0,1,0,0|2,0,0]=4 10470 B12R1.483 CCSCCC(=O)NC1COC1 aa6bb165e0fd9c0ca8c5061522877e8b [0,1,0,1,0,0|2,0,0]=4 10471 B12R1.483 COCCCC(=O)NC1CCC1 4e815e424fdc44b7367781003224ddaa [0,1,0,1,0,0|2,0,0]=4 10472 B12R1.483 COCCCC(=O)NC1COC1 cb74d50688ae5a30c2584b1d0493b64c [0,1,0,1,0,0|2,0,0]=4 10473 B12R1.483 COCCNC(=O)CC1CCC1 b0f66420f1c94644cc3fa3523ffd4f0d [0,1,0,1,0,0|1,0,0]=3 10474 B12R1.483 COCCNC(=O)CC1CCO1 6a8fb4feab21b2872722dd4d7b086889 [0,1,0,1,0,0|2,0,0]=4 10475 B12R1.483 COCCNC(=O)CC1COC1 cdd09172f79df5e5a3213f8da6054f15 [0,1,0,1,0,0|2,0,0]=4 10476 B12R1.483 COCCNC(=O)CC1CSC1 d67db1a21f76022776141ab2afc6058c [0,1,0,1,0,0|2,0,0]=4 10477 B12R1.483 COCCNC(=O)CN1CCC1 ce5c1947feea68581dc5b01d75b7d2f7 [0,1,0,1,0,0|2,0,0]=4 10478 B12R1.483 COCCNC(=O)NC1CCC1 1ee95f48cb32385c51d75dd4d0e91031 [0,1,0,1,0,0|2,0,0]=4 10479 B12R1.483 COCCOC(=O)CN1CCC1 0eb55fecbd770dc79fd6254d4159afc5 [0,1,0,1,0,0|1,0,0]=3 10480 B12R1.483 CSCCCC(=O)NC1CCC1 5629beb3684714117d1a8a092a6431e7 [0,1,0,1,0,0|2,0,0]=4 10481 B12R1.483 CSCCCC(=O)NC1COC1 baca9da8781c4d75c900112a4d75f3db [0,1,0,1,0,0|2,0,0]=4 10482 B12R1.483 CSCCNC(=O)CC1CCC1 e60da1144b07b567283bc23f7b43b186 [0,1,0,1,0,0|1,0,0]=3 10483 B12R1.483 CSCCNC(=O)CC1CCO1 e6d7580fa5b5ef582e1ab64550a6aeeb [0,1,0,1,0,0|2,0,0]=4 10484 B12R1.483 CSCCNC(=O)CC1COC1 7d7e8c7f8eaa09a25c7a4c48722311f1 [0,1,0,1,0,0|2,0,0]=4 10485 B12R1.483 CSCCNC(=O)CC1CSC1 9f949bd714fc47fcce9352bcd456dc35 [0,1,0,1,0,0|2,0,0]=4 10486 B12R1.483 CSCCNC(=O)CN1CCC1 4b198be847725de9a87eadfa1c158fc6 [0,1,0,1,0,0|2,0,0]=4 10487 B12R1.483 CSCCNC(=O)NC1CCC1 cb138e2c19013515e8841c0599c1efb7 [0,1,0,1,0,0|2,0,0]=4 10488 B12R1.483 N#CCCNC(=O)CC1CCC1 e33fff9c4c251c6ef1b730aaeeded18d [0,1,0,1,0,0|1,0,1]=4 10489 B12R1.483 NCCCNC(=O)NC1CCC1 f5ecf8f52eec3d607d777cc0fed4f965 [0,1,0,1,0,0|2,0,0]=4 10490 B12R1.483 NOCCNC(=O)CC1CCC1 5df64e8ea071b8fd983d23e9071ca9cf [0,1,0,1,0,0|2,0,0]=4 10491 B12R1.483 O=C(CC1CCC1)NCCCCl cb5ac745953ed4dbe79d5f41faa829b7 [0,1,0,1,0,0|1,0,0]=3 10492 B12R1.483 O=C(CC1CCC1)NCCCO aaa646c85918f9b810624b7782433a14 [0,1,0,1,0,0|1,0,0]=3 10493 B12R1.483 O=C(CC1CCO1)NCCCCl d2049ca39a69b373a50bb7c821e85996 [0,1,0,1,0,0|2,0,0]=4 10494 B12R1.483 O=C(CC1CCO1)NCCCO cfcfbe0c7578a4fc9cae937ea08ebf44 [0,1,0,1,0,0|2,0,0]=4 10495 B12R1.483 O=C(CC1COC1)NCCCCl 15ce3e15e02686c014356c76a03f3c15 [0,1,0,1,0,0|2,0,0]=4 10496 B12R1.483 O=C(CC1COC1)NCCCO f221acf98c255c64286b9a00afdac83f [0,1,0,1,0,0|2,0,0]=4 10497 B12R1.483 O=C(CC1CSC1)NCCCCl dfb1f68e3eb93babe8483cfa04851aba [0,1,0,1,0,0|2,0,0]=4 10498 B12R1.483 O=C(CC1CSC1)NCCCO af2ff744641c4d527c60d3b1e6fba05d [0,1,0,1,0,0|2,0,0]=4 10499 B12R1.483 O=C(CCCCF)NC1CCC1 a14fd59d5c06377d408af60bc2c2146f [0,1,0,1,0,0|2,0,0]=4 10500 B12R1.483 O=C(CCCCF)NC1COC1 61fb9e50677750f53faad85a2197fc7e [0,1,0,1,0,0|2,0,0]=4 10501 B12R1.483 O=C(CCCCO)NC1CCC1 af73873d4bcc4c2a2da3211ff7dd54f8 [0,1,0,1,0,0|2,0,0]=4 10502 B12R1.483 O=C(CCCCO)NC1COC1 39475992ed61d5608490535650de93d2 [0,1,0,1,0,0|2,0,0]=4 10503 B12R1.483 O=C(CCCCS)NC1CCC1 482a20834bdff768f43f3e2bde0e743d [0,1,0,1,0,0|2,0,0]=4 10504 B12R1.483 O=C(CCCCS)NC1COC1 5fd7cce3eb9daa7577d77855c98a0f64 [0,1,0,1,0,0|2,0,0]=4 10505 B12R1.483 O=C(CN1CCC1)NCCCCl 497ef9a79911befa09440a2bd3641370 [0,1,0,1,0,0|2,0,0]=4 10506 B12R1.483 O=C(CN1CCC1)NCCCO 552eb8a5fe22876f033f0fb572194fe6 [0,1,0,1,0,0|2,0,0]=4 10507 B12R1.483 O=C(COCCO)NC1CCC1 8fa949b04d15a89f5d5579bb57eaf3b9 [0,1,0,1,0,0|2,0,0]=4 10508 B12R1.483 O=C(COCCS)NC1CCC1 a7eca6b4d1970b7082d5cb8284d74642 [0,1,0,1,0,0|2,0,0]=4 10509 B12R1.483 O=C(NCCCO)NC1CCC1 8459800f2218663da0122838c0e1de8d [0,1,0,1,0,0|2,0,0]=4 10510 B12R1.485 CCCCNC(=O)C1CCN1C c445e75cd69b025db2931c8062c68367 [0,1,0,1,0,0|2,0,0]=4 10511 B12R1.485 CCCCNC(=O)[C@@H]1CCN1C 93925c29dfb8d0a2d0bc15cec1b89723 [0,1,0,1,0,0|2,0,0]=4 10512 B12R1.485 CCCCNC(=O)[C@H]1CCN1C 16e5d4c318c354e5d502fa38bc3a24fd [0,1,0,1,0,0|2,0,0]=4 10513 B12R1.485 CN1CCC1C(=O)NCCCCl 8e18f1e259c77bc1e1cc9650fcdd21eb [0,1,0,1,0,0|2,0,0]=4 10514 B12R1.485 CN1CCC1C(=O)NCCCO 12e971d32708fb057a52dffb0deac27b [0,1,0,1,0,0|2,0,0]=4 10515 B12R1.485 CN1CC[C@@H]1C(=O)NCCCCl 9ecb5808d1fa9c462e5b796a7a81591b [0,1,0,1,0,0|2,0,0]=4 10516 B12R1.485 CN1CC[C@@H]1C(=O)NCCCO 4443c4fa2bdd125c5a0162f9dd35df33 [0,1,0,1,0,0|2,0,0]=4 10517 B12R1.485 CN1CC[C@H]1C(=O)NCCCCl 09395790c331e2bce1c71bf61de6d597 [0,1,0,1,0,0|2,0,0]=4 10518 B12R1.485 CN1CC[C@H]1C(=O)NCCCO a3ad425deedd52200fb49d11e30bdb36 [0,1,0,1,0,0|2,0,0]=4 10519 B12R1.485 COCCNC(=O)C1CCN1C c15f381818d643fc35a03d2a6df6bcec [0,1,0,1,0,0|2,0,0]=4 10520 B12R1.485 COCCNC(=O)[C@@H]1CCN1C c63fe811f2fccbec906119a1044cd048 [0,1,0,1,0,0|2,0,0]=4 10521 B12R1.485 COCCNC(=O)[C@H]1CCN1C 643f58746b1f111babbbffa4c0377816 [0,1,0,1,0,0|2,0,0]=4 10522 B12R1.485 CSCCNC(=O)C1CCN1C db2d91871f895f4dc4784c581bdb2483 [0,1,0,1,0,0|2,0,0]=4 10523 B12R1.485 CSCCNC(=O)[C@@H]1CCN1C 886d8e1c6743d81ea6fdf3c9100dadad [0,1,0,1,0,0|2,0,0]=4 10524 B12R1.485 CSCCNC(=O)[C@H]1CCN1C 55125375666824782a48f199d95ca743 [0,1,0,1,0,0|2,0,0]=4 10525 B12R1.803 CCC1=C(C(=O)CC1)OCCF b2cfef7ac1452386aa660d44f5443869 [0,1,0,1,0,0|1,0,1]=4 10526 B12R1.803 CCC1=C(C(=O)CC1)OCCS e5e279d5420c838bbc5ca434235f9faa [0,1,0,1,0,0|1,0,1]=4 10527 B12R1.803 CCC1=C(C(=O)CC1)OCOC 495bed850f35c25ea6b9818310ed0eae [0,1,0,1,0,0|1,0,1]=4 10528 B12R1.803 CCC1=C(C(=O)CC1)OCSC 7a76c5ba6d6019ad647b43b611bfaa2f [0,1,0,1,0,0|1,0,1]=4 10529 B12R1.803 CCCOC1=C(CCC1=O)CC e3330aeebfa4bbb4539d9723213f7bad [0,1,0,1,0,0|0,0,1]=3 10530 B12R1.1414 CCCCOC1CCCCCC1 5c8aadcdbf47305cb92fab1b84769143 [0,1,0,1,0,0|1,0,1]=4 10531 B12R1.1414 CCCOCC1CCCCCC1 e708c2278ab01ea505612279d70b59d3 [0,1,0,1,0,0|1,0,1]=4 10532 B12R1.1414 CCOCOC1CCCCCC1 183e10bafe35ccb66af79844b4af7b2c [0,1,0,1,0,0|1,0,1]=4 10533 B12R1.1414 COCCOC1CCCCCC1 d288cfc86d24e2bf66a1473135ae3233 [0,1,0,1,0,0|1,0,1]=4 10534 B12R1.1414 CSCCOC1CCCCCC1 a310c205157b55ae90097ef212feec68 [0,1,0,1,0,0|1,0,1]=4 10535 B12R1.1414 FCCCOC1CCCCCC1 68edac04c8009567c89387b678da40c1 [0,1,0,1,0,0|1,0,1]=4 10536 B12R1.1414 SCCCOC1CCCCCC1 726f16c640c78e0f4015edd44cf362f3 [0,1,0,1,0,0|1,0,1]=4 10537 B12R1.1631 CCCOC1C(=O)CCCC1=O 2326c47973287e7aaad7997395652af1 [0,1,0,1,0,0|1,0,1]=4 10538 B12R1.1631 CCCOC1C(CCCC1C)C 1279164509ebc1bdc09498160705e6b5 [0,1,0,1,0,0|1,0,1]=4 10539 B12R1.1997 CCCOCC1(CCCCC1)C 752221613e4f44dccc6bcfab31464072 [0,1,0,1,0,0|1,0,1]=4 10540 B12R1.1997 CCCOCC1(CCCCC1)F 4ab4fd1b19901f376742dd8f80c22b96 [0,1,0,1,0,0|1,0,1]=4 10541 B12R1.125 C=C(C)COC1CCCOC1=O 040133ecfb50e4377af735d1b82e482d [0,1,0,1,0,0|1,0,1]=4 10542 B12R1.125 CC(C)CNC1CCCCC1=O 469ceb216d7f04ab13f9b3df2fbe43f7 [0,1,0,1,0,0|2,0,0]=4 10543 B12R1.125 CC(C)CNC1CCCNC1=O cbd6b417e9df25e6eb26680e1ee6a820 [0,1,0,1,0,0|2,0,0]=4 10544 B12R1.125 CC(C)CN[C@@H]1CCCNC1=O 7d7788c3d5155227b9123ac6a6aeb707 [0,1,0,1,0,0|2,0,0]=4 10545 B12R1.125 CC(C)CN[C@H]1CCCNC1=O 0c7641e05072e90890734a76529ba5bd [0,1,0,1,0,0|2,0,0]=4 10546 B12R1.125 CC(C)COC1CCCCC1=O a0f2c77d8948585b5610f98c5345691d [0,1,0,1,0,0|2,0,0]=4 10547 B12R1.125 CC(C)COC1CCCNC1=O c2541c088ec71858265f7064497111fd [0,1,0,1,0,0|2,0,0]=4 10548 B12R1.125 CC(C)COC1CCCOC1=O b33dfde8212ee6d757617789edd54c30 [0,1,0,1,0,0|1,0,0]=3 10549 B12R1.125 CC(C)CO[C@@H]1CCCNC1=O 9b2927d27f76dff3dbd03a3b4c4cc431 [0,1,0,1,0,0|2,0,0]=4 10550 B12R1.125 CC(C)CO[C@H]1CCCNC1=O 977e0b3e14f02b01351c69f5381a86b1 [0,1,0,1,0,0|2,0,0]=4 10551 B12R1.125 CC(C)OCC1CCCCC1=O 6c1fb32da731ed54a462ce45e88dc7bf [0,1,0,1,0,0|2,0,0]=4 10552 B12R1.125 CC(C)OCC1CCCNC1=O bc27e95e0133e0fba23214e6a846c234 [0,1,0,1,0,0|2,0,0]=4 10553 B12R1.125 CC(O)CNC1CCCCC1=O 77f1fb7c2ed0fd4a479515fede2da2e9 [0,1,0,1,0,0|2,0,0]=4 10554 B12R1.125 CC(O)CNC1CCCNC1=O 67febf972041de3025db88126c1a464f [0,1,0,1,0,0|2,0,0]=4 10555 B12R1.125 CC(O)CN[C@@H]1CCCNC1=O 2258d35924a3cc364448718a8c3e2057 [0,1,0,1,0,0|2,0,0]=4 10556 B12R1.125 CC(O)CN[C@H]1CCCNC1=O 0020ee874aa8e7a828388fd0445b69f0 [0,1,0,1,0,0|2,0,0]=4 10557 B12R1.125 CN(C)COC1CCCOC1=O 8cde25b80db3e9baf23efd5a1bc06ee6 [0,1,0,1,0,0|2,0,0]=4 10558 B12R1.125 C[C@@H](O)CNC1CCCCC1=O 2790235d8bd36517d0111567b1738437 [0,1,0,1,0,0|2,0,0]=4 10559 B12R1.125 C[C@@H](O)CNC1CCCNC1=O b2472bad0acb9b32e1d61c187bd64a0f [0,1,0,1,0,0|2,0,0]=4 10560 B12R1.125 C[C@@H](O)CN[C@@H]1CCCNC1=O 6a04f867703aa7956dda1730d661a525 [0,1,0,1,0,0|2,0,0]=4 10561 B12R1.125 C[C@@H](O)CN[C@H]1CCCNC1=O 42d1dab5708bcd248a4105657713bcde [0,1,0,1,0,0|2,0,0]=4 10562 B12R1.125 C[C@H](O)CNC1CCCCC1=O ecfeac1fe0295721a0068a2f606f9479 [0,1,0,1,0,0|2,0,0]=4 10563 B12R1.125 C[C@H](O)CNC1CCCNC1=O afabef42986ee0cad2b28b1d1da36ef3 [0,1,0,1,0,0|2,0,0]=4 10564 B12R1.125 C[C@H](O)CN[C@@H]1CCCNC1=O 80eb0502420860e6138c93900a43a835 [0,1,0,1,0,0|2,0,0]=4 10565 B12R1.125 C[C@H](O)CN[C@H]1CCCNC1=O adeed42e62565460869276360b860397 [0,1,0,1,0,0|2,0,0]=4 10566 B12R1.125 O=C1OCCCC1OCC(F)F e41407b2ad01af988b04c90fde1f35fc [0,1,0,1,0,0|2,0,0]=4 10567 B12R1.127 CC(C)CN1CC(=O)NCC1C 9b9061a30d7d94dfcd3e31c7e339cb64 [0,1,0,1,0,0|2,0,0]=4 10568 B12R1.127 CC(C)CN1CC(=O)NC[C@@H]1C 945c849f62ea3024bd54b065c8c69fad [0,1,0,1,0,0|2,0,0]=4 10569 B12R1.127 CC(C)CN1CC(=O)NC[C@H]1C c458e7a0101930e5bc85d916c6ba2c00 [0,1,0,1,0,0|2,0,0]=4 10570 B12R1.127 CC(O)CN1CC(=O)NCC1C 95311217820aedec5a91d6f1a4f4ff89 [0,1,0,1,0,0|2,0,0]=4 10571 B12R1.127 CC(O)CN1CC(=O)NC[C@@H]1C b96520564a65dc5d959e2a2580ca6f7e [0,1,0,1,0,0|2,0,0]=4 10572 B12R1.127 CC(O)CN1CC(=O)NC[C@H]1C 5b0393caea88416d49e4f39b47b69d88 [0,1,0,1,0,0|2,0,0]=4 10573 B12R1.127 CC1CNC(=O)CN1C[C@@H](C)O 266a164f79cab35d49a4cc1f3ebc14e1 [0,1,0,1,0,0|2,0,0]=4 10574 B12R1.127 CC1CNC(=O)CN1C[C@H](C)O fc651947df4e3478ca9f416ec5a45cd6 [0,1,0,1,0,0|2,0,0]=4 10575 B12R1.127 C[C@@H](O)CN1CC(=O)NC[C@@H]1C 1278ec823a4d23a81b46c33f03d12d80 [0,1,0,1,0,0|2,0,0]=4 10576 B12R1.127 C[C@@H]1CNC(=O)CN1C[C@@H](C)O 8518c78014bfaa1103584d9d024b6e42 [0,1,0,1,0,0|2,0,0]=4 10577 B12R1.127 C[C@H](O)CN1CC(=O)NC[C@@H]1C 83691e01a0874b944c8639c5a455dc08 [0,1,0,1,0,0|2,0,0]=4 10578 B12R1.127 C[C@H](O)CN1CC(=O)NC[C@H]1C 5a32754468c3096274ed1043bbfd6626 [0,1,0,1,0,0|2,0,0]=4 10579 B12R1.252 CC(C)COCC1=CCCCO1 64a7ee3f3cbebfb8ba6635b6075c1bf0 [0,1,0,1,0,0|2,0,0]=4 10580 B12R1.874 CC(C)CN1CCCNC(=O)C1 a75c2be9367463aac2ff4cab108bbd51 [0,1,0,1,0,0|2,0,0]=4 10581 B12R1.874 CC(C)OC1CCCNC(=O)C1 029010b05abf9975a9af31e8896960d6 [0,1,0,1,0,0|2,0,0]=4 10582 B12R1.874 CC(O)CN1CCCNC(=O)C1 f28ea827004d3b5de8f7f3812d010e0d [0,1,0,1,0,0|2,0,0]=4 10583 B12R1.874 C[C@@H](O)CN1CCCNC(=O)C1 5c4e8d852f610dffe81ee277b38d0280 [0,1,0,1,0,0|2,0,0]=4 10584 B12R1.874 C[C@H](O)CN1CCCNC(=O)C1 527eed6669b47de376075510c53854b0 [0,1,0,1,0,0|2,0,0]=4 10585 B12R1.1357 C=C(C)CCCC(=O)N1CCC1 2e2270bb551e51ce98e475749861721e [0,1,0,1,0,0|1,0,1]=4 10586 B12R1.1357 CC(=O)CCCC(=O)N1CCC1 c114df5e084302550cd51e5af7d1add1 [0,1,0,1,0,0|1,0,1]=4 10587 B12R1.1357 CC(C)CCCC(=O)N1CCC1 8e998420472ee46a1b275b06863533e4 [0,1,0,1,0,0|1,0,0]=3 10588 B12R1.1357 CC(C)CCNC(=O)N1CCC1 b04f8888e397472f5f3ceca91cd2104f [0,1,0,1,0,0|2,0,0]=4 10589 B12R1.1357 CC(C)CNCC(=O)C1CCC1 f492d3ef279a08d667eecd216aeee8cf [0,1,0,1,0,0|2,0,0]=4 10590 B12R1.1357 CC(C)CNCC(=O)N1CCC1 17ffe248f579b25d286f70ddae05aa8b [0,1,0,1,0,0|2,0,0]=4 10591 B12R1.1357 CC(C)COCC(=O)C1CCC1 6422a795ba63cbb4498eaa845a54c1d1 [0,1,0,1,0,0|2,0,0]=4 10592 B12R1.1357 CC(C)COCC(=O)N1CCC1 99428bde27c5f3effdaa0c54253c2b34 [0,1,0,1,0,0|2,0,0]=4 10593 B12R1.1357 CC(C)OCCC(=O)N1CCC1 641039b7d89a667f28e92f355df790dd [0,1,0,1,0,0|2,0,0]=4 10594 B12R1.1357 CC(C)SCCC(=O)N1CCC1 05e1852d9625e36f4b9d83fc99e73a42 [0,1,0,1,0,0|2,0,0]=4 10595 B12R1.1357 CC(F)COCC(=O)C1CCC1 5d1c776e6583b3cd5e9d3c72e1003737 [0,1,0,1,0,0|2,0,0]=4 10596 B12R1.1357 CC(F)COCC(=O)N1CCC1 b2bf53b8a6e7aded0a0c222bf198d05b [0,1,0,1,0,0|2,0,0]=4 10597 B12R1.1357 CC(O)CCNC(=O)N1CCC1 046f4219c31e2d49d7d08d788434aaa4 [0,1,0,1,0,0|2,0,0]=4 10598 B12R1.1357 CC(O)CNCC(=O)C1CCC1 63cc03172e1bf4d2033c78d40606b557 [0,1,0,1,0,0|2,0,0]=4 10599 B12R1.1357 CC(O)CNCC(=O)N1CCC1 fcd80075c5b36e0af22b85a79737312b [0,1,0,1,0,0|2,0,0]=4 10600 B12R1.1357 CC(S)COCC(=O)C1CCC1 a760614a5129afdc7243a7ad67f26fcf [0,1,0,1,0,0|2,0,0]=4 10601 B12R1.1357 CC(S)COCC(=O)N1CCC1 4b30af527ebf8de0d0ab9d79739ea451 [0,1,0,1,0,0|2,0,0]=4 10602 B12R1.1357 CN(C)CCCC(=O)N1CCC1 78fcb97abac1ac22b6832103246feed3 [0,1,0,1,0,0|2,0,0]=4 10603 B12R1.1357 C[C@@H](F)COCC(=O)C1CCC1 a52ba00be05754509a8f65876a014b43 [0,1,0,1,0,0|2,0,0]=4 10604 B12R1.1357 C[C@@H](F)COCC(=O)N1CCC1 8b0a23db752cdb41a96b58b26db16292 [0,1,0,1,0,0|2,0,0]=4 10605 B12R1.1357 C[C@@H](O)CCNC(=O)N1CCC1 c5aaf46c481c1ffdcf8e64aa37374fe5 [0,1,0,1,0,0|2,0,0]=4 10606 B12R1.1357 C[C@@H](O)CNCC(=O)C1CCC1 4f72a0a2e8b6e5ebdd63ec2a5d0ab0fa [0,1,0,1,0,0|2,0,0]=4 10607 B12R1.1357 C[C@@H](O)CNCC(=O)N1CCC1 2678e4829a32dc40f35e5315bf23b692 [0,1,0,1,0,0|2,0,0]=4 10608 B12R1.1357 C[C@H](F)COCC(=O)C1CCC1 56e0316d8db90404f1d85972ba4d8e97 [0,1,0,1,0,0|2,0,0]=4 10609 B12R1.1357 C[C@H](F)COCC(=O)N1CCC1 42ff18201be1164618c41b076f82ce4b [0,1,0,1,0,0|2,0,0]=4 10610 B12R1.1357 C[C@H](O)CCNC(=O)N1CCC1 4e2b119e69d454b77700df9fb3a41e60 [0,1,0,1,0,0|2,0,0]=4 10611 B12R1.1357 C[C@H](O)CNCC(=O)C1CCC1 2638150b61ffd9e345e0dd212a9b6980 [0,1,0,1,0,0|2,0,0]=4 10612 B12R1.1357 C[C@H](O)CNCC(=O)N1CCC1 9768e63b170ca3d362468234785f968c [0,1,0,1,0,0|2,0,0]=4 10613 B12R1.1359 C=C(C)CCCC(=O)NC1CC1 e2130272f0ec801bddc76522827e36c0 [0,1,0,1,0,0|1,0,1]=4 10614 B12R1.1359 CC(=O)CCCC(=O)NC1CC1 c33500f7b59038c7b26d7e7fbab4af85 [0,1,0,1,0,0|1,0,1]=4 10615 B12R1.1359 CC(C)CCCC(=O)NC1CC1 24bf673946a1d4adbb41a7abc647a778 [0,1,0,1,0,0|1,0,0]=3 10616 B12R1.1359 CC(C)CCCC(C)OC1CC1 70ae0820eb832f8df895e9189bb18ca1 [0,1,0,1,0,0|1,0,1]=4 10617 B12R1.1359 CC(C)CCNC(=O)CC1CC1 9231a98431852ce765aaeb590855e534 [0,1,0,1,0,0|2,0,0]=4 10618 B12R1.1359 CC(C)CCNC(=O)NC1CC1 2d2185649d40d4688761228a472576c2 [0,1,0,1,0,0|2,0,0]=4 10619 B12R1.1359 CC(C)CNCC(=O)NC1CC1 9cc7cc91d463af01b4459cc9b2c8a7c8 [0,1,0,1,0,0|2,0,0]=4 10620 B12R1.1359 CC(C)COCC(=O)NC1CC1 2a7825b5714bce3c1e2968a2cf68805e [0,1,0,1,0,0|2,0,0]=4 10621 B12R1.1359 CC(C)OCCC(=O)NC1CC1 8354b82e6a3cc908992839828bd43b83 [0,1,0,1,0,0|2,0,0]=4 10622 B12R1.1359 CC(F)COCC(=O)NC1CC1 d87ccd458b3f70ed83ab60f7cd75dd6b [0,1,0,1,0,0|2,0,0]=4 10623 B12R1.1359 CC(O)CCNC(=O)CC1CC1 b8d8e0950c6859c1a8e9b183e67d6f53 [0,1,0,1,0,0|2,0,0]=4 10624 B12R1.1359 CC(O)CCNC(=O)NC1CC1 4080808321e70ee1e3281802c205a0c1 [0,1,0,1,0,0|2,0,0]=4 10625 B12R1.1359 CC(O)CNCC(=O)NC1CC1 710f8b58ae2fb8657e127cce388a188d [0,1,0,1,0,0|2,0,0]=4 10626 B12R1.1359 CC(S)COCC(=O)NC1CC1 23fffe48f4d42631e623a65feaf7193e [0,1,0,1,0,0|2,0,0]=4 10627 B12R1.1359 CN(C)CCCC(=O)NC1CC1 18a4893be62a90f5b29504536493595b [0,1,0,1,0,0|2,0,0]=4 10628 B12R1.1359 C[C@@H](F)COCC(=O)NC1CC1 4067b394c08067e2840f2e7ccdc3ade4 [0,1,0,1,0,0|2,0,0]=4 10629 B12R1.1359 C[C@@H](O)CCNC(=O)CC1CC1 220f3925b7e4b74b02a7f85e6a2e6803 [0,1,0,1,0,0|2,0,0]=4 10630 B12R1.1359 C[C@@H](O)CCNC(=O)NC1CC1 f92790b6371a7a29695b2e4d84219f5f [0,1,0,1,0,0|2,0,0]=4 10631 B12R1.1359 C[C@@H](O)CNCC(=O)NC1CC1 cddb0a0b612287bf152a2523b3b1c7a0 [0,1,0,1,0,0|2,0,0]=4 10632 B12R1.1359 C[C@H](F)COCC(=O)NC1CC1 5807f3af3ae841cd43f2d0792630e7b7 [0,1,0,1,0,0|2,0,0]=4 10633 B12R1.1359 C[C@H](O)CCNC(=O)CC1CC1 3943faecf4c210140c1fbc61d0b64473 [0,1,0,1,0,0|2,0,0]=4 10634 B12R1.1359 C[C@H](O)CCNC(=O)NC1CC1 dc8312df09f34c8fcb13f7da02837d74 [0,1,0,1,0,0|2,0,0]=4 10635 B12R1.1359 C[C@H](O)CNCC(=O)NC1CC1 17e1dbec4455b8c60788d978e75a0b7d [0,1,0,1,0,0|2,0,0]=4 10636 B12R1.2043 CCCCC(=O)NC1CC1(C)C 173ee0bd104dcbd8ffb00fa195597bb9 [0,1,0,1,0,0|2,0,0]=4 10637 B12R1.2043 CCCCC(=O)N[C@@H]1CC1(C)C 61c8fbd50149bbafe5fb5ce074579422 [0,1,0,1,0,0|2,0,0]=4 10638 B12R1.2043 CCCCC(=O)N[C@H]1CC1(C)C 3c43d045782e455e020d1e48338a9958 [0,1,0,1,0,0|2,0,0]=4 10639 B12R1.2043 CCCNC(=O)CC1CC1(F)F d48d121825f9264bdd397e2446eff7fc [0,1,0,1,0,0|2,0,0]=4 10640 B12R1.2043 CCCNC(=O)CN1CC1(C)C b2bdeee4dac7e3a441b71410c301ebae [0,1,0,1,0,0|2,0,0]=4 10641 B12R1.2043 CCCNC(=O)NC1CC1(C)C 38586d7ad92b969b1893d53b2bf72d89 [0,1,0,1,0,0|2,0,0]=4 10642 B12R1.2043 CCCNC(=O)N[C@@H]1CC1(C)C cfead6820aaff525faebde630d402269 [0,1,0,1,0,0|2,0,0]=4 10643 B12R1.2043 CCCNC(=O)N[C@H]1CC1(C)C fe4271c73774de8af306761a6a627b9b [0,1,0,1,0,0|2,0,0]=4 10644 B12R1.2043 CCCOC(=O)CN1CC1(C)C 0c0534b7f49c91f08616aa02dbf8f7c0 [0,1,0,1,0,0|1,0,0]=3 10645 B12R1.25 CCCNC1CCCN(C1=O)C 6958a1f5ac75793251c642534f49749e [0,1,0,1,0,0|2,0,0]=4 10646 B12R1.25 CCCN[C@@H]1CCCN(C1=O)C 06cc52592bf12d5d508e2c1bb922e539 [0,1,0,1,0,0|2,0,0]=4 10647 B12R1.25 CCCN[C@H]1CCCN(C1=O)C 888128bb0d6df976d45cb91bd7dd4015 [0,1,0,1,0,0|2,0,0]=4 10648 B12R1.25 CCCOC1CCCC(C1C)C 537e03d0b3e251d02c53174cf0793a1e [0,1,0,1,0,0|1,0,1]=4 10649 B12R1.25 CCOCC1CCCN(C1=O)C ca5bd9a980ca7e518baed89606f9ea1c [0,1,0,1,0,0|2,0,0]=4 10650 B12R1.36 C#CC(OCCC)C1CCCC1 036434a80d6a6a7e96b0f84edc84214e [0,1,0,1,0,0|1,0,1]=4 10651 B12R1.2140 C#CC(CCCCC)OC1CC1 9f1a1ba7b22b4ffe061449ee016a2471 [0,1,0,1,0,0|1,0,1]=4 10652 B12R1.2140 C#C[C@H](CCCCC)OC1CC1 a40af962868b55e5ce3c7228e6f9aed5 [0,1,0,1,0,0|1,0,1]=4 10653 B12R1.2140 C=CC(CCCCC)OC1CC1 f3050c41824e93d1b0b4d29632e60a18 [0,1,0,1,0,0|1,0,1]=4 10654 B12R1.2140 C=C[C@H](CCCCC)OC1CC1 559437d2612ddcaaccfd005c07bf6da6 [0,1,0,1,0,0|1,0,1]=4 10655 B12R1.2140 CCCCCC(CC)OC1CC1 aedc9d30c606e24367ee2809684138d5 [0,1,0,1,0,0|1,0,1]=4 10656 B12R1.2140 CCCCC[C@H](CC)OC1CC1 d4d7c170970075c8f5f0ac0258d8306a [0,1,0,1,0,0|1,0,1]=4 10657 B12R1.15 CCC(C)NC(=O)C1CCCO1 2d6be275a3f794a95fbd068979257098 [0,1,0,1,0,0|2,0,0]=4 10658 B12R1.15 CCC(C)NC(=O)C1CCCS1 060587552ece4340003ea67e6c02563a [0,1,0,1,0,0|2,0,0]=4 10659 B12R1.15 CCC(C)NC(=O)[C@@H]1CCCO1 d9ad4510ce4a309e4545d7b5d9ad55de [0,1,0,1,0,0|2,0,0]=4 10660 B12R1.15 CCC(C)NC(=O)[C@H]1CCCO1 4f01d3ddf6301f94c1dae9463804b1f7 [0,1,0,1,0,0|2,0,0]=4 10661 B12R1.15 CCC(C)OC(C)C1CCCC1 316c0e5894ae7e830a2df08f07f1a4b7 [0,1,0,1,0,0|1,0,1]=4 10662 B12R1.15 CCN(C)CC(=O)C1CCCC1 398e8d6b9303adcbb48fca4fd3ba4b53 [0,1,0,1,0,0|2,0,0]=4 10663 B12R1.15 CC[C@@H](C)NC(=O)C1CCCO1 9a4e09fbd26bcd82de2d74f4ecdf5119 [0,1,0,1,0,0|2,0,0]=4 10664 B12R1.15 CC[C@@H](C)NC(=O)C1CCCS1 972a188d5cb9b16060f7b42cc4a086ab [0,1,0,1,0,0|2,0,0]=4 10665 B12R1.15 CC[C@@H](C)NC(=O)[C@@H]1CCCO1 d5a063a68d0a35ea793c55ba9efd1ca4 [0,1,0,1,0,0|2,0,0]=4 10666 B12R1.15 CC[C@@H](C)NC(=O)[C@H]1CCCO1 87f10c56c751a2733b9e8fe6ef6f3f8e [0,1,0,1,0,0|2,0,0]=4 10667 B12R1.15 CC[C@H](C)NC(=O)C1CCCO1 dabc0a28b4d9da6b8ae26880f0f2aaa6 [0,1,0,1,0,0|2,0,0]=4 10668 B12R1.15 CC[C@H](C)NC(=O)C1CCCS1 0dce1ac2e7291b7950d0cf3c5f67f0f8 [0,1,0,1,0,0|2,0,0]=4 10669 B12R1.15 CC[C@H](C)NC(=O)[C@@H]1CCCO1 f27fa1b15212448cdf986b02a6d45441 [0,1,0,1,0,0|2,0,0]=4 10670 B12R1.15 CC[C@H](C)NC(=O)[C@H]1CCCO1 9d96337f52afcacf025532b8ee484047 [0,1,0,1,0,0|2,0,0]=4 10671 B12R1.50 CCC(C)OC1CCCC(C1)C 8a2cd56002b446076b0e71a4d9739586 [0,1,0,1,0,0|1,0,1]=4 10672 B12R1.50 CCC(C)O[C@@H]1CCC[C@@H](C1)C b47087894cf4e0325002f3dfe8c52eae [0,1,0,1,0,0|1,0,1]=4 10673 B12R1.50 CCC(C)O[C@H]1CCC[C@@H](C1)C f6ff6f92baf83a710133ed0114b8da12 [0,1,0,1,0,0|1,0,1]=4 10674 B12R1.50 CCC(C)O[C@H]1CCC[C@H](C1)C 637e78c118cef7f89d5389f8a31f45e2 [0,1,0,1,0,0|1,0,1]=4 10675 B12R1.303 CCC(C)CC(=O)NC1CC1C 77e58cfb8dbc38428713cacb584b58c2 [0,1,0,1,0,0|2,0,0]=4 10676 B12R1.303 CCC(C)NC(=O)NC1CC1C fabf3e2af1f0dfaed7a8965a367db806 [0,1,0,1,0,0|2,0,0]=4 10677 B12R1.303 CCC(O)CC(=O)NC1CC1C caa9f8919900f4aa7b71d74b51cc43b4 [0,1,0,1,0,0|2,0,0]=4 10678 B12R1.303 CC[C@@H](C)CC(=O)NC1CC1C 6bbfc26165b927917239ba437c638538 [0,1,0,1,0,0|2,0,0]=4 10679 B12R1.303 CC[C@@H](C)NC(=O)NC1CC1C 3d9a8af1266685606cbd75751888f9cb [0,1,0,1,0,0|2,0,0]=4 10680 B12R1.303 CC[C@@H](O)CC(=O)NC1CC1C 066e2cdf63301b24503a69be8d6e832c [0,1,0,1,0,0|2,0,0]=4 10681 B12R1.303 CC[C@H](C)CC(=O)NC1CC1C c8ae64d83370c7a535be12803efc321b [0,1,0,1,0,0|2,0,0]=4 10682 B12R1.303 CC[C@H](C)NC(=O)NC1CC1C 825f5479d96d732ad563ca54d46f8d3b [0,1,0,1,0,0|2,0,0]=4 10683 B12R1.303 CC[C@H](O)CC(=O)NC1CC1C dd7ad4469d5c24ecefcf3cea4f08ac73 [0,1,0,1,0,0|2,0,0]=4 10684 B12R1.304 CC(CO)NC(=O)CC1CCC1 832f941e782cfb9d5810dadb8d2c7058 [0,1,0,1,0,0|2,0,0]=4 10685 B12R1.304 CCC(C)CC(=O)NC1CCC1 80e75cc35ffe514ca6364328d7508c4f [0,1,0,1,0,0|2,0,0]=4 10686 B12R1.304 CCC(C)NC(=O)CC1CCC1 dd6204d23f853b383914735f3bf79153 [0,1,0,1,0,0|1,0,0]=3 10687 B12R1.304 CCC(C)NC(=O)CC1CCO1 2ace382b43643f465aab2cdaa1a2b2a2 [0,1,0,1,0,0|2,0,0]=4 10688 B12R1.304 CCC(C)NC(=O)CC1COC1 4e682f784a8c32e04bd307491e67d70a [0,1,0,1,0,0|2,0,0]=4 10689 B12R1.304 CCC(C)NC(=O)CC1CSC1 f19faff241a53cd01bf0cb3557e51645 [0,1,0,1,0,0|2,0,0]=4 10690 B12R1.304 CCC(C)NC(=O)CN1CCC1 ddf6c6a29788d996bb0263438d43cf19 [0,1,0,1,0,0|2,0,0]=4 10691 B12R1.304 CCC(C)NC(=O)NC1CCC1 8587c296d86db376504c2024d8868169 [0,1,0,1,0,0|2,0,0]=4 10692 B12R1.304 CCC(O)CC(=O)NC1CCC1 020fd09cbb6ecc9b7596cf82d2697512 [0,1,0,1,0,0|2,0,0]=4 10693 B12R1.304 CC[C@@H](C)CC(=O)NC1CCC1 88ce477d05718e3073f734e30a026f3b [0,1,0,1,0,0|2,0,0]=4 10694 B12R1.304 CC[C@@H](C)NC(=O)CC1CCC1 d35c70b6b27c9b2adccdb143c0c5f873 [0,1,0,1,0,0|1,0,0]=3 10695 B12R1.304 CC[C@@H](C)NC(=O)CC1CCO1 5b4cb19ac0918cf3cef9dc9406879292 [0,1,0,1,0,0|2,0,0]=4 10696 B12R1.304 CC[C@@H](C)NC(=O)CC1COC1 aa0c3061d782c2260d80f2abe5bbba9d [0,1,0,1,0,0|2,0,0]=4 10697 B12R1.304 CC[C@@H](C)NC(=O)CC1CSC1 5f8652680db533b1e47e4875642d7853 [0,1,0,1,0,0|2,0,0]=4 10698 B12R1.304 CC[C@@H](C)NC(=O)CN1CCC1 fb01f024759d13b3dce9702bda484c11 [0,1,0,1,0,0|2,0,0]=4 10699 B12R1.304 CC[C@@H](C)NC(=O)NC1CCC1 004bfb7fa1a8321a4596729913ff9ea2 [0,1,0,1,0,0|2,0,0]=4 10700 B12R1.304 CC[C@@H](O)CC(=O)NC1CCC1 f2735c1c50a52b2a4be4389c44a7756f [0,1,0,1,0,0|2,0,0]=4 10701 B12R1.304 CC[C@H](C)CC(=O)NC1CCC1 b97d0570282744597706cef2f3d1d3db [0,1,0,1,0,0|2,0,0]=4 10702 B12R1.304 CC[C@H](C)NC(=O)CC1CCC1 6c66dccf8ce1b5d4e1d918a2a02f95b5 [0,1,0,1,0,0|1,0,0]=3 10703 B12R1.304 CC[C@H](C)NC(=O)CC1CCO1 9411bdf5761870b13c2a4c5278b5d373 [0,1,0,1,0,0|2,0,0]=4 10704 B12R1.304 CC[C@H](C)NC(=O)CC1COC1 08cc80a9459990292bfbd1ffecd6b1d1 [0,1,0,1,0,0|2,0,0]=4 10705 B12R1.304 CC[C@H](C)NC(=O)CC1CSC1 e8c6df36b74fc748e70b1716f80d2c26 [0,1,0,1,0,0|2,0,0]=4 10706 B12R1.304 CC[C@H](C)NC(=O)CN1CCC1 0b3a915b1aa9d2a2bb76e398bd2e85db [0,1,0,1,0,0|2,0,0]=4 10707 B12R1.304 CC[C@H](C)NC(=O)NC1CCC1 bba14fe4a54bc44a5c12af0977cc0658 [0,1,0,1,0,0|2,0,0]=4 10708 B12R1.304 CC[C@H](O)CC(=O)NC1CCC1 636842cec3c22341577a1aaabb0b30d3 [0,1,0,1,0,0|2,0,0]=4 10709 B12R1.304 C[C@@H](CO)NC(=O)CC1CCC1 62b6426747c77841b7749e3ebb245f0a [0,1,0,1,0,0|2,0,0]=4 10710 B12R1.304 C[C@H](CO)NC(=O)CC1CCC1 35ca669b02f1f4141cdf1df6fe0457e2 [0,1,0,1,0,0|2,0,0]=4 10711 B12R1.305 CC(CO)NC(=O)CCC1CC1 7ec536dea050ddb48c8f5e274838e266 [0,1,0,1,0,0|2,0,0]=4 10712 B12R1.305 CCC(C)CC(=O)NCC1CC1 47b6e0339850b54a4d92c15296a850ec [0,1,0,1,0,0|2,0,0]=4 10713 B12R1.305 CCC(C)NC(=O)CCC1CC1 c5c32f4f74e3479517d6745bd78a4c50 [0,1,0,1,0,0|1,0,0]=3 10714 B12R1.305 CCC(C)NC(=O)CNC1CC1 cd2d99049779115da938d71ce5118af2 [0,1,0,1,0,0|2,0,0]=4 10715 B12R1.305 CCC(C)NC(=O)COC1CC1 46374c33bf22777a2cd359204281adae [0,1,0,1,0,0|2,0,0]=4 10716 B12R1.305 CCC(C)NC(=O)NCC1CC1 fb48b102e50d50144fed9d611ccc6e56 [0,1,0,1,0,0|2,0,0]=4 10717 B12R1.305 CCC(O)CC(=O)NCC1CC1 34accf37c10b1f9aaaab94118e172259 [0,1,0,1,0,0|2,0,0]=4 10718 B12R1.305 CC[C@@H](C)CC(=O)NCC1CC1 f80834068c7ac13a1a871f63db196132 [0,1,0,1,0,0|2,0,0]=4 10719 B12R1.305 CC[C@@H](C)NC(=O)CCC1CC1 3b857f1036ea2279087211457267b4f3 [0,1,0,1,0,0|1,0,0]=3 10720 B12R1.305 CC[C@@H](C)NC(=O)COC1CC1 5e7bb8a2e82c032628ded06eaef2d9a8 [0,1,0,1,0,0|2,0,0]=4 10721 B12R1.305 CC[C@@H](C)NC(=O)NCC1CC1 6cf29244664a9670779e8ecb0909249d [0,1,0,1,0,0|2,0,0]=4 10722 B12R1.305 CC[C@@H](O)CC(=O)NCC1CC1 e3a6a989d3d47df832a7f2ade6d39832 [0,1,0,1,0,0|2,0,0]=4 10723 B12R1.305 CC[C@H](C)CC(=O)NCC1CC1 156db535f5a8e3e2f629fb1bd735e7ca [0,1,0,1,0,0|2,0,0]=4 10724 B12R1.305 CC[C@H](C)NC(=O)CCC1CC1 5a511b712cccaed1d5857660d152c15d [0,1,0,1,0,0|1,0,0]=3 10725 B12R1.305 CC[C@H](C)NC(=O)COC1CC1 f0a640372c1a486022405bdf20132b07 [0,1,0,1,0,0|2,0,0]=4 10726 B12R1.305 CC[C@H](C)NC(=O)NCC1CC1 c6ca8bd48151d71fd2dae3aef7ecd885 [0,1,0,1,0,0|2,0,0]=4 10727 B12R1.305 CC[C@H](O)CC(=O)NCC1CC1 eccf5e68e25e6e7a7faab9285649dda1 [0,1,0,1,0,0|2,0,0]=4 10728 B12R1.305 C[C@@H](CO)NC(=O)CCC1CC1 c17586c5d00418d36bb591a19c75b02d [0,1,0,1,0,0|2,0,0]=4 10729 B12R1.305 C[C@H](CO)NC(=O)CCC1CC1 6800ba364ffbcf1e249febaac9e26f5c [0,1,0,1,0,0|2,0,0]=4 10730 B12R1.306 CCC(C)NC(=O)C1CCN1C 91be5fb8ca2c0b09a09f30d43034b8e5 [0,1,0,1,0,0|2,0,0]=4 10731 B12R1.306 CCC(C)NC(=O)[C@@H]1CCN1C ce318e0daa038f10c06c51c6c2fefbca [0,1,0,1,0,0|2,0,0]=4 10732 B12R1.306 CCC(C)NC(=O)[C@H]1CCN1C 008f52987c7f5759743bb9af58d0f04f [0,1,0,1,0,0|2,0,0]=4 10733 B12R1.306 CC[C@@H](C)NC(=O)C1CCN1C a9194abbba4f15c05936f5786fa212f9 [0,1,0,1,0,0|2,0,0]=4 10734 B12R1.306 CC[C@@H](C)NC(=O)[C@@H]1CCN1C f062634604a9a8c6afe2219f7b9bd1a6 [0,1,0,1,0,0|2,0,0]=4 10735 B12R1.306 CC[C@@H](C)NC(=O)[C@H]1CCN1C 6db350ca3245db2fe560c5f1cbc16c75 [0,1,0,1,0,0|2,0,0]=4 10736 B12R1.306 CC[C@H](C)NC(=O)C1CCN1C 673724bd4c306b118add060551c16318 [0,1,0,1,0,0|2,0,0]=4 10737 B12R1.306 CC[C@H](C)NC(=O)[C@@H]1CCN1C 01dd727e6a6ec9fa1a204207b212600d [0,1,0,1,0,0|2,0,0]=4 10738 B12R1.306 CC[C@H](C)NC(=O)[C@H]1CCN1C 2bfc45d01b3a7c8cd86d848e3cfd1f97 [0,1,0,1,0,0|2,0,0]=4 10739 B12R1.900 CC1(CC1)NC(=O)CCCCF 72ef7760d6c02d42f0b73762b119d6d1 [0,1,0,1,0,0|2,0,0]=4 10740 B12R1.900 CC1(CC1)NC(=O)CCCCO 760e7d49555a163cf6d54affd54821fd [0,1,0,1,0,0|2,0,0]=4 10741 B12R1.900 CC1(CC1)NC(=O)CCCCS 7fd09b17b5d0783d80810e28c3174640 [0,1,0,1,0,0|2,0,0]=4 10742 B12R1.900 CCCCCC(=O)NC1(CC1)C fe36d423d46c7cc30595aaf267a2a03e [0,1,0,1,0,0|1,0,0]=3 10743 B12R1.900 CCCCNC(=O)CC1(CC1)C 3cd3f8c2482e1244165509e5f13aa5d8 [0,1,0,1,0,0|2,0,0]=4 10744 B12R1.900 CCCCNC(=O)NC1(CC1)C 7c4eb753ba5b5c7ca2b3c24ec75b5747 [0,1,0,1,0,0|2,0,0]=4 10745 B12R1.900 CCCOCC(=O)NC1(CC1)C 2da052a04ee65134d208a53257879e1b [0,1,0,1,0,0|2,0,0]=4 10746 B12R1.900 CCCSCC(=O)NC1(CC1)C 55b56463b8c14336a72fc6077e945606 [0,1,0,1,0,0|2,0,0]=4 10747 B12R1.900 CCSCCC(=O)NC1(CC1)C bc8b9c01056dd759be0b8f9d3d7d1d86 [0,1,0,1,0,0|2,0,0]=4 10748 B12R1.900 COCCCC(=O)NC1(CC1)C ff58caf7966ee013130bfae2e13cb869 [0,1,0,1,0,0|2,0,0]=4 10749 B12R1.900 CSCCCC(=O)NC1(CC1)C 04fcc10083707c1d0002aabffb5cc25c [0,1,0,1,0,0|2,0,0]=4 10750 B12R1.1748 CCC(C)OC1CCCCCC1 42c2d15d93d3d7d8d05005cace926125 [0,1,0,1,0,0|1,0,1]=4 10751 B12R1.1748 CC[C@@H](C)OC1CCCCCC1 da14d32e7fbf65384a691fd3c6166ab3 [0,1,0,1,0,0|1,0,1]=4 10752 B12R1.1748 CC[C@H](C)OC1CCCCCC1 e983925b66db7b50ac1fce0a2fd4232b [0,1,0,1,0,0|1,0,1]=4 10753 B12R1.55 CCCN(C)C(=O)C1CCCO1 fa264f3d2d8de9610402a0596255cd36 [0,1,0,1,0,0|2,0,0]=4 10754 B12R1.55 CCCN(C)C(=O)[C@@H]1CCCO1 278bfcd9dc94d512650a60098dc29414 [0,1,0,1,0,0|2,0,0]=4 10755 B12R1.55 CCCN(C)C(=O)[C@H]1CCCO1 a9360ce8177a819c868199597263b820 [0,1,0,1,0,0|2,0,0]=4 10756 B12R1.554 C=C(CCC)C(=O)NC1CC1C b029a519e4a5a443d113ba2447df60e1 [0,1,0,1,0,0|2,0,0]=4 10757 B12R1.554 CCCC(=O)C(=O)NC1CC1C 38dcad951078372e0db70d3f391bc6c6 [0,1,0,1,0,0|2,0,0]=4 10758 B12R1.554 CCCC(O)C(=O)NC1CC1C ca8c516fbb1db1b0eddf1b89becfbcc6 [0,1,0,1,0,0|2,0,0]=4 10759 B12R1.554 CCCN(C)C(=O)NC1CC1C c392dee30b6443d405e44678555d3dfd [0,1,0,1,0,0|2,0,0]=4 10760 B12R1.554 CCC[C@@H](O)C(=O)NC1CC1C dd95a52b879f9b0a41cb6b023aa2c3f9 [0,1,0,1,0,0|2,0,0]=4 10761 B12R1.554 CCC[C@H](O)C(=O)NC1CC1C b3c3cc756670af09d7e46010777d51af [0,1,0,1,0,0|2,0,0]=4 10762 B12R1.555 C=C(CCC)C(=O)NC1CCC1 0c717e40ff10fde52652249067edf379 [0,1,0,1,0,0|2,0,0]=4 10763 B12R1.555 CCCC(=O)C(=O)NC1CCC1 4f002886bd9c1faf2317f463563c6c44 [0,1,0,1,0,0|2,0,0]=4 10764 B12R1.555 CCCC(O)C(=O)NC1CCC1 da29eb3c2523be8b0076551417d99d0c [0,1,0,1,0,0|2,0,0]=4 10765 B12R1.555 CCCN(C)C(=O)CC1CCC1 b75f481882c436f815b82e103b02d19c [0,1,0,1,0,0|1,0,0]=3 10766 B12R1.555 CCCN(C)C(=O)CC1CCO1 bdd90b5986312753cc735690da342833 [0,1,0,1,0,0|2,0,0]=4 10767 B12R1.555 CCCN(C)C(=O)CC1COC1 df36da68752a304a1945ab6a3768ff33 [0,1,0,1,0,0|2,0,0]=4 10768 B12R1.555 CCCN(C)C(=O)CC1CSC1 99133a37b6cc1e35b0fa26757814b38a [0,1,0,1,0,0|2,0,0]=4 10769 B12R1.555 CCCN(C)C(=O)CN1CCC1 67e69a69485b722cc2bfadd3f4f001b3 [0,1,0,1,0,0|2,0,0]=4 10770 B12R1.555 CCCN(C)C(=O)NC1CCC1 f76c7ce6d693a0af7a5503b12a0a6a00 [0,1,0,1,0,0|2,0,0]=4 10771 B12R1.555 CCC[C@@H](O)C(=O)NC1CCC1 e99d499365e2969da7c626402eb9d2dc [0,1,0,1,0,0|2,0,0]=4 10772 B12R1.555 CCC[C@H](O)C(=O)NC1CCC1 9b3c5e6139a3ea276ed60fbec402fd72 [0,1,0,1,0,0|2,0,0]=4 10773 B12R1.555 CN(CCF)C(=O)CC1CCC1 4398395bb9710f5915f21ca9ce62957a [0,1,0,1,0,0|2,0,0]=4 10774 B12R1.555 CN(CCO)C(=O)CC1CCC1 703bfa73d10486c5e403c88dd699d820 [0,1,0,1,0,0|2,0,0]=4 10775 B12R1.556 C=C(CCC)C(=O)NCC1CC1 72bef1538a4536cc9661f9ffc6a185af [0,1,0,1,0,0|2,0,0]=4 10776 B12R1.556 CCCC(=O)C(=O)NCC1CC1 07a2c91387343019a946d3b7d393c2ee [0,1,0,1,0,0|2,0,0]=4 10777 B12R1.556 CCCC(O)C(=O)NCC1CC1 bdd8db3b58bb7d5795772c8aa26562a2 [0,1,0,1,0,0|2,0,0]=4 10778 B12R1.556 CCCN(C)C(=O)CCC1CC1 d5c6475a648e9f447d770552326d4890 [0,1,0,1,0,0|1,0,0]=3 10779 B12R1.556 CCCN(C)C(=O)COC1CC1 d589aa15f0853529df5529f5411e4faa [0,1,0,1,0,0|2,0,0]=4 10780 B12R1.556 CCCN(C)C(=O)NCC1CC1 b9f075f0f72d1a9a7ef8a75f6d80d53e [0,1,0,1,0,0|2,0,0]=4 10781 B12R1.556 CCC[C@@H](O)C(=O)NCC1CC1 9a42ee2792c5e7cf590f22a5d9133fe9 [0,1,0,1,0,0|2,0,0]=4 10782 B12R1.556 CCC[C@H](O)C(=O)NCC1CC1 ad56580dd641e99a849b3548d8e19adc [0,1,0,1,0,0|2,0,0]=4 10783 B12R1.556 CN(CCF)C(=O)CCC1CC1 104407016e2cd08377f6cdf04111615d [0,1,0,1,0,0|2,0,0]=4 10784 B12R1.556 CN(CCO)C(=O)CCC1CC1 93cd9016a0aede7ecfdb209145ce5113 [0,1,0,1,0,0|2,0,0]=4 10785 B12R1.557 CCCN(C)C(=O)C1CCN1C bb86418c353d31a1ec8b3eabffb9a04f [0,1,0,1,0,0|2,0,0]=4 10786 B12R1.557 CCCN(C)C(=O)[C@@H]1CCN1C e27554e2af93c0906db6e40ed35bb8c3 [0,1,0,1,0,0|2,0,0]=4 10787 B12R1.557 CCCN(C)C(=O)[C@H]1CCN1C 793feda4b26fea8330e73c8d6d722806 [0,1,0,1,0,0|2,0,0]=4 10788 B12R1.689 CCCCCC(=O)N(C)C1CC1 c8594607ab26d8d87c4af6008bad642e [0,1,0,1,0,0|1,0,0]=3 10789 B12R1.689 CCCCNC(=O)C(=O)C1CC1 b02cae744c82ed627143fbbd8604b588 [0,1,0,1,0,0|2,0,0]=4 10790 B12R1.689 CCCCNC(=O)C(O)C1CC1 7133cec2f3ee48cf5c5e7c4b19d401a5 [0,1,0,1,0,0|2,0,0]=4 10791 B12R1.689 CCCCNC(=O)N(C)C1CC1 a61cb9f84616781b746af07a3c550dbe [0,1,0,1,0,0|2,0,0]=4 10792 B12R1.689 CCCCNC(=O)[C@@H](O)C1CC1 418679711d9e7a3d27335c4d74aa1a37 [0,1,0,1,0,0|2,0,0]=4 10793 B12R1.689 CCCCNC(=O)[C@H](O)C1CC1 8d87b2dda7ecbbf8426c2906ec710991 [0,1,0,1,0,0|2,0,0]=4 10794 B12R1.689 CCCNCC(=O)N(C)C1CC1 53431086e1195732618355578fcc0a83 [0,1,0,1,0,0|2,0,0]=4 10795 B12R1.689 CCCOCC(=O)N(C)C1CC1 80cbd02a06217dabf275fc3ee5384271 [0,1,0,1,0,0|2,0,0]=4 10796 B12R1.689 CCCSCC(=O)N(C)C1CC1 bd0c74c14d2b03dd5aeb1758c7dcd99f [0,1,0,1,0,0|2,0,0]=4 10797 B12R1.689 CCNCCC(=O)N(C)C1CC1 903cfc769785b8f273d8da494d62f574 [0,1,0,1,0,0|2,0,0]=4 10798 B12R1.689 CCOCCC(=O)N(C)C1CC1 c3ff5377f1f28e7e66e86dbf5e7c60dd [0,1,0,1,0,0|2,0,0]=4 10799 B12R1.689 CCSCCC(=O)N(C)C1CC1 bd6a629aae013dc4dcb031a2cb23bdda [0,1,0,1,0,0|2,0,0]=4 10800 B12R1.689 CN(C(=O)CCCCF)C1CC1 f8fd987da89478f811925fa4f8ab3573 [0,1,0,1,0,0|2,0,0]=4 10801 B12R1.689 CN(C(=O)CCCCO)C1CC1 4fe022a16f917f8386cedf02b539e16e [0,1,0,1,0,0|2,0,0]=4 10802 B12R1.689 CN(C(=O)CCCCS)C1CC1 96f69aed52a994fe2d1595a9ffd64251 [0,1,0,1,0,0|2,0,0]=4 10803 B12R1.689 COCCCC(=O)N(C)C1CC1 47aec141043ae322beaf8813f89fdb9a [0,1,0,1,0,0|2,0,0]=4 10804 B12R1.689 CSCCCC(=O)N(C)C1CC1 1a941e5659900bd36cd7975e1bbf29a9 [0,1,0,1,0,0|2,0,0]=4 10805 B12R1.1123 CCCN1CC(=O)N(CC1C)C 99f356617275e6a68a904b352e9a3dd3 [0,1,0,1,0,0|2,0,0]=4 10806 B12R1.1123 CCCN1CC(=O)N(C[C@H]1C)C 73db10d0ace9fd190d22ed33f328997d [0,1,0,1,0,0|2,0,0]=4 10807 B12R1.1445 CCCN1CCCN(C(=O)C1)C 27a42f3aced8e23a8e84d4cb4b46d00a [0,1,0,1,0,0|2,0,0]=4 10808 B12R2.225 O=C1NCCCC1NC2CC2 0cb40571f73d03f1bef6c252fbd9edbd [0,0,0,2,0,0|2,0,0]=4 10809 B12R2.225 O=C1NCCCC1OC2CC2 ba2c241344ca8b8c7e3e5047149845f7 [0,0,0,2,0,0|2,0,0]=4 10810 B12R2.225 O=C1NCCC[C@@H]1NC2CC2 c6dda8dd31831767e917d2aecea0cb81 [0,0,0,2,0,0|2,0,0]=4 10811 B12R2.225 O=C1NCCC[C@@H]1OC2CC2 bb0ab584267add1c899c3711b1232c1c [0,0,0,2,0,0|2,0,0]=4 10812 B12R2.225 O=C1NCCC[C@H]1NC2CC2 35d96659b95db50873d43fdb9dacc29d [0,0,0,2,0,0|2,0,0]=4 10813 B12R2.225 O=C1NCCC[C@H]1OC2CC2 b49c1a80acc982572b149e20cba91319 [0,0,0,2,0,0|2,0,0]=4 10814 B12R2.517 O=C1CCCCC1N2CCC2 f051b0b6a60a73d4d414d9204e7bd40e [0,0,0,2,0,0|2,0,0]=4 10815 B12R2.517 O=C1NCCCC1N2CCC2 fe08113b3f4ea1cebb10375c6104b4cc [0,0,0,2,0,0|2,0,0]=4 10816 B12R2.2336 CCCOC1CC2CCC1C2 b23f93e0c4a8be3e3742bdc86a77439e [0,0,0,2,0,0|1,0,1]=4 10817 B12R2.2336 CCCOC1C[C@@H]2CC[C@H]1C2 7fd28db1e61c085f9b3b2cc40a1506bd [0,0,0,2,0,0|1,0,1]=4 10818 B12R2.2336 CCCOC1C[C@H]2CC[C@@H]1C2 789df6d7884fc8915355df1e233c3c74 [0,0,0,2,0,0|1,0,1]=4 10819 B12R2.2336 CCCO[C@@H]1C[C@H]2CC[C@@H]1C2 6ca42bba9453b67c7d611114ee4f262a [0,0,0,2,0,0|1,0,1]=4 10820 B12R2.2336 CCCO[C@H]1C[C@@H]2CC[C@H]1C2 9a8ab905143ee78cba078efa44930b60 [0,0,0,2,0,0|1,0,1]=4 10821 B12R2.2336 CCCO[C@H]1C[C@H]2CC[C@@H]1C2 04a5df877c83d6ced09e7a96c0667989 [0,0,0,2,0,0|1,0,1]=4 10822 B12R2.1286 CC1CCCC(C1)OC2CC2 9a87c805fa6ab669e4c87d00f76d38ec [0,0,0,2,0,0|1,0,1]=4 10823 B12R2.1286 C[C@@H]1CCC[C@@H](C1)OC2CC2 e9bab4aa88f41200ada971d320f890c1 [0,0,0,2,0,0|1,0,1]=4 10824 B12R2.1286 C[C@H]1CCC[C@@H](C1)OC2CC2 8e01c6dd3553c1391a88d17c5ce6cac0 [0,0,0,2,0,0|1,0,1]=4 10825 B12R2.1286 C[C@H]1CCC[C@H](C1)OC2CC2 96a6c2adf480fc831071ef7720a7f4db [0,0,0,2,0,0|1,0,1]=4 10826 B12R2.1519 CCCOC1CC2CC(C2)C1 c6c89133cfb5ab988cdb5a7ace3c7c58 [0,0,0,2,0,0|1,0,1]=4 10827 B12R2.375 CCN1CCC2C1CC(=O)N2 95fe1bc89c69fd037119d54148165090 [0,0,0,2,0,0|2,0,0]=4 10828 B12R2.375 CCN1CC[C@H]2[C@@H]1CC(=O)N2 364fbccfa6a52c797db6dfaa39020b0c [0,0,0,2,0,0|2,0,0]=4 10829 B12R2.2074 CC(OC1CC1)C2CCCC2 5b603c46f64d91b8613e7100ddb3814e [0,0,0,2,0,0|1,0,1]=4 10830 B12R2.2074 O=C(NC1CC1)C2CCCO2 bc174caa9ae3da53a64fff3f0e069e9a [0,0,0,2,0,0|2,0,0]=4 10831 B12R2.2074 O=C(NC1CC1)[C@@H]2CCCO2 2005c2984649d3fa52bd6c7850073465 [0,0,0,2,0,0|2,0,0]=4 10832 B12R2.2074 O=C(NC1CC1)[C@H]2CCCO2 703fffdea16796514a892eecdaaf3fa4 [0,0,0,2,0,0|2,0,0]=4 10833 B12R2.3797 O=C(C1CCCO1)N2CCC2 870011148d2e8fc68e12ed8be2b40812 [0,0,0,2,0,0|2,0,0]=4 10834 B12R2.3797 O=C(C1CCCS1)N2CCC2 fd5529b9f2cc79c6eaffe27e6f614bc7 [0,0,0,2,0,0|2,0,0]=4 10835 B12R2.3797 O=C([C@@H]1CCCO1)N2CCC2 2a8507819b16db1e615ec26f849918a9 [0,0,0,2,0,0|2,0,0]=4 10836 B12R2.3797 O=C([C@H]1CCCO1)N2CCC2 1ab40ed17ddf7761fb4dc35236a5f241 [0,0,0,2,0,0|2,0,0]=4 10837 B12R2.2257 CCN1[C@@H]2CC[C@H]1CC(=O)C2 74e055caab9c7da6d51091ce30f6d978 [0,0,0,2,0,0|2,0,0]=4 10838 B12R2.3808 C1CCCC(CC1)OC2CC2 efd7cd9ef0033983c793e46dc27fc106 [0,0,0,2,0,0|1,0,1]=4 10839 B12R2.1528 CCCOC1CC2(C1)CCC2 5b4c8ac2e568a20b5891963696c9f3b2 [0,0,0,2,0,0|1,0,1]=4 10840 B12R2.2040 CCN1C[C@@H]2CNC(=O)[C@@H]2C1 fe619d25b03f9144e5f06233a0edc616 [0,0,0,2,0,0|2,0,0]=4 10841 B12R2.2040 CCN1C[C@H]2CNC(=O)[C@H]2C1 daa5c0db8172ccd7576f1fa83362822b [0,0,0,2,0,0|2,0,0]=4 10842 B12R2.5146 CCCOC1CCC2(C1)CC2 38bd6f656ff8a184d4e63aac7075c8fa [0,0,0,2,0,0|1,0,1]=4 10843 B12R2.424 CC1CC1NC(=O)CC2CC2 dc3acb5033fd0661a7378df1574c77d0 [0,0,0,2,0,0|2,0,0]=4 10844 B12R2.424 CC1CC1NC(=O)NC2CC2 a2b47a9a417ddec704318244cddee0ef [0,0,0,2,0,0|2,0,0]=4 10845 B12R2.5405 CC1CC1NC(=O)N2CCC2 942edb9f014284641a0cdb32aa6610c7 [0,0,0,2,0,0|2,0,0]=4 10846 B12R2.3281 O=C(CC1CCC1)N2CCC2 534e4a265a51a85c3e139853ee956d12 [0,0,0,2,0,0|1,0,0]=3 10847 B12R2.3281 O=C(CC1CCO1)N2CCC2 d01a470a7475785035cc8ef047843c30 [0,0,0,2,0,0|2,0,0]=4 10848 B12R2.3281 O=C(CC1COC1)N2CCC2 430138c9b93d763da57dbcd71aa338d3 [0,0,0,2,0,0|2,0,0]=4 10849 B12R2.3281 O=C(CC1CSC1)N2CCC2 5b9cbc56250f9b5a8b5978c1cf0155bd [0,0,0,2,0,0|2,0,0]=4 10850 B12R2.3281 O=C(CN1CCC1)C2CCC2 57e8f87c3dda0b0f9597733650d180ed [0,0,0,2,0,0|2,0,0]=4 10851 B12R2.3281 O=C(CN1CCC1)N2CCC2 cd40ca66a50ceee523a19a18f06880cb [0,0,0,2,0,0|2,0,0]=4 10852 B12R2.3281 O=C(NC1CCC1)N2CCC2 4d1f1d19eafa0a40a9c0e5219e4b7cd3 [0,0,0,2,0,0|2,0,0]=4 10853 B12R2.3283 O=C(CC1CC1)NC2CCC2 aaca0e289ecfe86d88dc8c034e9ffee3 [0,0,0,2,0,0|2,0,0]=4 10854 B12R2.3283 O=C(CC1CCO1)NC2CC2 7e12b5443279f3885a51c2b340c4d3ac [0,0,0,2,0,0|2,0,0]=4 10855 B12R2.3283 O=C(CC1COC1)NC2CC2 5c59e247c01e50d574f2c235505e5a63 [0,0,0,2,0,0|2,0,0]=4 10856 B12R2.3283 O=C(CC1CSC1)NC2CC2 64791a7552aaa4d0292ef1a279ed875a [0,0,0,2,0,0|2,0,0]=4 10857 B12R2.3283 O=C(CN1CCC1)NC2CC2 a82f8d95bcebd8181d7c0bf6a7e40e2e [0,0,0,2,0,0|2,0,0]=4 10858 B12R2.3283 O=C(NC1CCC1)NC2CC2 1a20266847a43a65a7e447f183d36f27 [0,0,0,2,0,0|2,0,0]=4 10859 B12R2.3280 O=C(CCC1CC1)N2CCC2 8144699d6637478d9dcbe8a896d8337f [0,0,0,2,0,0|1,0,0]=3 10860 B12R2.3280 O=C(CNC1CC1)C2CCC2 15ae9525f7b43e9e616dd1529f855b83 [0,0,0,2,0,0|2,0,0]=4 10861 B12R2.3280 O=C(CNC1CC1)N2CCC2 07a149e67cd8a8f6e2ef0976cbf3cabe [0,0,0,2,0,0|2,0,0]=4 10862 B12R2.3280 O=C(COC1CC1)C2CCC2 a47ba9d2d0c6a0431a9fe2c8b8b75d00 [0,0,0,2,0,0|2,0,0]=4 10863 B12R2.3280 O=C(COC1CC1)N2CCC2 5ae877060fc64bd6329e32ff9b3b59b7 [0,0,0,2,0,0|2,0,0]=4 10864 B12R2.3280 O=C(NCC1CC1)N2CCC2 63e06696934a451a23437cebbffa4677 [0,0,0,2,0,0|2,0,0]=4 10865 B12R2.3288 O=C(CC1CC1)NCC2CC2 1ff34b491fcda1f58065e7e016630379 [0,0,0,2,0,0|2,0,0]=4 10866 B12R2.3288 O=C(CCC1CC1)NC2CC2 27abf1a5f8d3712ebe01c0e03f47fbc3 [0,0,0,2,0,0|1,0,0]=3 10867 B12R2.3288 O=C(CNC1CC1)NC2CC2 4de56bcf5e437ed22aa2f6a9f4992071 [0,0,0,2,0,0|2,0,0]=4 10868 B12R2.3288 O=C(COC1CC1)NC2CC2 b3d21f8880e50db4d4e9d61208cad8ff [0,0,0,2,0,0|2,0,0]=4 10869 B12R2.3288 O=C(NCC1CC1)NC2CC2 5c6e8e5c23aa232082de7a3b0c3878f8 [0,0,0,2,0,0|2,0,0]=4 10870 B12R2.1309 CN1CCC1C(=O)NC2CC2 13e6d9f98ef640c9d43dd5dc3c6ee0c1 [0,0,0,2,0,0|2,0,0]=4 10871 B12R2.1309 CN1CC[C@@H]1C(=O)NC2CC2 e231c015ecb77fc9db4693bd207c8362 [0,0,0,2,0,0|2,0,0]=4 10872 B12R2.1309 CN1CC[C@H]1C(=O)NC2CC2 fae6dab21dc327b2e8a790b1a07d3684 [0,0,0,2,0,0|2,0,0]=4 10873 B12R2.3003 CN1CCC1C(=O)N2CCC2 455c822042df46ab987b790038080146 [0,0,0,2,0,0|2,0,0]=4 10874 B12R2.3003 CN1CC[C@@H]1C(=O)N2CCC2 07a801360ff7f4098860dac58ae78465 [0,0,0,2,0,0|2,0,0]=4 10875 B12R2.3003 CN1CC[C@H]1C(=O)N2CCC2 d75b909ce86b87d94a587afbac081366 [0,0,0,2,0,0|2,0,0]=4