0 B11R1.25 C#CC(=O)NCC1CCCC1 19e5630ab56a67a623a78fe4eeb47110 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.25 C#CC(=O)NCC1CCCO1 2889d44d14552cc13c31003ff627244e [0,0,0,0,0,0|1,0,2]=3 2 B11R1.25 C#CC(=O)NC[C@@H]1CCCO1 844c6934857ced8278e92e2164c08c30 [0,0,0,0,0,0|1,0,2]=3 3 B11R1.25 C#CC(=O)NC[C@H]1CCCO1 1a9c613d913ff2f7de5c9e516a3c981a [0,0,0,0,0,0|1,0,2]=3 4 B11R1.25 C#CC(C)OCC1CCCO1 268cd8184a584df3abcaa7a3504caff3 [0,0,0,0,0,0|1,0,3]=4 5 B11R1.25 C#CC(C)OC[C@@H]1CCCO1 6234169ebb6abed2a43d80732cd03e8d [0,0,0,0,0,0|1,0,3]=4 6 B11R1.25 C#CC(C)OC[C@H]1CCCO1 cb1abba8853c27879683fe962a44ec27 [0,0,0,0,0,0|1,0,3]=4 7 B11R1.25 C#C[C@@H](C)OCC1CCCO1 36be0c00f86fb986ab57f18836aaafeb [0,0,0,0,0,0|1,0,3]=4 8 B11R1.25 C#C[C@H](C)OCC1CCCO1 1d2af16bec9976db0e86750dc12c4fd9 [0,0,0,0,0,0|1,0,3]=4 9 B11R1.25 C=C(C=O)OCC1CCCC1 ca47568c77ec94bb1b0ee5b31920d671 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.25 C=C(C=O)OCC1CCCO1 44f1e7b5cad390d3c679ca4a8a22eae5 [0,0,0,0,0,0|2,0,1]=3 11 B11R1.25 C=C(CC)CNC1CCCC1 221d97b4c0b39397eae5f5941a05a155 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.25 C=C(CC)COC1CCCC1 3db826f633a8df150d084661c4ce66d2 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.25 C=C(CC)COC1CCCO1 c9b5c65ffef18801be17937055fbbc00 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.25 C=C(COC1CCCO1)OC e322e9f419bf18e7a6eddc286f1857c9 [0,0,0,0,0,0|4,0,0]=4 15 B11R1.25 C=CC(=O)NCC1CCCC1 913510e2b5f2915dd764d86236e52066 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.25 C=CC(=O)NCC1CCCO1 495ea165cd1ad2fba9464714457cd8eb [0,0,0,0,0,0|1,0,2]=3 17 B11R1.25 C=CC(=O)NC[C@@H]1CCCO1 152cfd83b3800e991ae042e6339b5267 [0,0,0,0,0,0|1,0,2]=3 18 B11R1.25 C=CC(=O)NC[C@H]1CCCO1 2e93351e6b7693bfd6c84c06f95152e8 [0,0,0,0,0,0|1,0,2]=3 19 B11R1.25 C=CC(C)OCC1CCCO1 019a3164c34469fe57473a43512b34f2 [0,0,0,0,0,0|1,0,3]=4 20 B11R1.25 C=CC(C)OC[C@@H]1CCCO1 4a98b706d516d78733de1b8db896b541 [0,0,0,0,0,0|1,0,3]=4 21 B11R1.25 C=CC(C)OC[C@H]1CCCO1 41549e8a2fb1c992470e330b5341502f [0,0,0,0,0,0|1,0,3]=4 22 B11R1.25 C=C[C@H](C)OCC1CCCO1 4938bd6d08ca5ed1fc86269e69e8a854 [0,0,0,0,0,0|1,0,3]=4 23 B11R1.25 CC(C#N)OCC1CCCO1 c1460702de9dd5a176f8572b31eb6889 [0,0,0,0,0,0|2,0,2]=4 24 B11R1.25 CC(C#N)OC[C@@H]1CCCO1 aec3b13ad366f00b6e683d7f7dcc2d54 [0,0,0,0,0,0|2,0,2]=4 25 B11R1.25 CC(C#N)OC[C@H]1CCCO1 6591ecf6167d820289b347ff2d7a8da8 [0,0,0,0,0,0|2,0,2]=4 26 B11R1.25 CC(C=O)OCC1CCCO1 81cbd336f0735889383535040d38cb35 [0,0,0,0,0,0|2,0,2]=4 27 B11R1.25 CC(C=O)OC[C@@H]1CCCO1 8c1a8fa527faa2ea7fb5f3330913f3ba [0,0,0,0,0,0|2,0,2]=4 28 B11R1.25 CC(C=O)OC[C@H]1CCCO1 db304d54f491eb0b1dd35d60195562b8 [0,0,0,0,0,0|2,0,2]=4 29 B11R1.25 CC(CF)OCC1CCCC1 92132d71cb37fd3a7761bbd0006c5ed8 [0,0,0,0,0,0|3,0,1]=4 30 B11R1.25 CC(CF)OCC1CCCO1 3b7ca8302fb07525639d932a7caa65e5 [0,0,0,0,0,0|2,0,1]=3 31 B11R1.25 CC(CO)NCC1CCCO1 f606b6b915a9e76e42e05b0bf0502832 [0,0,0,0,0,0|3,0,1]=4 32 B11R1.25 CC(CO)NC[C@@H]1CCCO1 0b47e81a47f9ddf9330ebf3ca41b936a [0,0,0,0,0,0|3,0,1]=4 33 B11R1.25 CC(CO)NC[C@H]1CCCO1 e4115a6bf27946562bec2d7038df4177 [0,0,0,0,0,0|3,0,1]=4 34 B11R1.25 CC(CS)OCC1CCCC1 9546a67d59cbfa517924297deaef687b [0,0,0,0,0,0|3,0,1]=4 35 B11R1.25 CC(CS)OCC1CCCO1 85d87822bb02b0634e4a3415eeb39b82 [0,0,0,0,0,0|2,0,1]=3 36 B11R1.25 CCC(=O)CNC1CCCC1 76b45c3a0dd534705a0e971da9b0a719 [0,0,0,0,0,0|3,0,0]=3 37 B11R1.25 CCC(=O)CNC1CCOC1 5d9f28079521d44b92063d310bd4fc4e [0,0,0,0,0,0|4,0,0]=4 38 B11R1.25 CCC(=O)CNC1CCSC1 1eb7d5e13e3efc6b59097b7d0916df98 [0,0,0,0,0,0|4,0,0]=4 39 B11R1.25 CCC(=O)CN[C@@H]1CCOC1 7dc2f81201224c459e77fee27fe63266 [0,0,0,0,0,0|4,0,0]=4 40 B11R1.25 CCC(=O)CN[C@H]1CCOC1 c8f57ca53ebd88dee4bbe42f6d481370 [0,0,0,0,0,0|4,0,0]=4 41 B11R1.25 CCC(=O)COC1C=CCC1 ec23246ef581bcbb6677bf3ea7c34ac7 [0,0,0,0,0,0|3,0,1]=4 42 B11R1.25 CCC(=O)COC1CCCC1 f5592f3105f8177e7a774879be0a01c7 [0,0,0,0,0,0|3,0,0]=3 43 B11R1.25 CCC(=O)COC1CCCO1 5a89521f5c9671ced4dc78eda7ee797c [0,0,0,0,0,0|2,0,0]=2 44 B11R1.25 CCC(=O)COC1CCOC1 1e4817b6125006978f98978ab5934a8d [0,0,0,0,0,0|4,0,0]=4 45 B11R1.25 CCC(=O)COC1CCSC1 9019a46df842aebf34a8e4ec7c90535f [0,0,0,0,0,0|4,0,0]=4 46 B11R1.25 CCC(=O)CO[C@@H]1CCOC1 3f9d929c04975229f2e9f164e95124ff [0,0,0,0,0,0|4,0,0]=4 47 B11R1.25 CCC(=O)CO[C@@H]1CCSC1 6e2acb89c3469fedd7061aae2cc8e91c [0,0,0,0,0,0|4,0,0]=4 48 B11R1.25 CCC(=O)CO[C@H]1CCOC1 d5c1e605ecbd5e5be02da3f556c51bcf [0,0,0,0,0,0|4,0,0]=4 49 B11R1.25 CCC(=O)CO[C@H]1CCSC1 aa8333bb82443c75d1121348e2e24fb1 [0,0,0,0,0,0|4,0,0]=4 50 B11R1.25 CCC(=O)NCC1CC=CC1 eb0df1234184579653c0cffb0bdca79e [0,0,0,0,0,0|2,0,2]=4 51 B11R1.25 CCC(=O)NCC1CCCC1 c4f7a0ef14d38131f5bfe5b834523fe9 [0,0,0,0,0,0|2,0,0]=2 52 B11R1.25 CCC(=O)NCC1CCCO1 11b4bb6794a0a5284ed9d6e1fad2ba9e [0,0,0,0,0,0|1,0,0]=1 53 B11R1.25 CCC(=O)NCC1CCOC1 02395e5824ff993a7f87648aa9f6e129 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.25 CCC(=O)NC[C@@H]1CCCO1 b9b6d667c518c694c2bac7ebb91dcb9e [0,0,0,0,0,0|1,0,0]=1 55 B11R1.25 CCC(=O)NC[C@@H]1CCOC1 60d8ce231e5c3b9d8760e185bea35a50 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.25 CCC(=O)NC[C@H]1CCCO1 cf85512407294e366b6e722051353142 [0,0,0,0,0,0|1,0,0]=1 57 B11R1.25 CCC(=O)NC[C@H]1CCOC1 f30f07811c8e8f2337942f88836c4778 [0,0,0,0,0,0|3,0,0]=3 58 B11R1.25 CCC(=O)OCN1CC=CC1 98c3306b3fd6fd7351f7beed6d8e697c [0,0,0,0,0,0|2,0,2]=4 59 B11R1.25 CCC(=O)OCN1CCSC1 c6d500603d3d31ea740e8af3990c2944 [0,0,0,0,0,0|3,0,0]=3 60 B11R1.25 CCC(C)COC1CCCO1 8eddd58ba52bf906ef267dd68e62cf5f [0,0,0,0,0,0|3,0,1]=4 61 B11R1.25 CCC(C)NCC1CCCC1 c06a3a5583b028aeae26700575a134ae [0,0,0,0,0,0|3,0,1]=4 62 B11R1.25 CCC(C)NCC1CCCO1 bb82c483f626d78c2ebcfa1ff3cf5921 [0,0,0,0,0,0|2,0,1]=3 63 B11R1.25 CCC(C)NC[C@@H]1CCCO1 7796ea75a8919789835990d9e97b2b87 [0,0,0,0,0,0|2,0,1]=3 64 B11R1.25 CCC(C)NC[C@H]1CCCO1 cfec3d2e8a27bf012d13504571405775 [0,0,0,0,0,0|2,0,1]=3 65 B11R1.25 CCC(C)OCC1C=CCC1 18175f137ce80a5663d2848bf00ac5b7 [0,0,0,0,0,0|2,0,2]=4 66 B11R1.25 CCC(C)OCC1CCCC1 2f12543a32cb522b428f27964a4e9aef [0,0,0,0,0,0|2,0,1]=3 67 B11R1.25 CCC(C)OCC1CCCO1 d4b215de78532ff9cea366253338e108 [0,0,0,0,0,0|1,0,1]=2 68 B11R1.25 CCC(C)OCC1CCCS1 9f8bd7cbda692ad29d0995559d3e3479 [0,0,0,0,0,0|1,1,1]=3 69 B11R1.25 CCC(C)OCC1CCOC1 a4b73d69bb84fcb4b82799ece92ab6e4 [0,0,0,0,0,0|3,0,1]=4 70 B11R1.25 CCC(C)OCN1CCCC1 53bb80d9f4c4be9d06c5346802a39197 [0,0,0,0,0,0|3,0,1]=4 71 B11R1.25 CCC(C)OC[C@@H]1CCCO1 9d87c24db442f52f8c1bfcae0666166a [0,0,0,0,0,0|1,0,1]=2 72 B11R1.25 CCC(C)OC[C@@H]1CCOC1 1375b42fc0b70116059fe302e07d9833 [0,0,0,0,0,0|3,0,1]=4 73 B11R1.25 CCC(C)OC[C@H]1CCCO1 5c59077be51da46bbd72f71088d3e0df [0,0,0,0,0,0|1,0,1]=2 74 B11R1.25 CCC(C)OC[C@H]1CCOC1 323ed90642c4da0f0f913de11a2f20ff [0,0,0,0,0,0|3,0,1]=4 75 B11R1.25 CCN(C)CCC1CCCC1 b93500d11a676ccdc22704cfefd4a70c [0,0,0,0,0,0|4,0,0]=4 76 B11R1.25 CCN(C)CCC1CCCO1 b739f941604aca7822207b1b41cddc52 [0,0,0,0,0,0|3,0,0]=3 77 B11R1.25 CC[C@@H](C)COC1CCCO1 fe4d7dfe02547653c71514f9530a1224 [0,0,0,0,0,0|3,0,1]=4 78 B11R1.25 CC[C@@H](C)NCC1CCCC1 dcda174862540a8d4a422f5468d9ebc1 [0,0,0,0,0,0|3,0,1]=4 79 B11R1.25 CC[C@@H](C)NCC1CCCO1 7cc6324efe23ce527f28b0328604e2d3 [0,0,0,0,0,0|2,0,1]=3 80 B11R1.25 CC[C@@H](C)OCC1CCCC1 13fec55c187260c1660e170333da6324 [0,0,0,0,0,0|2,0,1]=3 81 B11R1.25 CC[C@@H](C)OCC1CCCO1 b6c0e1c892a8eab69b7a692fc82464e5 [0,0,0,0,0,0|1,0,1]=2 82 B11R1.25 CC[C@@H](C)OCC1CCOC1 f4720a6b398c7d62d7aed2a49e821219 [0,0,0,0,0,0|3,0,1]=4 83 B11R1.25 CC[C@H](C)COC1CCCO1 092dcb1749b2e36d206d7d7085e68858 [0,0,0,0,0,0|3,0,1]=4 84 B11R1.25 CC[C@H](C)NCC1CCCC1 90bcca65aa8744f0f10e04d8f9133b2b [0,0,0,0,0,0|3,0,1]=4 85 B11R1.25 CC[C@H](C)NCC1CCCO1 28098c079b75c39f6e0036393885b99a [0,0,0,0,0,0|2,0,1]=3 86 B11R1.25 CC[C@H](C)OCC1CCCC1 0d101bde4ae5e53f0d43f7b5ab5c1d19 [0,0,0,0,0,0|2,0,1]=3 87 B11R1.25 CC[C@H](C)OCC1CCCO1 d5a0dcf09235da78225e3235adde362d [0,0,0,0,0,0|1,0,1]=2 88 B11R1.25 CC[C@H](C)OCC1CCOC1 49ddeb2a369eb758018569938c256dab [0,0,0,0,0,0|3,0,1]=4 89 B11R1.25 CNC(=O)CNC1CCCC1 b5948cfc8f68ee9e7ce479dd3670fe33 [0,0,0,0,0,0|4,0,0]=4 90 B11R1.25 CNC(=O)COC1CCCC1 5d981b3872cdec3b1a66c1fafc01c71b [0,0,0,0,0,0|4,0,0]=4 91 B11R1.25 CNC(=O)COC1CCCO1 e76c51a97bc2230919a638326196f5ce [0,0,0,0,0,0|3,0,0]=3 92 B11R1.25 COC(=O)CNC1CCCC1 b87ff11671c5cc80045ee4f67f2c7d8b [0,0,0,0,0,0|4,0,0]=4 93 B11R1.25 COC(=O)COC1CCCC1 085020e1b123128ec3ee74cb59ea108d [0,0,0,0,0,0|4,0,0]=4 94 B11R1.25 COC(=O)COC1CCCO1 488ce1775fb1ab5ed24680c3d56b6b00 [0,0,0,0,0,0|3,0,0]=3 95 B11R1.25 COC(=O)OCN1CCSC1 ed056ad0cdbcf4c94fc833d47f4fa510 [0,0,0,0,0,0|4,0,0]=4 96 B11R1.25 C[C@@H](CO)NCC1CCCO1 8fdc02e2cab7c988d66f37625ac50e74 [0,0,0,0,0,0|3,0,1]=4 97 B11R1.25 C[C@@H](CO)NC[C@@H]1CCCO1 5cf5fa462ab83ea9ce0ec64d3c1e45c2 [0,0,0,0,0,0|3,0,1]=4 98 B11R1.25 C[C@@H](CO)NC[C@H]1CCCO1 67ad5288c041d0b0be76d5d326fc8828 [0,0,0,0,0,0|3,0,1]=4 99 B11R1.25 C[C@H](C=O)OCC1CCCO1 a78e8cc8bd41c66465a9a3709b365c57 [0,0,0,0,0,0|2,0,2]=4 100 B11R1.25 C[C@H](C=O)OC[C@@H]1CCCO1 e588548d76b0cb713ac35988754ca3b9 [0,0,0,0,0,0|2,0,2]=4 101 B11R1.25 C[C@H](C=O)OC[C@H]1CCCO1 30d6ae5ab3703079edfc50055b1d962d [0,0,0,0,0,0|2,0,2]=4 102 B11R1.25 C[C@H](CO)NCC1CCCO1 dbde9a45b2e14fcb8fa74f3e5280ec6b [0,0,0,0,0,0|3,0,1]=4 103 B11R1.25 C[C@H](CO)NC[C@@H]1CCCO1 a3f98df562983512e22208cc140339da [0,0,0,0,0,0|3,0,1]=4 104 B11R1.25 C[C@H](CO)NC[C@H]1CCCO1 1e7541c62d444744fcfdfff7c1544109 [0,0,0,0,0,0|3,0,1]=4 105 B11R1.25 C[C@H](CS)OCC1CCCC1 12bee09d5374d66e9483677de99a4162 [0,0,0,0,0,0|3,0,1]=4 106 B11R1.25 C[C@H](CS)OCC1CCCO1 383093e50b1d27310fcd30efaab4498b [0,0,0,0,0,0|2,0,1]=3 107 B11R1.25 N#CC(F)OCC1CCCO1 b8f832cf5e0d9d33f5d15771d1107a93 [0,0,0,0,0,0|2,0,2]=4 108 B11R1.25 N#CC(F)OC[C@@H]1CCCO1 9974f079689e44d55e52c217c42758b4 [0,0,0,0,0,0|2,0,2]=4 109 B11R1.25 N#CC(F)OC[C@H]1CCCO1 02d52aecd58e0e4f8c4da44da0fb27f3 [0,0,0,0,0,0|2,0,2]=4 110 B11R1.25 O=C(CF)NCC1CCCC1 99bf786d6f4caaa837fed42ace4d07b6 [0,0,0,0,0,0|3,0,0]=3 111 B11R1.25 O=C(CF)NCC1CCCO1 171856a2d3d7cfb63016b1b44e1189a9 [0,0,0,0,0,0|2,0,0]=2 112 B11R1.25 O=C(CF)NCC1CCOC1 f099376968b9213811d650349d7284a7 [0,0,0,0,0,0|4,0,0]=4 113 B11R1.25 O=C(CF)NC[C@@H]1CCCO1 f153bc7611a63347c48a5758e08b8fef [0,0,0,0,0,0|2,0,0]=2 114 B11R1.25 O=C(CF)NC[C@@H]1CCOC1 3848fcd7924b5743a125541d2bced3b2 [0,0,0,0,0,0|4,0,0]=4 115 B11R1.25 O=C(CF)NC[C@H]1CCCO1 1b4193cab798555c29b052109d7e3852 [0,0,0,0,0,0|2,0,0]=2 116 B11R1.25 O=C(CF)NC[C@H]1CCOC1 2e96b2f70f5ee920eff3c22148521719 [0,0,0,0,0,0|4,0,0]=4 117 B11R1.25 O=C(CO)CNC1CCCC1 d04a6ed6af16e8c43144caf464503e98 [0,0,0,0,0,0|4,0,0]=4 118 B11R1.25 O=C(CO)NCC1CCCC1 f7ac91afe6b6e514190cbfb9dcc5af90 [0,0,0,0,0,0|3,0,0]=3 119 B11R1.25 O=C(CO)NCC1CCCO1 b1a2e6b1ddf82d78b13eefaf2d170353 [0,0,0,0,0,0|2,0,0]=2 120 B11R1.25 O=C(CO)NCC1CCOC1 eab29b4d8716d6d0f87dc0141843f021 [0,0,0,0,0,0|4,0,0]=4 121 B11R1.25 O=C(CO)NC[C@@H]1CCCO1 c0a62b388b236d3289ff2f16373b4946 [0,0,0,0,0,0|2,0,0]=2 122 B11R1.25 O=C(CO)NC[C@@H]1CCOC1 0dbe4b7b463ddf225b4e362a3958e630 [0,0,0,0,0,0|4,0,0]=4 123 B11R1.25 O=C(CO)NC[C@H]1CCCO1 094ef3167d1e3f0ba1564141941f0a38 [0,0,0,0,0,0|2,0,0]=2 124 B11R1.25 O=C(CO)NC[C@H]1CCOC1 884dcfcb16e122c8f6658a4974a5da24 [0,0,0,0,0,0|4,0,0]=4 125 B11R1.25 O=C(CS)NCC1CCCC1 8fb56c7ce7e1ab96cfce8ab70e30d7b0 [0,0,0,0,0,0|3,0,0]=3 126 B11R1.25 O=C(CS)NCC1CCCO1 b1d089a15bc44d45fa62294f52fd3e82 [0,0,0,0,0,0|2,0,0]=2 127 B11R1.25 O=C(CS)NCC1CCOC1 f768c094da051309ac94b74317f5a37a [0,0,0,0,0,0|4,0,0]=4 128 B11R1.25 O=C(CS)NC[C@@H]1CCCO1 800c0a94bc3baa900c68fa51485eb2d0 [0,0,0,0,0,0|2,0,0]=2 129 B11R1.25 O=C(CS)NC[C@@H]1CCOC1 f05c5c3950c21c0277e5b944ea5f4127 [0,0,0,0,0,0|4,0,0]=4 130 B11R1.25 O=C(CS)NC[C@H]1CCCO1 5893c9611d9226ab8b47bf620357a39c [0,0,0,0,0,0|2,0,0]=2 131 B11R1.25 O=C(CS)NC[C@H]1CCOC1 46977bf5941c5128aca20086c8a6b48a [0,0,0,0,0,0|4,0,0]=4 132 B11R1.25 O=CC(=O)NCC1CCCC1 4b289dc4922d113792ba2f006dfe3859 [0,0,0,0,0,0|3,0,1]=4 133 B11R1.25 O=CC(=O)NCC1CCCO1 91775e100e8322a6341849d28da29a85 [0,0,0,0,0,0|2,0,1]=3 134 B11R1.25 O=CC(=O)NC[C@@H]1CCCO1 0e7087bd0b03ae18dd6bd0d104c2d517 [0,0,0,0,0,0|2,0,1]=3 135 B11R1.25 O=CC(=O)NC[C@H]1CCCO1 70ea4c7e737f110112849eb57c90af93 [0,0,0,0,0,0|2,0,1]=3 136 B10R1.21 BrCCNCC1CCCO1 c5dca22b5fbf16e64db6c0a7523a6dd6 [1,0,0,0,0,0|2,0,1]=4 137 B10R1.21 C#CCOCC1CCCO1 9058943e4b64975584a1e03c5f82dd53 [1,0,0,0,0,0|0,0,3]=4 138 B10R1.21 C#CCOC[C@@H]1CCCO1 25adccf09b2f7d66108305f95af2a08d [1,0,0,0,0,0|0,0,3]=4 139 B10R1.21 C#CCOC[C@H]1CCCO1 7e2d49ca6ba71666a184f8916c0ed837 [1,0,0,0,0,0|0,0,3]=4 140 B10R1.21 C/C=C/COC1CCCO1 065398478186a46e3ebaa26095b8a6f8 [1,0,0,0,0,0|2,0,1]=4 141 B10R1.21 C/C=C\COC1CCCO1 236cfb7898a43610c2ad370e000ea3a3 [1,0,0,0,0,0|2,0,1]=4 142 B10R1.21 C=CCOCC1CCCO1 cbc50a2505d1c5d42a7c19e596b741ef [1,0,0,0,0,0|0,0,3]=4 143 B10R1.21 C=CCOC[C@@H]1CCCO1 124dc32d173490769596cbcea6f459d9 [1,0,0,0,0,0|0,0,3]=4 144 B10R1.21 C=CCOC[C@H]1CCCO1 2ff347c9ba51e6d6c992d821135260a3 [1,0,0,0,0,0|0,0,3]=4 145 B10R1.21 CCCCOC1CCCO1 0895124ff10908b56ac50a853beca9be [1,0,0,0,0,0|2,0,1]=4 146 B10R1.21 CCCNCC1CCCC1 6d20394155d3df530face2c16c9304e6 [1,0,0,0,0,0|2,0,1]=4 147 B10R1.21 CCCNCC1CCCO1 17989f20eff3e86e34afb456a2bc0a94 [1,0,0,0,0,0|1,0,1]=3 148 B10R1.21 CCCNC[C@@H]1CCCO1 571f33c391aa41dc09b1462e2c98ed58 [1,0,0,0,0,0|1,0,1]=3 149 B10R1.21 CCCNC[C@H]1CCCO1 3cd25e92767d9a7ad9b4ef71d8fc9b8d [1,0,0,0,0,0|1,0,1]=3 150 B10R1.21 CCCOCC1C=CCC1 432e0f58c9f3ac15b57d888692e1e4d2 [1,0,0,0,0,0|1,0,2]=4 151 B10R1.21 CCCOCC1CCCC1 9ec4067f6ba1a091a75824fa347b24bd [1,0,0,0,0,0|1,0,1]=3 152 B10R1.21 CCCOCC1CCCO1 baa8ccf330aa1744d961c9756c0cf907 [1,0,0,0,0,0|0,0,1]=2 153 B10R1.21 CCCOCC1CCCS1 9a600e1f0e584fadde1bd69acf5304ee [1,0,0,0,0,0|0,1,1]=3 154 B10R1.21 CCCOCC1CCOC1 49b407ef4c1e349558a7fb7e1999afc3 [1,0,0,0,0,0|2,0,1]=4 155 B10R1.21 CCCOCN1CCCC1 e27d783ea1fbc8e4f86e2dc316632960 [1,0,0,0,0,0|2,0,1]=4 156 B10R1.21 CCCOC[C@@H]1CCCO1 18d024a7dbc4d7db27483c4a6b14c89d [1,0,0,0,0,0|0,0,1]=2 157 B10R1.21 CCCOC[C@@H]1CCOC1 a0282af3b76efc34eba5e39ada717a60 [1,0,0,0,0,0|2,0,1]=4 158 B10R1.21 CCCOC[C@H]1CCCO1 daa168017d9d88a3a9a0c35f3b64adc9 [1,0,0,0,0,0|0,0,1]=2 159 B10R1.21 CCCOC[C@H]1CCOC1 17c4f619723f7d6980f2b938a7b156c8 [1,0,0,0,0,0|2,0,1]=4 160 B10R1.21 CCNCCC1CCCC1 4298e7da1f2a581aa4744ee10a845ea5 [1,0,0,0,0,0|3,0,0]=4 161 B10R1.21 CCNCCC1CCCO1 ec581c3d19e3b2a023c62cdb86e4dc14 [1,0,0,0,0,0|2,0,0]=3 162 B10R1.21 CCOCCC1CCCC1 635c7a31aec6fa4a0699c0f9f96cad8a [1,0,0,0,0,0|3,0,0]=4 163 B10R1.21 CCOCCC1CCCO1 259f96ba320a3b49deb223b863f40fa3 [1,0,0,0,0,0|2,0,0]=3 164 B10R1.21 CCOCOC1CCCO1 7b13a9cd2fcc5eb6415186b3097254aa [1,0,0,0,0,0|3,0,0]=4 165 B10R1.21 COCNCC1CCCO1 cdab02b7dc06c3052e01a065f2078cd0 [1,0,0,0,0,0|2,0,1]=4 166 B10R1.21 COCNC[C@@H]1CCCO1 4a5d890ae2a3fa318e85e92ae56b67c0 [1,0,0,0,0,0|2,0,1]=4 167 B10R1.21 COCNC[C@H]1CCCO1 ba028de97fb429b67f3a19200b8eacf1 [1,0,0,0,0,0|2,0,1]=4 168 B10R1.21 COCOCC1CCCC1 461d5d83c61018a3c89261fac5bac84e [1,0,0,0,0,0|2,0,1]=4 169 B10R1.21 COCOCC1CCCO1 adee50c03699781c9c33aaf8e6975a99 [1,0,0,0,0,0|1,0,1]=3 170 B10R1.21 COCOCC1CCCS1 def2fbaaef745bb3f84f5804512d09eb [1,0,0,0,0,0|1,1,1]=4 171 B10R1.21 COCOC[C@@H]1CCCO1 b0e9c434588adac303cfa34ee8a06c96 [1,0,0,0,0,0|1,0,1]=3 172 B10R1.21 COCOC[C@H]1CCCO1 b0a34ad56ef79bf603cfa0ec5211b87b [1,0,0,0,0,0|1,0,1]=3 173 B10R1.21 CSCNCC1CCCO1 1568a8cff25c9e3e16bd5eb8be2089a8 [1,0,0,0,0,0|2,0,1]=4 174 B10R1.21 CSCNC[C@@H]1CCCO1 7879f18ff664d7314ef0e1314ccccdc9 [1,0,0,0,0,0|2,0,1]=4 175 B10R1.21 CSCNC[C@H]1CCCO1 0727237e08f9bc7f351890a8f1054484 [1,0,0,0,0,0|2,0,1]=4 176 B10R1.21 CSCOCC1CCCC1 2e9d1aa6c4eec9a4bf4c442653d1fac0 [1,0,0,0,0,0|2,0,1]=4 177 B10R1.21 CSCOCC1CCCO1 c07114c7cff494063cca095e199cdb7f [1,0,0,0,0,0|1,0,1]=3 178 B10R1.21 CSCOCC1CCCS1 75c1a9ccbe49c4863854f69bb9406aeb [1,0,0,0,0,0|1,1,1]=4 179 B10R1.21 CSCOC[C@@H]1CCCO1 8bdd2f629df06a8b10fc95fa2c114b58 [1,0,0,0,0,0|1,0,1]=3 180 B10R1.21 CSCOC[C@H]1CCCO1 d058a48ff8f6f79e0e6787b25ede9ebb [1,0,0,0,0,0|1,0,1]=3 181 B10R1.21 FCCNCC1CCCO1 9b546513e6ccca2a94fa39aea6a34cac [1,0,0,0,0,0|2,0,1]=4 182 B10R1.21 FCCNC[C@@H]1CCCO1 fe972d894fe33310f944cfcac93c3c85 [1,0,0,0,0,0|2,0,1]=4 183 B10R1.21 FCCNC[C@H]1CCCO1 22d8060c83da242e2f7cf913da972a58 [1,0,0,0,0,0|2,0,1]=4 184 B10R1.21 FCCOCC1CCCC1 d888ffec0068cd43d0efabd20a06333c [1,0,0,0,0,0|2,0,1]=4 185 B10R1.21 FCCOCC1CCCO1 d075b5cd45c3f168345ed819a5fed7ce [1,0,0,0,0,0|1,0,1]=3 186 B10R1.21 FCCOCC1CCCS1 859a7c90c5d97bf8867157bf39132c1d [1,0,0,0,0,0|1,1,1]=4 187 B10R1.21 FCCOC[C@@H]1CCCO1 1920db474ddd58adbc7b5fea666f8c85 [1,0,0,0,0,0|1,0,1]=3 188 B10R1.21 FCCOC[C@H]1CCCO1 15aee51715dfa28542faa4663327e33d [1,0,0,0,0,0|1,0,1]=3 189 B10R1.21 FCNCCC1CCCO1 5e1e26e08c59f11090a1b4168ad9358e [1,0,0,0,0,0|3,0,0]=4 190 B10R1.21 FCOCCC1CCCO1 063a4280bb69071a26631342d9917f89 [1,0,0,0,0,0|3,0,0]=4 191 B10R1.21 ICCNCC1CCCO1 8a0f928eadda755fc5bd21248abca8b5 [1,0,0,0,0,0|2,0,1]=4 192 B10R1.21 N#CCOCC1CCCO1 54aaf8e694ded03f4142763c01dabb84 [1,0,0,0,0,0|1,0,2]=4 193 B10R1.21 N#CCOC[C@@H]1CCCO1 d58a79671e34de5c9fd74c537f9cd892 [1,0,0,0,0,0|1,0,2]=4 194 B10R1.21 N#CCOC[C@H]1CCCO1 f7d219226faa4142345f2da63ff01f38 [1,0,0,0,0,0|1,0,2]=4 195 B10R1.21 O=CCOCC1CCCO1 9b305258563b1d197dcf6a0340481b7d [1,0,0,0,0,0|1,0,2]=4 196 B10R1.21 O=CCOC[C@@H]1CCCO1 22ef27558e0db554e0e97363ba4fb874 [1,0,0,0,0,0|1,0,2]=4 197 B10R1.21 O=CCOC[C@H]1CCCO1 e795ea4249def3aedce2b5fb22800920 [1,0,0,0,0,0|1,0,2]=4 198 B10R1.21 OCCNCC1CCCO1 71b709f6ad78fb32e569a1892c5bafaa [1,0,0,0,0,0|2,0,1]=4 199 B10R1.21 OCCNC[C@@H]1CCCO1 203f7b334dcd34a221858f60c1dfb172 [1,0,0,0,0,0|2,0,1]=4 200 B10R1.21 OCCNC[C@H]1CCCO1 a9ac46796a0d30b60acba83a218b5def [1,0,0,0,0,0|2,0,1]=4 201 B10R1.21 OCNCCC1CCCO1 4ddd9d929f4c4e84c48a48abef949b18 [1,0,0,0,0,0|3,0,0]=4 202 B10R1.21 SCCNCC1CCCO1 fae54df499f3241075c9558ba951e144 [1,0,0,0,0,0|2,0,1]=4 203 B10R1.21 SCCNC[C@@H]1CCCO1 1d32e11e770a9f8fcf7c187a0ae17048 [1,0,0,0,0,0|2,0,1]=4 204 B10R1.21 SCCNC[C@H]1CCCO1 875f7c90e0e0ddd02d70b8f35a53a3a0 [1,0,0,0,0,0|2,0,1]=4 205 B10R1.21 SCCOCC1CCCC1 c6070ec10c01f53d403cb6296d04a038 [1,0,0,0,0,0|2,0,1]=4 206 B10R1.21 SCCOCC1CCCO1 17a43711f067a14a26f89645f266da1e [1,0,0,0,0,0|1,0,1]=3 207 B10R1.21 SCCOCC1CCCS1 67d906c77086234b71015d59c73273f6 [1,0,0,0,0,0|1,1,1]=4 208 B10R1.21 SCCOC[C@@H]1CCCO1 5c2967e29ef519f2469aad93149a84c8 [1,0,0,0,0,0|1,0,1]=3 209 B10R1.21 SCCOC[C@H]1CCCO1 29973a0cd2e31e66fd812123ea55baaf [1,0,0,0,0,0|1,0,1]=3 210 B10R1.66 C=C(C)COC1CCCO1 9bcabb6c3559b4526cef6761c5109c8d [1,0,0,0,0,0|3,0,0]=4 211 B10R1.66 CC(=O)CNC1CCCC1 982a895596cb411344b5d5d1059736c0 [1,0,0,0,0,0|3,0,0]=4 212 B10R1.66 CC(=O)COC1CCCC1 b4a4ed405f24170df2e680b9b91276af [1,0,0,0,0,0|3,0,0]=4 213 B10R1.66 CC(=O)NCC1CCCC1 4b033df2d5e9c8dc815e6cf1e844965d [1,0,0,0,0,0|2,0,0]=3 214 B10R1.66 CC(=O)NCC1CCCO1 d796e1bcbe3ecee47a944fbd2b1407c2 [1,0,0,0,0,0|1,0,0]=2 215 B10R1.66 CC(=O)NCC1CCOC1 bce87e20d96a11e99377f7808ef9095b [1,0,0,0,0,0|3,0,0]=4 216 B10R1.66 CC(=O)NC[C@@H]1CCCO1 10aff43ea33a655572bc7f4810244226 [1,0,0,0,0,0|1,0,0]=2 217 B10R1.66 CC(=O)NC[C@@H]1CCOC1 ec1b203015848b3faf316ffb2ea83643 [1,0,0,0,0,0|3,0,0]=4 218 B10R1.66 CC(=O)NC[C@H]1CCCO1 c97b710d0be598ef27ac8c5431018722 [1,0,0,0,0,0|1,0,0]=2 219 B10R1.66 CC(=O)NC[C@H]1CCOC1 6ae094c27ca10209607a242335b1813d [1,0,0,0,0,0|3,0,0]=4 220 B10R1.66 CC(=O)OCN1CCSC1 4139c31a074537b464d10aa0725d07a3 [1,0,0,0,0,0|3,0,0]=4 221 B10R1.66 CC(C)NCC1CCCO1 4b25bc8de68c5cccfefaf7ab6acaec7b [1,0,0,0,0,0|2,0,1]=4 222 B10R1.66 CC(C)NC[C@@H]1CCCO1 4426469c4377958d7e3df4438da767c0 [1,0,0,0,0,0|2,0,1]=4 223 B10R1.66 CC(C)NC[C@H]1CCCO1 f9127e03268a493ffc938c95b539931d [1,0,0,0,0,0|2,0,1]=4 224 B10R1.66 CC(C)OCC1CCCC1 f73fb5f6ffcc78b54bf60e6e5169f56c [1,0,0,0,0,0|2,0,1]=4 225 B10R1.66 CC(C)OCC1CCCO1 dc4f8d95f712b7cad3d79bf4638edd07 [1,0,0,0,0,0|1,0,1]=3 226 B10R1.66 CC(C)OCC1CCCS1 ac05d7e7bb96c1338050bfb300c753d7 [1,0,0,0,0,0|1,1,1]=4 227 B10R1.66 CC(C)OC[C@@H]1CCCO1 68e4bd5e239bef928187ae9198e2984e [1,0,0,0,0,0|1,0,1]=3 228 B10R1.66 CC(C)OC[C@H]1CCCO1 9ae01c9be9a744781eaf8509d7650ba3 [1,0,0,0,0,0|1,0,1]=3 229 B10R1.66 NC(=O)COC1CCCO1 572c264c8f8acc8112572869238c174e [1,0,0,0,0,0|3,0,0]=4 230 B10R1.66 O=C(O)COC1CCCO1 9af41fcd5b2bf45f089ffbb228468f59 [1,0,0,0,0,0|3,0,0]=4 231 B12R1.15 C#CC(=O)NC(C)C1CCCO1 6dd5a9dd2a2c353978341344f0291b24 [0,1,0,0,0,0|1,0,2]=4 232 B12R1.15 C#CC(=O)N[C@@H](C)[C@@H]1CCCO1 e234d5874d06a9241eeaa1a5441702d9 [0,1,0,0,0,0|1,0,2]=4 233 B12R1.15 C=CC(=O)NC(C)C1CCCO1 8496b7e1750c407bfc702ac882e878f0 [0,1,0,0,0,0|1,0,2]=4 234 B12R1.15 C=CC(=O)N[C@@H](C)[C@@H]1CCCO1 8784386e587f21f5be17a3dcf3190caa [0,1,0,0,0,0|1,0,2]=4 235 B12R1.15 CC(NC(=O)C=O)C1CCCO1 388de663a33c1a92532e60a8326bbe3e [0,1,0,0,0,0|2,0,1]=4 236 B12R1.15 CC(NC(=O)CF)C1CCCC1 0b078398ba24e6ed25f46f39cc9fe46c [0,1,0,0,0,0|3,0,0]=4 237 B12R1.15 CC(NC(=O)CO)C1CCCC1 037272dadbd5152377ec9780a4e80b7b [0,1,0,0,0,0|3,0,0]=4 238 B12R1.15 CC(NC(=O)CS)C1CCCC1 5a6787d17f0b5ee305c232c3d28b99cb [0,1,0,0,0,0|3,0,0]=4 239 B12R1.15 CCC(=O)CN(C)C1CCCC1 2962ac12afa6f93b5a81ef5f30697dec [0,1,0,0,0,0|3,0,0]=4 240 B12R1.15 CCC(=O)NC(C)C1CCCC1 40c175cbc9183c0880a77facb8ecc023 [0,1,0,0,0,0|2,0,0]=3 241 B12R1.15 CCC(=O)N[C@H](C)C1CCOC1 6b1c86961616b9840425de934a407cf2 [0,1,0,0,0,0|3,0,0]=4 242 B12R1.15 CCC(C)NC(C)C1CCCO1 c6ece712bb442932c46f9eff4c9132af [0,1,0,0,0,0|2,0,1]=4 243 B12R1.15 CCC(C)N[C@@H](C)[C@@H]1CCCO1 c8066d2167f585e0f2d42008dc4ec879 [0,1,0,0,0,0|2,0,1]=4 244 B12R1.15 CCC(C)OC(C)C1CCCC1 316c0e5894ae7e830a2df08f07f1a4b7 [0,1,0,0,0,0|2,0,1]=4 245 B12R1.15 CCC(C)O[C@H](C)[C@H]1CCCO1 db3d97fa608c0c92981553065844c15e [0,1,0,0,0,0|1,0,1]=3 246 B12R1.15 C[C@H](NC(=O)C=O)[C@@H]1CCCO1 fd2517438f9336ac7d4cc79d8df40121 [0,1,0,0,0,0|2,0,1]=4 247 B12R1.26 CCC(=O)CNC1CCC(C1)C c3e4d50001c22111b30b6a7121a18e1c [0,1,0,0,0,0|3,0,0]=4 248 B12R1.26 CCC(=O)CNC1CCC(C1)O 504e54077eb965676ac43129c0b4f043 [0,1,0,0,0,0|3,0,0]=4 249 B12R1.26 CCC(=O)CN[C@@H]1CC[C@@H](C1)O 098f6d48ba60b9a49d1dfbabdb6d64a8 [0,1,0,0,0,0|3,0,0]=4 250 B12R1.26 CCC(=O)CN[C@@H]1CC[C@H](C1)O 8d7546343eed00be241462120103632f [0,1,0,0,0,0|3,0,0]=4 251 B12R1.26 CCC(=O)CN[C@H]1CC[C@@H](C1)O 8a333bf1083e4af22be26ff14cbeef19 [0,1,0,0,0,0|3,0,0]=4 252 B12R1.26 CCC(=O)CN[C@H]1CC[C@H](C1)O 6ec2cc1107cab142e7d49dabb90b0c7b [0,1,0,0,0,0|3,0,0]=4 253 B12R1.26 CCC(=O)COC1CCC(C1)C 1b300b2b44c31184b061c19f860db8fe [0,1,0,0,0,0|3,0,0]=4 254 B12R1.26 CCC(=O)COC1CCC(C1)F a74cc086b7ad764a0ba7a4b2a3c1d585 [0,1,0,0,0,0|3,0,0]=4 255 B12R1.26 CCC(=O)NCC1CCC(=O)N1 3faf7bf57ac82fa2f448287cc37b9aa4 [0,1,0,0,0,0|2,0,1]=4 256 B12R1.26 CCC(=O)NCC1CCC(C1)O 451ae69fa679f5f0a80f05ff1a0a549d [0,1,0,0,0,0|2,0,0]=3 257 B12R1.26 CCC(=O)NCC1CCN(C1)C fe91e22beec028479a63c6bb1ffd7f21 [0,1,0,0,0,0|3,0,0]=4 258 B12R1.26 CCC(=O)NC[C@@H]1CCC(=O)N1 429f83feb83c3f394285faf7568da81b [0,1,0,0,0,0|2,0,1]=4 259 B12R1.26 CCC(=O)NC[C@@H]1CCN(C1)C 085b01143daf69742d78d80d8483212c [0,1,0,0,0,0|3,0,0]=4 260 B12R1.26 CCC(=O)NC[C@H]1CCC(=O)N1 ab6f0b7b47bbf2ddeeab3ba1b792af70 [0,1,0,0,0,0|2,0,1]=4 261 B12R1.26 CCC(=O)NC[C@H]1CCN(C1)C 7af2bfeef87a92a643b538db67ee3a50 [0,1,0,0,0,0|3,0,0]=4 262 B12R1.26 CCC(=O)OCN1CCC(C1)C a3bc142bf5b4b9ed8dcd1bf30a6ca766 [0,1,0,0,0,0|2,0,0]=3 263 B12R1.26 CCC(=O)OCN1CCC(C1)F c128a3693b6619e3da549e6cab17db29 [0,1,0,0,0,0|2,0,0]=3 264 B12R1.26 CCC(=O)OCN1CCC(C1)O 6d481ad352357328138689a2006541c9 [0,1,0,0,0,0|2,0,0]=3 265 B12R1.26 CCC(=O)OCN1CCN(C1)C 828b5db31a03a85cb4988fbbf6fad6a2 [0,1,0,0,0,0|3,0,0]=4 266 B12R1.26 CCC(=O)OCN1CC[C@@H](C1)F 8753f439f8dd0adb9438558c94d95c09 [0,1,0,0,0,0|2,0,0]=3 267 B12R1.26 CCC(=O)OCN1CC[C@@H](C1)O 93b9dfa16d5962c9d7cb4bde96e87874 [0,1,0,0,0,0|2,0,0]=3 268 B12R1.26 CCC(=O)OCN1CC[C@H](C1)F 98f24ab2106c981f29d56c1eeb289d9f [0,1,0,0,0,0|2,0,0]=3 269 B12R1.26 CCC(=O)OCN1CC[C@H](C1)O c6e3baec382890986b2b1793ff83b81d [0,1,0,0,0,0|2,0,0]=3 270 B12R1.26 CCC(C)OCC1CCC(=O)O1 5d0f3203b8bcf6d0d350c9f463d42330 [0,1,0,0,0,0|1,0,2]=4 271 B12R1.26 CCC(C)OCC1CCC(C1)C 05203306c366313e1f5883f7639466c3 [0,1,0,0,0,0|2,0,1]=4 272 B12R1.26 CCC(C)OCC1CCC(C1)F adb61957296b740ee593ffb860e25c35 [0,1,0,0,0,0|2,0,1]=4 273 B12R1.26 CCC(C)OCC1CCC(O1)C eadeed10ada0e7c42b54f9eda683083e [0,1,0,0,0,0|1,0,1]=3 274 B12R1.26 CCC(C)OC[C@@H]1CCC(=O)O1 572788763e4fb13407722258f3051b04 [0,1,0,0,0,0|1,0,2]=4 275 B12R1.26 CCC(C)OC[C@@H]1CC[C@@H](O1)C 44ce057743c8cb5aceeed7eb61efe20c [0,1,0,0,0,0|1,0,1]=3 276 B12R1.26 CCC(C)OC[C@@H]1CC[C@H](C1)F 9136c160be706dc9c5e40117cb501438 [0,1,0,0,0,0|2,0,1]=4 277 B12R1.26 CCC(C)OC[C@H]1CCC(=O)O1 6fd35ba63656a1b2d014ab2eb143652e [0,1,0,0,0,0|1,0,2]=4 278 B12R1.26 CCC(C)OC[C@H]1CC[C@H](C1)F da4802c5b5307bbe4f90da3a0d71a006 [0,1,0,0,0,0|2,0,1]=4 279 B12R1.26 CC[C@@H](C)OCC1CCC(=O)O1 599921a06e5fdda5f83ad7578ad20cad [0,1,0,0,0,0|1,0,2]=4 280 B12R1.26 CC[C@H](C)OCC1CCC(=O)O1 b07b99796d5dfcd75a139730545adbfe [0,1,0,0,0,0|1,0,2]=4 281 B12R1.26 COC(=O)OCN1CCC(C1)C 39c5c6796e7a9525585f676e41aee042 [0,1,0,0,0,0|3,0,0]=4 282 B12R1.26 COC(=O)OCN1CCC(C1)F e32c83afbd4f769b4db2f32e2f71810c [0,1,0,0,0,0|3,0,0]=4 283 B12R1.26 COC(=O)OCN1CCC(C1)O 2e900dddfa5c603d57b9f96ea6bc1ff2 [0,1,0,0,0,0|3,0,0]=4 284 B12R1.26 COC(=O)OCN1CC[C@@H](C1)F bc36b61bf623cd81294b6477c6b6762b [0,1,0,0,0,0|3,0,0]=4 285 B12R1.26 COC(=O)OCN1CC[C@@H](C1)O 995e463fb9f517dfb9915558d9c56d57 [0,1,0,0,0,0|3,0,0]=4 286 B12R1.26 COC(=O)OCN1CC[C@H](C1)F 76b492e503d0da7fb158266545698838 [0,1,0,0,0,0|3,0,0]=4 287 B12R1.26 COC(=O)OCN1CC[C@H](C1)O fe88d83a3abe5f506d5be626a80fe87f [0,1,0,0,0,0|3,0,0]=4 288 B12R1.26 O=C(CF)NCC1CCC(C1)O 8b484fc617c5e0ef94d042af728e2a64 [0,1,0,0,0,0|3,0,0]=4 289 B12R1.26 O=C(CO)NCC1CCC(C1)O 1f5e6e722c6747006810f6037930f327 [0,1,0,0,0,0|3,0,0]=4 290 B12R1.26 O=C(CS)NCC1CCC(C1)O 791996d5f9512af55cab61b62968403c [0,1,0,0,0,0|3,0,0]=4 291 B12R1.51 C#CCC(=O)NCC1CCCC1 adec45adf7c612a3acdd5706b230348c [0,1,0,0,0,0|2,0,1]=4 292 B12R1.51 C#CCC(=O)NCC1CCCO1 21176b12bb56c6685b514fc9d8b9670d [0,1,0,0,0,0|1,0,1]=3 293 B12R1.51 C#CCC(=O)NC[C@@H]1CCCO1 d37a9cfca863939de09b0000a5f96436 [0,1,0,0,0,0|1,0,1]=3 294 B12R1.51 C#CCC(=O)NC[C@H]1CCCO1 b1ed82082004e8a807f0b45a89a3fa82 [0,1,0,0,0,0|1,0,1]=3 295 B12R1.51 C#CCC(C)OCC1CCCO1 de97ec392f8a8287d9878a74c2528b89 [0,1,0,0,0,0|1,0,2]=4 296 B12R1.51 C/C=C/C(=O)NCC1CCCC1 ba948ebbfe160e6b2e2292368b526934 [0,1,0,0,0,0|2,0,1]=4 297 B12R1.51 C/C=C/C(=O)NCC1CCCO1 2f213a375d6f3dd8d6cd6f8cc4f9161c [0,1,0,0,0,0|1,0,1]=3 298 B12R1.51 C/C=C/C(=O)NC[C@@H]1CCCO1 fb27270a21a21eee19fc19397cdc761c [0,1,0,0,0,0|1,0,1]=3 299 B12R1.51 C/C=C/C(=O)NC[C@H]1CCCO1 007b615625dfd0c5f9cfd8bf217fb193 [0,1,0,0,0,0|1,0,1]=3 300 B12R1.51 C/C=C/C(C)OCC1CCCO1 3a33d798678421c0c464e47964752467 [0,1,0,0,0,0|1,0,2]=4 301 B12R1.51 C=CCC(=O)NCC1CCCC1 546486ea4fa41fce433c7cbcc8fcebdd [0,1,0,0,0,0|2,0,1]=4 302 B12R1.51 C=CCC(=O)NCC1CCCO1 64c40cbf9f7022dac293145613771856 [0,1,0,0,0,0|1,0,1]=3 303 B12R1.51 C=CCC(=O)NC[C@@H]1CCCO1 467aef36d16b23d83ae6678b68da9b24 [0,1,0,0,0,0|1,0,1]=3 304 B12R1.51 C=CCC(=O)NC[C@H]1CCCO1 b4bf0deccfe02c814ba820f69ef19f32 [0,1,0,0,0,0|1,0,1]=3 305 B12R1.51 C=CCC(C)OCC1CCCO1 1594398f8a810275b82088c34af7f549 [0,1,0,0,0,0|1,0,2]=4 306 B12R1.51 C=CC[C@@H](C)OCC1CCCO1 c4d8dfea3662b7e590b801b0c1b9518d [0,1,0,0,0,0|1,0,2]=4 307 B12R1.51 C=CC[C@H](C)OCC1CCCO1 9e364bf166096bba8455c7a3530b3bfc [0,1,0,0,0,0|1,0,2]=4 308 B12R1.51 CC#CC(=O)NCC1CCCC1 7925299f9cb781cce7729a2877c57d69 [0,1,0,0,0,0|2,0,1]=4 309 B12R1.51 CC#CC(=O)NCC1CCCO1 f990134f7fcaa3fafe4a5d0646f3a005 [0,1,0,0,0,0|1,0,1]=3 310 B12R1.51 CC#CC(=O)NC[C@@H]1CCCO1 dfba25f55b777fdd7cbc77d66655c60f [0,1,0,0,0,0|1,0,1]=3 311 B12R1.51 CC#CC(=O)NC[C@H]1CCCO1 4ac3dc77ed0d57cef808cff1c76095fb [0,1,0,0,0,0|1,0,1]=3 312 B12R1.51 CC#CC(C)OCC1CCCO1 4880ebd51f4a045a7febffe40cb62af1 [0,1,0,0,0,0|1,0,2]=4 313 B12R1.51 CC(CC#N)OCC1CCCO1 e50a81388bccca8ecab43bf573b18e50 [0,1,0,0,0,0|1,0,2]=4 314 B12R1.51 CC(CC#N)OC[C@@H]1CCCO1 b03c95fa834bcb0e0758d088fce6eed8 [0,1,0,0,0,0|1,0,2]=4 315 B12R1.51 CC(CC#N)OC[C@H]1CCCO1 7a848d3f429f10c44770b2ed52069161 [0,1,0,0,0,0|1,0,2]=4 316 B12R1.51 CC(CCO)NCC1CCCO1 bca099be99397dbb927225e3e839c1cc [0,1,0,0,0,0|2,0,1]=4 317 B12R1.51 CC(CCO)NC[C@@H]1CCCO1 37434841e197427addfb91ce1fe9e1e7 [0,1,0,0,0,0|2,0,1]=4 318 B12R1.51 CC(CCO)NC[C@H]1CCCO1 0fc7aef4aa3b229709ece9d1fd041e29 [0,1,0,0,0,0|2,0,1]=4 319 B12R1.51 CC=CC(C)OCC1CCCO1 fea3a8ec31b143e32a7a67d5c0152a11 [0,1,0,0,0,0|1,0,2]=4 320 B12R1.51 CCCC(=O)CNC1CCCC1 9a4a4d9626f3134efce8838d40eda105 [0,1,0,0,0,0|3,0,0]=4 321 B12R1.51 CCCC(=O)COC1CCCC1 4071714b381bd78a53d7cf9e1365d50f [0,1,0,0,0,0|3,0,0]=4 322 B12R1.51 CCCC(=O)COC1CCCO1 57a2688735a65f75410539ea4e47637c [0,1,0,0,0,0|2,0,0]=3 323 B12R1.51 CCCC(=O)NCC1CCCC1 cfcb200415709c214a1d801f83e6a4b6 [0,1,0,0,0,0|2,0,0]=3 324 B12R1.51 CCCC(=O)NCC1CCCO1 e4a03b1f607ff098a7b99b505f41ca9d [0,1,0,0,0,0|1,0,0]=2 325 B12R1.51 CCCC(=O)NCC1CCOC1 0059562e061f3db7f993cab5ce4b010a [0,1,0,0,0,0|3,0,0]=4 326 B12R1.51 CCCC(=O)NC[C@@H]1CCCO1 fa412fcaf3ac17029c350efdfa77a0ca [0,1,0,0,0,0|1,0,0]=2 327 B12R1.51 CCCC(=O)NC[C@@H]1CCOC1 142bbab18148f83d6a881c091ad157d7 [0,1,0,0,0,0|3,0,0]=4 328 B12R1.51 CCCC(=O)NC[C@H]1CCCO1 09ba24c92f7c743a1d210609eeb0d318 [0,1,0,0,0,0|1,0,0]=2 329 B12R1.51 CCCC(=O)NC[C@H]1CCOC1 90f0df9a6003c98e94f82e7235bcb390 [0,1,0,0,0,0|3,0,0]=4 330 B12R1.51 CCCC(=O)OCN1CCSC1 9a8d222f261a1ed1c068662b128ae5a1 [0,1,0,0,0,0|3,0,0]=4 331 B12R1.51 CCCC(=S)OCC1=CCCC1 b2f2478f9267ed016c7a562ce03e2a3c [0,1,0,0,0,0|1,1,1]=4 332 B12R1.51 CCCC(=S)OCC1CCCC1 dbb56b416236bceabe144b79562a70fc [0,1,0,0,0,0|1,1,0]=3 333 B12R1.51 CCCC(=S)OCC1CCCO1 b0b7deffb14dc9b7b714948792f41892 [0,1,0,0,0,0|0,1,0]=2 334 B12R1.51 CCCC(=S)OCC1CCOC1 96f491f1917c321df4bf780870050342 [0,1,0,0,0,0|2,1,0]=4 335 B12R1.51 CCCC(C)NCC1CCCO1 1d9bfc757b8ba39bd1e204b6ca3ea08c [0,1,0,0,0,0|2,0,1]=4 336 B12R1.51 CCCC(C)NC[C@@H]1CCCO1 f01379694ceb6fb46825808caf93d60f [0,1,0,0,0,0|2,0,1]=4 337 B12R1.51 CCCC(C)NC[C@H]1CCCO1 d1205419d3eb2c5134207b7a8b4eb124 [0,1,0,0,0,0|2,0,1]=4 338 B12R1.51 CCCC(C)OCC1CCCC1 1808933eb5de90ba7eaa5373a0c14484 [0,1,0,0,0,0|2,0,1]=4 339 B12R1.51 CCCC(C)OCC1CCCO1 f9b187f6ca284fcc83cf9580d2a6b19a [0,1,0,0,0,0|1,0,1]=3 340 B12R1.51 CCCC(C)OCC1CCCS1 85fb708e4034a414380440c69e9c1c21 [0,1,0,0,0,0|1,1,1]=4 341 B12R1.51 CCCC(C)OC[C@@H]1CCCO1 fc073b0267cd3b0a3dc9e7d6262160f9 [0,1,0,0,0,0|1,0,1]=3 342 B12R1.51 CCCC(C)OC[C@H]1CCCO1 429e40dcdb6d69fb6e4bdd5d7b4910ed [0,1,0,0,0,0|1,0,1]=3 343 B12R1.51 CCCN(C)CCC1CCCO1 7e3c6d564e9aeaf17f5f33be72abbe39 [0,1,0,0,0,0|3,0,0]=4 344 B12R1.51 CCC[C@@H](C)OCC1CCCC1 4d8e153605cd37943335cc3be94c5e7c [0,1,0,0,0,0|2,0,1]=4 345 B12R1.51 CCC[C@@H](C)OCC1CCCO1 c92f0295cf0b410da1ba5b9eeb1c4365 [0,1,0,0,0,0|1,0,1]=3 346 B12R1.51 CCC[C@H](C)NCC1CCCO1 60d86e4991e1513ed870f71afdb3e5b5 [0,1,0,0,0,0|2,0,1]=4 347 B12R1.51 CCC[C@H](C)OCC1CCCC1 b9ce31dd9a49392e934bb36b943ecb9e [0,1,0,0,0,0|2,0,1]=4 348 B12R1.51 CCC[C@H](C)OCC1CCCO1 e671b0d46e44d9456c79af588c8e3434 [0,1,0,0,0,0|1,0,1]=3 349 B12R1.51 CCNC(=O)CNC1CCCC1 65f1b988041f696ddd11740c100fca07 [0,1,0,0,0,0|3,0,0]=4 350 B12R1.51 CCNC(=O)COC1CCCC1 a35c2466cf72cd04a0d31e930cbcfefc [0,1,0,0,0,0|3,0,0]=4 351 B12R1.51 CCNC(=O)COC1CCCO1 384581e3172f5d40036c2d5de48039d0 [0,1,0,0,0,0|2,0,0]=3 352 B12R1.51 CCOC(=O)CNC1CCCC1 a385a38555c8482595f001367ab698e4 [0,1,0,0,0,0|3,0,0]=4 353 B12R1.51 CCOC(=O)COC1CCCC1 ac71fdfb9de8db34ecb53d8b4837512e [0,1,0,0,0,0|3,0,0]=4 354 B12R1.51 CCOC(=O)COC1CCCO1 15122d4990e6299de769df253b8bae33 [0,1,0,0,0,0|2,0,0]=3 355 B12R1.51 CCOC(=O)OCN1CCSC1 fc8424ac7542eab8b6b5bd6546b67859 [0,1,0,0,0,0|3,0,0]=4 356 B12R1.51 CCSC(=O)OCN1CCSC1 fad3853a73eb4b2c8f508e39ec9a1fa8 [0,1,0,0,0,0|3,0,0]=4 357 B12R1.51 CN(CCF)CCC1CCCO1 b86fee83cbfda272b0faf02f36ccb1fd [0,1,0,0,0,0|3,0,0]=4 358 B12R1.51 CN(CCO)CCC1CCCO1 a2975e8a9090d8cac182209140037752 [0,1,0,0,0,0|3,0,0]=4 359 B12R1.51 COCC(=O)CNC1CCCC1 3eb4736d2ac65401488d3c966c319dd4 [0,1,0,0,0,0|3,0,0]=4 360 B12R1.51 COCC(=O)COC1CCCC1 8df1326a8ad57557cf382b6bcdf97036 [0,1,0,0,0,0|3,0,0]=4 361 B12R1.51 COCC(=O)COC1CCCO1 3eb532a1296cad116dbd7da0df2554b0 [0,1,0,0,0,0|2,0,0]=3 362 B12R1.51 COCC(=O)NCC1CCCC1 5df29ac1f4d18d74192d82ee7a059590 [0,1,0,0,0,0|2,0,0]=3 363 B12R1.51 COCC(=O)NCC1CCCO1 3e1d7aea831bcb4f8a3925fd197734bc [0,1,0,0,0,0|1,0,0]=2 364 B12R1.51 COCC(=O)NCC1CCOC1 3e845f31a40ae2c396314dc9c52b730a [0,1,0,0,0,0|3,0,0]=4 365 B12R1.51 COCC(=O)NC[C@@H]1CCCO1 e29ebd924b7718979399596f02e1c2f5 [0,1,0,0,0,0|1,0,0]=2 366 B12R1.51 COCC(=O)NC[C@@H]1CCOC1 663e1af38e680b06b5fc8fbf19b72c25 [0,1,0,0,0,0|3,0,0]=4 367 B12R1.51 COCC(=O)NC[C@H]1CCCO1 ba19568ab494426171d2c741ba0d6deb [0,1,0,0,0,0|1,0,0]=2 368 B12R1.51 COCC(=O)NC[C@H]1CCOC1 9fc7e454051a67338d5fb09dcdaf6701 [0,1,0,0,0,0|3,0,0]=4 369 B12R1.51 COCC(C)NCC1CCCO1 f44dda47e880f942f8ec1d628df5b9dc [0,1,0,0,0,0|2,0,1]=4 370 B12R1.51 COCC(C)NC[C@@H]1CCCO1 796fc28bf13bfc8a229cd2b2ffd1b0a6 [0,1,0,0,0,0|2,0,1]=4 371 B12R1.51 COCC(C)NC[C@H]1CCCO1 72fb42dcedc35af3f7a38c00dfd0da1f [0,1,0,0,0,0|2,0,1]=4 372 B12R1.51 COCC(C)OCC1CCCC1 1ef6957025b8a9c67ea4c4188087c645 [0,1,0,0,0,0|2,0,1]=4 373 B12R1.51 COCC(C)OCC1CCCO1 a8048f041e92d7e5afc3040d818b39d6 [0,1,0,0,0,0|1,0,1]=3 374 B12R1.51 COCC(C)OCC1CCCS1 e4fb6179bd2ccad2d74c9902f02c0b43 [0,1,0,0,0,0|1,1,1]=4 375 B12R1.51 COCC(C)OC[C@@H]1CCCO1 9b8a1d5f5e30cc014353632fab54a0cd [0,1,0,0,0,0|1,0,1]=3 376 B12R1.51 COCC(C)OC[C@H]1CCCO1 d1743fc7d49d8cc2ea834ea3255e9fe5 [0,1,0,0,0,0|1,0,1]=3 377 B12R1.51 COC[C@@H](C)NCC1CCCO1 c2a81d28a37801871b68eaa87e0c95c4 [0,1,0,0,0,0|2,0,1]=4 378 B12R1.51 COC[C@@H](C)OCC1CCCC1 31528cae521b71fb55d07ec0cec0b298 [0,1,0,0,0,0|2,0,1]=4 379 B12R1.51 COC[C@@H](C)OCC1CCCO1 c41cbfb83f9b28e98ba54a1c4071a585 [0,1,0,0,0,0|1,0,1]=3 380 B12R1.51 COC[C@H](C)NCC1CCCO1 eee0fe2e51e70bf8b2fd721bd4b56b92 [0,1,0,0,0,0|2,0,1]=4 381 B12R1.51 COC[C@H](C)OCC1CCCC1 8947c85bbb7b3825658e2a7c34f92141 [0,1,0,0,0,0|2,0,1]=4 382 B12R1.51 COC[C@H](C)OCC1CCCO1 42de6dc437537f45c6209ae3aa75a4a3 [0,1,0,0,0,0|1,0,1]=3 383 B12R1.51 CSCC(=O)NCC1CCCC1 3ec106889c89688efa216fb15eb6567a [0,1,0,0,0,0|2,0,0]=3 384 B12R1.51 CSCC(=O)NCC1CCCO1 1a7c13392a02383c0ff9aa95c37e9d34 [0,1,0,0,0,0|1,0,0]=2 385 B12R1.51 CSCC(=O)NCC1CCOC1 ec942e59531a329f1eb1227fadef2cd6 [0,1,0,0,0,0|3,0,0]=4 386 B12R1.51 CSCC(=O)NC[C@@H]1CCCO1 c002d059d7699cc6b2c34d70b60941e0 [0,1,0,0,0,0|1,0,0]=2 387 B12R1.51 CSCC(=O)NC[C@@H]1CCOC1 c43c866d879cb245d7b46e55b35e93cf [0,1,0,0,0,0|3,0,0]=4 388 B12R1.51 CSCC(=O)NC[C@H]1CCCO1 8eecf5c799de2e76e84d950d90bf7567 [0,1,0,0,0,0|1,0,0]=2 389 B12R1.51 CSCC(=O)NC[C@H]1CCOC1 1ae1b775d5849ae7116c1a544e16d4a1 [0,1,0,0,0,0|3,0,0]=4 390 B12R1.51 CSCC(C)OCC1CCCC1 5eb892d34e6f902be6e8e03248d6e945 [0,1,0,0,0,0|2,0,1]=4 391 B12R1.51 CSCC(C)OCC1CCCO1 109efdfff3423b815cab459edb0a4aa0 [0,1,0,0,0,0|1,0,1]=3 392 B12R1.51 C[C@@H](CC#N)OCC1CCCO1 8b39c9daa0b8a4d3442d625e25ff0e65 [0,1,0,0,0,0|1,0,2]=4 393 B12R1.51 C[C@@H](CCO)NCC1CCCO1 d4c8fcb8886991774ea324c5a901374a [0,1,0,0,0,0|2,0,1]=4 394 B12R1.51 C[C@H](CC#N)OCC1CCCO1 010aa6feed32a80989ea53c44a54696a [0,1,0,0,0,0|1,0,2]=4 395 B12R1.51 C[C@H](CCO)NCC1CCCO1 3b37ba91606d0a7ae9d3c4f0d9b6a5ff [0,1,0,0,0,0|2,0,1]=4 396 B12R1.51 N#CCC(=O)NCC1CCCC1 8d30ad0b059388e9a01ab5b4fe306d99 [0,1,0,0,0,0|2,0,1]=4 397 B12R1.51 N#CCC(=O)NCC1CCCO1 9bfa4082dec05f66535885de2081775c [0,1,0,0,0,0|1,0,1]=3 398 B12R1.51 N#CCC(=O)NC[C@@H]1CCCO1 dfee71d3e6dd8e5593bd77ca235bdeed [0,1,0,0,0,0|1,0,1]=3 399 B12R1.51 N#CCC(=O)NC[C@H]1CCCO1 78d6b5bf226b6a61a0be3eb585b86246 [0,1,0,0,0,0|1,0,1]=3 400 B12R1.51 N#CNC(=O)CCC1CCCO1 aa8bf7b38bb25547eb1f9b1dee1fe262 [0,1,0,0,0,0|2,0,1]=4 401 B12R1.51 N#CNC(=O)NCC1CCCO1 b6140a0cd1d8cdf42b6b5eb9e69017f5 [0,1,0,0,0,0|2,0,1]=4 402 B12R1.51 N#CNC(=O)NC[C@@H]1CCCO1 65582b8c01714320ee46807d92f9e13b [0,1,0,0,0,0|2,0,1]=4 403 B12R1.51 N#CNC(=O)NC[C@H]1CCCO1 8f85549d0763dac3ab55a4f2212ecaa0 [0,1,0,0,0,0|2,0,1]=4 404 B12R1.51 NOCC(=O)NCC1CCCC1 d6196c94be6935ee1913cb587295b6e9 [0,1,0,0,0,0|3,0,0]=4 405 B12R1.51 NOCC(=O)NCC1CCCO1 8456dcb024df3b2cb7a1caa999ae2ce2 [0,1,0,0,0,0|2,0,0]=3 406 B12R1.51 NOCC(=O)NC[C@@H]1CCCO1 99fde6a474a6c634416fcacfefdd4aed [0,1,0,0,0,0|2,0,0]=3 407 B12R1.51 NOCC(=O)NC[C@H]1CCCO1 07f5f171ef256b0af1613a958a33cee1 [0,1,0,0,0,0|2,0,0]=3 408 B12R1.51 O=C(/C=C/Br)NCC1CCCO1 8e205706074f16ca16e071d77ef70ffb [0,1,0,0,0,0|1,0,2]=4 409 B12R1.51 O=C(/C=C/Br)NC[C@@H]1CCCO1 1cdfe1f99ec0e9f0df9e15e5e70d3d87 [0,1,0,0,0,0|1,0,2]=4 410 B12R1.51 O=C(/C=C/Br)NC[C@H]1CCCO1 22685b1e29429dbf458e62e9f8db0308 [0,1,0,0,0,0|1,0,2]=4 411 B12R1.51 O=C(/C=C/Cl)NCC1CCCO1 c7512ed5383dde29e0c43054a62f2ea7 [0,1,0,0,0,0|1,0,2]=4 412 B12R1.51 O=C(/C=C/Cl)NC[C@@H]1CCCO1 9160cc3133627e82972d17cca3ecd396 [0,1,0,0,0,0|1,0,2]=4 413 B12R1.51 O=C(/C=C/Cl)NC[C@H]1CCCO1 d533974cf9ce4c5dc13b0e912d5036c1 [0,1,0,0,0,0|1,0,2]=4 414 B12R1.51 O=C(/C=C/I)NCC1CCCO1 996855340b802bc67f200e8646103ef8 [0,1,0,0,0,0|1,0,2]=4 415 B12R1.51 O=C(/C=C/I)NC[C@@H]1CCCO1 25ddb93e3047f9d411a62fc11a812ae4 [0,1,0,0,0,0|1,0,2]=4 416 B12R1.51 O=C(/C=C/I)NC[C@H]1CCCO1 871d2e4003b3e54cefbeb2295c85272c [0,1,0,0,0,0|1,0,2]=4 417 B12R1.51 O=C(/C=C\Br)NCC1CCCO1 da921a41c9f82b2954b7642d1acf98eb [0,1,0,0,0,0|1,0,2]=4 418 B12R1.51 O=C(/C=C\Br)NC[C@@H]1CCCO1 33fff4aa7ce615a8fc2d8ebf327ecc4d [0,1,0,0,0,0|1,0,2]=4 419 B12R1.51 O=C(/C=C\Br)NC[C@H]1CCCO1 5e155697a8a52d070f8d911c46e770fe [0,1,0,0,0,0|1,0,2]=4 420 B12R1.51 O=C(/C=C\Cl)NCC1CCCO1 5286050153add785f949c6cb41092797 [0,1,0,0,0,0|1,0,2]=4 421 B12R1.51 O=C(/C=C\Cl)NC[C@@H]1CCCO1 d10066e310005e477f8e8ae95f4c8394 [0,1,0,0,0,0|1,0,2]=4 422 B12R1.51 O=C(/C=C\Cl)NC[C@H]1CCCO1 91abfd14402f3785f670ddb59051d6f4 [0,1,0,0,0,0|1,0,2]=4 423 B12R1.51 O=C(/C=C\I)NCC1CCCO1 c34aad4bcad0cda7d752d166ec1833d4 [0,1,0,0,0,0|1,0,2]=4 424 B12R1.51 O=C(/C=C\I)NC[C@@H]1CCCO1 e94c4b3a7db426dbec59f7a9eeb6ecc9 [0,1,0,0,0,0|1,0,2]=4 425 B12R1.51 O=C(/C=C\I)NC[C@H]1CCCO1 4edce3a70c4645f707635e2b2822038f [0,1,0,0,0,0|1,0,2]=4 426 B12R1.51 O=C(C#CBr)NCC1CCCO1 ef73b7436b36c059172eacc7e770082f [0,1,0,0,0,0|1,0,2]=4 427 B12R1.51 O=C(C#CBr)NC[C@@H]1CCCO1 7baf1c9bbf928f45fcf4f4b2d2a10649 [0,1,0,0,0,0|1,0,2]=4 428 B12R1.51 O=C(C#CBr)NC[C@H]1CCCO1 da3edb8181ba12560b7dd1683dc19146 [0,1,0,0,0,0|1,0,2]=4 429 B12R1.51 O=C(C=CBr)NCC1CCCO1 8f2e9265a3ce4b2f84cfc685e7a58f92 [0,1,0,0,0,0|1,0,2]=4 430 B12R1.51 O=C(C=CBr)NC[C@@H]1CCCO1 c6f1e2f06ee712e77d096b59e226e9f8 [0,1,0,0,0,0|1,0,2]=4 431 B12R1.51 O=C(C=CBr)NC[C@H]1CCCO1 9a1e3587ce3fea8ba6d2908649f2900a [0,1,0,0,0,0|1,0,2]=4 432 B12R1.51 O=C(C=CI)NCC1CCCO1 7a51a88b6bbd91bac016a632b86b11f6 [0,1,0,0,0,0|1,0,2]=4 433 B12R1.51 O=C(C=CI)NC[C@@H]1CCCO1 bbd248ec6235e0d5ac47b7712df50d92 [0,1,0,0,0,0|1,0,2]=4 434 B12R1.51 O=C(C=CI)NC[C@H]1CCCO1 d979e389c73236eb3a92e55a4e372b6e [0,1,0,0,0,0|1,0,2]=4 435 B12R1.51 O=C(CCF)NCC1CCCC1 b2452aeae29ad7c9bbfc9d4a5e63bc5f [0,1,0,0,0,0|2,0,0]=3 436 B12R1.51 O=C(CCF)NCC1CCCO1 80af6f68d9167c55911b66c422415169 [0,1,0,0,0,0|1,0,0]=2 437 B12R1.51 O=C(CCF)NCC1CCOC1 a9898fa085228da07933206e70b1b43b [0,1,0,0,0,0|3,0,0]=4 438 B12R1.51 O=C(CCF)NC[C@@H]1CCCO1 b8da5523535daa551e6f4695c788cb11 [0,1,0,0,0,0|1,0,0]=2 439 B12R1.51 O=C(CCF)NC[C@@H]1CCOC1 c0284008d33072450b623d95a6e793d5 [0,1,0,0,0,0|3,0,0]=4 440 B12R1.51 O=C(CCF)NC[C@H]1CCCO1 0a38a4102df85dd7f063628bb8182f32 [0,1,0,0,0,0|1,0,0]=2 441 B12R1.51 O=C(CCF)NC[C@H]1CCOC1 5a59f5b26cd6c56b11d387eabe84d7aa [0,1,0,0,0,0|3,0,0]=4 442 B12R1.51 O=C(CCO)NCC1CCCC1 0e6efe94600c3b09dba4f7d419378823 [0,1,0,0,0,0|2,0,0]=3 443 B12R1.51 O=C(CCO)NCC1CCCO1 d20e439d1a721581ff2df4b012d978a9 [0,1,0,0,0,0|1,0,0]=2 444 B12R1.51 O=C(CCO)NCC1CCOC1 e32827993011305de429e871e1fd66a3 [0,1,0,0,0,0|3,0,0]=4 445 B12R1.51 O=C(CCO)NC[C@@H]1CCCO1 35d72620ecf7842f82f15f9a1e3f1c94 [0,1,0,0,0,0|1,0,0]=2 446 B12R1.51 O=C(CCO)NC[C@@H]1CCOC1 9fa6dfb35ed7e604cfe4137c36ce7577 [0,1,0,0,0,0|3,0,0]=4 447 B12R1.51 O=C(CCO)NC[C@H]1CCCO1 e093b56b61eb1c2f825b31975d81ec9b [0,1,0,0,0,0|1,0,0]=2 448 B12R1.51 O=C(CCO)NC[C@H]1CCOC1 71bc53462ec6b650075e3a8e1e94e89d [0,1,0,0,0,0|3,0,0]=4 449 B12R1.51 O=C(CCS)NCC1CCCC1 aa4b678e4a693fe89ef8a8bb4cb10536 [0,1,0,0,0,0|2,0,0]=3 450 B12R1.51 O=C(CCS)NCC1CCCO1 88b89f89c89ac89eb9f1e2a6879b0523 [0,1,0,0,0,0|1,0,0]=2 451 B12R1.51 O=C(CCS)NCC1CCOC1 8c2c779bdc5780bf9d92f6afe9607d7b [0,1,0,0,0,0|3,0,0]=4 452 B12R1.51 O=C(CCS)NC[C@@H]1CCCO1 322ebbbee1d50e631ebbe19a0c27726f [0,1,0,0,0,0|1,0,0]=2 453 B12R1.51 O=C(CCS)NC[C@@H]1CCOC1 1c4c3f3874a7aedeb27c044dbab5ebc4 [0,1,0,0,0,0|3,0,0]=4 454 B12R1.51 O=C(CCS)NC[C@H]1CCCO1 3dc9c2241d36984c25353d1888311c50 [0,1,0,0,0,0|1,0,0]=2 455 B12R1.51 O=C(CCS)NC[C@H]1CCOC1 37ada72e8bb021fcb5fc61f87e09184e [0,1,0,0,0,0|3,0,0]=4 456 B12R1.51 O=CCC(=O)NCC1CCCC1 b308bf809e721780681e948b428af674 [0,1,0,0,0,0|2,0,1]=4 457 B12R1.51 O=CCC(=O)NCC1CCCO1 153a86512b79abb3da9787013517d4f6 [0,1,0,0,0,0|1,0,1]=3 458 B12R1.51 O=CCC(=O)NC[C@@H]1CCCO1 983ffbc19361652ab5d1b11f55fd39b3 [0,1,0,0,0,0|1,0,1]=3 459 B12R1.51 O=CCC(=O)NC[C@H]1CCCO1 6022d06de84155679bcfcdeb6fa34328 [0,1,0,0,0,0|1,0,1]=3 460 B12R1.108 C#CC(=O)N(C)CC1CCCO1 d1a09028388f7804922c2d9bc73304f2 [0,1,0,0,0,0|1,0,2]=4 461 B12R1.108 C=CC(=O)N(C)CC1CCCO1 9435121d523635b39c9a2de8dfe0a15b [0,1,0,0,0,0|1,0,2]=4 462 B12R1.108 CCC(=O)C(=O)NC1CCCC1 b85bda82ce2332de61c3cb7f4fff4181 [0,1,0,0,0,0|3,0,0]=4 463 B12R1.108 CCC(=O)C(C)NC1CCCC1 9fb9d737763fbc526a89b5d06ffc54ee [0,1,0,0,0,0|3,0,0]=4 464 B12R1.108 CCC(=O)C(C)OC1CCCC1 e98ae7826c6fa44cc6ef7158a0f45d87 [0,1,0,0,0,0|3,0,0]=4 465 B12R1.108 CCC(=O)C(C)OC1CCCO1 11ad4b0deb8b19de6f1ca9a2b3044903 [0,1,0,0,0,0|2,0,0]=3 466 B12R1.108 CCC(=O)N(C)CC1CCCC1 fa3d088cf37c869d9eda52baddc5286e [0,1,0,0,0,0|2,0,0]=3 467 B12R1.108 CCC(=O)N(C)CC1CCCO1 cdd6ca7eee433efdfa5e10c6447177e3 [0,1,0,0,0,0|1,0,0]=2 468 B12R1.108 CCC(=O)N(C)CC1CCOC1 b1df3e1c90c12f00ad1f9eaed1517ea3 [0,1,0,0,0,0|3,0,0]=4 469 B12R1.108 CCC(C)N(C)CC1CCCO1 ba39f7f27b5b7b8e5887797f433cd812 [0,1,0,0,0,0|2,0,1]=4 470 B12R1.108 CCN(C)C(=O)CC1CCCO1 6f6bf38c2e2bc85dfb20d6486f9f9fe0 [0,1,0,0,0,0|3,0,0]=4 471 B12R1.108 CN(CC1CCCC1)C(=O)CF 9f016c4a01ead0d976adf3760f9cd87e [0,1,0,0,0,0|3,0,0]=4 472 B12R1.108 CN(CC1CCCC1)C(=O)CO d6b4036dbe5ed8c3fc5db138578e91a5 [0,1,0,0,0,0|3,0,0]=4 473 B12R1.108 CN(CC1CCCC1)C(=O)CS c1b2f74c96702332ef40eea816c94657 [0,1,0,0,0,0|3,0,0]=4 474 B12R1.108 CN(CC1CCCO1)C(=O)C=O 6080474827f357dc4ef72c7124d77465 [0,1,0,0,0,0|2,0,1]=4 475 B12R1.108 CN(CC1CCCO1)C(=O)CF 23b2a036ef458cc9a05e90949825fef5 [0,1,0,0,0,0|2,0,0]=3 476 B12R1.108 CN(CC1CCCO1)C(=O)CO 9788ac6e3ff23373d09f076a68f19d85 [0,1,0,0,0,0|2,0,0]=3 477 B12R1.108 CN(CC1CCCO1)C(=O)CS 833913f3b3bb02e65083b5182a17c7e3 [0,1,0,0,0,0|2,0,0]=3 478 B12R1.108 CNC(=O)C(C)OC1CCCO1 6e0210a7441b5021a90f1f5896732e28 [0,1,0,0,0,0|3,0,0]=4 479 B12R1.108 COC(=O)C(C)OC1CCCO1 e382ef3db43e7fcb2d217e03dd7c6067 [0,1,0,0,0,0|3,0,0]=4 480 B12R1.108 COC(=O)[C@@H](C)OC1CCCO1 973344fb513ecd6554129da45cf7543b [0,1,0,0,0,0|3,0,0]=4 481 B12R1.108 COC(=O)[C@H](C)OC1CCCO1 de12ab5a4400fa50492f761cfe004d2b [0,1,0,0,0,0|3,0,0]=4 482 B12R1.196 CCC(C)(C)NCC1CCCO1 82b8ed09408bdbcf605e1bad9b638be3 [0,1,0,0,0,0|2,0,1]=4 483 B12R1.264 C=C(Br)C(=O)NCC1CCCO1 9e7d541b1ceb5fb232a07af97aabf952 [0,1,0,0,0,0|1,0,2]=4 484 B12R1.264 C=C(Br)C(=O)NC[C@@H]1CCCO1 0d3c1fe6cdddbc943594308cc1d51ad3 [0,1,0,0,0,0|1,0,2]=4 485 B12R1.264 C=C(Br)C(=O)NC[C@H]1CCCO1 1ef9101a73ac6806f1646afbe832f891 [0,1,0,0,0,0|1,0,2]=4 486 B12R1.264 C=C(C)C(=O)NCC1CCCC1 2fc54ad501aa9623c16e266079280762 [0,1,0,0,0,0|2,0,1]=4 487 B12R1.264 C=C(C)C(=O)NCC1CCCO1 99b16a8718d87f2bea8b955c1fea46d1 [0,1,0,0,0,0|1,0,1]=3 488 B12R1.264 C=C(C)C(=O)NC[C@@H]1CCCO1 d08bdbbb12d791d9b3d8f3ada3489107 [0,1,0,0,0,0|1,0,1]=3 489 B12R1.264 C=C(C)C(=O)NC[C@H]1CCCO1 dc389b8baa35c4e9eb2e4990faef9a79 [0,1,0,0,0,0|1,0,1]=3 490 B12R1.264 C=C(Cl)C(=O)NCC1CCCO1 6adbbbfdff12182670e2a3f78f65dca1 [0,1,0,0,0,0|1,0,2]=4 491 B12R1.264 C=C(Cl)C(=O)NC[C@@H]1CCCO1 371668dd41bffcd582214be07d3817f2 [0,1,0,0,0,0|1,0,2]=4 492 B12R1.264 C=C(Cl)C(=O)NC[C@H]1CCCO1 fefc8ca33efae5855558fe8fbce4d047 [0,1,0,0,0,0|1,0,2]=4 493 B12R1.264 C=C(F)C(=O)NCC1CCCO1 c1748dcc4007fee655e234dfd58c7c2c [0,1,0,0,0,0|1,0,2]=4 494 B12R1.264 C=C(F)C(=O)NC[C@@H]1CCCO1 885c22310d2ba85a5601e135b4610738 [0,1,0,0,0,0|1,0,2]=4 495 B12R1.264 C=C(F)C(=O)NC[C@H]1CCCO1 ba9f2ed697c8c9d59c447970db379bdf [0,1,0,0,0,0|1,0,2]=4 496 B12R1.264 CC(=O)C(=O)COC1CCCO1 668673fd89d11d3c9404e1792db615f5 [0,1,0,0,0,0|2,0,1]=4 497 B12R1.264 CC(=O)C(=O)NCC1CCCC1 131e669e7817b546dae6db3b12cd91cf [0,1,0,0,0,0|2,0,1]=4 498 B12R1.264 CC(=O)C(=O)NCC1CCCO1 cbc798b1e161c8a1770792ba1bccd278 [0,1,0,0,0,0|1,0,1]=3 499 B12R1.264 CC(=O)C(=O)NC[C@@H]1CCCO1 c248611c0c734b3600309ae664c9d56c [0,1,0,0,0,0|1,0,1]=3 500 B12R1.264 CC(=O)C(=O)NC[C@H]1CCCO1 6bac0900a49bb610817d86a45ea361ac [0,1,0,0,0,0|1,0,1]=3 501 B12R1.264 CC(=O)C(C)OCC1CCCO1 c7449fe7f2ff2319d6d76f27d761a32b [0,1,0,0,0,0|1,0,2]=4 502 B12R1.264 CC(=O)C(C)OC[C@@H]1CCCO1 91604a879fe0327f3ab2e3013bc66b68 [0,1,0,0,0,0|1,0,2]=4 503 B12R1.264 CC(=O)C(C)OC[C@H]1CCCO1 29b033a05e33ad64168d1a097b8bb2eb [0,1,0,0,0,0|1,0,2]=4 504 B12R1.264 CC(C)C(=O)CNC1CCCC1 c40af5f6f3c77d4befeb5399d70d53d6 [0,1,0,0,0,0|3,0,0]=4 505 B12R1.264 CC(C)C(=O)COC1CCCC1 033e27ec6ba46038ed0175f62acf5236 [0,1,0,0,0,0|3,0,0]=4 506 B12R1.264 CC(C)C(=O)COC1CCCO1 4d8b406eae2d5cd203ee1e1e5cc69762 [0,1,0,0,0,0|2,0,0]=3 507 B12R1.264 CC(C)C(=O)OCN1CCSC1 97e16faa055232805e78ea2e888031e4 [0,1,0,0,0,0|3,0,0]=4 508 B12R1.264 CC(C)C(C)NCC1CCCO1 5f564924d99430c7a5f4537e9256d21a [0,1,0,0,0,0|2,0,1]=4 509 B12R1.264 CC(C)C(C)NC[C@@H]1CCCO1 ee9abb6e2fb804cd7b4afa8650dd8ccc [0,1,0,0,0,0|2,0,1]=4 510 B12R1.264 CC(C)C(C)NC[C@H]1CCCO1 c61baedff042795e9a4c5be5263c94bd [0,1,0,0,0,0|2,0,1]=4 511 B12R1.264 CC(C)C(C)OCC1CCCC1 45cafbafd72fb13930b5206b04f28cd8 [0,1,0,0,0,0|2,0,1]=4 512 B12R1.264 CC(C)C(C)OCC1CCCO1 bc74651e3cb44f65f4ab333e062fa456 [0,1,0,0,0,0|1,0,1]=3 513 B12R1.264 CC(C)C(C)OCC1CCCS1 1a232fc09fe15e618affae9926599f45 [0,1,0,0,0,0|1,1,1]=4 514 B12R1.264 CC(C)C(C)OC[C@@H]1CCCO1 bfa0dc72f3f0aba8b2ded39196089d36 [0,1,0,0,0,0|1,0,1]=3 515 B12R1.264 CC(C)C(C)OC[C@H]1CCCO1 b295b3d979a321c024d78fcbc56991dd [0,1,0,0,0,0|1,0,1]=3 516 B12R1.264 CC(C)N(C)CCC1CCCO1 0999d79f395787fedc1482f30a519bcf [0,1,0,0,0,0|3,0,0]=4 517 B12R1.264 CC(C)[C@@H](C)NCC1CCCO1 9fe5dfd5cd491235d4a7b003a571efa0 [0,1,0,0,0,0|2,0,1]=4 518 B12R1.264 CC(C)[C@@H](C)OCC1CCCC1 a6d7d7385528a9afcbffb44c19740fe7 [0,1,0,0,0,0|2,0,1]=4 519 B12R1.264 CC(C)[C@@H](C)OCC1CCCO1 86c4ef89e9ac5606ed63cc91fb8b4901 [0,1,0,0,0,0|1,0,1]=3 520 B12R1.264 CC(C)[C@H](C)NCC1CCCO1 dad8f90fe4eb71392e9f07cdbaf13176 [0,1,0,0,0,0|2,0,1]=4 521 B12R1.264 CC(C)[C@H](C)OCC1CCCC1 a0b9452953e23c9a23ca6b756363afde [0,1,0,0,0,0|2,0,1]=4 522 B12R1.264 CC(C)[C@H](C)OCC1CCCO1 57a668ff54a106b578f8a0b6c04b48bb [0,1,0,0,0,0|1,0,1]=3 523 B12R1.264 CC(F)C(=O)NCC1CCCC1 e9d773fedb910f5f34e9f05a1fffa5e3 [0,1,0,0,0,0|2,0,0]=3 524 B12R1.264 CC(F)C(=O)NCC1CCCO1 b1085f9d8d838b684585f2c968a5367d [0,1,0,0,0,0|1,0,0]=2 525 B12R1.264 CC(F)C(=O)NCC1CCOC1 bc90c7d084921f81649249496d5f66ff [0,1,0,0,0,0|3,0,0]=4 526 B12R1.264 CC(F)C(=O)NC[C@@H]1CCCO1 33d09add6090220eeac887f140660e0a [0,1,0,0,0,0|1,0,0]=2 527 B12R1.264 CC(F)C(=O)NC[C@@H]1CCOC1 a3cbc791f54ca99ef53a86d359969d2f [0,1,0,0,0,0|3,0,0]=4 528 B12R1.264 CC(F)C(=O)NC[C@H]1CCCO1 7dcdcbb44e76686ad931de1582da1a3d [0,1,0,0,0,0|1,0,0]=2 529 B12R1.264 CC(F)C(=O)NC[C@H]1CCOC1 f1f08605b5877b8102023f6f5ec6f0c7 [0,1,0,0,0,0|3,0,0]=4 530 B12R1.264 CC(O)C(=O)NCC1CCCC1 dd6a328b6f3bcc26fc6e554d91a5323c [0,1,0,0,0,0|2,0,0]=3 531 B12R1.264 CC(O)C(=O)NCC1CCCO1 a786e68563ce9c70c810249bd55b3e9e [0,1,0,0,0,0|1,0,0]=2 532 B12R1.264 CC(O)C(=O)NCC1CCOC1 bb6e23a577138d211f4fc07667ecf756 [0,1,0,0,0,0|3,0,0]=4 533 B12R1.264 CC(O)C(=O)NC[C@@H]1CCCO1 8363d12238a13a31b25822dbe53f62f5 [0,1,0,0,0,0|1,0,0]=2 534 B12R1.264 CC(O)C(=O)NC[C@@H]1CCOC1 c865c5bf89f2a9438fdacd082b351ec6 [0,1,0,0,0,0|3,0,0]=4 535 B12R1.264 CC(O)C(=O)NC[C@H]1CCCO1 45a47db27a098dd2a7a363d2881e0555 [0,1,0,0,0,0|1,0,0]=2 536 B12R1.264 CC(O)C(=O)NC[C@H]1CCOC1 a89f379c8802d01d65ba637326e135a5 [0,1,0,0,0,0|3,0,0]=4 537 B12R1.264 CC(O)C(C)NCC1CCCO1 a4d9c5bfd931972e78f145b8c52022df [0,1,0,0,0,0|2,0,1]=4 538 B12R1.264 CC(OCC1CCCO1)C(F)F 4739bf311589941f2353eff9d1cbaf70 [0,1,0,0,0,0|2,0,1]=4 539 B12R1.264 CC(S)C(=O)NCC1CCCC1 30d52e0f5ac45afa72701b15e9b959e7 [0,1,0,0,0,0|2,0,0]=3 540 B12R1.264 CC(S)C(=O)NCC1CCCO1 fe06a1cf1d7abcf60c1c3bf2c484c71f [0,1,0,0,0,0|1,0,0]=2 541 B12R1.264 CC(S)C(=O)NCC1CCOC1 585c2b36c4cd40480b2b72fe4eb0853f [0,1,0,0,0,0|3,0,0]=4 542 B12R1.264 CC(S)C(=O)NC[C@@H]1CCCO1 0cd18946b680383cb83801925418118d [0,1,0,0,0,0|1,0,0]=2 543 B12R1.264 CC(S)C(=O)NC[C@@H]1CCOC1 417f2ed673afc009ee937ef3bbad4b18 [0,1,0,0,0,0|3,0,0]=4 544 B12R1.264 CC(S)C(=O)NC[C@H]1CCCO1 3f219ac6ed12d907c794335dccb80a79 [0,1,0,0,0,0|1,0,0]=2 545 B12R1.264 CC(S)C(=O)NC[C@H]1CCOC1 4d0a4a8a63ea5bfecef60f3f8630349a [0,1,0,0,0,0|3,0,0]=4 546 B12R1.264 CC(S)C(C)OCC1CCCC1 279e34ff7345b413a3d9366036c40a99 [0,1,0,0,0,0|2,0,1]=4 547 B12R1.264 CC(S)C(C)OCC1CCCO1 353f0802bae6f8c37302cee097252739 [0,1,0,0,0,0|1,0,1]=3 548 B12R1.264 CN(C)C(=O)COC1CCCO1 ed1b1c065880251707e2497530467d51 [0,1,0,0,0,0|3,0,0]=4 549 B12R1.264 C[C@@H](F)C(=O)NCC1CCCC1 5c2df7b16e35c64802413a008ecc2811 [0,1,0,0,0,0|2,0,0]=3 550 B12R1.264 C[C@@H](F)C(=O)NCC1CCCO1 69497df72b2646fe032a2d817e722996 [0,1,0,0,0,0|1,0,0]=2 551 B12R1.264 C[C@@H](F)C(=O)NCC1CCOC1 2854cf3896112e9b1e1403bc21d8e35d [0,1,0,0,0,0|3,0,0]=4 552 B12R1.264 C[C@@H](F)C(=O)NC[C@@H]1CCCO1 d0a16c4142b21376d6de4aa8cc88e761 [0,1,0,0,0,0|1,0,0]=2 553 B12R1.264 C[C@@H](F)C(=O)NC[C@@H]1CCOC1 cc425789a8ab3160541742610d687919 [0,1,0,0,0,0|3,0,0]=4 554 B12R1.264 C[C@@H](F)C(=O)NC[C@H]1CCCO1 0237c03f2c31a39f65ab8f00f505c731 [0,1,0,0,0,0|1,0,0]=2 555 B12R1.264 C[C@@H](F)C(=O)NC[C@H]1CCOC1 9af302177b6e2bbfc2b3ed5c8ad70b2b [0,1,0,0,0,0|3,0,0]=4 556 B12R1.264 C[C@@H](O)C(=O)NCC1CCCC1 436d2f58915779627b060803865174d4 [0,1,0,0,0,0|2,0,0]=3 557 B12R1.264 C[C@@H](O)C(=O)NCC1CCCO1 b669f428afeb2ad5c5d781d3c6dca01e [0,1,0,0,0,0|1,0,0]=2 558 B12R1.264 C[C@@H](O)C(=O)NCC1CCOC1 da6e9beeb44c898e39079543f4d94286 [0,1,0,0,0,0|3,0,0]=4 559 B12R1.264 C[C@@H](O)C(=O)NC[C@@H]1CCCO1 0a21c6a4f3346c8c815c12c419bbe956 [0,1,0,0,0,0|1,0,0]=2 560 B12R1.264 C[C@@H](O)C(=O)NC[C@@H]1CCOC1 b43fd75945489233191e6f37afc0da92 [0,1,0,0,0,0|3,0,0]=4 561 B12R1.264 C[C@@H](O)C(=O)NC[C@H]1CCCO1 62316d9d0cb057fc4e375385f328c2ce [0,1,0,0,0,0|1,0,0]=2 562 B12R1.264 C[C@@H](O)C(=O)NC[C@H]1CCOC1 b030751dd9c61e88f2a06a9a6d377aad [0,1,0,0,0,0|3,0,0]=4 563 B12R1.264 C[C@H](F)C(=O)NCC1CCCC1 0fba2a3a354462fd728512e5edf5c358 [0,1,0,0,0,0|2,0,0]=3 564 B12R1.264 C[C@H](F)C(=O)NCC1CCCO1 872812a7b87058a660bd4dc665c13360 [0,1,0,0,0,0|1,0,0]=2 565 B12R1.264 C[C@H](F)C(=O)NCC1CCOC1 027f0f7ce17b4741f7d7ee2784eb3d34 [0,1,0,0,0,0|3,0,0]=4 566 B12R1.264 C[C@H](F)C(=O)NC[C@@H]1CCCO1 1a0e4a5b60d5241099200a3f773f2256 [0,1,0,0,0,0|1,0,0]=2 567 B12R1.264 C[C@H](F)C(=O)NC[C@@H]1CCOC1 766f8a231672bef216f6f2d2e85b41e4 [0,1,0,0,0,0|3,0,0]=4 568 B12R1.264 C[C@H](F)C(=O)NC[C@H]1CCCO1 a05c4278da46f8b09e16fea4435f248d [0,1,0,0,0,0|1,0,0]=2 569 B12R1.264 C[C@H](F)C(=O)NC[C@H]1CCOC1 188ca4b05981edaa79cd11ee0267c37a [0,1,0,0,0,0|3,0,0]=4 570 B12R1.264 C[C@H](O)C(=O)NCC1CCCC1 81328a278ab11dd7acc08d98b3eb0d01 [0,1,0,0,0,0|2,0,0]=3 571 B12R1.264 C[C@H](O)C(=O)NCC1CCCO1 2428abca2a1ac1a5ca1e2024dcbf2b53 [0,1,0,0,0,0|1,0,0]=2 572 B12R1.264 C[C@H](O)C(=O)NCC1CCOC1 ffb27ef8e74dc39a2ac7c15a06bb1cfa [0,1,0,0,0,0|3,0,0]=4 573 B12R1.264 C[C@H](O)C(=O)NC[C@@H]1CCCO1 2235cdb6f1a837a09cb3de8dd6c14852 [0,1,0,0,0,0|1,0,0]=2 574 B12R1.264 C[C@H](O)C(=O)NC[C@@H]1CCOC1 a650b06a78d6cd11c44d85081529ef2f [0,1,0,0,0,0|3,0,0]=4 575 B12R1.264 C[C@H](O)C(=O)NC[C@H]1CCCO1 72cc62039bfee7111c2abe42a376d95a [0,1,0,0,0,0|1,0,0]=2 576 B12R1.264 C[C@H](O)C(=O)NC[C@H]1CCOC1 ca1f76da8debe74137c11a10fc5e733d [0,1,0,0,0,0|3,0,0]=4 577 B12R1.264 NC(=O)C(=O)NCC1CCCO1 166a808aa52087c1e63cca07f61c9e74 [0,1,0,0,0,0|2,0,1]=4 578 B12R1.264 NC(=O)C(=O)NC[C@@H]1CCCO1 30e5b36a6226030b76a02a6be98eb4f6 [0,1,0,0,0,0|2,0,1]=4 579 B12R1.264 NC(=O)C(=O)NC[C@H]1CCCO1 211c78bbd9e32b2384a4f9fa2681d6e2 [0,1,0,0,0,0|2,0,1]=4 580 B12R1.264 O=C(COC1CCCO1)C(F)F a2ad742d9b64fd9f0ec0becf449bf079 [0,1,0,0,0,0|3,0,0]=4 581 B12R1.264 O=C(NCC1CCCC1)C(F)F ddb6fe71273b08effda6dbbc6624ce04 [0,1,0,0,0,0|3,0,0]=4 582 B12R1.264 O=C(NCC1CCCC1)C(O)O 1a6ba73eb2fd4ee19b91cc8e2d8d2f30 [0,1,0,0,0,0|3,0,0]=4 583 B12R1.264 O=C(NCC1CCCO1)C(F)F f493bb0b941000293e3906ab5d3b7af0 [0,1,0,0,0,0|2,0,0]=3 584 B12R1.264 O=C(NCC1CCCO1)C(O)O 38106c30c8353893143c8445b5398bbf [0,1,0,0,0,0|2,0,0]=3 585 B12R1.264 O=C(NC[C@@H]1CCCO1)C(F)F 0770a94d74d4fdd377d737b19c804720 [0,1,0,0,0,0|2,0,0]=3 586 B12R1.264 O=C(NC[C@@H]1CCCO1)C(O)O 251a1f0fa5313b9c9e5a81254ae7e607 [0,1,0,0,0,0|2,0,0]=3 587 B12R1.264 O=C(NC[C@H]1CCCO1)C(F)F 4e231dbbc95f49e504120b67f63aed97 [0,1,0,0,0,0|2,0,0]=3 588 B12R1.264 O=C(NC[C@H]1CCCO1)C(O)O 146e7e8cbb27521565ca07e1f6c84350 [0,1,0,0,0,0|2,0,0]=3 589 B12R1.297 BrCC(CBr)OCC1CCCO1 0e757c484252a6abbad47484ad314b89 [0,1,0,0,0,0|2,0,1]=4 590 B12R1.297 C#CC(CC)OCC1CCCC1 83b0397042ce9609e83e37862ebf6155 [0,1,0,0,0,0|2,0,1]=4 591 B12R1.297 C#CC(CC)OCC1CCCO1 16b025521e60c25cbdef351423194950 [0,1,0,0,0,0|1,0,1]=3 592 B12R1.297 C=CC(CC)OCC1CCCC1 6565d376ed15ba24f97aedb5be36f5f6 [0,1,0,0,0,0|2,0,1]=4 593 B12R1.297 C=CC(CC)OCC1CCCO1 d0b22bcb96ae72bbf40e7e5590146510 [0,1,0,0,0,0|1,0,1]=3 594 B12R1.297 CCC(C#N)OCC1CCCC1 21e1e1cc578e9ea964113d3949a38d5b [0,1,0,0,0,0|2,0,1]=4 595 B12R1.297 CCC(C#N)OCC1CCCO1 8a7809cfda4d666e98d3c632025c9470 [0,1,0,0,0,0|1,0,1]=3 596 B12R1.297 CCC(C=O)NCC1CCCC1 2202bda39a94a4bd820c0e8907a7dac8 [0,1,0,0,0,0|2,0,1]=4 597 B12R1.297 CCC(C=O)NCC1CCCO1 e07a656112493fcd845bf4a7bdb18c89 [0,1,0,0,0,0|1,0,1]=3 598 B12R1.297 CCC(C=O)NC[C@@H]1CCCO1 bb37d05a620bb75e94c5d0834aff2335 [0,1,0,0,0,0|1,0,1]=3 599 B12R1.297 CCC(C=O)NC[C@H]1CCCO1 8716797416ee7e45dda60fa93ba583ea [0,1,0,0,0,0|1,0,1]=3 600 B12R1.297 CCC(C=O)OCC1C=CCC1 c150cbb715d75dfc59c109933a081bd0 [0,1,0,0,0,0|1,0,2]=4 601 B12R1.297 CCC(C=O)OCC1CCCC1 2b119f4248afac6f96e2b9d89f0c7605 [0,1,0,0,0,0|1,0,1]=3 602 B12R1.297 CCC(C=O)OCC1CCCO1 b9df560a7e33280e7f1fdd19f4359cb9 [0,1,0,0,0,0|0,0,1]=2 603 B12R1.297 CCC(C=O)OCC1CCCS1 fa9f128d8819a52695d5b87482c6ea90 [0,1,0,0,0,0|0,1,1]=3 604 B12R1.297 CCC(C=O)OCC1CCOC1 cc0da51f26f46bcbd98845fe2d8832af [0,1,0,0,0,0|2,0,1]=4 605 B12R1.297 CCC(C=O)OCN1CCCC1 845cbec9b3cda86e2523a4a8a657d91b [0,1,0,0,0,0|2,0,1]=4 606 B12R1.297 CCC(C=O)OC[C@@H]1CCCO1 2d2cc63b5f3cf6014b40144f03225fe3 [0,1,0,0,0,0|0,0,1]=2 607 B12R1.297 CCC(C=O)OC[C@@H]1CCOC1 64548708995abbae70be573427cd0a19 [0,1,0,0,0,0|2,0,1]=4 608 B12R1.297 CCC(C=O)OC[C@H]1CCCO1 117076abe5d5da6412dcb60757128d97 [0,1,0,0,0,0|0,0,1]=2 609 B12R1.297 CCC(C=O)OC[C@H]1CCOC1 3aa86436235c89e7089548b8ef661a05 [0,1,0,0,0,0|2,0,1]=4 610 B12R1.297 CCC(CC)NCC1CCCO1 4e486ca8ad0cb5b69ce1449efee8c54b [0,1,0,0,0,0|2,0,1]=4 611 B12R1.297 CCC(CC)NC[C@@H]1CCCO1 8ac46cafc2b0b570c1250877060e5238 [0,1,0,0,0,0|2,0,1]=4 612 B12R1.297 CCC(CC)NC[C@H]1CCCO1 3e1c303c54196cf230bb7653eeb86d41 [0,1,0,0,0,0|2,0,1]=4 613 B12R1.297 CCC(CC)OCC1CCCC1 aff1fcc8d3d79a73955432deb50e3171 [0,1,0,0,0,0|2,0,1]=4 614 B12R1.297 CCC(CC)OCC1CCCO1 8ad351f5ac0252e3159ca6d9c8f0388a [0,1,0,0,0,0|1,0,1]=3 615 B12R1.297 CCC(CC)OCC1CCCS1 9d6d5afd4ddb8ddc61f8e7f011df2dc0 [0,1,0,0,0,0|1,1,1]=4 616 B12R1.297 CCC(CC)OC[C@@H]1CCCO1 2be0b27ecc5a8f6cd633a1d24d71d53b [0,1,0,0,0,0|1,0,1]=3 617 B12R1.297 CCC(CC)OC[C@H]1CCCO1 c31f0b5295f79c75c86a4050e31ea403 [0,1,0,0,0,0|1,0,1]=3 618 B12R1.297 CCC(CO)NCC1CCCO1 81d8022eb7abfe9707d8b104e3c25de5 [0,1,0,0,0,0|1,0,2]=4 619 B12R1.297 CCC(CO)NC[C@@H]1CCCO1 60c93a0fcf8aacbcf23fddfbd7a81600 [0,1,0,0,0,0|1,0,2]=4 620 B12R1.297 CCC(CO)NC[C@H]1CCCO1 df70be5f3f7bdc511a49e4849bb00d29 [0,1,0,0,0,0|1,0,2]=4 621 B12R1.297 CC[C@@H](CO)NCC1CCCO1 6228e1f6527c52f5f815c776bbb7473f [0,1,0,0,0,0|1,0,2]=4 622 B12R1.297 CC[C@H](CO)NCC1CCCO1 65ece28ecce3bcfdad312c76f94e5de2 [0,1,0,0,0,0|1,0,2]=4 623 B12R1.297 ClCC(CBr)OCC1CCCO1 45b7141d133ecc049bd0e94f7458857e [0,1,0,0,0,0|2,0,1]=4 624 B12R1.297 ClCC(CCl)OCC1CCCO1 c2d8cfddff4c08a8cffd6ba322cc3a53 [0,1,0,0,0,0|2,0,1]=4 625 B12R1.297 ClC[C@@H](CI)OCC1CCCO1 6b655c985ceb5b3d3ebcbed7b4573021 [0,1,0,0,0,0|2,0,1]=4 626 B12R1.297 ClC[C@H](CI)OCC1CCCO1 039be9bad712e488634c022ad176a72b [0,1,0,0,0,0|2,0,1]=4 627 B12R1.297 FCC(CF)OCC1CCCO1 e20e5d788c023e2270f4b79173953f4d [0,1,0,0,0,0|2,0,1]=4 628 B12R1.297 FCC(CF)OC[C@@H]1CCCO1 a2e443ef419cbb0de9cd3c421fcbb62c [0,1,0,0,0,0|2,0,1]=4 629 B12R1.297 FCC(CF)OC[C@H]1CCCO1 3615ca7812bfced4cc548cda5cc48eef [0,1,0,0,0,0|2,0,1]=4 630 B12R1.297 N#CC(C=O)OCC1CCCO1 1996670e3a0604c79924ee5c6e0c2cb6 [0,1,0,0,0,0|1,0,2]=4 631 B12R1.297 N#CC(C=O)OC[C@@H]1CCCO1 9e8701232fd44c9e7042357c3bebf7df [0,1,0,0,0,0|1,0,2]=4 632 B12R1.297 N#CC(C=O)OC[C@H]1CCCO1 92570f3744477d0f081b28f02a4acea4 [0,1,0,0,0,0|1,0,2]=4 633 B12R1.297 O=CC(C=O)OCC1CCCO1 dca8850d7b43babb2239717d120162d3 [0,1,0,0,0,0|1,0,2]=4 634 B12R1.297 O=CC(C=O)OC[C@@H]1CCCO1 808e3157b12f3b621eae193887acd448 [0,1,0,0,0,0|1,0,2]=4 635 B12R1.297 O=CC(C=O)OC[C@H]1CCCO1 6b7fcf82f6278db1b583f2aac057f1f5 [0,1,0,0,0,0|1,0,2]=4 636 B12R1.297 OCC(CO)OCC1CCCO1 ea5f7ba8bc21805abb83ca29d7664eee [0,1,0,0,0,0|1,0,2]=4 637 B12R1.297 OCC(CO)OC[C@@H]1CCCO1 a63274de72c5db8780d0ab6d5d198f19 [0,1,0,0,0,0|1,0,2]=4 638 B12R1.297 OCC(CO)OC[C@H]1CCCO1 bc41fa91da05b856d2f3f3050590b604 [0,1,0,0,0,0|1,0,2]=4 639 B12R1.353 CCC(=O)CNC1CCCC1O 8d882fa44e0bd4b1dc1bb6caa79eebbe [0,1,0,0,0,0|3,0,0]=4 640 B12R1.353 CCC(=O)CN[C@@H]1CCC[C@@H]1O 6c24ef43ab1005266682f198506d3567 [0,1,0,0,0,0|3,0,0]=4 641 B12R1.353 CCC(=O)CN[C@@H]1CCC[C@H]1O c0fb0764ab7bcafe67cbb646efb89aba [0,1,0,0,0,0|3,0,0]=4 642 B12R1.353 CCC(=O)CN[C@H]1CCC[C@@H]1O 71c339f6651e40bc66a6d2fe46ec8855 [0,1,0,0,0,0|3,0,0]=4 643 B12R1.353 CCC(=O)CN[C@H]1CCC[C@H]1O d28873d749b47feb1e4ae3451e3af85c [0,1,0,0,0,0|3,0,0]=4 644 B12R1.353 CCC(=O)COC1CCCC1=O 779788e35e5153299dea538d141dfd11 [0,1,0,0,0,0|3,0,0]=4 645 B12R1.353 CCC(=O)COC1CCCC1C 86ab1d0a96237a58d9951a7df77f1d96 [0,1,0,0,0,0|3,0,0]=4 646 B12R1.353 CCC(=O)CO[C@@H]1CCC[C@@H]1C 0b478ff0a3e5f4f2333350271987a78f [0,1,0,0,0,0|3,0,0]=4 647 B12R1.353 CCC(=O)CO[C@@H]1CCC[C@H]1C 900a89e389d5dc2474c4c9a1e816c40c [0,1,0,0,0,0|3,0,0]=4 648 B12R1.353 CCC(=O)CO[C@@H]1CCC[C@H]1F a7b1db8846a1096698dc26e66040d49f [0,1,0,0,0,0|3,0,0]=4 649 B12R1.353 CCC(=O)CO[C@H]1CCC[C@@H]1C ed4203b528da59cb5c5af891f6a2d6e7 [0,1,0,0,0,0|3,0,0]=4 650 B12R1.353 CCC(=O)CO[C@H]1CCC[C@H]1C 10ee2c8d249454ec529953b400846820 [0,1,0,0,0,0|3,0,0]=4 651 B12R1.353 CCC(=O)NCC1CCCC1O ab314c67c93fbeea965595dfdbef4847 [0,1,0,0,0,0|2,0,0]=3 652 B12R1.353 CCC(=O)NCC1CCCN1C ffcbaf126849421e52982a5160000fe7 [0,1,0,0,0,0|2,0,0]=3 653 B12R1.353 CCC(=O)NCC1CCNC1=O 7abbb25e34b88280849bb344371a1db2 [0,1,0,0,0,0|3,0,0]=4 654 B12R1.353 CCC(=O)NC[C@@H]1CCCN1C a57f9da814390f70a80c556561317af5 [0,1,0,0,0,0|2,0,0]=3 655 B12R1.353 CCC(=O)NC[C@@H]1COC[C@@H]1O ce306e347e033be3722d219e4b5d61a1 [0,1,0,0,0,0|3,0,0]=4 656 B12R1.353 CCC(=O)NC[C@H]1CCCN1C c633923afd7f5f139e8a064e96a30225 [0,1,0,0,0,0|2,0,0]=3 657 B12R1.353 CCC(=O)OCN1CCCC1C 2aea3bfc566405311c280166aa9512b1 [0,1,0,0,0,0|2,0,0]=3 658 B12R1.353 CCC(=O)OCN1CCCC1O a7bd6423c45e03354122bd25e7cfcf94 [0,1,0,0,0,0|2,0,0]=3 659 B12R1.353 CCC(=O)OCN1CCC[C@@H]1C 21911b8545a89fc4d317b31d212391ac [0,1,0,0,0,0|2,0,0]=3 660 B12R1.353 CCC(=O)OCN1CCC[C@H]1C b31141efc1b96adfcd6c2c7999fa9f99 [0,1,0,0,0,0|2,0,0]=3 661 B12R1.353 CCC(=O)OCN1CCSC1C c4a7b5b0e118a1a7123fe2a0a0d60306 [0,1,0,0,0,0|3,0,0]=4 662 B12R1.353 CCC(C)OCC1CCCC1=O 37454923ba302bffb23791918d6b0833 [0,1,0,0,0,0|2,0,1]=4 663 B12R1.353 CCC(C)OCC1CCCC1C 420bb18f4ba0731d821cc7078ed3f53d [0,1,0,0,0,0|2,0,1]=4 664 B12R1.353 CCC(C)OCC1CCCN1C f0ac84593b0b0fcfd82eb57e8a467ea3 [0,1,0,0,0,0|2,0,1]=4 665 B12R1.353 CCC(C)OCC1OCCC1C d0ef56d94e3ff4922c657795ab20cff6 [0,1,0,0,0,0|1,0,1]=3 666 B12R1.353 CCC(C)OC[C@@H]1CCCN1C 2d4c3084035d1be0da8e70f3931b565d [0,1,0,0,0,0|2,0,1]=4 667 B12R1.353 CCC(C)OC[C@@H]1CCC[C@H]1F 54a5c0934c184f54c447bcd49b5412a8 [0,1,0,0,0,0|2,0,1]=4 668 B12R1.353 CCC(C)OC[C@H]1CCCN1C 2337877c92c3c75184cc6eaed2c9cc0b [0,1,0,0,0,0|2,0,1]=4 669 B12R1.353 CN1CCCC1CNC(=O)CF 678b24e5ed7174771ef33ccb7ba1cb71 [0,1,0,0,0,0|3,0,0]=4 670 B12R1.353 CN1CCCC1CNC(=O)CO 83afc7f108de3ed16020018b8459b78e [0,1,0,0,0,0|3,0,0]=4 671 B12R1.353 CN1CCCC1CNC(=O)CS f4d850f4833bca923a062cdf2379b4a1 [0,1,0,0,0,0|3,0,0]=4 672 B12R1.353 CN1CCC[C@@H]1CNC(=O)CF ff35c8a43d101f51f8b1554c74a38ec6 [0,1,0,0,0,0|3,0,0]=4 673 B12R1.353 CN1CCC[C@@H]1CNC(=O)CO ce606076c08092b2ce0301108db34339 [0,1,0,0,0,0|3,0,0]=4 674 B12R1.353 CN1CCC[C@@H]1CNC(=O)CS 1491e29ecb8b57b63a201fb97f9b2002 [0,1,0,0,0,0|3,0,0]=4 675 B12R1.353 CN1CCC[C@H]1CNC(=O)CF e4910ddc0120e9c085e2bf63113bc742 [0,1,0,0,0,0|3,0,0]=4 676 B12R1.353 CN1CCC[C@H]1CNC(=O)CO 8a96bacc0d020ea32f06e9432b08c270 [0,1,0,0,0,0|3,0,0]=4 677 B12R1.353 CN1CCC[C@H]1CNC(=O)CS 1d48fb7b2fe59406e67b28a7fc314701 [0,1,0,0,0,0|3,0,0]=4 678 B12R1.353 COC(=O)OCN1CCCC1C 03af4e306f88e34e55bf81495f1ceb63 [0,1,0,0,0,0|3,0,0]=4 679 B12R1.353 COC(=O)OCN1CCCC1O c8d99c46df370dda9448de72cb4d6f25 [0,1,0,0,0,0|3,0,0]=4 680 B12R1.353 COC(=O)OCN1CCC[C@@H]1C ccc7e0631286fc9bdb3c81b9a4110d2e [0,1,0,0,0,0|3,0,0]=4 681 B12R1.353 COC(=O)OCN1CCC[C@H]1C 941935b25dc194a9b1a978f76d3fe80e [0,1,0,0,0,0|3,0,0]=4 682 B12R1.353 O=C(CF)NCC1CCCC1O 01944c6fc66cf6f07dec1a4ea5315745 [0,1,0,0,0,0|3,0,0]=4 683 B12R1.353 O=C(CO)NCC1CCCC1O cbf814a1531e1a527ca9b1a213570ac7 [0,1,0,0,0,0|3,0,0]=4 684 B12R1.353 O=C(CS)NCC1CCCC1O 7906bed4767a1fa7231326c3b16fd837 [0,1,0,0,0,0|3,0,0]=4 685 B12R1.1677 C#CC(=O)NCC1(CCCO1)C a0b7663c85006c368a505abeff706526 [0,1,0,0,0,0|1,0,2]=4 686 B12R1.1677 C=CC(=O)NCC1(CCCO1)C 8ec1ec1a2424730ed8f697158c73695f [0,1,0,0,0,0|1,0,2]=4 687 B12R1.1677 CC1(CCCC1)CNC(=O)CF 585ab8b557486ac423f5bc41b6cbca1c [0,1,0,0,0,0|3,0,0]=4 688 B12R1.1677 CC1(CCCC1)CNC(=O)CO 19bce96220c6e4f15bf18edb7c7bba5d [0,1,0,0,0,0|3,0,0]=4 689 B12R1.1677 CC1(CCCC1)CNC(=O)CS c53f80df792d85e3877ae8a38809cb6e [0,1,0,0,0,0|3,0,0]=4 690 B12R1.1677 CC1(CCCO1)CNC(=O)C=O afd78154c71dd0690403e73f9f708a1f [0,1,0,0,0,0|2,0,1]=4 691 B12R1.1677 CC1(CCCO1)CNC(=O)CF 98edfad58301e03de1d89c59d56af4f4 [0,1,0,0,0,0|2,0,0]=3 692 B12R1.1677 CC1(CCCO1)CNC(=O)CO 3465cfadb558f74f5d39a040c8fa16b4 [0,1,0,0,0,0|2,0,0]=3 693 B12R1.1677 CC1(CCCO1)CNC(=O)CS 178f92f7049ddca8a3e0001bb2ff8929 [0,1,0,0,0,0|2,0,0]=3 694 B12R1.1677 CCC(=O)CNC1(CCCC1)C eed37aa67ee3602fd4919656dbf04a39 [0,1,0,0,0,0|3,0,0]=4 695 B12R1.1677 CCC(=O)NCC1(CCCC1)C e3f15b72ec47bc664c9c1ef24922392e [0,1,0,0,0,0|2,0,0]=3 696 B12R1.1677 CCC(=O)NCC1(CCCC1)F de4c39c5d26392d8c279c1b37d8e827a [0,1,0,0,0,0|2,0,0]=3 697 B12R1.1677 CCC(=O)NCC1(CCCC1)O a70ddcc2f1f48b69bbeb3da0ec03b416 [0,1,0,0,0,0|2,0,0]=3 698 B12R1.1677 CCC(=O)NCC1(CCCO1)C af9cc4963decb2e314591c01076d188c [0,1,0,0,0,0|1,0,0]=2 699 B12R1.1677 CCC(=O)NCC1(CCOC1)C 259b49eb6fe8dfc142ecd2e54f204932 [0,1,0,0,0,0|3,0,0]=4 700 B12R1.1677 CCC(=O)NCC1(CCOC1)O 854c0c25b2e8cdc073673d1ef064d66d [0,1,0,0,0,0|3,0,0]=4 701 B12R1.1677 CCC(C)NCC1(CCCO1)C 73afceccdcc998edcdd1da19c7c68a07 [0,1,0,0,0,0|2,0,1]=4 702 B12R1.1677 CCC(C)OCC1(CCCC1)C 2b855db3d970506aa9b69f89c569e20d [0,1,0,0,0,0|2,0,1]=4 703 B12R1.1677 CCC(C)OCC1(CCCC1)F 03fa59948be6abb20842ad2a263526cd [0,1,0,0,0,0|2,0,1]=4 704 B12R1.1677 CCC(C)OCC1(CCCO1)C c863bef6d67e48f4ac25c05d88a3d339 [0,1,0,0,0,0|1,0,1]=3 705 B12R1.1677 CC[C@@H](C)OCC1(CCCC1)C 53f28a6dfc80caef8bc5dd117ae68b15 [0,1,0,0,0,0|2,0,1]=4 706 B12R1.1677 CC[C@@H](C)OCC1(CCCC1)F f66ce863502aeb74a35fd161ac926bdd [0,1,0,0,0,0|2,0,1]=4 707 B12R1.1677 CC[C@H](C)OCC1(CCCC1)C 231dd899f82e691f28cbf53decd77a71 [0,1,0,0,0,0|2,0,1]=4 708 B12R1.1677 CC[C@H](C)OCC1(CCCC1)F a9c8e01a405e8bbfa8e6c18cd0d19ebf [0,1,0,0,0,0|2,0,1]=4 709 B12R1.1677 O=C(CF)NCC1(CCCC1)F 4818b9bc39d977bd149abc3cd6855f94 [0,1,0,0,0,0|3,0,0]=4 710 B12R1.1677 O=C(CF)NCC1(CCCC1)O e6721daa572da25d1ed4398fe7215201 [0,1,0,0,0,0|3,0,0]=4 711 B12R1.1677 O=C(CO)NCC1(CCCC1)F a9a3a7e1d43b64d5fe35c222d7c0ac9d [0,1,0,0,0,0|3,0,0]=4 712 B12R1.1677 O=C(CO)NCC1(CCCC1)O fe0f5b49ae7ea7c54047bb27110ae4f0 [0,1,0,0,0,0|3,0,0]=4 713 B12R1.1677 O=C(CS)NCC1(CCCC1)F fef0db9e1974a1f70fefb038e73523db [0,1,0,0,0,0|3,0,0]=4 714 B12R1.1677 O=C(CS)NCC1(CCCC1)O fe76737a5141651b4814424ae0d6a681 [0,1,0,0,0,0|3,0,0]=4 715 B10R0.45 CCC(=O)CNC(CC)CC b5677abb631c8e601604e41fa46302ba [0,0,1,0,0,0|3,0,0]=4 716 B10R0.45 CCC(=O)COC(CC)CC 457b963a51515bca2b5971d0fc888cb9 [0,0,1,0,0,0|3,0,0]=4 717 B10R0.45 CCC(=O)NCC(CC)CC c63b81ac2eb539585cc18775ceb5435f [0,0,1,0,0,0|2,0,0]=3 718 B10R0.45 CCC(=O)NCC(CC)CO f2f9690f6a8af9a096c4f2a8f1d10e9e [0,0,1,0,0,0|3,0,0]=4 719 B10R0.45 CCC(=O)NCC(OC)OC 305073a00454bdea0e67c56b7cc2365c [0,0,1,0,0,0|2,0,0]=3 720 B10R0.45 CCC(=O)NC[C@H](CO)OC b1f92f2e21da5a9696829fa58ba29f11 [0,0,1,0,0,0|2,0,0]=3 721 B10R0.45 CCC(C)OCC(CC)OC 56a50c826e4050359933b83176914abc [0,0,1,0,0,0|1,0,1]=3 722 B10R0.45 CCC(C)OCC(OC)OC fc2bdd347b4c32f4a55fbe9002f821cb [0,0,1,0,0,0|2,0,1]=4 723 B10R0.45 CCC(CC)CNC(=O)CF 0db34e47a5b08c56e7ca71f408474bac [0,0,1,0,0,0|3,0,0]=4 724 B10R0.45 CCC(CC)CNC(=O)CO 488cd5ac975b7311ef5251701d17b9df [0,0,1,0,0,0|3,0,0]=4 725 B10R0.45 CCC(CC)CNC(=O)CS 8189402eddfa6f8736af10231198cb38 [0,0,1,0,0,0|3,0,0]=4 726 B10R0.45 CCC(CC)COC(C)CC 9ab979fc13886e055505adb53315afbb [0,0,1,0,0,0|2,0,1]=4 727 B10R0.45 CCC(CC)CO[C@@H](C)CC a649cf4be3a36031b32a9125e49a4f4f [0,0,1,0,0,0|2,0,1]=4 728 B10R0.45 CCC(CC)CO[C@H](C)CC dcd304edbd5285d1a17d68e8718f78cd [0,0,1,0,0,0|2,0,1]=4 729 B10R0.45 CC[C@@H](C)OCC(OC)OC a63a72f7d6ff97c0aba5557e29080db1 [0,0,1,0,0,0|2,0,1]=4 730 B10R0.45 CC[C@H](C)OCC(OC)OC fb1e827d2a93eefabcbea061b8e710a5 [0,0,1,0,0,0|2,0,1]=4 731 B10R0.45 COC(CNC(=O)CF)OC 4d232449dff9729d3abf37b223a48a82 [0,0,1,0,0,0|3,0,0]=4 732 B10R0.45 COC(CNC(=O)CO)OC 8037d48d6a30193757cc677140e66f51 [0,0,1,0,0,0|3,0,0]=4 733 B10R0.45 COC(CNC(=O)CS)OC c2605f7a7f708ebab7a5a23e46855bbc [0,0,1,0,0,0|3,0,0]=4 734 B10R0.45 CO[C@@H](CO)CNC(=O)CF cc7199a455d414bb8c35e94d29d23228 [0,0,1,0,0,0|3,0,0]=4 735 B10R0.45 CO[C@@H](CO)CNC(=O)CO 675bf0fd7826c9d5b68bc85732536a1f [0,0,1,0,0,0|3,0,0]=4 736 B10R0.45 CO[C@@H](CO)CNC(=O)CS 16ab7236b2a3b96dbacbe8e6a097111a [0,0,1,0,0,0|3,0,0]=4 737 B10R0.74 C#CC(=O)NCCCCCO 78ae8ebf48e66c623f7ebe96afd1b089 [0,0,1,0,0,0|1,0,2]=4 738 B10R0.74 C#CC(=O)NCCOCCC 9b3bdb9245cd962112137111d214f9c0 [0,0,1,0,0,0|1,0,2]=4 739 B10R0.74 C#CCCCCNC(=O)CC 905ddcf3dfdb08776af0009f7eb22b15 [0,0,1,0,0,0|2,0,1]=4 740 B10R0.74 C#CCCNCOC(=O)CC 63fb0bc677fd1dbf16d22325ff00bd2c [0,0,1,0,0,0|2,0,1]=4 741 B10R0.74 C#CCCOCOC(=O)CC 6605460fe2dd7b4ef5a76babfdfa4d74 [0,0,1,0,0,0|2,0,1]=4 742 B10R0.74 C#CCOCCNC(=O)CC 489f1b0b7fa9b6858d3de4f64d91f0ef [0,0,1,0,0,0|1,0,2]=4 743 B10R0.74 C#CCOCCOC(=O)CC b64f2b242877dc7c7d86e43c2819d350 [0,0,1,0,0,0|0,0,2]=3 744 B10R0.74 C#CCOCCOC(=O)OC f10a0aa75b2ba43fd7c87c198345ac6d [0,0,1,0,0,0|1,0,2]=4 745 B10R0.74 C=C(C=O)OCCOCCC 654023781d9a6da849a330900fdeef06 [0,0,1,0,0,0|2,0,1]=4 746 B10R0.74 C=C(CC)CNCCCCO 115dc04ff66cb402e13c6336ff0d4066 [0,0,1,0,0,0|3,0,0]=4 747 B10R0.74 C=CC(=O)CCCOCCC 2f1f5ed625ae1d833f97ac1c8ad75a3e [0,0,1,0,0,0|1,0,2]=4 748 B10R0.74 C=CC(=O)NCCCCCO ce222738eaf189ce2ba47ad69dacec89 [0,0,1,0,0,0|1,0,2]=4 749 B10R0.74 C=CC(=O)NCCOCCC 66bf7ac7732e825d411a87372c0e16bf [0,0,1,0,0,0|1,0,2]=4 750 B10R0.74 C=CC(=O)OCCNCCC dc3d9fb28749e0db9da8f5b756c6273e [0,0,1,0,0,0|1,0,2]=4 751 B10R0.74 C=CC(=O)OCCNCCO bd26696c4c29f49b7b57d308fc4d387b [0,0,1,0,0,0|1,0,2]=4 752 B10R0.74 C=CC(=O)OCCOCCC 58d9a252ddc93e7a4f2569b1795784b6 [0,0,1,0,0,0|0,0,2]=3 753 B10R0.74 C=CC(=O)OCCOCCF e5b82dc622866e9186eaae6bebd8851c [0,0,1,0,0,0|1,0,2]=4 754 B10R0.74 C=CC(=O)OCCOCCS 6c50ffe865b024ce346420237354f979 [0,0,1,0,0,0|1,0,2]=4 755 B10R0.74 C=CC(=O)OCCOCOC 0c2c41aacfcef9111f174c007434f19f [0,0,1,0,0,0|1,0,2]=4 756 B10R0.74 C=CC(=O)OCCOCSC e9db31c6feaf7d57d1cfc9e44722f53a [0,0,1,0,0,0|1,0,2]=4 757 B10R0.74 C=CCCCCNC(=O)CC 100c7380435002fc66a3df3f6174cb33 [0,0,1,0,0,0|2,0,1]=4 758 B10R0.74 C=CCCNCOC(=O)CC ce9afddea68cafc4784f4d9ab8188256 [0,0,1,0,0,0|2,0,1]=4 759 B10R0.74 C=CCCOCOC(=O)CC a146581b06b884e09651af0166d94113 [0,0,1,0,0,0|2,0,1]=4 760 B10R0.74 C=CCOCCNC(=O)CC 059fbbd5cadaa8cce60a5a727ba3feac [0,0,1,0,0,0|1,0,2]=4 761 B10R0.74 C=CCOCCOC(=O)CC 2e7e6ea791520486a4468b3dc7280dcf [0,0,1,0,0,0|0,0,2]=3 762 B10R0.74 C=CCOCCOC(=O)OC 18c27afc3a61cf1a80947f6222ef7c23 [0,0,1,0,0,0|1,0,2]=4 763 B10R0.74 CCC(=O)CNCCCCCl 58b326e56bd105b75957a3417ada4b94 [0,0,1,0,0,0|3,0,0]=4 764 B10R0.74 CCC(=O)CNCCCCO afa336155d3d50267b56893fb4eea6a2 [0,0,1,0,0,0|2,0,0]=3 765 B10R0.74 CCC(=O)CNCCCCS 89d3a8e0e76cf4458dea73594882c77e [0,0,1,0,0,0|2,1,0]=4 766 B10R0.74 CCC(=O)COCCCCF 4256b82eb7b4015a55aaae3b4f33c831 [0,0,1,0,0,0|3,0,0]=4 767 B10R0.74 CCC(=O)COCCCCS 6565f26a778339bd381373257b145382 [0,0,1,0,0,0|2,1,0]=4 768 B10R0.74 CCC(=O)NCCCCC#N 720d6d1e9d467d505504d4e767692fea [0,0,1,0,0,0|2,0,1]=4 769 B10R0.74 CCC(=O)NCCCCCCl 719912c2fc32999aaca586ce6a33a4fc [0,0,1,0,0,0|2,0,0]=3 770 B10R0.74 CCC(=O)NCCCCCO 1c6fabc29010351852246ff1decd06a1 [0,0,1,0,0,0|1,0,0]=2 771 B10R0.74 CCC(=O)NCCCCOC 304fb086e3dbdc4472ef768bd3e17d25 [0,0,1,0,0,0|3,0,0]=4 772 B10R0.74 CCC(=O)NCCCCSC e2aaa2c9252a2834ce862f0cb7545c18 [0,0,1,0,0,0|3,0,0]=4 773 B10R0.74 CCC(=O)NCCNCCF fd25c97c5eb8a1172b86ccaa5061596f [0,0,1,0,0,0|3,0,0]=4 774 B10R0.74 CCC(=O)NCCNCCO ba12937f5401ba778b8513ef4b4fc91e [0,0,1,0,0,0|2,0,0]=3 775 B10R0.74 CCC(=O)NCCNCCS 16d2dc47cbcafd15a354c934e01318cf [0,0,1,0,0,0|2,1,0]=4 776 B10R0.74 CCC(=O)NCCNCOC 9952a345c9a8cdd34adffb1944c6583a [0,0,1,0,0,0|3,0,0]=4 777 B10R0.74 CCC(=O)NCCNCSC 1f89b175f4a6052942478ab519ca7a93 [0,0,1,0,0,0|3,0,0]=4 778 B10R0.74 CCC(=O)NCCOCC#N 91eb6568972acb3d1fb318925116c550 [0,0,1,0,0,0|2,0,1]=4 779 B10R0.74 CCC(=O)NCCOCC=O 072367443bd0c933e25dac832d2b5637 [0,0,1,0,0,0|2,0,1]=4 780 B10R0.74 CCC(=O)NCCOCCF 9aab78011bfd00861df1eb2b3213a78e [0,0,1,0,0,0|2,0,0]=3 781 B10R0.74 CCC(=O)NCCOCCO daf4c2cc3bcbeca643ffd0a9313a2e7b [0,0,1,0,0,0|2,0,0]=3 782 B10R0.74 CCC(=O)NCCOCCS 8e0cea67279d82f3f36c10876f639d56 [0,0,1,0,0,0|2,0,0]=3 783 B10R0.74 CCC(=O)NCCOCOC cc0047c265870a2ef78ee1130fdac00d [0,0,1,0,0,0|2,0,0]=3 784 B10R0.74 CCC(=O)NCCOCSC b7d157b0d453a2190330c83a1a4ecc78 [0,0,1,0,0,0|2,0,0]=3 785 B10R0.74 CCC(=O)NCCSCCO b08969d3025803381e2ce07c6d765d5c [0,0,1,0,0,0|2,0,0]=3 786 B10R0.74 CCC(=O)OCCOCC#N f571c09afb49ea7fd8de9d433651645b [0,0,1,0,0,0|1,0,1]=3 787 B10R0.74 CCC(=O)OCCOCC=O 5a0aeb87cb5895fedfe8179b99fec552 [0,0,1,0,0,0|1,0,1]=3 788 B10R0.74 CCC(=O)OCCOCCF 75e8b54fcf29a0e03136f1625a8b73df [0,0,1,0,0,0|1,0,0]=2 789 B10R0.74 CCC(=O)OCCOCCS ffcfb497b0e8e847d2aae5949bcc3b02 [0,0,1,0,0,0|1,0,0]=2 790 B10R0.74 CCC(=O)OCCOCOC b0cf2670be1c51cb7d28b494dab7a281 [0,0,1,0,0,0|1,0,0]=2 791 B10R0.74 CCC(=O)OCCOCSC 53ccdfd0347d71d18fb8deaa419fd0a6 [0,0,1,0,0,0|1,0,0]=2 792 B10R0.74 CCC(=O)OCNCCC#N 53662183dc86fe174719b5e219519c53 [0,0,1,0,0,0|2,0,1]=4 793 B10R0.74 CCC(=O)OCNCCCCl 3d8db2c007ee67b725b045806166e035 [0,0,1,0,0,0|2,0,0]=3 794 B10R0.74 CCC(=O)OCNCCCO 038039977670cebe6ece45337cd238e4 [0,0,1,0,0,0|1,0,0]=2 795 B10R0.74 CCC(=O)OCNCCOC 19bf9954c4a78b1e0c8476c5a32711c3 [0,0,1,0,0,0|3,0,0]=4 796 B10R0.74 CCC(=O)OCNCCON e9850ce7ad9fa8661e681f3cc655dd36 [0,0,1,0,0,0|3,0,0]=4 797 B10R0.74 CCC(=O)OCNCCSC 1623c48f18ffa5605d5dd5fa66efd68a [0,0,1,0,0,0|3,0,0]=4 798 B10R0.74 CCC(=O)OCOCCC#N 7388eafa3589b5c050b56bc0ca3bb2f8 [0,0,1,0,0,0|2,0,1]=4 799 B10R0.74 CCC(=O)OCOCCC=O 875c3d67720fd33954ac8dff82742af8 [0,0,1,0,0,0|1,0,2]=4 800 B10R0.74 CCC(=O)OCOCCCF 4bdc784745e5892b79d18d7d77771a86 [0,0,1,0,0,0|2,0,0]=3 801 B10R0.74 CCC(=O)OCOCCCS 53066e59b6649572f039e13de7b59bf7 [0,0,1,0,0,0|1,1,0]=3 802 B10R0.74 CCC(=O)OCOCCOC 48126896527ee72db031c83f3c78ba34 [0,0,1,0,0,0|3,0,0]=4 803 B10R0.74 CCC(=O)OCOCCSC 7579e4f5a08aefdb6810fe47748d055a [0,0,1,0,0,0|3,0,0]=4 804 B10R0.74 CCC(C)NCCCCCO 5ef3aa1a131b4afd404c7a54c1965778 [0,0,1,0,0,0|2,0,1]=4 805 B10R0.74 CCC(C)OCCCCCF 6a3c3628c413a5f1aac0fa42f865c11e [0,0,1,0,0,0|2,0,1]=4 806 B10R0.74 CCC(C)OCCOCCF d25df27fdf5256cf1e3d939e28e5a773 [0,0,1,0,0,0|2,0,1]=4 807 B10R0.74 CCC(C)OCCOCCS 661420845bc3c5578025ec9a20cce414 [0,0,1,0,0,0|2,0,1]=4 808 B10R0.74 CCC(C)OCCOCOC 9e0ba5b9602fe3de6d626b825bccd62d [0,0,1,0,0,0|2,0,1]=4 809 B10R0.74 CCCCCCNC(=O)CC f0032df3cc8c2000bc1576b718e1412f [0,0,1,0,0,0|2,0,0]=3 810 B10R0.74 CCCCCCNC(=O)CF 738680f040b17c056aa0d8344a6ec8af [0,0,1,0,0,0|3,0,0]=4 811 B10R0.74 CCCCCCNC(=O)CO e8cf9f23cdf04b79897a080a69f10636 [0,0,1,0,0,0|3,0,0]=4 812 B10R0.74 CCCCCCNC(=O)CS 3e91e20700d92addaced40b0a6fc3a10 [0,0,1,0,0,0|3,0,0]=4 813 B10R0.74 CCCCCCOC(C)CC 63a0e53b4936ff9a126507b425b4f873 [0,0,1,0,0,0|2,0,1]=4 814 B10R0.74 CCCCCCO[C@@H](C)CC 913d8fe5eb0dc2cd00df16877f67de0e [0,0,1,0,0,0|2,0,1]=4 815 B10R0.74 CCCCCCO[C@H](C)CC c063b7a21fad8b8f0def39d173f79e48 [0,0,1,0,0,0|2,0,1]=4 816 B10R0.74 CCCCCNCC(=O)CC 9dd2e224792ae6d66bce0b7cb1ae679b [0,0,1,0,0,0|3,0,0]=4 817 B10R0.74 CCCCCOCC(=O)CC dbc68622c1630e1162d4ac42bae10c20 [0,0,1,0,0,0|3,0,0]=4 818 B10R0.74 CCCCNCOC(=O)CC e0b802cea9bb962c4bfe33b428a79424 [0,0,1,0,0,0|2,0,0]=3 819 B10R0.74 CCCCNCOC(=O)OC b9862ebe4e8cf9ca635d6e2c0b6a69d3 [0,0,1,0,0,0|3,0,0]=4 820 B10R0.74 CCCCOCOC(=O)CC 79f92447ebf68bdbe7c87af9f238ac09 [0,0,1,0,0,0|2,0,0]=3 821 B10R0.74 CCCCOCOC(=O)OC f2b08abd9d6a5d7efd1cbb987a41251e [0,0,1,0,0,0|3,0,0]=4 822 B10R0.74 CCCNCCCC(=O)NC a3b31883785f33a03890cefb42b1d82a [0,0,1,0,0,0|3,0,0]=4 823 B10R0.74 CCCNCCCC(=O)OC b16643f72059eae0ad94565e3f229a1f [0,0,1,0,0,0|3,0,0]=4 824 B10R0.74 CCCNCCNC(=O)CC 654790e0c463f303ea5b5f1e104b3b23 [0,0,1,0,0,0|2,0,0]=3 825 B10R0.74 CCCOC/C=C/C(=O)OC bfce11a355dc4f4a5487c0dbb8f55e6b [0,0,1,0,0,0|2,0,1]=4 826 B10R0.74 CCCOC/C=C\C(=O)OC dcfa8ae3af300ec4f68156f25ffba366 [0,0,1,0,0,0|2,0,1]=4 827 B10R0.74 CCCOCC#CC(=O)OC c1615b7f88b4176630c07fca414f7744 [0,0,1,0,0,0|2,0,1]=4 828 B10R0.74 CCCOCC=CC(=O)OC 6c5e7ef1753396b9c64f09bd9c14ee05 [0,0,1,0,0,0|2,0,1]=4 829 B10R0.74 CCCOCCCC(=O)NC 47cc15a6d3336cd77ff2e352f7e46945 [0,0,1,0,0,0|2,0,0]=3 830 B10R0.74 CCCOCCCC(=O)OC 6777d826a7092669282f32ac583d5482 [0,0,1,0,0,0|2,0,0]=3 831 B10R0.74 CCCOCCCC(C)CC 830720c7a42a213e98aa1689bfd341de [0,0,1,0,0,0|2,0,1]=4 832 B10R0.74 CCCOCCCN(C)CC 4b6b7ea1a0b082f6cb271198bde9bda0 [0,0,1,0,0,0|3,0,0]=4 833 B10R0.74 CCCOCCC[C@@H](C)CC 6a40126846604dd5c0859f3f0606466c [0,0,1,0,0,0|2,0,1]=4 834 B10R0.74 CCCOCCNC(=O)C=O b48a2b43e340f8d8431622a53eccba21 [0,0,1,0,0,0|2,0,1]=4 835 B10R0.74 CCCOCCNC(=O)CC 37663f297721ace7d18f666f43feb975 [0,0,1,0,0,0|1,0,0]=2 836 B10R0.74 CCCOCCNC(=O)CF 5013b76951d3f24534e4a2f4ef6f16d8 [0,0,1,0,0,0|2,0,0]=3 837 B10R0.74 CCCOCCNC(=O)CO 2ce5430bc5513b3c98ba20d9c18070bf [0,0,1,0,0,0|2,0,0]=3 838 B10R0.74 CCCOCCNC(=O)CS bc82f7eca67c7644035f9bc9a0838786 [0,0,1,0,0,0|2,0,0]=3 839 B10R0.74 CCCOCCNC(C)CC e2e69f4ae04d5ba391c30eaacd1735b6 [0,0,1,0,0,0|2,0,1]=4 840 B10R0.74 CCCOCCN[C@@H](C)CC 4b040ad3421edf5e9ba6d2e921911f72 [0,0,1,0,0,0|2,0,1]=4 841 B10R0.74 CCCOCCN[C@H](C)CC f851988b5dbd5645378976ba47094792 [0,0,1,0,0,0|2,0,1]=4 842 B10R0.74 CCCOCCOC(=O)CC 0266b80a03c10e2cb61b113dd4b9130c [0,0,1,0,0,0|0,0,0]=1 843 B10R0.74 CCCOCCOC(=O)OC 19df69bdbd15a1dd1020380f97d55a25 [0,0,1,0,0,0|1,0,0]=2 844 B10R0.74 CCCOCCOC(C)CC caa02544192185eca0b2f14146ba92c3 [0,0,1,0,0,0|1,0,1]=3 845 B10R0.74 CCCOCCOC(C)CF b34847404ba0a621ad5c9b5cff0df881 [0,0,1,0,0,0|2,0,1]=4 846 B10R0.74 CCCOCCOC(C)CS 191223edd3e982f982e69cfcb0c63d41 [0,0,1,0,0,0|2,0,1]=4 847 B10R0.74 CCCOCCO[C@@H](C)CC 1788ab32bc60c6e109792f373c0a19a4 [0,0,1,0,0,0|1,0,1]=3 848 B10R0.74 CCCOCCO[C@H](C)CC 1b07f88c4baf03d429c02bfb85ce8c6b [0,0,1,0,0,0|1,0,1]=3 849 B10R0.74 CCCOCCO[C@H](C)CS 9efaa37f0b522bfc356599e01f9eb14d [0,0,1,0,0,0|2,0,1]=4 850 B10R0.74 CCCSCCOC(C)CC 2733f49a83cc68881a8534ace6386d1a [0,0,1,0,0,0|1,1,1]=4 851 B10R0.74 CCN(C)CCCCCCO e3aa6c11ae31868348749421607ee8ee [0,0,1,0,0,0|3,0,0]=4 852 B10R0.74 CCOCCCNC(=O)CC 32ec07714ce8038f039e2cd922179ddc [0,0,1,0,0,0|3,0,0]=4 853 B10R0.74 CCS(=O)CCNCCCO aa44ebb0eb57921853b6b221149e599a [0,0,1,0,0,0|3,0,0]=4 854 B10R0.74 CC[C@@H](C)NCCCCCO aaa5aeff2aed862877873e27029f2476 [0,0,1,0,0,0|2,0,1]=4 855 B10R0.74 CC[C@@H](C)OCCCCCF fe7bde4b10b0c741125aafe39950f0b4 [0,0,1,0,0,0|2,0,1]=4 856 B10R0.74 CC[C@@H](C)OCCOCOC 6158c750f401dcb863999ad26f0b2e4a [0,0,1,0,0,0|2,0,1]=4 857 B10R0.74 CC[C@H](C)NCCCCCO dbff4715f95689b70d43d454046f9210 [0,0,1,0,0,0|2,0,1]=4 858 B10R0.74 CC[C@H](C)OCCCCCF 91a7577f977af415fb6b736c966e0fff [0,0,1,0,0,0|2,0,1]=4 859 B10R0.74 CC[C@H](C)OCCOCOC 90541c72c5d7557a479262234e8633f4 [0,0,1,0,0,0|2,0,1]=4 860 B10R0.74 CNC(=O)CCCNCCO a86b9197033a953d5a019d019724da8f [0,0,1,0,0,0|3,0,0]=4 861 B10R0.74 CNC(=O)CCCOCCF 0db3ebb5f2cb21fdc582cf0e295e5c9c [0,0,1,0,0,0|3,0,0]=4 862 B10R0.74 CNC(=O)CCCOCCS 507a06ed57ac68f0da280bf5fa21321e [0,0,1,0,0,0|3,0,0]=4 863 B10R0.74 CNC(=O)CCCOCOC b97404eaddea3fd296603f6afce517f9 [0,0,1,0,0,0|3,0,0]=4 864 B10R0.74 CNC(=O)CCCOCSC da9605829d888f8ef09324597b688ab0 [0,0,1,0,0,0|3,0,0]=4 865 B10R0.74 CNC(=O)CCNCCCO 2ac308ad2c10a6726746a34dc88a0836 [0,0,1,0,0,0|3,0,0]=4 866 B10R0.74 CNC(=O)CNCCCCO 9fcc3c262abd92a26d930ee64b845fe6 [0,0,1,0,0,0|3,0,0]=4 867 B10R0.74 COC(=O)CCCCNCO f030f24f4426fe74e7d8ea04e70e74ca [0,0,1,0,0,0|3,0,0]=4 868 B10R0.74 COC(=O)CCCNCCO 8668c445b163b442f85ab895d00987c8 [0,0,1,0,0,0|3,0,0]=4 869 B10R0.74 COC(=O)CCCOCCF 7a0d6361420304c7bd4ae6ecca548250 [0,0,1,0,0,0|3,0,0]=4 870 B10R0.74 COC(=O)CCCOCCS c957c36687ac3de604796819e2d658fc [0,0,1,0,0,0|3,0,0]=4 871 B10R0.74 COC(=O)CCNCCCO e96655e5337f5162972d522187b13057 [0,0,1,0,0,0|3,0,0]=4 872 B10R0.74 COC(=O)CNCCCCO ea42ac0b81f4922b97a1f7174639fed1 [0,0,1,0,0,0|3,0,0]=4 873 B10R0.74 COC(=O)OCCOCC#N e2896742d1d3cccbb89017ead03c7338 [0,0,1,0,0,0|2,0,1]=4 874 B10R0.74 COC(=O)OCCOCC=O ea68ce6f84ccf0154e4d7caf13653714 [0,0,1,0,0,0|2,0,1]=4 875 B10R0.74 COC(=O)OCCOCCF 3e93e2da9fd5bb891a00a4d9e4ff966c [0,0,1,0,0,0|2,0,0]=3 876 B10R0.74 COC(=O)OCCOCCS 4f916091a7653337bd8b08ea257c2679 [0,0,1,0,0,0|2,0,0]=3 877 B10R0.74 COC(=O)OCCOCSC 26e45fce16a76890b8820ac852cfbbed [0,0,1,0,0,0|2,0,0]=3 878 B10R0.74 COC(=O)OCNCCCCl d79540cf63b385e5a7bb99911ba947b9 [0,0,1,0,0,0|3,0,0]=4 879 B10R0.74 COC(=O)OCNCCCO aa57fdea458b9cde3098f1b2b1cac60d [0,0,1,0,0,0|2,0,0]=3 880 B10R0.74 COC(=O)OCOCCCF 0bd11ef2421d394ee1fc14f2647065ad [0,0,1,0,0,0|3,0,0]=4 881 B10R0.74 COC(=O)OCOCCCS e0aafe56f3d968247475b6fe1690b9c8 [0,0,1,0,0,0|2,1,0]=4 882 B10R0.74 COCOCCCC(=O)OC b68fbbe3b66cde135d1c1e599e84c93f [0,0,1,0,0,0|3,0,0]=4 883 B10R0.74 COCOCCOC(=O)OC 40eecdd82c26596431406769198420fd [0,0,1,0,0,0|2,0,0]=3 884 B10R0.74 O=C(CF)NCCCCCCl 6b93aba3941c6d4a7ff32a8d7d29cb35 [0,0,1,0,0,0|3,0,0]=4 885 B10R0.74 O=C(CF)NCCCCCO cc98c8ff260eb1512f4030c943faa4ab [0,0,1,0,0,0|2,0,0]=3 886 B10R0.74 O=C(CF)NCCOCCO ed8cf1820194d208c32f59c40db67805 [0,0,1,0,0,0|3,0,0]=4 887 B10R0.74 O=C(CF)NCCOCCS a4b85b58ce4f78a43681e3fcb23831ed [0,0,1,0,0,0|3,0,0]=4 888 B10R0.74 O=C(CF)NCCSCCO b410e057826a2f0b528f26bf35d22bc8 [0,0,1,0,0,0|3,0,0]=4 889 B10R0.74 O=C(CO)CNCCCCO 814979fe34337e9065f3333a43425939 [0,0,1,0,0,0|3,0,0]=4 890 B10R0.74 O=C(CO)NCCCCCCl bb852b5e0473f7eaf3faafcb8f02cf64 [0,0,1,0,0,0|3,0,0]=4 891 B10R0.74 O=C(CO)NCCCCCO 8ea79bd119a2d2f4afdd555f388978a6 [0,0,1,0,0,0|2,0,0]=3 892 B10R0.74 O=C(CO)NCCOCCO a60d1514c3ec1001cb06ee0fb7350fe4 [0,0,1,0,0,0|3,0,0]=4 893 B10R0.74 O=C(CO)NCCOCCS d1c07c44305f486ba9727cb76548192e [0,0,1,0,0,0|3,0,0]=4 894 B10R0.74 O=C(CO)NCCSCCO 801fd1b3808ba931f3ac65e6d2d53fa4 [0,0,1,0,0,0|3,0,0]=4 895 B10R0.74 O=C(CS)NCCCCCCl 5338d3b263c8353b8756bcc2bc2e3eb1 [0,0,1,0,0,0|3,0,0]=4 896 B10R0.74 O=C(CS)NCCCCCO f99d02ad12fcfe5a585d335e2a21ea39 [0,0,1,0,0,0|2,0,0]=3 897 B10R0.74 O=C(CS)NCCOCCO 6e13c91d233ee6e19158ca87b72c66a8 [0,0,1,0,0,0|3,0,0]=4 898 B10R0.74 O=C(CS)NCCOCCS 605043b0839f0819b1f0ef6af2f1ce0c [0,0,1,0,0,0|3,0,0]=4 899 B10R0.74 O=C(CS)NCCSCCO 153828e2df7dc798efaa6edc57929b14 [0,0,1,0,0,0|3,0,0]=4 900 B10R0.74 O=CC(=O)NCCCCCO 7a2388d74c1856698a8110420b0ac876 [0,0,1,0,0,0|2,0,1]=4 901 B10R0.108 C#CC(=O)NCC(C)OCC c3fc9c46a16b32ae8a9215a6a22927a3 [0,0,1,0,0,0|1,0,2]=4 902 B10R0.108 C#CC(=O)NCC(O)CCC 95bfcc657c506c23466ac2d215d06885 [0,0,1,0,0,0|1,0,2]=4 903 B10R0.108 C=CC(=O)NCC(C)OCC 7a683023f236a9a49e6fc13c0adae0b2 [0,0,1,0,0,0|1,0,2]=4 904 B10R0.108 C=CC(=O)NCC(O)CCC fdd0bbb6f877d20d2143d86df364e03f [0,0,1,0,0,0|1,0,2]=4 905 B10R0.108 C=CCC(O)CNC(=O)CC 550e11ed44cd70a3f136771d50288136 [0,0,1,0,0,0|1,0,2]=4 906 B10R0.108 CCC(=O)NCC(C)CCO ac2cf2f2c658d5fa46cb5ee084c0c22e [0,0,1,0,0,0|3,0,0]=4 907 B10R0.108 CCC(=O)NCC(O)COC 3e322a4507cdf82601a1d34063c8a0d4 [0,0,1,0,0,0|2,0,0]=3 908 B10R0.108 CCC(=O)NC[C@H](O)COC 1392aed237ad4a68574719b757aa32ea [0,0,1,0,0,0|2,0,0]=3 909 B10R0.108 CCC(=O)OCN(C)CCF d5b42cd5e4aaca1a32477c20737ad589 [0,0,1,0,0,0|3,0,0]=4 910 B10R0.108 CCC(=O)OCN(C)CCO 17c83b848fb5cad9374f84f6611ae634 [0,0,1,0,0,0|3,0,0]=4 911 B10R0.108 CCC(C)OC[C@@H](O)CCO e33a3b16c420cb7b82f5eebe548ad591 [0,0,1,0,0,0|2,0,1]=4 912 B10R0.108 CCCC(C)COC(C)CC 6c2499ccbaeb041ba7e4d717bf84e2a0 [0,0,1,0,0,0|2,0,1]=4 913 B10R0.108 CCCC(C)CO[C@@H](C)CC a819a6a039eb04d1987b9b0a35e1d0ae [0,0,1,0,0,0|2,0,1]=4 914 B10R0.108 CCCC(C)CO[C@H](C)CC 7fcf3bf3bb0af02290c79a629cb31773 [0,0,1,0,0,0|2,0,1]=4 915 B10R0.108 CCCC(C)NCC(=O)CC 426a74f124c21cc364a77b7c9e4f4952 [0,0,1,0,0,0|3,0,0]=4 916 B10R0.108 CCCC(C)OCC(=O)CC df9f71d675c7bef4a5faa721d5ee4a09 [0,0,1,0,0,0|3,0,0]=4 917 B10R0.108 CCCC(O)CNC(=O)C=O 73b91a60073faf0d66732a7e3daee8fc [0,0,1,0,0,0|2,0,1]=4 918 B10R0.108 CCCC(O)CNC(=O)CC 72f52de595dccb7d77c42b465f3ab180 [0,0,1,0,0,0|1,0,0]=2 919 B10R0.108 CCCC(O)CNC(=O)CF 1bb83f9c19204be89f43bf923ab09899 [0,0,1,0,0,0|2,0,0]=3 920 B10R0.108 CCCC(O)CNC(=O)CO 2a77dafbfd0bc1d3ef65741c327c5cd9 [0,0,1,0,0,0|2,0,0]=3 921 B10R0.108 CCCC(O)CNC(=O)CS 859a48ca7d781ce8947c9297c043cb61 [0,0,1,0,0,0|2,0,0]=3 922 B10R0.108 CCCC(O)CNC(C)CC 320a804997fc346ba8ecb2750fb90e84 [0,0,1,0,0,0|2,0,1]=4 923 B10R0.108 CCCN(C)COC(=O)CC 0613aff8d3d6a7603a8d72717e0c7609 [0,0,1,0,0,0|2,0,0]=3 924 B10R0.108 CCCN(C)COC(=O)OC b89260c6d72332a5f898fa5705b88009 [0,0,1,0,0,0|3,0,0]=4 925 B10R0.108 CCC[C@@H](C)OCC(=O)CC 43942a366aeae7c58f2c09b6f65d0c94 [0,0,1,0,0,0|3,0,0]=4 926 B10R0.108 CCC[C@H](C)NCC(=O)CC 856fa4c3c2496ce8f584b3cbd91b3525 [0,0,1,0,0,0|3,0,0]=4 927 B10R0.108 CCC[C@H](C)OCC(=O)CC 4e0bd1f59f8ed3a7ca11e2eec973dff4 [0,0,1,0,0,0|3,0,0]=4 928 B10R0.108 CCOC(=O)CNC(=O)CC d3d7341838c871ad43be6029bfd75589 [0,0,1,0,0,0|2,0,1]=4 929 B10R0.108 CCOC(C)CCC(C)CC a022098aac07521ba0782f55f38c17af [0,0,1,0,0,0|2,0,1]=4 930 B10R0.108 CCOC(C)CNC(=O)C=O 88a366a0e4f3e742fe714a61db7a8bcf [0,0,1,0,0,0|2,0,1]=4 931 B10R0.108 CCOC(C)CNC(=O)CC 5185962b38095a3d9ed2d02c86953406 [0,0,1,0,0,0|1,0,0]=2 932 B10R0.108 CCOC(C)CNC(=O)CF 0ab8cba3fcdd4906ee1c7eaf16ff5000 [0,0,1,0,0,0|2,0,0]=3 933 B10R0.108 CCOC(C)CNC(=O)CO 54916cbd9aeff9268aa0670c21e9bd26 [0,0,1,0,0,0|2,0,0]=3 934 B10R0.108 CCOC(C)CNC(=O)CS ea758d4d337399d36a927c74c4c59ea5 [0,0,1,0,0,0|2,0,0]=3 935 B10R0.108 CCOC(C)CNC(C)CC 5e034de0a38851e86b85f4bb0e39e0ec [0,0,1,0,0,0|2,0,1]=4 936 B10R0.108 CCOC(C)COC(C)CC 00f5d7ae8eda0b7b4db9101e25522b05 [0,0,1,0,0,0|1,0,1]=3 937 B10R0.108 CC[C@@H](C)OC[C@@H](O)CCO 4b8f59cfdb83077dffef6c548f6552d2 [0,0,1,0,0,0|2,0,1]=4 938 B10R0.108 CC[C@H](C)OC[C@@H](O)CCO bc1a90e77e19dad1ec858a8572ea6a17 [0,0,1,0,0,0|2,0,1]=4 939 B10R0.108 COCC(O)CNC(=O)CF cf482189f84d3927c008631b40eeb4b0 [0,0,1,0,0,0|3,0,0]=4 940 B10R0.108 COCC(O)CNC(=O)CO 8b2a9186fb3e3cb8eba74a3a1defbfcd [0,0,1,0,0,0|3,0,0]=4 941 B10R0.108 COCC(O)CNC(=O)CS b5df07a221dcedb2873bc5145601deb5 [0,0,1,0,0,0|3,0,0]=4 942 B10R0.108 COC[C@@H](O)CNC(=O)CF 356dbcb3270fd33d2ab0537063bbe53f [0,0,1,0,0,0|3,0,0]=4 943 B10R0.108 COC[C@@H](O)CNC(=O)CO 82919c983a45c5f57f42c8c65f180caf [0,0,1,0,0,0|3,0,0]=4 944 B10R0.108 COC[C@@H](O)CNC(=O)CS a744bae16118ce81e7fc20202b788382 [0,0,1,0,0,0|3,0,0]=4 945 B12R2.12 O=C1CCC1OC2CCCC2 8aaa785dd1ff622db91d38f502b9fd41 [0,0,0,1,0,0|3,0,0]=4 946 B12R2.20 CC1CC1NCC2CCCO2 701b4baf6085255fa15e380cefb0d8af [0,0,0,1,0,0|2,0,1]=4 947 B12R2.1542 CCC(=O)N1CC2C1CCC2 0fb5b37b2bdfcade218826ac9d433669 [0,0,0,1,0,0|2,0,0]=3 948 B12R2.1542 CCC(=O)N1C[C@H]2[C@@H]1CCC2 43f71198479ffce6703e590e5d564bc3 [0,0,0,1,0,0|2,0,0]=3 949 B12R2.1542 O=C(CF)N1CC2C1CCC2 6900110d78dbb4b05c1e018caf3a8778 [0,0,0,1,0,0|3,0,0]=4 950 B12R2.1542 O=C(CF)N1C[C@H]2[C@@H]1CCC2 e4301f9e300d4e3fad7594230249bcc5 [0,0,0,1,0,0|3,0,0]=4 951 B12R2.1542 O=C(CO)N1CC2C1CCC2 8c429d699c2753b298af364ba151303d [0,0,0,1,0,0|3,0,0]=4 952 B12R2.1542 O=C(CO)N1C[C@H]2[C@@H]1CCC2 6ac8180c0397f41dee32329cf406bf58 [0,0,0,1,0,0|3,0,0]=4 953 B12R2.1542 O=C(CS)N1CC2C1CCC2 6a2a3289e01fc4088607be6ca9932e09 [0,0,0,1,0,0|3,0,0]=4 954 B12R2.1542 O=C(CS)N1C[C@H]2[C@@H]1CCC2 d8655f4f4069e05d7434f9bedb582f90 [0,0,0,1,0,0|3,0,0]=4 955 B12R2.1575 CCC(C)OCC12CCC1C2 677c7998584d398feccb60b920e32d57 [0,0,0,1,0,0|2,0,1]=4 956 B12R2.1596 C#CC(=O)N1CC2CC1CO2 32aa7c05a22b3130ff9573438374cd16 [0,0,0,1,0,0|1,0,2]=4 957 B12R2.1596 C#CC(=O)N1C[C@@H]2C[C@H]1CO2 da3a0ad80b5d5cb4e9abfb88ace23688 [0,0,0,1,0,0|1,0,2]=4 958 B12R2.1596 C#CC(=O)N1C[C@H]2C[C@@H]1CO2 c85a82204135e33bd303233139645e7a [0,0,0,1,0,0|1,0,2]=4 959 B12R2.1596 C=CC(=O)N1CC2CC1CO2 96c33be355d76a344cd7213ef076f44b [0,0,0,1,0,0|1,0,2]=4 960 B12R2.1596 C=CC(=O)N1C[C@@H]2C[C@H]1CO2 272c4c09f920f7ad06248e038aa70ead [0,0,0,1,0,0|1,0,2]=4 961 B12R2.1596 C=CC(=O)N1C[C@H]2C[C@@H]1CO2 feb0fe3b7c59aeb620829fd418f3f165 [0,0,0,1,0,0|1,0,2]=4 962 B12R2.1596 CCC(=O)N1CC2C=CC1C2 3bd2b9ebe16d1d346920ca5f34a66315 [0,0,0,1,0,0|2,0,1]=4 963 B12R2.1596 CCC(=O)N1CC2CC1CO2 7918921094ce73b104d12a61730e7edc [0,0,0,1,0,0|1,0,0]=2 964 B12R2.1596 CCC(=O)N1CC2CCC1C2 1ca6aed55cc20a8d68210f03424cfb9a [0,0,0,1,0,0|2,0,0]=3 965 B12R2.1596 CCC(=O)N1C[C@@H]2CC[C@H]1C2 47b57c5d13cdf98616a66ce6c1e0f2c4 [0,0,0,1,0,0|2,0,0]=3 966 B12R2.1596 CCC(=O)N1C[C@@H]2C[C@H]1CO2 6718e050024ad25bc37bb651ff8cb773 [0,0,0,1,0,0|1,0,0]=2 967 B12R2.1596 CCC(=O)N1C[C@H]2C=C[C@@H]1C2 100cd1681f25c11030e4238166ae56a4 [0,0,0,1,0,0|2,0,1]=4 968 B12R2.1596 CCC(=O)N1C[C@H]2CC[C@@H]1C2 3a1e75014a45913d37aacb805e640622 [0,0,0,1,0,0|2,0,0]=3 969 B12R2.1596 CCC(=O)N1C[C@H]2C[C@@H]1CO2 d2cde6db46c6d2b27aec08927b666043 [0,0,0,1,0,0|1,0,0]=2 970 B12R2.1596 CCC(C)N1CC2CC1CO2 022416cdca4fbb1509364f3893644ca1 [0,0,0,1,0,0|2,0,1]=4 971 B12R2.1596 CCC(C)N1C[C@@H]2C[C@H]1CO2 17605dbf0977efa095daf1f468e27b3a [0,0,0,1,0,0|2,0,1]=4 972 B12R2.1596 CCC(C)N1C[C@H]2C[C@@H]1CO2 dc32523eb3e422b5cf52f3788a79fcd5 [0,0,0,1,0,0|2,0,1]=4 973 B12R2.1596 O=C(CF)N1CC2CC1CO2 182f8fc8757a241bfd1579c296fc21c1 [0,0,0,1,0,0|2,0,0]=3 974 B12R2.1596 O=C(CF)N1CC2CCC1C2 2165e66ada6be07d4e54f9ba5a1965d8 [0,0,0,1,0,0|3,0,0]=4 975 B12R2.1596 O=C(CF)N1C[C@@H]2CC[C@H]1C2 3d60ada119f7efe39964ff6a7399cf8c [0,0,0,1,0,0|3,0,0]=4 976 B12R2.1596 O=C(CF)N1C[C@@H]2C[C@H]1CO2 29ba5a1e07ed24e671b83036fc52458a [0,0,0,1,0,0|2,0,0]=3 977 B12R2.1596 O=C(CF)N1C[C@H]2CC[C@@H]1C2 f268ab5d14a2c8133ab864ca49b57f9a [0,0,0,1,0,0|3,0,0]=4 978 B12R2.1596 O=C(CF)N1C[C@H]2C[C@@H]1CO2 6e17044dd0a8f82828e97d5ad54c77a1 [0,0,0,1,0,0|2,0,0]=3 979 B12R2.1596 O=C(CO)N1CC2CC1CO2 4a965574d276207346143c906af188e9 [0,0,0,1,0,0|2,0,0]=3 980 B12R2.1596 O=C(CO)N1CC2CCC1C2 23ab83b81ff799660606fa5be362998e [0,0,0,1,0,0|3,0,0]=4 981 B12R2.1596 O=C(CO)N1C[C@@H]2CC[C@H]1C2 9b3d2f3ae025c46aff0c2ae5e7c0bb0f [0,0,0,1,0,0|3,0,0]=4 982 B12R2.1596 O=C(CO)N1C[C@@H]2C[C@H]1CO2 5030ce793e336758b75750cffad14c9e [0,0,0,1,0,0|2,0,0]=3 983 B12R2.1596 O=C(CO)N1C[C@H]2CC[C@@H]1C2 43dc28184ab8d5c187d447b5f0f825b1 [0,0,0,1,0,0|3,0,0]=4 984 B12R2.1596 O=C(CO)N1C[C@H]2C[C@@H]1CO2 c087c39eb92c51903ff5a7e2ad14ed4f [0,0,0,1,0,0|2,0,0]=3 985 B12R2.1596 O=C(CS)N1CC2CC1CO2 a1cf89c791ef3ab3a859156bfd30eba6 [0,0,0,1,0,0|2,0,0]=3 986 B12R2.1596 O=C(CS)N1CC2CCC1C2 cd0fcf464736349d1ed825413f5e74e4 [0,0,0,1,0,0|3,0,0]=4 987 B12R2.1596 O=C(CS)N1C[C@@H]2CC[C@H]1C2 4beda0e0854570dd09112c47a1c0f605 [0,0,0,1,0,0|3,0,0]=4 988 B12R2.1596 O=C(CS)N1C[C@@H]2C[C@H]1CO2 77eff47485bf1251db169f4ba450b8b7 [0,0,0,1,0,0|2,0,0]=3 989 B12R2.1596 O=C(CS)N1C[C@H]2CC[C@@H]1C2 d0b452337541ad01338f25af820226a6 [0,0,0,1,0,0|3,0,0]=4 990 B12R2.1596 O=C(CS)N1C[C@H]2C[C@@H]1CO2 200395bf04a8aef44942cd756ab0355f [0,0,0,1,0,0|2,0,0]=3 991 B12R2.1596 O=CC(=O)N1CC2CC1CO2 4b5343eef71100f8ba31b05e08768162 [0,0,0,1,0,0|2,0,1]=4 992 B12R2.1596 O=CC(=O)N1C[C@@H]2C[C@H]1CO2 3cf56689ce0e8985a9d74b4a2886da03 [0,0,0,1,0,0|2,0,1]=4 993 B12R2.1596 O=CC(=O)N1C[C@H]2C[C@@H]1CO2 1450d23ad09baa69a573a69e5fab770b [0,0,0,1,0,0|2,0,1]=4 994 B12R2.1626 CCC(=O)CN1C2C1CCC2 217f53e3d12bdea1d1365333f298a910 [0,0,0,1,0,0|3,0,0]=4 995 B12R2.1858 CCN1CCC2(C1)CCCO2 0cde5b013a54890441a333969520cf10 [0,0,0,1,0,0|3,0,0]=4 996 B12R2.2056 C1CC(C1)NCC2CCCO2 b19b77841b996244e42e47a0ce6bd17b [0,0,0,1,0,0|2,0,1]=4 997 B12R2.2056 C1CC(C1)NC[C@@H]2CCCO2 6f2b0237a47eeaf16fd20ce95348d0d0 [0,0,0,1,0,0|2,0,1]=4 998 B12R2.2056 C1CC(C1)NC[C@H]2CCCO2 2a2232d48298865a39363cb084d05e63 [0,0,0,1,0,0|2,0,1]=4 999 B12R2.2056 C1CC(C1)OCC2CCCO2 522231a57d0ddf225cb54e20a646b123 [0,0,0,1,0,0|1,0,1]=3 1000 B12R2.2056 C1CC(C1)OCC2CCCS2 f79d6253536e768f7539a9eb6b2d92e8 [0,0,0,1,0,0|1,1,1]=4 1001 B12R2.2056 C1CC(C1)OC[C@@H]2CCCO2 42785b165c2bf1e40aadd2ce564e07a2 [0,0,0,1,0,0|1,0,1]=3 1002 B12R2.2056 C1CC(C1)OC[C@H]2CCCO2 982ac60a382290760d449879ed436fec [0,0,0,1,0,0|1,0,1]=3 1003 B12R2.2056 C1CCC(C1)COC2CCC2 b235e9847f2d6062fc5ffa3d0c200eb3 [0,0,0,1,0,0|2,0,1]=4 1004 B12R2.2056 C1COC(C1)CCN2CCC2 95a74325344c02cffd7d47d22acb7cc8 [0,0,0,1,0,0|3,0,0]=4 1005 B12R2.2056 C1COC(C1)COC2COC2 5c0d66e6b269ac1a27a1a50ade397834 [0,0,0,1,0,0|2,0,1]=4 1006 B12R2.2056 C1COC(C1)COC2CSC2 c7b3cd9dcede60ed21fd5f13c6d71ceb [0,0,0,1,0,0|2,0,1]=4 1007 B12R2.2056 C1CO[C@@H](C1)COC2COC2 02d6357ee77bdef1d5203f14b5987723 [0,0,0,1,0,0|2,0,1]=4 1008 B12R2.2056 C1CO[C@H](C1)COC2COC2 1bc27fc8ab044833d46448f3f100ffc7 [0,0,0,1,0,0|2,0,1]=4 1009 B12R2.2399 CC1(CC1)NCC2CCCO2 77b0b81073943c3711fc4e547f5d854a [0,0,0,1,0,0|2,0,1]=4 1010 B10R1.27 CCC(=O)CN1CCSC1 fcec8fd23eee8bbf882ed44d5dc68d62 [0,0,0,0,1,0|3,0,0]=4 1011 B10R1.27 CCC(=O)NC1CCCC1 ad0e329a839e42fb4e68b66bf7fc6efa [0,0,0,0,1,0|2,0,0]=3 1012 B10R1.27 CCC(=O)NC1CCOC1 87d823c2977e75e2fb89114c398fc88c [0,0,0,0,1,0|3,0,0]=4 1013 B10R1.27 CCC(=O)NC1CCSC1 127f48c4e5eb5bad27859a6e7623bb0c [0,0,0,0,1,0|3,0,0]=4 1014 B10R1.27 CCC(=O)N[C@@H]1CCOC1 469148a4d98c127e4133b4bff5bab61c [0,0,0,0,1,0|3,0,0]=4 1015 B10R1.27 CCC(=O)N[C@H]1CCOC1 b0d0a712a6b535c8cf47044a81b431e0 [0,0,0,0,1,0|3,0,0]=4 1016 B10R1.27 CCC(C)OC1CCCC1 30148a90da521268d6abe312e5583276 [0,0,0,0,1,0|2,0,1]=4 1017 B10R1.27 CCC(C)OC1CCCO1 5b6363d966e8191a9efd9f01e6f672a2 [0,0,0,0,1,0|1,0,1]=3 1018 B10R1.27 CCN(C)CC1CCCC1 94e6f2d1b2fb00bbba95ce64cfb383b3 [0,0,0,0,1,0|3,0,0]=4 1019 B10R1.27 CCN(C)CC1CCCO1 acf14a3b06b05262d412ae574858fa7a [0,0,0,0,1,0|2,0,0]=3 1020 B10R1.27 CC[C@@H](C)OC1CCCC1 c171b6529460dbd027cee80392bb2c21 [0,0,0,0,1,0|2,0,1]=4 1021 B10R1.27 CC[C@H](C)OC1CCCC1 a67891fdf9084075b692338a2669208f [0,0,0,0,1,0|2,0,1]=4 1022 B10R1.27 CN(CF)CC1CCCO1 7a446f8a084c524b82744b6c8a0afec2 [0,0,0,0,1,0|3,0,0]=4 1023 B10R1.27 CN(CO)CC1CCCO1 a484c3542e8148b4f1d79b992b9ffe70 [0,0,0,0,1,0|3,0,0]=4 1024 B10R1.27 O=C(CF)NC1CCCC1 7def253a7d58d7abaf0b2c052c6b4bd2 [0,0,0,0,1,0|3,0,0]=4 1025 B10R1.27 O=C(CO)NC1CCCC1 a2af8330b212ec9a8ca0312ee053bb08 [0,0,0,0,1,0|3,0,0]=4 1026 B10R1.27 O=C(CS)NC1CCCC1 e18c16444a3ea35ed584a201cdde414c [0,0,0,0,1,0|3,0,0]=4 1027 B10R1.151 C#CC(=O)NCC1CCC1 d4b0cd4e53c849c060618a1dfcada0d3 [0,0,0,0,1,0|1,0,2]=4 1028 B10R1.151 C#CC(=O)NCC1CCO1 02b7351d0bfa5b1a15c2c63a9a8505e1 [0,0,0,0,1,0|1,0,2]=4 1029 B10R1.151 C#CC(=O)NC[C@@H]1CCO1 9a0b176145e3b5101a9b69e1e725d07e [0,0,0,0,1,0|1,0,2]=4 1030 B10R1.151 C#CC(=O)NC[C@H]1CCO1 c2e6fc4579cbd013f4d9fa6cd9ffb42b [0,0,0,0,1,0|1,0,2]=4 1031 B10R1.151 C=C(C=O)OCC1CCC1 980b98a6318ac2503eadfe95761faa78 [0,0,0,0,1,0|2,0,1]=4 1032 B10R1.151 C=C(C=O)OCC1CCO1 bac18a5ba6acc326920ac04e1e81940f [0,0,0,0,1,0|2,0,1]=4 1033 B10R1.151 C=C(C=O)OC[C@@H]1CCO1 ea310a33058a3d84f58c50d2b4085c25 [0,0,0,0,1,0|2,0,1]=4 1034 B10R1.151 C=C(C=O)OC[C@H]1CCO1 f413a3d03a6df9351135efe9827c85c9 [0,0,0,0,1,0|2,0,1]=4 1035 B10R1.151 C=C(CC)CNC1CCC1 f42e4d1cbd424b7c1a80b4c680f22f78 [0,0,0,0,1,0|3,0,0]=4 1036 B10R1.151 C=C(CC)COC1CCC1 f1fe3538e2f0e67184c2b3c3aad6703b [0,0,0,0,1,0|3,0,0]=4 1037 B10R1.151 C=CC(=O)NCC1CCC1 6b2c8b503741da5e8af70a0ed12e2bfb [0,0,0,0,1,0|1,0,2]=4 1038 B10R1.151 C=CC(=O)NCC1CCO1 1fbb6209fa19c43559ebaf067461d62e [0,0,0,0,1,0|1,0,2]=4 1039 B10R1.151 C=CC(=O)NC[C@@H]1CCO1 48257ac50374e9e73d6620f81a6c0295 [0,0,0,0,1,0|1,0,2]=4 1040 B10R1.151 C=CC(=O)NC[C@H]1CCO1 94ddecaceed33b9d67e70db86d3637e8 [0,0,0,0,1,0|1,0,2]=4 1041 B10R1.151 CC(CF)OCC1CCC1 985b9f1f3c50860f77024209dcf8abe0 [0,0,0,0,1,0|2,0,1]=4 1042 B10R1.151 CC(CF)OCC1CCO1 283c25ec8b9b29ef7485607dc7134a38 [0,0,0,0,1,0|2,0,1]=4 1043 B10R1.151 CC(CF)OC[C@@H]1CCO1 3100f2a6535c711d853b5b7cb8b13f02 [0,0,0,0,1,0|2,0,1]=4 1044 B10R1.151 CC(CF)OC[C@H]1CCO1 9b26d2c9319fe5f44eecf73428ea7f0d [0,0,0,0,1,0|2,0,1]=4 1045 B10R1.151 CC(CS)OCC1CCC1 858633a79b53e69d842f7d3d9f2722ec [0,0,0,0,1,0|2,0,1]=4 1046 B10R1.151 CC(CS)OCC1CCO1 601836b083b03d93b24a06a5663656da [0,0,0,0,1,0|2,0,1]=4 1047 B10R1.151 CC(CS)OC[C@@H]1CCO1 dc3d10e437eb51bb6622d0726f560646 [0,0,0,0,1,0|2,0,1]=4 1048 B10R1.151 CC(CS)OC[C@H]1CCO1 c0d64c691a84a47624e6c20bd2ce1d68 [0,0,0,0,1,0|2,0,1]=4 1049 B10R1.151 CCC(=O)CNC1CCC1 b8353731ffe0f4c691cfd4114f586b11 [0,0,0,0,1,0|2,0,0]=3 1050 B10R1.151 CCC(=O)CNC1COC1 43ab27367dcfe3544f06a6fe8c665d8a [0,0,0,0,1,0|3,0,0]=4 1051 B10R1.151 CCC(=O)COC1CCC1 797a1b47e733c60d896bb18b4fc6eb5c [0,0,0,0,1,0|2,0,0]=3 1052 B10R1.151 CCC(=O)COC1COC1 d581deff071999ac16b627fcd9f4fe1b [0,0,0,0,1,0|3,0,0]=4 1053 B10R1.151 CCC(=O)COC1CSC1 e60386b0a832af3cfff3f28f5a2d72a2 [0,0,0,0,1,0|3,0,0]=4 1054 B10R1.151 CCC(=O)NCC1CCC1 4b327f7481ceaf5062c90f58b0555e1b [0,0,0,0,1,0|1,0,0]=2 1055 B10R1.151 CCC(=O)NCC1CCO1 6e081790014140f46dd7c4d8bad3f382 [0,0,0,0,1,0|1,0,0]=2 1056 B10R1.151 CCC(=O)NCC1COC1 cc64a9825624f29d57f4c2acf602700b [0,0,0,0,1,0|2,0,0]=3 1057 B10R1.151 CCC(=O)NC[C@@H]1CCO1 4805f632513bbf187ce949159dc9399d [0,0,0,0,1,0|1,0,0]=2 1058 B10R1.151 CCC(=O)NC[C@H]1CCO1 57ebee47cf4796710668d66d4b495f17 [0,0,0,0,1,0|1,0,0]=2 1059 B10R1.151 CCC(=O)OCN1CCC1 fd123feae34d71647188f23a94cc8c05 [0,0,0,0,1,0|1,0,0]=2 1060 B10R1.151 CCC(C)NCC1CCC1 602bed144c9b8f5289d92a79aac713a2 [0,0,0,0,1,0|2,0,1]=4 1061 B10R1.151 CCC(C)NCC1CCO1 f8cfd15328d38f4f1217ad86df5cadf4 [0,0,0,0,1,0|2,0,1]=4 1062 B10R1.151 CCC(C)NC[C@@H]1CCO1 0a068af6ce696a1f6a939f41855f7383 [0,0,0,0,1,0|2,0,1]=4 1063 B10R1.151 CCC(C)NC[C@H]1CCO1 9f5164a6d1e81dea3967582e2256d495 [0,0,0,0,1,0|2,0,1]=4 1064 B10R1.151 CCC(C)OCC1CCC1 64478b28f17ff782fccb086026fdb3d1 [0,0,0,0,1,0|1,0,1]=3 1065 B10R1.151 CCC(C)OCC1CCO1 2f91f9ddfbeded3aff67cf4ba18e2fa4 [0,0,0,0,1,0|1,0,1]=3 1066 B10R1.151 CCC(C)OCC1COC1 07c2af8d40f052169d9985a253f5e66c [0,0,0,0,1,0|2,0,1]=4 1067 B10R1.151 CCC(C)OCC1CSC1 005d63b5f6fccd11be6fa6654d1f7a03 [0,0,0,0,1,0|2,0,1]=4 1068 B10R1.151 CCC(C)OC[C@@H]1CCO1 a1a8290f3ad3d7bf07f02dbd41fccc4a [0,0,0,0,1,0|1,0,1]=3 1069 B10R1.151 CCC(C)OC[C@H]1CCO1 c7cc600854c0df3af8d77c2a4f386065 [0,0,0,0,1,0|1,0,1]=3 1070 B10R1.151 CCN(C)CCC1CCC1 695965404daa6b4e3f5227fd6e07eec8 [0,0,0,0,1,0|3,0,0]=4 1071 B10R1.151 CCN(C)CCC1CCO1 1e21e2ba51a670a228423ce204eba389 [0,0,0,0,1,0|3,0,0]=4 1072 B10R1.151 CCS(=O)CCN1CCC1 ade64182b0507954db824ee3478d94b8 [0,0,0,0,1,0|3,0,0]=4 1073 B10R1.151 CC[C@@H](C)NCC1CCC1 5eaad1c726ff7850f0b76b05114ad115 [0,0,0,0,1,0|2,0,1]=4 1074 B10R1.151 CC[C@@H](C)NCC1CCO1 71489c7d92fb47d8db37443aac8376a3 [0,0,0,0,1,0|2,0,1]=4 1075 B10R1.151 CC[C@@H](C)NC[C@@H]1CCO1 4dad89d501f1bce67f13642b0dc98bbe [0,0,0,0,1,0|2,0,1]=4 1076 B10R1.151 CC[C@@H](C)NC[C@H]1CCO1 f3e159910dc931b0e400c15805d0a72b [0,0,0,0,1,0|2,0,1]=4 1077 B10R1.151 CC[C@@H](C)OCC1CCC1 38ba48ce6de88737e5573ffc67f149a5 [0,0,0,0,1,0|1,0,1]=3 1078 B10R1.151 CC[C@@H](C)OCC1CCO1 8bd2c62533eb0f52da7202ddf0a5f46d [0,0,0,0,1,0|1,0,1]=3 1079 B10R1.151 CC[C@@H](C)OCC1COC1 60049824e74973e237b4670490d417aa [0,0,0,0,1,0|2,0,1]=4 1080 B10R1.151 CC[C@@H](C)OC[C@@H]1CCO1 04d124b77af9e6272c7bd1e6aa655943 [0,0,0,0,1,0|1,0,1]=3 1081 B10R1.151 CC[C@@H](C)OC[C@H]1CCO1 1584f11687544094eb442746424e0fda [0,0,0,0,1,0|1,0,1]=3 1082 B10R1.151 CC[C@H](C)NCC1CCC1 1508c2b75c705769ad01603e9e799056 [0,0,0,0,1,0|2,0,1]=4 1083 B10R1.151 CC[C@H](C)NCC1CCO1 88c9e02986d6d25f1a1407b0bf2763ed [0,0,0,0,1,0|2,0,1]=4 1084 B10R1.151 CC[C@H](C)NC[C@@H]1CCO1 ba7eefd5fd89e4428ee82ea1b0ee71c3 [0,0,0,0,1,0|2,0,1]=4 1085 B10R1.151 CC[C@H](C)NC[C@H]1CCO1 a699e09a9004be5d79fe3266b9234ff4 [0,0,0,0,1,0|2,0,1]=4 1086 B10R1.151 CC[C@H](C)OCC1CCC1 216475738fa1c5139bd52964b0605b90 [0,0,0,0,1,0|1,0,1]=3 1087 B10R1.151 CC[C@H](C)OCC1CCO1 0e128590c12794f310923814da71d607 [0,0,0,0,1,0|1,0,1]=3 1088 B10R1.151 CC[C@H](C)OCC1COC1 1d20e44982db682520b49129f0e5c726 [0,0,0,0,1,0|2,0,1]=4 1089 B10R1.151 CC[C@H](C)OC[C@@H]1CCO1 d9b4ea8055a8d7d10ada6355faeb756d [0,0,0,0,1,0|1,0,1]=3 1090 B10R1.151 CC[C@H](C)OC[C@H]1CCO1 0d98a42f7220aff9ef398a83f8197562 [0,0,0,0,1,0|1,0,1]=3 1091 B10R1.151 CNC(=O)CCN1CCC1 9390160ff8f8a733d31d9719963702b0 [0,0,0,0,1,0|3,0,0]=4 1092 B10R1.151 CNC(=O)CNC1CCC1 9f43ced8f085b3c1c528c524db22050c [0,0,0,0,1,0|3,0,0]=4 1093 B10R1.151 CNC(=O)COC1CCC1 b6cc148756523be4d6b12add450181de [0,0,0,0,1,0|3,0,0]=4 1094 B10R1.151 COC(=O)CCN1CCC1 b6b9450829ae00a320827947425cf4b4 [0,0,0,0,1,0|3,0,0]=4 1095 B10R1.151 COC(=O)CNC1CCC1 47fed8153837f98eba2bf21b9b094a29 [0,0,0,0,1,0|3,0,0]=4 1096 B10R1.151 COC(=O)COC1CCC1 e1c8681508bb329ef8ea35404f130e0f [0,0,0,0,1,0|3,0,0]=4 1097 B10R1.151 COC(=O)OCN1CCC1 28258fa458aec354217a5f111d7d8f32 [0,0,0,0,1,0|2,0,0]=3 1098 B10R1.151 C[C@H](CS)OCC1CCC1 8305630ef10a49b78f58a31ab6a4c5a3 [0,0,0,0,1,0|2,0,1]=4 1099 B10R1.151 C[C@H](CS)OCC1CCO1 11d676661632bb784c7493cb6d6b2fb8 [0,0,0,0,1,0|2,0,1]=4 1100 B10R1.151 C[C@H](CS)OC[C@@H]1CCO1 d0e8749d8db358c689e24fd1463f72b3 [0,0,0,0,1,0|2,0,1]=4 1101 B10R1.151 C[C@H](CS)OC[C@H]1CCO1 bc6b5abda23eda5b00a71318beb159a9 [0,0,0,0,1,0|2,0,1]=4 1102 B10R1.151 O=C(CF)NCC1CCC1 58c4549873420e199e9d9a483bb826da [0,0,0,0,1,0|2,0,0]=3 1103 B10R1.151 O=C(CF)NCC1CCO1 3b07bf48c099df0136f577d8d957243e [0,0,0,0,1,0|2,0,0]=3 1104 B10R1.151 O=C(CF)NCC1COC1 dfb702185775057eeee6522c82caebbf [0,0,0,0,1,0|3,0,0]=4 1105 B10R1.151 O=C(CF)NC[C@@H]1CCO1 d794e6d17b9e49aa25279f1b17ef1617 [0,0,0,0,1,0|2,0,0]=3 1106 B10R1.151 O=C(CF)NC[C@H]1CCO1 c6fb18373fcf926baf6fca6130f0e63a [0,0,0,0,1,0|2,0,0]=3 1107 B10R1.151 O=C(CO)CNC1CCC1 80ea11ca4bfd9e03668324fd43891b57 [0,0,0,0,1,0|3,0,0]=4 1108 B10R1.151 O=C(CO)NCC1CCC1 abc401872fc69faa8595385d5786eb98 [0,0,0,0,1,0|2,0,0]=3 1109 B10R1.151 O=C(CO)NCC1CCO1 e4056cee7a4716ac0419be043a62c59f [0,0,0,0,1,0|2,0,0]=3 1110 B10R1.151 O=C(CO)NCC1COC1 6fcbac90f5beb62d7376397d4ec3eda7 [0,0,0,0,1,0|3,0,0]=4 1111 B10R1.151 O=C(CO)NC[C@@H]1CCO1 db72d3db0a06f540843e16f1b1fd9c90 [0,0,0,0,1,0|2,0,0]=3 1112 B10R1.151 O=C(CO)NC[C@H]1CCO1 397da1a119e2d84137a100d0ba764bda [0,0,0,0,1,0|2,0,0]=3 1113 B10R1.151 O=C(CS)NCC1CCC1 6d37979fbbd0321af54f46e683440eeb [0,0,0,0,1,0|2,0,0]=3 1114 B10R1.151 O=C(CS)NCC1CCO1 32e60c39d6146402af75f7a1fc7b8b55 [0,0,0,0,1,0|2,0,0]=3 1115 B10R1.151 O=C(CS)NCC1COC1 24b8f0e50511fa7a8d3e88ba3aade6bc [0,0,0,0,1,0|3,0,0]=4 1116 B10R1.151 O=C(CS)NC[C@@H]1CCO1 7fb3b950fa2903c4fa0d1587d603beaa [0,0,0,0,1,0|2,0,0]=3 1117 B10R1.151 O=C(CS)NC[C@H]1CCO1 0dcf4d2dee7aeed4e0d62989f3c01ca5 [0,0,0,0,1,0|2,0,0]=3 1118 B10R1.151 O=CC(=O)NCC1CCC1 6dddb6ab87c1606fb2ab16e8c4b4f7d2 [0,0,0,0,1,0|2,0,1]=4 1119 B10R1.151 O=CC(=O)NCC1CCO1 4a325f54a178ab63f02e1e2340b31599 [0,0,0,0,1,0|2,0,1]=4 1120 B10R1.151 O=CC(=O)NC[C@@H]1CCO1 bc45e84345d7568d30ff9c34c07f77af [0,0,0,0,1,0|2,0,1]=4 1121 B10R1.151 O=CC(=O)NC[C@H]1CCO1 1089cb96222890c76dd669ec02a0ad1a [0,0,0,0,1,0|2,0,1]=4 1122 B12R1.27 C#CC(=O)NCC1CCCCO1 0ad43328d41ba5e00e9548bf0429ffdc [0,0,0,0,0,1|1,0,2]=4 1123 B12R1.27 C#CC(=O)NCC1CCCOC1 5ffc4f8e2aebfd0824294b4586333f8d [0,0,0,0,0,1|1,0,2]=4 1124 B12R1.27 C#CC(=O)NCC1COCCO1 8a73cda56d9b57294c991eea15263667 [0,0,0,0,0,1|1,0,2]=4 1125 B12R1.27 C#CC(=O)NC[C@@H]1CCCOC1 97566a99ed2836d21bad3593d7b3a758 [0,0,0,0,0,1|1,0,2]=4 1126 B12R1.27 C#CC(=O)NC[C@H]1CCCOC1 64fa1964101f7c0b0b1ffbe71f5167b1 [0,0,0,0,0,1|1,0,2]=4 1127 B12R1.27 C#CC(=O)NC[C@H]1COCCO1 fbe9e47accd9eb07615af82f76ae64df [0,0,0,0,0,1|1,0,2]=4 1128 B12R1.27 C=C(C=O)OCC1CCCCO1 30b7943419bc75a9ad546009f1018caf [0,0,0,0,0,1|2,0,1]=4 1129 B12R1.27 C=C(C=O)OCC1CCCOC1 b7a8ec600bd0c6a36663fdda00c0daf9 [0,0,0,0,0,1|2,0,1]=4 1130 B12R1.27 C=C(C=O)OCC1COCCO1 a374aa00542f9d699fe55139c2d9568d [0,0,0,0,0,1|2,0,1]=4 1131 B12R1.27 C=C(CC)CNC1CCCOC1 2ea4b27f1ad05e48a8d192cdc4af0553 [0,0,0,0,0,1|3,0,0]=4 1132 B12R1.27 C=C(CC)CN[C@@H]1CCCOC1 5660227a5b9029ee6b753c78a4f9eb69 [0,0,0,0,0,1|3,0,0]=4 1133 B12R1.27 C=C(CC)CN[C@H]1CCCOC1 bac21c707d12ac6b938a160ad98dbfc9 [0,0,0,0,0,1|3,0,0]=4 1134 B12R1.27 C=C(CC)COC1CCCCO1 46cfc133ede466c626f8de5cdd404ede [0,0,0,0,0,1|3,0,0]=4 1135 B12R1.27 C=C(CC)COC1CCCOC1 9a6273cf790676a2f4bd2d7dde2ef781 [0,0,0,0,0,1|3,0,0]=4 1136 B12R1.27 C=C(CC)CO[C@@H]1CCCOC1 eab333f0172c23acab1f022f212df09a [0,0,0,0,0,1|3,0,0]=4 1137 B12R1.27 C=C(CC)CO[C@H]1CCCOC1 db7c7baa7aeb5a45eb8c0f86c33dc26f [0,0,0,0,0,1|3,0,0]=4 1138 B12R1.27 C=CC(=O)NCC1CCCCO1 fcba6e9c3daf8683412517ad961ad123 [0,0,0,0,0,1|1,0,2]=4 1139 B12R1.27 C=CC(=O)NCC1CCCOC1 4bdeb158f767cbdd922720340021a46e [0,0,0,0,0,1|1,0,2]=4 1140 B12R1.27 C=CC(=O)NCC1COCCO1 78be6996b7d62a777042ecb940a67d84 [0,0,0,0,0,1|1,0,2]=4 1141 B12R1.27 C=CC(=O)NC[C@@H]1CCCOC1 de6e1286525efcd840d1d7a6cc6e9aa6 [0,0,0,0,0,1|1,0,2]=4 1142 B12R1.27 C=CC(=O)NC[C@H]1CCCOC1 8380e05db6193292e34ed3d8e4915c4e [0,0,0,0,0,1|1,0,2]=4 1143 B12R1.27 C=CC(=O)NC[C@H]1COCCO1 8f1ddbd6217b8cb0a7143451e5c0c446 [0,0,0,0,0,1|1,0,2]=4 1144 B12R1.27 CC(CF)OCC1CCCCO1 320021efcb88be1628c2dd390fa005f5 [0,0,0,0,0,1|2,0,1]=4 1145 B12R1.27 CC(CF)OCC1CCCOC1 41a29117727cd4fbfee41ca52f717908 [0,0,0,0,0,1|2,0,1]=4 1146 B12R1.27 CC(CF)OCC1COCCO1 a240c2ed70465bd81a6693dbe55d0486 [0,0,0,0,0,1|2,0,1]=4 1147 B12R1.27 CC(CS)OCC1CCCCO1 16ffa55dcb17fb7c769bf1f193c210ba [0,0,0,0,0,1|2,0,1]=4 1148 B12R1.27 CC(CS)OCC1CCCOC1 d6a1174dc020802ca938c1d91990aba3 [0,0,0,0,0,1|2,0,1]=4 1149 B12R1.27 CC(CS)OCC1COCCO1 972bc25551a43910047c818477e0f3e4 [0,0,0,0,0,1|2,0,1]=4 1150 B12R1.27 CCC(=O)CNC1C=CCCC1 3aaff5f2f6162f773caa918120df8f09 [0,0,0,0,0,1|3,0,0]=4 1151 B12R1.27 CCC(=O)CNC1CCCOC1 3bf9ae88cf10816f3c9f30ce72d55b0e [0,0,0,0,0,1|2,0,0]=3 1152 B12R1.27 CCC(=O)CNC1CCOCC1 95dbea107f4433ec258bbd51548b3472 [0,0,0,0,0,1|3,0,0]=4 1153 B12R1.27 CCC(=O)CNC1CCSCC1 b2bcb9c89b2e474687d6aff905e1695d [0,0,0,0,0,1|3,0,0]=4 1154 B12R1.27 CCC(=O)CN[C@@H]1CCCOC1 f968ecbc297ac21622b2daebbcfd089e [0,0,0,0,0,1|2,0,0]=3 1155 B12R1.27 CCC(=O)CN[C@H]1CCCOC1 b8d1385eef4ec62c98bb60a191ad5201 [0,0,0,0,0,1|2,0,0]=3 1156 B12R1.27 CCC(=O)COC1C=CCCC1 dae077a8ac399725bf3222ecf9d8a00b [0,0,0,0,0,1|3,0,0]=4 1157 B12R1.27 CCC(=O)COC1CCCCC1 b08dae3654feebf4586bf4d8e9316d63 [0,0,0,0,0,1|3,0,0]=4 1158 B12R1.27 CCC(=O)COC1CCCCO1 43af0a78cc790bc8b6618df7b331d913 [0,0,0,0,0,1|2,0,0]=3 1159 B12R1.27 CCC(=O)COC1CCCOC1 ad6accf2966aa9bcd71c11ed6a56edc8 [0,0,0,0,0,1|2,0,0]=3 1160 B12R1.27 CCC(=O)COC1CCCSC1 30967f085b1a21a371d29e65f8c886a9 [0,0,0,0,0,1|2,1,0]=4 1161 B12R1.27 CCC(=O)COC1CCOCC1 88a26483f038389d341a5d673cff253f [0,0,0,0,0,1|3,0,0]=4 1162 B12R1.27 CCC(=O)COC1CCSCC1 fcc40f19b2a06893729c425378009d3f [0,0,0,0,0,1|3,0,0]=4 1163 B12R1.27 CCC(=O)CO[C@@H]1CCCOC1 6d8681d55358211fa277593d96ccbb9e [0,0,0,0,0,1|2,0,0]=3 1164 B12R1.27 CCC(=O)CO[C@H]1CCCOC1 d02939f825716eccf7c48a69b8e7b521 [0,0,0,0,0,1|2,0,0]=3 1165 B12R1.27 CCC(=O)NCC1=CCCCC1 5ded9dfa0d3ce75eaa796020f3067579 [0,0,0,0,0,1|2,0,1]=4 1166 B12R1.27 CCC(=O)NCC1CC=CCC1 76e5a11539a12ccc61d98d5698f1ff2c [0,0,0,0,0,1|2,0,1]=4 1167 B12R1.27 CCC(=O)NCC1CCCCC1 35e0fbdc611a9ce372d9ee9dc56fc820 [0,0,0,0,0,1|2,0,0]=3 1168 B12R1.27 CCC(=O)NCC1CCCCO1 c169646266aca4879b8dbdec62646656 [0,0,0,0,0,1|1,0,0]=2 1169 B12R1.27 CCC(=O)NCC1CCCOC1 8479f69adfbfa2598248bc26426514bc [0,0,0,0,0,1|1,0,0]=2 1170 B12R1.27 CCC(=O)NCC1CCOCC1 65a56836389bd10a345909ee6ac85ae0 [0,0,0,0,0,1|2,0,0]=3 1171 B12R1.27 CCC(=O)NCC1CCSCC1 cf39039272e7e4c6bfffe72c6263b040 [0,0,0,0,0,1|2,0,0]=3 1172 B12R1.27 CCC(=O)NCC1COCCO1 aa9c5ff0d4680101fb3a3310f06d0302 [0,0,0,0,0,1|1,0,0]=2 1173 B12R1.27 CCC(=O)NC[C@@H]1CCCOC1 540e96c83c1ef62cc91e933f54f8a2e0 [0,0,0,0,0,1|1,0,0]=2 1174 B12R1.27 CCC(=O)NC[C@H]1CCCOC1 1e82abc03475530f47e0cbe5813f208c [0,0,0,0,0,1|1,0,0]=2 1175 B12R1.27 CCC(=O)NC[C@H]1COCCO1 9b55133fbf088ecf7eba6ac0f692112f [0,0,0,0,0,1|1,0,0]=2 1176 B12R1.27 CCC(=O)OCN1CC=CCC1 cf058ff5417e3b166e8af567c54bad5e [0,0,0,0,0,1|2,0,1]=4 1177 B12R1.27 CCC(=O)OCN1CCCOC1 a076e45fe22348b6ec24a77bcce3654b [0,0,0,0,0,1|1,0,0]=2 1178 B12R1.27 CCC(=O)OCN1CCCSC1 b8e2989063021f9473eccb18fc2ab9b9 [0,0,0,0,0,1|1,1,0]=3 1179 B12R1.27 CCC(=O)OCN1CCOCC1 9bf070f19478f62528c6d6f27ab84517 [0,0,0,0,0,1|2,0,0]=3 1180 B12R1.27 CCC(=O)OCN1CCSCC1 c5ee87cad9285b7daa708647e8bade0b [0,0,0,0,0,1|2,0,0]=3 1181 B12R1.27 CCC(C)NCC1CCCCO1 52c3fad6cd533ad76cd61ecdc659e0d6 [0,0,0,0,0,1|2,0,1]=4 1182 B12R1.27 CCC(C)NCC1CCCOC1 8e4da29deb9f3152b4f19524b46e3077 [0,0,0,0,0,1|2,0,1]=4 1183 B12R1.27 CCC(C)NCC1COCCO1 2a6d1ac625f3abea714b508a1dd1ad97 [0,0,0,0,0,1|2,0,1]=4 1184 B12R1.27 CCC(C)NC[C@@H]1CCCOC1 c87255329409799cf1fdae932fdf1b77 [0,0,0,0,0,1|2,0,1]=4 1185 B12R1.27 CCC(C)NC[C@H]1CCCOC1 d0460259989facb1968b051edd5d0c8b [0,0,0,0,0,1|2,0,1]=4 1186 B12R1.27 CCC(C)NC[C@H]1COCCO1 248d9fb1d2518c988f9bf931b930de65 [0,0,0,0,0,1|2,0,1]=4 1187 B12R1.27 CCC(C)OCC1=CCCCO1 1dc8587ab411bef769e8b14dd09bfe96 [0,0,0,0,0,1|1,0,2]=4 1188 B12R1.27 CCC(C)OCC1CCC=CO1 52b9e01ecd9308df218d76d6c728aadc [0,0,0,0,0,1|1,0,2]=4 1189 B12R1.27 CCC(C)OCC1CCCCC1 eaedbcb2ff20ccbfda1ca0c3eaf5ad99 [0,0,0,0,0,1|2,0,1]=4 1190 B12R1.27 CCC(C)OCC1CCCCO1 3527b5d8308b45b94b4637bf268df7a0 [0,0,0,0,0,1|1,0,1]=3 1191 B12R1.27 CCC(C)OCC1CCCOC1 ae62983ea81828290be20524ee67b30d [0,0,0,0,0,1|1,0,1]=3 1192 B12R1.27 CCC(C)OCC1CCOCC1 55d515d0cc975636ab51af1c4ba8fdb3 [0,0,0,0,0,1|2,0,1]=4 1193 B12R1.27 CCC(C)OCC1CCSCC1 95a4c5d25a7c898f0e472a9af8c87d8a [0,0,0,0,0,1|2,0,1]=4 1194 B12R1.27 CCC(C)OCC1COCCO1 ae1b570ba0153a3b16e9c21653ad6d00 [0,0,0,0,0,1|1,0,1]=3 1195 B12R1.27 CCC(C)OC[C@@H]1CCCCO1 f35bee9fd46d0369a3f5578f5b14c9dd [0,0,0,0,0,1|1,0,1]=3 1196 B12R1.27 CCC(C)OC[C@@H]1CCCOC1 b88965fa76b08779b48f60105f8c0c82 [0,0,0,0,0,1|1,0,1]=3 1197 B12R1.27 CCC(C)OC[C@@H]1COCCO1 e0ba0288333f10dcb9fcc994a74cd7c0 [0,0,0,0,0,1|1,0,1]=3 1198 B12R1.27 CCC(C)OC[C@H]1CCCCO1 1ef75aeffa3c88b08b15a9f31dcff5e2 [0,0,0,0,0,1|1,0,1]=3 1199 B12R1.27 CCC(C)OC[C@H]1CCCOC1 3555d4aa7ab5f81843c8309a26f64e56 [0,0,0,0,0,1|1,0,1]=3 1200 B12R1.27 CCC(C)OC[C@H]1COCCO1 c9a42861b81ff5fec0f80776dda6a7ce [0,0,0,0,0,1|1,0,1]=3 1201 B12R1.27 CCN(C)CCC1CCCOC1 5afba826b000069893c40cbf453da0af [0,0,0,0,0,1|3,0,0]=4 1202 B12R1.27 CCN(C)CCC1COCCO1 4a9919112782c91ce15728c04f7e1968 [0,0,0,0,0,1|3,0,0]=4 1203 B12R1.27 CC[C@@H](C)NCC1CCCCO1 3a5fd63770303e383da6d2c2058a4a22 [0,0,0,0,0,1|2,0,1]=4 1204 B12R1.27 CC[C@@H](C)NCC1CCCOC1 996609138279258195b81cff21f41f19 [0,0,0,0,0,1|2,0,1]=4 1205 B12R1.27 CC[C@@H](C)NCC1COCCO1 c9a0c76e94daea02d4ef41a782a98c21 [0,0,0,0,0,1|2,0,1]=4 1206 B12R1.27 CC[C@@H](C)OCC1CCCCC1 1ab8bc83389abc029cb1ea482f6d623e [0,0,0,0,0,1|2,0,1]=4 1207 B12R1.27 CC[C@@H](C)OCC1CCCCO1 714b749a570cfbdfc41d9cce16ed6b49 [0,0,0,0,0,1|1,0,1]=3 1208 B12R1.27 CC[C@@H](C)OCC1CCCOC1 1b0835dd682e1f3dfd73a66af724a3d5 [0,0,0,0,0,1|1,0,1]=3 1209 B12R1.27 CC[C@@H](C)OCC1CCOCC1 4b2eebb7d8ccf1afbf9f7fe6ba4bb35b [0,0,0,0,0,1|2,0,1]=4 1210 B12R1.27 CC[C@@H](C)OCC1CCSCC1 3613e86dc141f2d75e570af5c4ae4cf2 [0,0,0,0,0,1|2,0,1]=4 1211 B12R1.27 CC[C@@H](C)OCC1COCCO1 38a2d799e13c1e8a6cfb569d86ed79e2 [0,0,0,0,0,1|1,0,1]=3 1212 B12R1.27 CC[C@H](C)NCC1CCCCO1 6a7e6faedf0e5c3cdbd1e76f4ef6e470 [0,0,0,0,0,1|2,0,1]=4 1213 B12R1.27 CC[C@H](C)NCC1CCCOC1 9b33239865a85c8202336f40d8b74016 [0,0,0,0,0,1|2,0,1]=4 1214 B12R1.27 CC[C@H](C)NCC1COCCO1 7d381fb4e727ae611f1e235c9848e8df [0,0,0,0,0,1|2,0,1]=4 1215 B12R1.27 CC[C@H](C)OCC1CCCCC1 74e485591ba06fd98d555b7fb83aac1b [0,0,0,0,0,1|2,0,1]=4 1216 B12R1.27 CC[C@H](C)OCC1CCCCO1 041810624368794685ed9b64e26895f1 [0,0,0,0,0,1|1,0,1]=3 1217 B12R1.27 CC[C@H](C)OCC1CCCOC1 557bf615594841fd7ff90e769e8b099e [0,0,0,0,0,1|1,0,1]=3 1218 B12R1.27 CC[C@H](C)OCC1CCOCC1 aec0375666357ea8f2347395cd29c77f [0,0,0,0,0,1|2,0,1]=4 1219 B12R1.27 CC[C@H](C)OCC1CCSCC1 fa86af61cf4f32fd8a32570b0e719703 [0,0,0,0,0,1|2,0,1]=4 1220 B12R1.27 CC[C@H](C)OCC1COCCO1 41ae5f5771e934276192865336d3bd4d [0,0,0,0,0,1|1,0,1]=3 1221 B12R1.27 CNC(=O)CCN1CCCOC1 e14541b47c21d71af7257d73da56aa68 [0,0,0,0,0,1|3,0,0]=4 1222 B12R1.27 CNC(=O)CNC1CCCCO1 c96cf238c0be261a69dc398af6a1666c [0,0,0,0,0,1|3,0,0]=4 1223 B12R1.27 CNC(=O)CNC1CCCOC1 14850c7028fc0b3f7df757566847f0c3 [0,0,0,0,0,1|3,0,0]=4 1224 B12R1.27 CNC(=O)CN[C@@H]1CCCOC1 ebee9a242ac6d064be060728277041d6 [0,0,0,0,0,1|3,0,0]=4 1225 B12R1.27 CNC(=O)CN[C@H]1CCCOC1 d95e20d15b0cfa6d8d186102a9a81b62 [0,0,0,0,0,1|3,0,0]=4 1226 B12R1.27 CNC(=O)COC1CCCCO1 86900bb64237f77f8bc7ea66009e47ee [0,0,0,0,0,1|3,0,0]=4 1227 B12R1.27 CNC(=O)COC1CCCOC1 c373263a6d386a890078742bda2b476a [0,0,0,0,0,1|3,0,0]=4 1228 B12R1.27 CNC(=O)CO[C@@H]1CCCOC1 f6dd8c2140e7b02eeed3782f08ab4fe6 [0,0,0,0,0,1|3,0,0]=4 1229 B12R1.27 CNC(=O)CO[C@H]1CCCOC1 92f0d1f1cef1c7ccb838daf65ad2ddf1 [0,0,0,0,0,1|3,0,0]=4 1230 B12R1.27 COC(=O)CCN1CCCOC1 f02fdd35a1ed8b737dd2b59ee0a7b85e [0,0,0,0,0,1|3,0,0]=4 1231 B12R1.27 COC(=O)CNC1CCCOC1 7747717f03d47b34aad74eb6f070aca0 [0,0,0,0,0,1|3,0,0]=4 1232 B12R1.27 COC(=O)CN[C@@H]1CCCOC1 f76ce2969a24a9ec2c2b3bf3b944d400 [0,0,0,0,0,1|3,0,0]=4 1233 B12R1.27 COC(=O)CN[C@H]1CCCOC1 ed6ea967e94c1cb63d5c4647b86d06d5 [0,0,0,0,0,1|3,0,0]=4 1234 B12R1.27 COC(=O)COC1CCCCO1 dcb8fcbe121eabf4fab691572eae8e5e [0,0,0,0,0,1|3,0,0]=4 1235 B12R1.27 COC(=O)COC1CCCOC1 a3ca0e49ee1ca962719e623df7604c67 [0,0,0,0,0,1|3,0,0]=4 1236 B12R1.27 COC(=O)CO[C@@H]1CCCOC1 3a29aa3ae815c37b90b42570ab26ae8f [0,0,0,0,0,1|3,0,0]=4 1237 B12R1.27 COC(=O)CO[C@H]1CCCOC1 2e3fbbdc152b5fcd91e26d4238f4937f [0,0,0,0,0,1|3,0,0]=4 1238 B12R1.27 COC(=O)OCN1CCCOC1 4a2156bf949a1699b25780a996ead470 [0,0,0,0,0,1|2,0,0]=3 1239 B12R1.27 COC(=O)OCN1CCCSC1 ea1d4703e856d65cd9f0d2d3607f2e48 [0,0,0,0,0,1|2,1,0]=4 1240 B12R1.27 COC(=O)OCN1CCOCC1 587dffb46fc852d8c170105f66c49ad4 [0,0,0,0,0,1|3,0,0]=4 1241 B12R1.27 COC(=O)OCN1CCSCC1 3323560cdfaa1f2fc3dc04eb915f01ac [0,0,0,0,0,1|3,0,0]=4 1242 B12R1.27 C[C@H](CS)OCC1CCCCO1 bd447d70a9ed3f2cc4ec4e7001f1f504 [0,0,0,0,0,1|2,0,1]=4 1243 B12R1.27 C[C@H](CS)OCC1CCCOC1 d6a485f2dd193ba94e433fd1d9517c42 [0,0,0,0,0,1|2,0,1]=4 1244 B12R1.27 C[C@H](CS)OCC1COCCO1 ace4ecfc2b6811e7e5e5b1a891af19e4 [0,0,0,0,0,1|2,0,1]=4 1245 B12R1.27 O=C(CF)NCC1CCCCC1 85267d433b64042bd98cb5b7960ad061 [0,0,0,0,0,1|3,0,0]=4 1246 B12R1.27 O=C(CF)NCC1CCCCO1 c37ea0f006fc2b2edcb315175ac78911 [0,0,0,0,0,1|2,0,0]=3 1247 B12R1.27 O=C(CF)NCC1CCCOC1 8a84adac033ba194b2135c29ef5febd5 [0,0,0,0,0,1|2,0,0]=3 1248 B12R1.27 O=C(CF)NCC1CCOCC1 85335b719060d2be5866ffbf1f5d68a7 [0,0,0,0,0,1|3,0,0]=4 1249 B12R1.27 O=C(CF)NCC1CCSCC1 7d70aaabc99e964852066818967310a6 [0,0,0,0,0,1|3,0,0]=4 1250 B12R1.27 O=C(CF)NCC1COCCO1 54c8bf11c97a0e26d30217671100306e [0,0,0,0,0,1|2,0,0]=3 1251 B12R1.27 O=C(CF)NC[C@@H]1CCCOC1 ee2ca5248bc44989aa5567ddd9abdc2c [0,0,0,0,0,1|2,0,0]=3 1252 B12R1.27 O=C(CF)NC[C@H]1CCCOC1 825c7b9ece2cb3c4ec23ac9119805f4c [0,0,0,0,0,1|2,0,0]=3 1253 B12R1.27 O=C(CF)NC[C@H]1COCCO1 8c20a30b76ac9042401f5990a783d093 [0,0,0,0,0,1|2,0,0]=3 1254 B12R1.27 O=C(CO)CNC1CCCOC1 012afa7f7d7d4c64ce1ffc510ade26b2 [0,0,0,0,0,1|3,0,0]=4 1255 B12R1.27 O=C(CO)CN[C@@H]1CCCOC1 6943994fa1edc4e3ed514d66fca756f9 [0,0,0,0,0,1|3,0,0]=4 1256 B12R1.27 O=C(CO)CN[C@H]1CCCOC1 06540aca30cbc930c99608064b124633 [0,0,0,0,0,1|3,0,0]=4 1257 B12R1.27 O=C(CO)NCC1CCCCC1 a9b19c31cfe7e54de0a8e15666fe55c4 [0,0,0,0,0,1|3,0,0]=4 1258 B12R1.27 O=C(CO)NCC1CCCCO1 a0b85a72929faf80d49f9aa457212602 [0,0,0,0,0,1|2,0,0]=3 1259 B12R1.27 O=C(CO)NCC1CCCOC1 9b5a10ae622856b5ece96bd82a763357 [0,0,0,0,0,1|2,0,0]=3 1260 B12R1.27 O=C(CO)NCC1CCOCC1 24b098e97e0e50b6897d864119c80419 [0,0,0,0,0,1|3,0,0]=4 1261 B12R1.27 O=C(CO)NCC1CCSCC1 316832830cae03828b9ada6996210f2f [0,0,0,0,0,1|3,0,0]=4 1262 B12R1.27 O=C(CO)NCC1COCCO1 0987459aec9b7f522a54aafd5bb30c12 [0,0,0,0,0,1|2,0,0]=3 1263 B12R1.27 O=C(CO)NC[C@@H]1CCCOC1 e1daf7fd1570807659cff6a79e6568aa [0,0,0,0,0,1|2,0,0]=3 1264 B12R1.27 O=C(CO)NC[C@H]1CCCOC1 5a1d1a75bcd04122fb0398328cb9f823 [0,0,0,0,0,1|2,0,0]=3 1265 B12R1.27 O=C(CO)NC[C@H]1COCCO1 7a135d4328f9584bffcf314ccdb57f78 [0,0,0,0,0,1|2,0,0]=3 1266 B12R1.27 O=C(CS)NCC1CCCCC1 33d2c387c724c957bea6e873762e7541 [0,0,0,0,0,1|3,0,0]=4 1267 B12R1.27 O=C(CS)NCC1CCCCO1 3d46a81af503b7f8e67da01ab6bc75fa [0,0,0,0,0,1|2,0,0]=3 1268 B12R1.27 O=C(CS)NCC1CCCOC1 6f33f19a5ebf29c977986bef5d9f9c2f [0,0,0,0,0,1|2,0,0]=3 1269 B12R1.27 O=C(CS)NCC1CCOCC1 ad29fa2b5524ad9098f4fc8b6aae5354 [0,0,0,0,0,1|3,0,0]=4 1270 B12R1.27 O=C(CS)NCC1CCSCC1 0e16bcd6b2361f7aca737c810c3ac0c2 [0,0,0,0,0,1|3,0,0]=4 1271 B12R1.27 O=C(CS)NCC1COCCO1 3cbd6f44a44369640e035f2be4a7fe06 [0,0,0,0,0,1|2,0,0]=3 1272 B12R1.27 O=C(CS)NC[C@@H]1CCCOC1 abb8f032b254685534c3c43506ce617a [0,0,0,0,0,1|2,0,0]=3 1273 B12R1.27 O=C(CS)NC[C@H]1CCCOC1 54631ab99b7e6d8b99b04a1058214042 [0,0,0,0,0,1|2,0,0]=3 1274 B12R1.27 O=C(CS)NC[C@H]1COCCO1 a5555a40070d26530bde71f14430044d [0,0,0,0,0,1|2,0,0]=3 1275 B12R1.27 O=CC(=O)NCC1CCCCO1 f31b0708b0ecfffc5288c069a7e08a20 [0,0,0,0,0,1|2,0,1]=4 1276 B12R1.27 O=CC(=O)NCC1CCCOC1 6f31fff4cba958b3f5dbf489f84dc9ff [0,0,0,0,0,1|2,0,1]=4 1277 B12R1.27 O=CC(=O)NCC1COCCO1 687bb23a6b241fbebfe9283d7b4a8928 [0,0,0,0,0,1|2,0,1]=4 1278 B12R1.27 O=CC(=O)NC[C@@H]1CCCOC1 1d84f2be02ec67fdea45b2e2e4158c0d [0,0,0,0,0,1|2,0,1]=4 1279 B12R1.27 O=CC(=O)NC[C@H]1CCCOC1 1b9ac586e40643ad9610db9a6f96e681 [0,0,0,0,0,1|2,0,1]=4 1280 B12R1.27 O=CC(=O)NC[C@H]1COCCO1 274a7df56d99ed5a32ec25dfdef4aa6a [0,0,0,0,0,1|2,0,1]=4 1281 B12R1.477 BrCC(Br)COCC1CCCO1 b308128aec02eb11416487e27d7e51da [0,0,0,0,0,1|2,0,1]=4 1282 B12R1.477 C#CC(=O)NCCC1CCCO1 0afa7f8d305c31db47b48924e9a8fe42 [0,0,0,0,0,1|1,0,2]=4 1283 B12R1.477 C/C(=C\I)/COCC1CCCO1 5513b3f27ee761fd6e3f5cab5cc72096 [0,0,0,0,0,1|2,0,1]=4 1284 B12R1.477 C=C(C#N)COCC1CCCO1 f4ae95b03b00ac49efa859c0d8a067ba [0,0,0,0,0,1|2,0,1]=4 1285 B12R1.477 C=C(C#N)COC[C@@H]1CCCO1 6a4cc7fb97c7f4e25d3abcb16f0f7d51 [0,0,0,0,0,1|2,0,1]=4 1286 B12R1.477 C=C(C#N)COC[C@H]1CCCO1 d56b9c3413c0ae328ccd5a0e18c10a3e [0,0,0,0,0,1|2,0,1]=4 1287 B12R1.477 C=C(C=O)OCCC1CCCO1 41bd997b15b8ca07bdc5aba9889bd4f0 [0,0,0,0,0,1|2,0,1]=4 1288 B12R1.477 C=C(CC)CNCC1CCCC1 ee1bbf14d8074accee323940bd2dcbfa [0,0,0,0,0,1|3,0,0]=4 1289 B12R1.477 C=C(CC)CNCC1CCCO1 91b1f0ffc5bae0424370889528cd7aee [0,0,0,0,0,1|2,0,0]=3 1290 B12R1.477 C=C(CC)CNC[C@@H]1CCCO1 8e595e989917335fdb059d0f6eb1c9b2 [0,0,0,0,0,1|2,0,0]=3 1291 B12R1.477 C=C(CC)CNC[C@H]1CCCO1 1feb5af456d3650d880ae673e00840b5 [0,0,0,0,0,1|2,0,0]=3 1292 B12R1.477 C=C(CC)COCC1C=CCC1 513a5c559002097f4bc1eee002ca1dfe [0,0,0,0,0,1|2,0,1]=4 1293 B12R1.477 C=C(CC)COCC1CCCC1 f3758d30ada2bfa89603d9927498480d [0,0,0,0,0,1|2,0,0]=3 1294 B12R1.477 C=C(CC)COCC1CCCO1 34626decf47e9e31911df2f1ee35f462 [0,0,0,0,0,1|1,0,0]=2 1295 B12R1.477 C=C(CC)COCC1CCCS1 40a26e81a19541708f981c7dd8f918e2 [0,0,0,0,0,1|1,1,0]=3 1296 B12R1.477 C=C(CC)COCC1CCOC1 36df501e02cb31006a998e04bd82d9cd [0,0,0,0,0,1|3,0,0]=4 1297 B12R1.477 C=C(CC)COCN1CCCC1 b5d4ca57def60300ecaf601f4605b1cf [0,0,0,0,0,1|3,0,0]=4 1298 B12R1.477 C=C(CC)COC[C@@H]1CCCO1 b9305558b0fae67a9f2b75d735e43172 [0,0,0,0,0,1|1,0,0]=2 1299 B12R1.477 C=C(CC)COC[C@@H]1CCOC1 3a0bbea1c2aa87fd8d1cb9d7ce8bb99f [0,0,0,0,0,1|3,0,0]=4 1300 B12R1.477 C=C(CC)COC[C@H]1CCCO1 c7da95d0ebcf5491911040afeaa7385b [0,0,0,0,0,1|1,0,0]=2 1301 B12R1.477 C=C(CC)COC[C@H]1CCOC1 e3b9e98edc8670f49d49d570dc873c8a [0,0,0,0,0,1|3,0,0]=4 1302 B12R1.477 C=C(CNCC1CCCO1)OC 2eef7cb508371145917ef32d465f3bfb [0,0,0,0,0,1|3,0,0]=4 1303 B12R1.477 C=C(CNC[C@@H]1CCCO1)OC cd7d2c85ed4c5b623484841b382c9fb0 [0,0,0,0,0,1|3,0,0]=4 1304 B12R1.477 C=C(CNC[C@H]1CCCO1)OC 36e69dca3f2c338ca51c2650f85c1a2c [0,0,0,0,0,1|3,0,0]=4 1305 B12R1.477 C=C(CO)CNCC1CCCO1 4e9c948e40b52c18832817579b68c537 [0,0,0,0,0,1|3,0,0]=4 1306 B12R1.477 C=C(CO)CNC[C@@H]1CCCO1 c1c0f9e9a28c2902e832f32923e4d19b [0,0,0,0,0,1|3,0,0]=4 1307 B12R1.477 C=C(CO)CNC[C@H]1CCCO1 7f426e9fc6dd35d6324bf7ffd3de8552 [0,0,0,0,0,1|3,0,0]=4 1308 B12R1.477 C=C(COCC1CCCC1)OC e3f2a7404aaae0aa8c123273e757d116 [0,0,0,0,0,1|3,0,0]=4 1309 B12R1.477 C=C(COCC1CCCO1)OC 7f630f2c07a27387e081ab60d276d7d8 [0,0,0,0,0,1|2,0,0]=3 1310 B12R1.477 C=C(COCC1CCCS1)OC 1c194310efbfdd85cf50b80a496d4463 [0,0,0,0,0,1|2,1,0]=4 1311 B12R1.477 C=C(COC[C@@H]1CCCO1)OC f5afaec2b2d0cb7a385d500f360554e1 [0,0,0,0,0,1|2,0,0]=3 1312 B12R1.477 C=C(COC[C@H]1CCCO1)OC 6268aa5e51d1ebe9f937dc622af9860d [0,0,0,0,0,1|2,0,0]=3 1313 B12R1.477 C=CC(=O)NCCC1CCCO1 5ccceeaa5ffc07fb8067dd15ada6abdf [0,0,0,0,0,1|1,0,2]=4 1314 B12R1.477 CC(=CI)COCC1CCCO1 22716572cb968b7da8b39289c6d3d76a [0,0,0,0,0,1|2,0,1]=4 1315 B12R1.477 CC(CF)OCCC1CCCO1 0259c8ae2d060ae3c982f473e2d3179b [0,0,0,0,0,1|2,0,1]=4 1316 B12R1.477 CC(CS)OCCC1CCCO1 69f6e2e06e677f419505808853cd60a4 [0,0,0,0,0,1|2,0,1]=4 1317 B12R1.477 CCC(=O)CNCC1CCCC1 2af5053710eeb80541edd9fbad68b39d [0,0,0,0,0,1|2,0,0]=3 1318 B12R1.477 CCC(=O)CNCC1CCCO1 54365f49dab6857bc2ab3fd565a8be46 [0,0,0,0,0,1|1,0,0]=2 1319 B12R1.477 CCC(=O)CNCC1CCOC1 d240cac21aa9502fc217ffb561616a93 [0,0,0,0,0,1|3,0,0]=4 1320 B12R1.477 CCC(=O)CNC[C@@H]1CCCO1 c35303f849c4fea5f081fc4c54d92416 [0,0,0,0,0,1|1,0,0]=2 1321 B12R1.477 CCC(=O)CNC[C@@H]1CCOC1 84c8ac34a628372c8d49ab8c93c28829 [0,0,0,0,0,1|3,0,0]=4 1322 B12R1.477 CCC(=O)CNC[C@H]1CCCO1 496f8500292f19c8b47b6b6d89acfd56 [0,0,0,0,0,1|1,0,0]=2 1323 B12R1.477 CCC(=O)CNC[C@H]1CCOC1 1a46419b3f88d189d07897f5a56578a7 [0,0,0,0,0,1|3,0,0]=4 1324 B12R1.477 CCC(=O)COCC1C=CCC1 f2c07ed3af74bbd3bb709980cebc1612 [0,0,0,0,0,1|1,0,1]=3 1325 B12R1.477 CCC(=O)COCC1CC=CC1 e8c74af7d1a89b31cb972083481d334c [0,0,0,0,0,1|1,0,2]=4 1326 B12R1.477 CCC(=O)COCC1CCCC1 c8562fd75fad6a35e585f68a8bed3581 [0,0,0,0,0,1|1,0,0]=2 1327 B12R1.477 CCC(=O)COCC1CCCO1 c4f7fb75281193ef4162e6013af67a21 [0,0,0,0,0,1|0,0,0]=1 1328 B12R1.477 CCC(=O)COCC1CCCS1 ad827b19ff6e9a6e9646d1abee1cc6ec [0,0,0,0,0,1|0,1,0]=2 1329 B12R1.477 CCC(=O)COCC1CCOC1 e7c823a086234449dc3ac0d20978d1ea [0,0,0,0,0,1|2,0,0]=3 1330 B12R1.477 CCC(=O)COCN1CCCC1 9bda17e69f6f3c10b346a86d489b9337 [0,0,0,0,0,1|2,0,0]=3 1331 B12R1.477 CCC(=O)COC[C@@H]1CCCO1 c87973751310d4878355b83cd8a8204b [0,0,0,0,0,1|0,0,0]=1 1332 B12R1.477 CCC(=O)COC[C@@H]1CCOC1 eac3d7daa14e6844f5bbea43261f4207 [0,0,0,0,0,1|2,0,0]=3 1333 B12R1.477 CCC(=O)COC[C@H]1CCCO1 f9e0691c371b6d34aad65da482932916 [0,0,0,0,0,1|0,0,0]=1 1334 B12R1.477 CCC(=O)COC[C@H]1CCOC1 d14d54065361f9dc2e321b868bb99193 [0,0,0,0,0,1|2,0,0]=3 1335 B12R1.477 CCC(=O)NCCC1CCCC1 b67cf06d1e0a23d3026b35a48b608ff0 [0,0,0,0,0,1|2,0,0]=3 1336 B12R1.477 CCC(=O)NCCC1CCCO1 e82ee9ec4c520b5eca6fdd9b30b5d2e2 [0,0,0,0,0,1|1,0,0]=2 1337 B12R1.477 CCC(=O)NCCC1CCOC1 7184f6cb57ca5fe02182fe571158583d [0,0,0,0,0,1|3,0,0]=4 1338 B12R1.477 CCC(=O)NCCN1CCCC1 f751147cd9e0ad430888dd51dbdab63e [0,0,0,0,0,1|3,0,0]=4 1339 B12R1.477 CCC(=O)OCNC1CC=CC1 12ca7e9295412a00ed2c10f456f933ff [0,0,0,0,0,1|1,0,2]=4 1340 B12R1.477 CCC(=O)OCNC1CCCC1 0d4cb49b0aeee27c2c6cfea91795ddce [0,0,0,0,0,1|1,0,0]=2 1341 B12R1.477 CCC(=O)OCNC1CCOC1 d0b7d5fc63b940552c230bb3a744c3ee [0,0,0,0,0,1|2,0,0]=3 1342 B12R1.477 CCC(=O)OCNC1CCSC1 0db7918c715b0ddd219e8fe9b063b2c5 [0,0,0,0,0,1|2,0,0]=3 1343 B12R1.477 CCC(=O)OCN[C@@H]1CCOC1 099379a176dc79fc97e66514393c2ef1 [0,0,0,0,0,1|2,0,0]=3 1344 B12R1.477 CCC(=O)OCN[C@H]1CCOC1 b403c5348617b3d1e062094f3ae85451 [0,0,0,0,0,1|2,0,0]=3 1345 B12R1.477 CCC(=O)OCOC1C=CCC1 b1bb9c887cb41b9ed2049568bacae7ea [0,0,0,0,0,1|1,0,1]=3 1346 B12R1.477 CCC(=O)OCOC1CC=CC1 c35a97c57e116bf675c94c4d28639b68 [0,0,0,0,0,1|1,0,2]=4 1347 B12R1.477 CCC(=O)OCOC1CCCC1 14d3c1eadadedb2bc6b3b9d836da0898 [0,0,0,0,0,1|1,0,0]=2 1348 B12R1.477 CCC(=O)OCOC1CCCO1 f8d0e9ce891e00515f9b1c2868ea1701 [0,0,0,0,0,1|0,0,0]=1 1349 B12R1.477 CCC(=O)OCOC1CCOC1 e4df6797f118ffd5af890b6f38dfd95b [0,0,0,0,0,1|2,0,0]=3 1350 B12R1.477 CCC(=O)OCOC1CCSC1 f918a86935d973061c7dca1d20126e1a [0,0,0,0,0,1|2,0,0]=3 1351 B12R1.477 CCC(=O)OCO[C@@H]1CCOC1 2f9070e58620f043adca470f510490d2 [0,0,0,0,0,1|2,0,0]=3 1352 B12R1.477 CCC(=O)OCO[C@@H]1CCSC1 099c5ac345d114dedf94bf77e9368844 [0,0,0,0,0,1|2,0,0]=3 1353 B12R1.477 CCC(=O)OCO[C@H]1CCOC1 087ffe50ca8c6b5f636ec8a0ac49f742 [0,0,0,0,0,1|2,0,0]=3 1354 B12R1.477 CCC(=O)OCO[C@H]1CCSC1 117805108d1e0b0f615cc039b9cde099 [0,0,0,0,0,1|2,0,0]=3 1355 B12R1.477 CCC(C)CCOC1CCCO1 b05c375f9443d4f928bb805d6b55c59b [0,0,0,0,0,1|2,0,1]=4 1356 B12R1.477 CCC(C)CNCC1CCCO1 01e7b047f0cc41bbb76aa769607ae2fb [0,0,0,0,0,1|2,0,1]=4 1357 B12R1.477 CCC(C)CNC[C@@H]1CCCO1 53f4d26508f438ac64a45a8298242883 [0,0,0,0,0,1|2,0,1]=4 1358 B12R1.477 CCC(C)CNC[C@H]1CCCO1 a82d530780c8c2f7bd183c4ea9b7f88d [0,0,0,0,0,1|2,0,1]=4 1359 B12R1.477 CCC(C)COCC1CCCC1 6fbba9c366e215f32af87d6389fea04e [0,0,0,0,0,1|2,0,1]=4 1360 B12R1.477 CCC(C)COCC1CCCO1 74acb498e6c8ee55b88a9b5b908cc090 [0,0,0,0,0,1|1,0,1]=3 1361 B12R1.477 CCC(C)COCC1CCCS1 02ebbffaa05c53ddd6ef2b88d96d70fa [0,0,0,0,0,1|1,1,1]=4 1362 B12R1.477 CCC(C)COC[C@@H]1CCCO1 2cbadfe2144f8502863884ffa3de3929 [0,0,0,0,0,1|1,0,1]=3 1363 B12R1.477 CCC(C)COC[C@H]1CCCO1 018399b0fcf1b4a0dd3d6be5a2240e89 [0,0,0,0,0,1|1,0,1]=3 1364 B12R1.477 CCC(C)NCCC1CCCO1 3ae074d1ec464112b9d7b24290e9cb17 [0,0,0,0,0,1|2,0,1]=4 1365 B12R1.477 CCC(C)OCCC1CCCC1 a53a742a870bbfd4613a10c4e9f0a0b4 [0,0,0,0,0,1|2,0,1]=4 1366 B12R1.477 CCC(C)OCCC1CCCO1 01a5921d716eb0d19a27650ac66aaabf [0,0,0,0,0,1|1,0,1]=3 1367 B12R1.477 CCC(O)CNCC1CCCO1 9877bd1937122fe04d3244db35c784fc [0,0,0,0,0,1|1,0,2]=4 1368 B12R1.477 CCC(O)CNC[C@@H]1CCCO1 67e6b7eedf929ad68cda756bdc9c11fb [0,0,0,0,0,1|1,0,2]=4 1369 B12R1.477 CCC(O)CNC[C@H]1CCCO1 ddaf38c30eae31aab211bdbe0c7b2a56 [0,0,0,0,0,1|1,0,2]=4 1370 B12R1.477 CCN(C)CCCC1CCCO1 8614caa4a4c4478318ea2fe887a089ee [0,0,0,0,0,1|3,0,0]=4 1371 B12R1.477 CCS(=O)CCNC1CCCC1 7e9908cf795c85083229184cc0138c9c [0,0,0,0,0,1|3,0,0]=4 1372 B12R1.477 CCS(=O)CCOC1CCCC1 f7a44b26700fc0814a08737bfff23316 [0,0,0,0,0,1|3,0,0]=4 1373 B12R1.477 CCS(=O)CCOC1CCCO1 3a3c4a935d6b44f477784611d59e6a41 [0,0,0,0,0,1|2,0,0]=3 1374 B12R1.477 CC[C@@H](C)CNCC1CCCO1 fd3f0b0b167ce609c5f6a618e9e6ab01 [0,0,0,0,0,1|2,0,1]=4 1375 B12R1.477 CC[C@@H](C)CNC[C@@H]1CCCO1 edf0ff9060dc97ba2e080e9cf952f967 [0,0,0,0,0,1|2,0,1]=4 1376 B12R1.477 CC[C@@H](C)CNC[C@H]1CCCO1 c2b566a30bbf2ef2a8f22161bff01504 [0,0,0,0,0,1|2,0,1]=4 1377 B12R1.477 CC[C@@H](C)COCC1CCCC1 a1e431a0a6b5c7880e90c8555c1d75b8 [0,0,0,0,0,1|2,0,1]=4 1378 B12R1.477 CC[C@@H](C)COCC1CCCO1 c19ca4a4d1227c5518be1f6dc78627e4 [0,0,0,0,0,1|1,0,1]=3 1379 B12R1.477 CC[C@@H](C)COCC1CCCS1 5e9653c2fe4f5538bb7471cc52d81a5b [0,0,0,0,0,1|1,1,1]=4 1380 B12R1.477 CC[C@@H](C)COC[C@@H]1CCCO1 1eb72fce18bd7fd0c63fe29df1a87235 [0,0,0,0,0,1|1,0,1]=3 1381 B12R1.477 CC[C@@H](C)COC[C@H]1CCCO1 2ffc2dd1c832accb6302e8cf8964a92d [0,0,0,0,0,1|1,0,1]=3 1382 B12R1.477 CC[C@@H](C)NCCC1CCCO1 599a901a11ebee357e396327b85c3b3c [0,0,0,0,0,1|2,0,1]=4 1383 B12R1.477 CC[C@@H](C)OCCC1CCCC1 8baa8aed2fd5838c7c7588edd75960e4 [0,0,0,0,0,1|2,0,1]=4 1384 B12R1.477 CC[C@@H](C)OCCC1CCCO1 95a926742c22aa968cdcb6c10e5529d6 [0,0,0,0,0,1|1,0,1]=3 1385 B12R1.477 CC[C@@H](O)CNCC1CCCO1 55fab9d5bee9d99d5e29217a0da5d0f1 [0,0,0,0,0,1|1,0,2]=4 1386 B12R1.477 CC[C@H](C)CNCC1CCCO1 e9372d60ff7657909f6bc9df6f0fafdc [0,0,0,0,0,1|2,0,1]=4 1387 B12R1.477 CC[C@H](C)CNC[C@@H]1CCCO1 09b3f834b0919544b73df450bae0bdd4 [0,0,0,0,0,1|2,0,1]=4 1388 B12R1.477 CC[C@H](C)CNC[C@H]1CCCO1 a014892d73157a96793215cdfff23ae9 [0,0,0,0,0,1|2,0,1]=4 1389 B12R1.477 CC[C@H](C)COCC1CCCC1 9867bcdf79813862a80a0e2d7de02857 [0,0,0,0,0,1|2,0,1]=4 1390 B12R1.477 CC[C@H](C)COCC1CCCO1 e7aa0e4118a7fd72c4f4ade0f92c5041 [0,0,0,0,0,1|1,0,1]=3 1391 B12R1.477 CC[C@H](C)COCC1CCCS1 306d9572d26992dd1d1a60d224f18255 [0,0,0,0,0,1|1,1,1]=4 1392 B12R1.477 CC[C@H](C)COC[C@@H]1CCCO1 6f39b3190d286e9c7c47ee0408ae30cd [0,0,0,0,0,1|1,0,1]=3 1393 B12R1.477 CC[C@H](C)COC[C@H]1CCCO1 a855573fc24cfd4959b2c7b93a43e4f9 [0,0,0,0,0,1|1,0,1]=3 1394 B12R1.477 CC[C@H](C)NCCC1CCCO1 3f602183c2b694b3409a6af1f69f0591 [0,0,0,0,0,1|2,0,1]=4 1395 B12R1.477 CC[C@H](C)OCCC1CCCC1 adf0797a7a46de98ffb1d8a40bcdd1cf [0,0,0,0,0,1|2,0,1]=4 1396 B12R1.477 CC[C@H](C)OCCC1CCCO1 fb1e517cabcb587276be566fca2d71dd [0,0,0,0,0,1|1,0,1]=3 1397 B12R1.477 CNC(=O)CCNC1CCCC1 275e0bbd6b606809a14f79f5f01f29a4 [0,0,0,0,0,1|3,0,0]=4 1398 B12R1.477 CNC(=O)CCOC1CCCC1 8b7da3673c3e4357e2f34cc70ea81c24 [0,0,0,0,0,1|3,0,0]=4 1399 B12R1.477 CNC(=O)CCOC1CCCO1 5dea02a7930430731fb0b9828659a0db [0,0,0,0,0,1|2,0,0]=3 1400 B12R1.477 CNC(=O)CNCC1CCCC1 01b8a3421decd7d426b1a46ac1db61b1 [0,0,0,0,0,1|3,0,0]=4 1401 B12R1.477 CNC(=O)CNCC1CCCO1 e92fceaf5a8ceca8ace38602bfc6bc9d [0,0,0,0,0,1|2,0,0]=3 1402 B12R1.477 CNC(=O)CNC[C@@H]1CCCO1 ee5d18fc409e38b107e7ab650c02de65 [0,0,0,0,0,1|2,0,0]=3 1403 B12R1.477 CNC(=O)CNC[C@H]1CCCO1 1d9b8738d125c6dfad651118bf7c4ef4 [0,0,0,0,0,1|2,0,0]=3 1404 B12R1.477 CNC(=O)COCC1C=CCC1 0b4d8f2e1718c823c05cbfc4e12b5ff6 [0,0,0,0,0,1|2,0,1]=4 1405 B12R1.477 CNC(=O)COCC1CCCC1 84da474abc3ba7db49d4d7ae70ee776a [0,0,0,0,0,1|2,0,0]=3 1406 B12R1.477 CNC(=O)COCC1CCCO1 90dfdef63e2d723d2075ec4ff52f5281 [0,0,0,0,0,1|1,0,0]=2 1407 B12R1.477 CNC(=O)COCC1CCCS1 0640f8ebebc4809dbd5c91a20a4e496a [0,0,0,0,0,1|1,1,0]=3 1408 B12R1.477 CNC(=O)COCC1CCOC1 a8e57406ec282b73b45e7fc2f92cf9cd [0,0,0,0,0,1|3,0,0]=4 1409 B12R1.477 CNC(=O)COCN1CCCC1 ce2f66b73d518f7f3611dd7d7df380a5 [0,0,0,0,0,1|3,0,0]=4 1410 B12R1.477 CNC(=O)COC[C@@H]1CCCO1 1b8e15ce446c07f8a7f62eba277036a4 [0,0,0,0,0,1|1,0,0]=2 1411 B12R1.477 CNC(=O)COC[C@@H]1CCOC1 d47fcde9a19319dc51326b0064dd6079 [0,0,0,0,0,1|3,0,0]=4 1412 B12R1.477 CNC(=O)COC[C@H]1CCCO1 cd04da54e96dff20a06e106232eb292a [0,0,0,0,0,1|1,0,0]=2 1413 B12R1.477 CNC(=O)COC[C@H]1CCOC1 c293eb2d347e70a51c4062ebfb31969e [0,0,0,0,0,1|3,0,0]=4 1414 B12R1.477 COC(=O)CCNC1CCCC1 c4b2842664eca5b647db2fe8d4345eb3 [0,0,0,0,0,1|3,0,0]=4 1415 B12R1.477 COC(=O)CCOC1CCCC1 41d99f7c621e9109f1f013725365133e [0,0,0,0,0,1|3,0,0]=4 1416 B12R1.477 COC(=O)CCOC1CCCO1 25981cdab28ee735d3f6c64731aaf211 [0,0,0,0,0,1|2,0,0]=3 1417 B12R1.477 COC(=O)CNCC1CCCC1 692c814c416947e44d12c088aefccadc [0,0,0,0,0,1|3,0,0]=4 1418 B12R1.477 COC(=O)CNCC1CCCO1 822d5a6c75d7f017f2b57ef1a64dfbca [0,0,0,0,0,1|2,0,0]=3 1419 B12R1.477 COC(=O)CNC[C@@H]1CCCO1 aec82e2288587ddeb7bb624c9c7b557a [0,0,0,0,0,1|2,0,0]=3 1420 B12R1.477 COC(=O)CNC[C@H]1CCCO1 9d580e0519cc51401b6153e1698d2e94 [0,0,0,0,0,1|2,0,0]=3 1421 B12R1.477 COC(=O)COCC1C=CCC1 9587d3088f97daeed9e117cf6fd7fc65 [0,0,0,0,0,1|2,0,1]=4 1422 B12R1.477 COC(=O)COCC1CCCC1 4a84ec77ee1ef1fabaaa560f99e066bc [0,0,0,0,0,1|2,0,0]=3 1423 B12R1.477 COC(=O)COCC1CCCO1 f7c0ba7e2b26608f0e4bd8e3c4f9eb24 [0,0,0,0,0,1|1,0,0]=2 1424 B12R1.477 COC(=O)COCC1CCCS1 f1777d842bdca49aed1fe873fef0e789 [0,0,0,0,0,1|1,1,0]=3 1425 B12R1.477 COC(=O)COCC1CCOC1 4f9da43a09f90e821d909e3e23f6ec64 [0,0,0,0,0,1|3,0,0]=4 1426 B12R1.477 COC(=O)COCN1CCCC1 6d21cde373e9710f280ae9e418e09b9c [0,0,0,0,0,1|3,0,0]=4 1427 B12R1.477 COC(=O)COC[C@@H]1CCCO1 00c70f086359aea2056666989b4e290d [0,0,0,0,0,1|1,0,0]=2 1428 B12R1.477 COC(=O)COC[C@@H]1CCOC1 a80e380c8248c3c0fa1abd51b757e442 [0,0,0,0,0,1|3,0,0]=4 1429 B12R1.477 COC(=O)COC[C@H]1CCCO1 550359bec18cb8404f66f23f40e02bec [0,0,0,0,0,1|1,0,0]=2 1430 B12R1.477 COC(=O)COC[C@H]1CCOC1 eec13af091c3f42433c01a10e82a3eb6 [0,0,0,0,0,1|3,0,0]=4 1431 B12R1.477 COC(=O)OCNC1CCCC1 0f4e46742845637443ce2c99efedc9f2 [0,0,0,0,0,1|2,0,0]=3 1432 B12R1.477 COC(=O)OCNC1CCOC1 6ddc1fb7ef60de89fc4404c3b60c5414 [0,0,0,0,0,1|3,0,0]=4 1433 B12R1.477 COC(=O)OCNC1CCSC1 96f15ebb68a3013b44c0c205767a467f [0,0,0,0,0,1|3,0,0]=4 1434 B12R1.477 COC(=O)OCN[C@@H]1CCOC1 57cf639a35fdfdb6990291dd452bd78f [0,0,0,0,0,1|3,0,0]=4 1435 B12R1.477 COC(=O)OCN[C@H]1CCOC1 7587097cbafca7e4825c05dfdcd099fe [0,0,0,0,0,1|3,0,0]=4 1436 B12R1.477 COC(=O)OCOC1C=CCC1 129fa73c2b6287c75bf493d70c9f2eeb [0,0,0,0,0,1|2,0,1]=4 1437 B12R1.477 COC(=O)OCOC1CCCC1 060a5b1821cf3f92c2e316db26c3c2ed [0,0,0,0,0,1|2,0,0]=3 1438 B12R1.477 COC(=O)OCOC1CCCO1 1ce1e4c1cddbea6c5971e7e38f7ed835 [0,0,0,0,0,1|1,0,0]=2 1439 B12R1.477 COC(=O)OCOC1CCOC1 5a51947df7d62e0727eb36fe6de84d06 [0,0,0,0,0,1|3,0,0]=4 1440 B12R1.477 COC(=O)OCOC1CCSC1 85db043538612e4d88f4d3ef76bb202f [0,0,0,0,0,1|3,0,0]=4 1441 B12R1.477 COC(=O)OCO[C@@H]1CCOC1 6e1e3ef07509450316972f17282351ba [0,0,0,0,0,1|3,0,0]=4 1442 B12R1.477 COC(=O)OCO[C@@H]1CCSC1 51dbac903791d10c87f0d7d0c8e360ac [0,0,0,0,0,1|3,0,0]=4 1443 B12R1.477 COC(=O)OCO[C@H]1CCOC1 a6022f23ad866ac3269a1ff07c0b30ed [0,0,0,0,0,1|3,0,0]=4 1444 B12R1.477 COC(=O)OCO[C@H]1CCSC1 6648633616ac80938f1f25b237f95724 [0,0,0,0,0,1|3,0,0]=4 1445 B12R1.477 COC(C)COCC1CCCO1 cedbbbea1aec730d418413c6951fcfac [0,0,0,0,0,1|2,0,1]=4 1446 B12R1.477 COC(C)COC[C@@H]1CCCO1 8a8ec1e80bdd09ebc9c8ac2db318ac14 [0,0,0,0,0,1|2,0,1]=4 1447 B12R1.477 COC(C)COC[C@H]1CCCO1 3d7e1e15226de7b3c69be50aaf0d37c5 [0,0,0,0,0,1|2,0,1]=4 1448 B12R1.477 CO[C@@H](C)COCC1CCCO1 d1c9eccb630f2494ff2805947064c496 [0,0,0,0,0,1|2,0,1]=4 1449 B12R1.477 CO[C@@H](C)COC[C@@H]1CCCO1 140576b3c833a5e2f9762b2b35679c56 [0,0,0,0,0,1|2,0,1]=4 1450 B12R1.477 CO[C@@H](C)COC[C@H]1CCCO1 855d251ea40c091e00cc910eb23fe4c8 [0,0,0,0,0,1|2,0,1]=4 1451 B12R1.477 CO[C@H](C)COCC1CCCO1 d44314b37b0d921ca18b18437ad2cb32 [0,0,0,0,0,1|2,0,1]=4 1452 B12R1.477 CO[C@H](C)COC[C@@H]1CCCO1 c5b028adf3396fbd2b1296c1898597a3 [0,0,0,0,0,1|2,0,1]=4 1453 B12R1.477 CO[C@H](C)COC[C@H]1CCCO1 3f863668270ae9dacfb3b5ad75a3b552 [0,0,0,0,0,1|2,0,1]=4 1454 B12R1.477 C[C@H](CS)OCCC1CCCO1 0d43ad39663b0e275adfdb89785dbd36 [0,0,0,0,0,1|2,0,1]=4 1455 B12R1.477 Cl/C=C(\Cl)/COCC1CCCO1 30ba14a6c9f087513d50f49b69e8c1a6 [0,0,0,0,0,1|2,0,1]=4 1456 B12R1.477 Cl/C=C(\Cl)/COC[C@@H]1CCCO1 e9438784c0950d4383b1704d5d73c6ac [0,0,0,0,0,1|2,0,1]=4 1457 B12R1.477 Cl/C=C(\Cl)/COC[C@H]1CCCO1 1d11853df83d827d63f3c0663dae3f36 [0,0,0,0,0,1|2,0,1]=4 1458 B12R1.477 ClCC(Cl)COCC1CCCO1 fbf891153dec509579a8ae68ab60e74e [0,0,0,0,0,1|2,0,1]=4 1459 B12R1.477 O=C(CF)NCCC1CCCC1 aad47396246e7569f841ff5d4c95e8d5 [0,0,0,0,0,1|3,0,0]=4 1460 B12R1.477 O=C(CF)NCCC1CCCO1 1cb054038bd1da8636ad4962d33ba1c3 [0,0,0,0,0,1|2,0,0]=3 1461 B12R1.477 O=C(CNCC1CCCO1)NO 6d0086f99d50c2f8009ce941c424b9d4 [0,0,0,0,0,1|3,0,0]=4 1462 B12R1.477 O=C(CO)CNCC1CCCC1 13b56baa62884b550a7694ff53b7a71c [0,0,0,0,0,1|3,0,0]=4 1463 B12R1.477 O=C(CO)CNCC1CCCO1 7adbded3788e1d7dea3b9cb26245b0ab [0,0,0,0,0,1|2,0,0]=3 1464 B12R1.477 O=C(CO)CNC[C@@H]1CCCO1 f16e0ccad2108eb64b1a60bee8178cb2 [0,0,0,0,0,1|2,0,0]=3 1465 B12R1.477 O=C(CO)CNC[C@H]1CCCO1 0cefd9f5ef345e607ce70fc59c947a94 [0,0,0,0,0,1|2,0,0]=3 1466 B12R1.477 O=C(CO)NCCC1CCCC1 301c51d7daf278472f0abfac18d54600 [0,0,0,0,0,1|3,0,0]=4 1467 B12R1.477 O=C(CO)NCCC1CCCO1 ddeb247837a443a908b1a34d0ecb8200 [0,0,0,0,0,1|2,0,0]=3 1468 B12R1.477 O=C(CS)NCCC1CCCC1 7d9728b966c49d33f1404bb261928c9e [0,0,0,0,0,1|3,0,0]=4 1469 B12R1.477 O=C(CS)NCCC1CCCO1 5cf3066a40976c7ea2bb113600269976 [0,0,0,0,0,1|2,0,0]=3 1470 B12R1.477 O=CC(=O)NCCC1CCCO1 108f03a85445cb79ce92c44509ffbcef [0,0,0,0,0,1|2,0,1]=4 1471 B12R1.477 OCC(O)COCC1CCCO1 f84b9b14031d78397eb4e2fa232fe500 [0,0,0,0,0,1|1,0,2]=4 1472 B12R1.477 OCC(O)COC[C@@H]1CCCO1 2dcfb70e4d8cb651aa054a678f9cde12 [0,0,0,0,0,1|1,0,2]=4 1473 B12R1.477 OCC(O)COC[C@H]1CCCO1 fc088f484369d2136feca27d9ea6b86a [0,0,0,0,0,1|1,0,2]=4 1474 B12R1.477 OC[C@@H](O)COCC1CCCO1 9afe995c3d029a57f15f6fc8f4539b08 [0,0,0,0,0,1|1,0,2]=4 1475 B12R1.477 OC[C@@H](O)COC[C@@H]1CCCO1 127f8e24718d412e8e8759025aa76936 [0,0,0,0,0,1|1,0,2]=4 1476 B12R1.477 OC[C@@H](O)COC[C@H]1CCCO1 618e419a282b385b4a54b53148fd99e7 [0,0,0,0,0,1|1,0,2]=4 1477 B12R1.477 OC[C@H](O)COCC1CCCO1 c5d6791a8ee90e787a6348c6d6d4f5ec [0,0,0,0,0,1|1,0,2]=4 1478 B12R1.477 OC[C@H](O)COC[C@@H]1CCCO1 b1a8540f5b54d3f17c1654d5506c729a [0,0,0,0,0,1|1,0,2]=4 1479 B12R1.477 OC[C@H](O)COC[C@H]1CCCO1 ecd8ed0ee3248d8e7060150055c5fdec [0,0,0,0,0,1|1,0,2]=4 1480 B12R1.477 SCC(S)COCC1CCCO1 f127f37675e0fb49b1898f2928acff46 [0,0,0,0,0,1|1,1,1]=4 1481 B9R0.24 CCC(=O)CNC(C)CC 8a7f34411ea9ff22baecd2bec9987e81 [1,0,1,0,0,0|2,0,0]=4 1482 B9R0.24 CCC(=O)CN[C@@H](C)CC cf0e7ed200bceabd78136172de6ecd6c [1,0,1,0,0,0|2,0,0]=4 1483 B9R0.24 CCC(=O)CN[C@H](C)CC e6fe0f86a523db447d188f70083e09d0 [1,0,1,0,0,0|2,0,0]=4 1484 B9R0.24 CCC(=O)COC(C)CC 29d5bfcc3cb37f7ca0dad75c651a7aa4 [1,0,1,0,0,0|2,0,0]=4 1485 B9R0.24 CCC(=O)CO[C@@H](C)CC 83299bde6aa7b405212942272cb01c0d [1,0,1,0,0,0|2,0,0]=4 1486 B9R0.24 CCC(=O)CO[C@H](C)CC 22a053d890b84a836a154b9ddc55610a [1,0,1,0,0,0|2,0,0]=4 1487 B9R0.24 CCC(=O)NCC(C)CC 7a5f4f534369b61d9e8fb6bbf4fc8b31 [1,0,1,0,0,0|1,0,0]=3 1488 B9R0.24 CCC(=O)NCC(C)CO fa40852dedb4d165bd8eab47072e49aa [1,0,1,0,0,0|2,0,0]=4 1489 B9R0.24 CCC(=O)NCC(O)CC 0c6f585c4a613c01d94eec57c41006a2 [1,0,1,0,0,0|1,0,0]=3 1490 B9R0.24 CCC(=O)NCC(O)CO a9d4f4728b89c5e6414c2d930cfecd01 [1,0,1,0,0,0|2,0,0]=4 1491 B9R0.24 CCC(=O)NC[C@@H](C)CC 20f140a9a510d7ecd72cce257acfa2d6 [1,0,1,0,0,0|1,0,0]=3 1492 B9R0.24 CCC(=O)NC[C@@H](C)OC 2b4d3bc307acd070b3e7f7cf9dd3ff4c [1,0,1,0,0,0|1,0,0]=3 1493 B9R0.24 CCC(=O)NC[C@@H](O)CO 00282dbf7533c20a1e96c426773318a2 [1,0,1,0,0,0|2,0,0]=4 1494 B9R0.24 CCC(=O)NC[C@H](C)CO 2514ca8a6ee761d51abaccbd3a6de585 [1,0,1,0,0,0|2,0,0]=4 1495 B9R0.24 CCC(=O)NC[C@H](C)OC e43467fd548414270671303609820f3d [1,0,1,0,0,0|1,0,0]=3 1496 B9R0.24 CCC(=O)NC[C@H](O)CC d28190137f6e71fee6c5823aba62fd52 [1,0,1,0,0,0|1,0,0]=3 1497 B9R0.24 CCC(=O)NC[C@H](O)CO 3a2fa83cc974a2501a0e0cdc5c896afd [1,0,1,0,0,0|2,0,0]=4 1498 B9R0.24 CCC(=O)OCN(C)CC a281a4ec29756b3b4107ca2ca9de7f75 [1,0,1,0,0,0|1,0,0]=3 1499 B9R0.24 CCC(C)CNC(=O)CF 62d42cdf2cc7f038e9e989a2ab9bdb8f [1,0,1,0,0,0|2,0,0]=4 1500 B9R0.24 CCC(C)CNC(=O)CO c83ed1127f884f4213e48db54a8973b6 [1,0,1,0,0,0|2,0,0]=4 1501 B9R0.24 CCC(C)CNC(=O)CS 583bdfa66e6c39cd626f1854cfe0c0b0 [1,0,1,0,0,0|2,0,0]=4 1502 B9R0.24 CCC(C)COC(C)CC d18d328bc30bed33830e4af3e5c505ad [1,0,1,0,0,0|1,0,1]=4 1503 B9R0.24 CCC(C)CO[C@@H](C)CC 9c069ff9e82f1c77bf76bd4eb0073a3b [1,0,1,0,0,0|1,0,1]=4 1504 B9R0.24 CCC(C)CO[C@H](C)CC a240270bdf881e516a23068b63609ead [1,0,1,0,0,0|1,0,1]=4 1505 B9R0.24 CCC(C)OCC(C)OC 55845eefb5c30d2fe9f4c69cf6821c58 [1,0,1,0,0,0|1,0,1]=4 1506 B9R0.24 CCC(C)OC[C@@H](C)CC 45c92f6250dbd8c4f8407cc37202870a [1,0,1,0,0,0|1,0,1]=4 1507 B9R0.24 CCC(C)OC[C@@H](C)OC 43633c9129aab3ee04d569f20ecdda3d [1,0,1,0,0,0|1,0,1]=4 1508 B9R0.24 CCC(C)OC[C@H](C)CC 111ec7b818d6044b70ccefe8fe1fec3a [1,0,1,0,0,0|1,0,1]=4 1509 B9R0.24 CCC(C)OC[C@H](C)OC ac0d5cbc19428644b7bb99dc79ea7274 [1,0,1,0,0,0|1,0,1]=4 1510 B9R0.24 CCC(O)CNC(=O)CF 5703595eeaf3ecd363b7c14820e24fd8 [1,0,1,0,0,0|2,0,0]=4 1511 B9R0.24 CCC(O)CNC(=O)CO 0928fe22cca3c4eea08bea77b1ae9315 [1,0,1,0,0,0|2,0,0]=4 1512 B9R0.24 CCC(O)CNC(=O)CS a7aef8097f57ecee3e6d0de1b8bef33d [1,0,1,0,0,0|2,0,0]=4 1513 B9R0.24 CCN(C)COC(=O)OC 7edde911e4bf2f7ddb416a1e0f67633c [1,0,1,0,0,0|2,0,0]=4 1514 B9R0.24 CC[C@@H](C)CO[C@@H](C)CC b5a9f0da4a6563defb6e414e92d4755b [1,0,1,0,0,0|1,0,1]=4 1515 B9R0.24 CC[C@@H](C)CO[C@H](C)CC cbc59f7e8c2583260e431e36b1653fbf [1,0,1,0,0,0|1,0,1]=4 1516 B9R0.24 CC[C@@H](C)OCC(C)OC c45a2cd48462924ae961bd42ed716210 [1,0,1,0,0,0|1,0,1]=4 1517 B9R0.24 CC[C@@H](C)OC[C@@H](C)OC f1c1280d7867d8a7c79f0b2ecb03af8b [1,0,1,0,0,0|1,0,1]=4 1518 B9R0.24 CC[C@@H](C)OC[C@H](C)OC 77b18b4de4f06aebd5e13e7034fa28b7 [1,0,1,0,0,0|1,0,1]=4 1519 B9R0.24 CC[C@@H](O)CNC(=O)CF ad570a8918919566498a65d0b9acf1d8 [1,0,1,0,0,0|2,0,0]=4 1520 B9R0.24 CC[C@@H](O)CNC(=O)CO 7575280e7285d9a3f58054ddb6e7bd3c [1,0,1,0,0,0|2,0,0]=4 1521 B9R0.24 CC[C@@H](O)CNC(=O)CS 54601b1a15927eccedc92db33a081850 [1,0,1,0,0,0|2,0,0]=4 1522 B9R0.24 CC[C@H](C)CNC(=O)CF 54640882e6fae5c3ab1ad5ca09996f5a [1,0,1,0,0,0|2,0,0]=4 1523 B9R0.24 CC[C@H](C)CNC(=O)CO 71f236c0490b4515463a284ebbba7293 [1,0,1,0,0,0|2,0,0]=4 1524 B9R0.24 CC[C@H](C)CNC(=O)CS 479dfc2f85af34ba043b18392d8bbcea [1,0,1,0,0,0|2,0,0]=4 1525 B9R0.24 CC[C@H](C)CO[C@@H](C)CC 34e669db8534d801d9cb404ba91b9c18 [1,0,1,0,0,0|1,0,1]=4 1526 B9R0.24 CC[C@H](C)CO[C@H](C)CC 432fe060d8c2f343bfec9f5cef31736b [1,0,1,0,0,0|1,0,1]=4 1527 B9R0.24 CC[C@H](C)OCC(C)OC 8b007a5ffba31eb0414267c9d1fb1089 [1,0,1,0,0,0|1,0,1]=4 1528 B9R0.24 CC[C@H](C)OC[C@@H](C)OC 74ddae12fdca8c59c4bc83df99dc0e69 [1,0,1,0,0,0|1,0,1]=4 1529 B9R0.24 CC[C@H](C)OC[C@H](C)OC abd7f4f9f60edbdce308cc07f1d2afb8 [1,0,1,0,0,0|1,0,1]=4 1530 B9R0.24 CO[C@@H](C)CNC(=O)CF 9c71752e88e3537f1549ea2c34796f20 [1,0,1,0,0,0|2,0,0]=4 1531 B9R0.24 CO[C@@H](C)CNC(=O)CO b95fa8c7148a81b6451cdc622cbb6140 [1,0,1,0,0,0|2,0,0]=4 1532 B9R0.24 CO[C@@H](C)CNC(=O)CS b904d4a82cbed37ba466c43dfd72cd4b [1,0,1,0,0,0|2,0,0]=4 1533 B9R0.24 CO[C@H](C)CNC(=O)CF cd8f253fbdfc6148e4534a97efffcc39 [1,0,1,0,0,0|2,0,0]=4 1534 B9R0.24 CO[C@H](C)CNC(=O)CO 27142753b862c3bf94f22d3bf8c13f99 [1,0,1,0,0,0|2,0,0]=4 1535 B9R0.24 CO[C@H](C)CNC(=O)CS dff05e26c5c67063a3031ad9d0febc1c [1,0,1,0,0,0|2,0,0]=4 1536 B9R0.43 CCC(CC)CNC(=O)C 1549f79204b015c6741805722d63f02b [1,0,1,0,0,0|2,0,0]=4 1537 B9R0.43 CCC(COC(C)C)OC 3d6803c156f915ab36e517a6515cb7f5 [1,0,1,0,0,0|1,0,1]=4 1538 B9R0.43 COC(CNC(=O)C)OC 7667afb1129bf19fdd7549c6df961d11 [1,0,1,0,0,0|2,0,0]=4 1539 B9R0.43 CO[C@@H](CO)CNC(=O)C 595c34503ab75b4f13d4a0f790389747 [1,0,1,0,0,0|2,0,0]=4 1540 B9R0.50 CCC(COCCF)OC dde8ae092daea004997f8cee5f7f59b8 [1,0,1,0,0,0|1,0,1]=4 1541 B9R0.50 CCC(COCCS)OC e074849f0f2588641cfd62a222ed9b43 [1,0,1,0,0,0|1,0,1]=4 1542 B9R0.50 CCC(COCOC)OC 3e61e4b3ed3822cf023f26d2a95b66ad [1,0,1,0,0,0|1,0,1]=4 1543 B9R0.50 CCC(COCSC)OC b475aa922f822dc418830a12ad6386b4 [1,0,1,0,0,0|1,0,1]=4 1544 B9R0.50 CCCOCC(CC)CC 67ff0241d66372bbbaaf95685c7ebbc2 [1,0,1,0,0,0|1,0,1]=4 1545 B9R0.50 CCCOCC(CC)OC 126e67525572f519a796e73aa9590c5e [1,0,1,0,0,0|0,0,1]=3 1546 B9R0.50 CCCOCC(OC)OC dfe17f5f6072cf89e2d77f75730ba44a [1,0,1,0,0,0|1,0,1]=4 1547 B9R0.2 C#CCOCCOC(=O)C f64b6f1d064c034ca32c68982e29ce75 [1,0,1,0,0,0|0,0,2]=4 1548 B9R0.2 C=C(C)CCCOCCC 4f69b68cc6888e5abf6b0488c9a109cb [1,0,1,0,0,0|2,0,0]=4 1549 B9R0.2 C=CCOCCOC(=O)C b8c209519513104470d81d0ada77afd3 [1,0,1,0,0,0|0,0,2]=4 1550 B9R0.2 CC(=O)CCCNCCO 047c4ea1e2699a309316392bf693b2f3 [1,0,1,0,0,0|2,0,0]=4 1551 B9R0.2 CC(=O)CCCOCCF 8be6dab59aed4b188d6918cf109dee02 [1,0,1,0,0,0|2,0,0]=4 1552 B9R0.2 CC(=O)CCCOCCS 3982bfab81dc2189a86b86f7de9c7da1 [1,0,1,0,0,0|2,0,0]=4 1553 B9R0.2 CC(=O)CCNCCCO 41ab0e7b58a0373c2b6f1dd023df8651 [1,0,1,0,0,0|2,0,0]=4 1554 B9R0.2 CC(=O)CNCCCCO 96082e5297f4b4820c770800699f2247 [1,0,1,0,0,0|2,0,0]=4 1555 B9R0.2 CC(=O)NCCCCCCl 9810fdb3b44bef22ae3578265fbb7e47 [1,0,1,0,0,0|2,0,0]=4 1556 B9R0.2 CC(=O)NCCCCCO 6528e540cd36869e25e869b54ef6b7c3 [1,0,1,0,0,0|1,0,0]=3 1557 B9R0.2 CC(=O)NCCCNCO 328911bf7c359f53194dbd7fe75621ee [1,0,1,0,0,0|2,0,0]=4 1558 B9R0.2 CC(=O)NCCNCCO bfd2a90f03ebdd248fdc140ab742c195 [1,0,1,0,0,0|2,0,0]=4 1559 B9R0.2 CC(=O)NCCOCCF 0973cce223af140d06d4871f0bda3943 [1,0,1,0,0,0|2,0,0]=4 1560 B9R0.2 CC(=O)NCCOCCO 57d4166bc7f64eeb4fe6b2614e2e763f [1,0,1,0,0,0|2,0,0]=4 1561 B9R0.2 CC(=O)NCCOCCS fc352a6fdb39855a43a3d0ad8c15f379 [1,0,1,0,0,0|2,0,0]=4 1562 B9R0.2 CC(=O)NCCSCCO 0bd987c0ecd20e315a5e853d68c36be8 [1,0,1,0,0,0|2,0,0]=4 1563 B9R0.2 CC(=O)OCCCOCF 839300b4a23ae7f13d770824ad5ba603 [1,0,1,0,0,0|2,0,0]=4 1564 B9R0.2 CC(=O)OCCNCCBr 86e70651e2ef68f3f2552b68c9fd9535 [1,0,1,0,0,0|2,0,0]=4 1565 B9R0.2 CC(=O)OCCNCCF bec963d44f70641aefa68f79b9e9f243 [1,0,1,0,0,0|2,0,0]=4 1566 B9R0.2 CC(=O)OCCNCCI 512fc7b78f65a98aaa9b5a24a55dd29e [1,0,1,0,0,0|2,0,0]=4 1567 B9R0.2 CC(=O)OCCNCCO fbc6a9b22162aa146956efcd3fed83de [1,0,1,0,0,0|1,0,0]=3 1568 B9R0.2 CC(=O)OCCNCCS 0d342b6bb6a97266d2b38620542a908c [1,0,1,0,0,0|1,1,0]=4 1569 B9R0.2 CC(=O)OCCOCC#N 7baac828bd0ad193165dca07df48a84c [1,0,1,0,0,0|1,0,1]=4 1570 B9R0.2 CC(=O)OCCOCC=O 50de9809b657b57c3e7b1c5e62714176 [1,0,1,0,0,0|1,0,1]=4 1571 B9R0.2 CC(=O)OCCOCCF 5233cd269967a92f3e4bf92bf7bbcb9d [1,0,1,0,0,0|1,0,0]=3 1572 B9R0.2 CC(=O)OCCOCCS 63ea2c4adc5d14c13c2d8bc53161cf6c [1,0,1,0,0,0|1,0,0]=3 1573 B9R0.2 CC(=O)OCNCCCCl 4c34a9d20da691b9859482fc9219ac0e [1,0,1,0,0,0|2,0,0]=4 1574 B9R0.2 CC(=O)OCNCCCO 89aaf0a95b5cea62d4321235936deeff [1,0,1,0,0,0|1,0,0]=3 1575 B9R0.2 CC(=O)OCOCCCF 2bfb3b9762b06c6017d0cd676ab47db2 [1,0,1,0,0,0|2,0,0]=4 1576 B9R0.2 CC(=O)OCOCCCS 3586e68ace2929307ff5b4a00f63eae7 [1,0,1,0,0,0|1,1,0]=4 1577 B9R0.2 CC(=O)SCCNCCO f793beb03d64f0dfcb25ac2a3004ffc4 [1,0,1,0,0,0|1,1,0]=4 1578 B9R0.2 CC(=O)SCCOCCF 97f7396d15109ed2126bfd23c7da33fa [1,0,1,0,0,0|1,1,0]=4 1579 B9R0.2 CC(=O)SCCOCCS 749ecc917cc404f091b4a3e262baed35 [1,0,1,0,0,0|1,1,0]=4 1580 B9R0.2 CCCCCCNC(=O)C 39216d9115deaeddca0efb3bbde5d8cb [1,0,1,0,0,0|2,0,0]=4 1581 B9R0.2 CCCCNCOC(=O)C f747ae8d75ae5077cb457c21af32c3d4 [1,0,1,0,0,0|2,0,0]=4 1582 B9R0.2 CCCCOCOC(=O)C 52b453d7294c4b6acb8f00c70315374a [1,0,1,0,0,0|2,0,0]=4 1583 B9R0.2 CCCNCCCC(=O)C 59b56db2c5ba6f2408c45d91cf5d07cf [1,0,1,0,0,0|2,0,0]=4 1584 B9R0.2 CCCNCCNC(=O)C 8ec9c538248c1278a7a78c753f9b558d [1,0,1,0,0,0|2,0,0]=4 1585 B9R0.2 CCCNCCOC(=O)C 1f7e1f87180a6b7613488d41ed0bd627 [1,0,1,0,0,0|1,0,0]=3 1586 B9R0.2 CCCNCCSC(=O)C 9a734654dda6d6cb5b5c8675b98c7ffb [1,0,1,0,0,0|1,1,0]=4 1587 B9R0.2 CCCOCCC=C(C)C ff6fc9b7b0a2446d5a1ca048cc1d0112 [1,0,1,0,0,0|2,0,0]=4 1588 B9R0.2 CCCOCCCC(=O)C 3197867314079ee7d28a75ba48b024e1 [1,0,1,0,0,0|1,0,0]=3 1589 B9R0.2 CCCOCCCC(=O)N 070095bcac514fc69d894401c1bbf694 [1,0,1,0,0,0|2,0,0]=4 1590 B9R0.2 CCCOCCCC(=O)O 0bf29d754b3e882141bfdc8089deee25 [1,0,1,0,0,0|2,0,0]=4 1591 B9R0.2 CCCOCCNC(=O)C 2d108407d153229ed52501407a328bfe [1,0,1,0,0,0|1,0,0]=3 1592 B9R0.2 CCCOCCNC(=O)N de0f07e5faa70e06a173f52c30b9f0f6 [1,0,1,0,0,0|2,0,0]=4 1593 B9R0.2 CCCOCCOC(=O)C f41b865aa303cc7ca2bd22086d82154a [1,0,1,0,0,0|0,0,0]=2 1594 B9R0.2 CCCOCCOC(C)C bab68f481c98df0f765c595bef6a5e4a [1,0,1,0,0,0|1,0,1]=4 1595 B9R0.2 CCCOCCSC(=O)C e5fbc3852cf2e5bc0f0d48122e1eb071 [1,0,1,0,0,0|0,1,0]=3 1596 B9R0.2 CCOCCCOC(=O)C 521ac746c4773e46268f3042c9c9e91c [1,0,1,0,0,0|2,0,0]=4 1597 B9R0.2 COCOCCCC(=O)C f43054086d226c36ed78969c345787dd [1,0,1,0,0,0|2,0,0]=4 1598 B9R0.2 COCOCCNC(=O)C 3efb8e5988f380a09e447f8453fc669b [1,0,1,0,0,0|2,0,0]=4 1599 B9R0.2 COCOCCOC(=O)C c1d21b4657b103686de2e70024d8053c [1,0,1,0,0,0|1,0,0]=3 1600 B9R0.2 COCOCCSC(=O)C 08a4a36a589b662a246281790c16f756 [1,0,1,0,0,0|1,1,0]=4 1601 B9R0.2 CSCOCCCC(=O)C 37d7fc5efc38029b2c30ac3a6898185c [1,0,1,0,0,0|2,0,0]=4 1602 B9R0.2 CSCOCCNC(=O)C 8bf9fe079133cd630591ad7e21810fd8 [1,0,1,0,0,0|2,0,0]=4 1603 B9R0.2 CSCOCCOC(=O)C 85f658ca31404ad6a9d937e79a707f17 [1,0,1,0,0,0|1,0,0]=3 1604 B9R0.45 C/C=C/CCCOCCC 6078f7ffc27dfa8185f6236738ef681e [1,0,1,0,0,0|1,0,1]=4 1605 B9R0.45 C/C=C\CCCOCCC 083c73f409535e210af3eb7849dd56ad [1,0,1,0,0,0|1,0,1]=4 1606 B9R0.45 CC/C=C/CCOCCC 0a76c2aa4cb5309f57046e961567e1f0 [1,0,1,0,0,0|1,0,0]=3 1607 B9R0.45 CC/C=C/CCOCCF 67cb50c940f1ea24e380ed351a9e27a4 [1,0,1,0,0,0|2,0,0]=4 1608 B9R0.45 CC/C=C/CCOCCS 4e6dcfeca03f19c51d7947aefe2b01ad [1,0,1,0,0,0|2,0,0]=4 1609 B9R0.45 CC/C=C/CCOCOC 796ebdddd1f42ca6def4f4ec2bad3826 [1,0,1,0,0,0|2,0,0]=4 1610 B9R0.45 CC/C=C/CCOCSC ec77883b00b8cd5828d5d0af69a4f670 [1,0,1,0,0,0|2,0,0]=4 1611 B9R0.45 CC/C=C/CNCCCO cb7b5cd9fbacab019b7f7229d9ec3bad [1,0,1,0,0,0|2,0,0]=4 1612 B9R0.45 CC/C=C\CCNCCC 3bbbe00683e3d998587775bf41dd95d1 [1,0,1,0,0,0|2,0,0]=4 1613 B9R0.45 CC/C=C\CCNCCO a24354b5170b61b119e5744674583b1d [1,0,1,0,0,0|2,0,0]=4 1614 B9R0.45 CC/C=C\CCOCCC 5fdb5a65a47740420a9d274005a3115f [1,0,1,0,0,0|1,0,0]=3 1615 B9R0.45 CC/C=C\CCOCCF abbcbf46201292033d3f156f0dd55de6 [1,0,1,0,0,0|2,0,0]=4 1616 B9R0.45 CC/C=C\CCOCCS 7038af308828495d311d4bc2f471647f [1,0,1,0,0,0|2,0,0]=4 1617 B9R0.45 CC/C=C\CCOCOC 888241aa2c4a0a3e7d9b504c0bf516e6 [1,0,1,0,0,0|2,0,0]=4 1618 B9R0.45 CC/C=C\CCOCSC db623e610663b8da8c1cd9145a0ca2fa [1,0,1,0,0,0|2,0,0]=4 1619 B9R0.45 CC=CCCCOCCC 544004ad9efa2af2fea80f1c7a474136 [1,0,1,0,0,0|1,0,1]=4 1620 B9R0.45 CCC#CCCOCCC 4cc8a61a8d84e6a0c5e1fcd690fd5b56 [1,0,1,0,0,0|1,0,1]=4 1621 B9R0.45 CCCCCCOCCC e53b5b4f9e861a4f0969c775813c954e [1,0,1,0,0,0|1,0,1]=4 1622 B9R0.45 CCCNCCCCCO f3d6f4913e5f254c1bf460b36dd70b4c [1,0,1,0,0,0|1,0,1]=4 1623 B9R0.45 CCCNCCOCCC c9636642ffae561b1adc5cd9ae1dccad [1,0,1,0,0,0|1,0,1]=4 1624 B9R0.45 CCCOCCCCCF b14e93115958730ea8214bff1c89eb77 [1,0,1,0,0,0|1,0,1]=4 1625 B9R0.45 CCCOCCCNCC 9c5f9e1a8eab534703971dfcd50dc3a4 [1,0,1,0,0,0|2,0,0]=4 1626 B9R0.45 CCCOCCCNCO f453546a549baebba8d4dda9dd1f2b96 [1,0,1,0,0,0|1,0,1]=4 1627 B9R0.45 CCCOCCCOCC 7ae5cc2cef81f72870de148e55495f6e [1,0,1,0,0,0|2,0,0]=4 1628 B9R0.45 CCCOCCCSCC a587632712094e0a386067bb302c3743 [1,0,1,0,0,0|2,0,0]=4 1629 B9R0.45 CCCOCCNCCO 2fe038760c01b7075e45b162c476ceb9 [1,0,1,0,0,0|1,0,1]=4 1630 B9R0.45 CCCOCCOCCC 96ef823798ad295a7793168e0a9a50d1 [1,0,1,0,0,0|0,0,1]=3 1631 B9R0.45 CCCOCCOCCF 8a699727db0990fdbea753b75227c0f9 [1,0,1,0,0,0|1,0,1]=4 1632 B9R0.45 CCCOCCOCCS 135d5deeb48c2dba9fda7000503f9b47 [1,0,1,0,0,0|1,0,1]=4 1633 B9R0.45 CCCOCCOCOC d883cdf177c224a93accb6f6a22cfd33 [1,0,1,0,0,0|1,0,1]=4 1634 B9R0.45 CCCOCCOCSC 6797f3697f583a66f6057547c0c4920a [1,0,1,0,0,0|1,0,1]=4 1635 B9R0.45 CCCOCCSCCC ef95f0015148e44bf9c71ec82f7f1f36 [1,0,1,0,0,0|0,1,1]=4 1636 B9R0.45 CCNCCCCCCO 59b1923e7d0b8671db87a813cf6b4ab5 [1,0,1,0,0,0|2,0,0]=4 1637 B9R0.46 C#CCOCOC(=O)CC 6a3a2984ecf1aa602992322c4fc87f14 [1,0,1,0,0,0|0,0,2]=4 1638 B9R0.46 C=C(CC)CNCCCO 18776204e4c91a3cb89e6a2582d8ff83 [1,0,1,0,0,0|2,0,0]=4 1639 B9R0.46 C=CC(=O)OCCOCC a7267376030751357e0b12ad264c9728 [1,0,1,0,0,0|0,0,2]=4 1640 B9R0.46 CCC(=O)CNCCCCl 084f431780a63ff3cebb43ca20d6371f [1,0,1,0,0,0|2,0,0]=4 1641 B9R0.46 CCC(=O)CNCCCO ad1bcc1a73963d84d1bed75acffddf2c [1,0,1,0,0,0|1,0,0]=3 1642 B9R0.46 CCC(=O)COCCCF 34ba52aa0b28bc859119658e634d4251 [1,0,1,0,0,0|2,0,0]=4 1643 B9R0.46 CCC(=O)COCCCS 2f3d517fdc40535b8ad4d871be51ef0c [1,0,1,0,0,0|1,1,0]=4 1644 B9R0.46 CCC(=O)NCCCCCl 8081b71d766c256ee6da55d9cbe39209 [1,0,1,0,0,0|2,0,0]=4 1645 B9R0.46 CCC(=O)NCCCCO 8628e89c17da0854907af2b22bdfd1c4 [1,0,1,0,0,0|1,0,0]=3 1646 B9R0.46 CCC(=O)NCCCCS 8259147db310bd3d03b77243f1626c91 [1,0,1,0,0,0|1,1,0]=4 1647 B9R0.46 CCC(=O)NCCCOC 3d06561303fae74e9ebe236f96b57cdc [1,0,1,0,0,0|2,0,0]=4 1648 B9R0.46 CCC(=O)NCCCSC c0a88e186e06619ed1f956bb505aa757 [1,0,1,0,0,0|2,0,0]=4 1649 B9R0.46 CCC(=O)NCCNCO 03dc81aae02f0d729bdddc35124dee9e [1,0,1,0,0,0|2,0,0]=4 1650 B9R0.46 CCC(=O)NCCOCF 23e78801b622f7fad277c2f392a8cb8f [1,0,1,0,0,0|2,0,0]=4 1651 B9R0.46 CCC(=O)OCCOCF dac9515ba882d559f224c99beb993b2d [1,0,1,0,0,0|1,0,0]=3 1652 B9R0.46 CCC(=O)OCNCCBr 04a60479c3fae8cce77a2420fc0b6713 [1,0,1,0,0,0|2,0,0]=4 1653 B9R0.46 CCC(=O)OCNCCF b95baeda4ff1a3ff8a2c7d4e7c40b748 [1,0,1,0,0,0|2,0,0]=4 1654 B9R0.46 CCC(=O)OCNCCI 14e9c8e2dc7a21d4a9573bdcfc5044a0 [1,0,1,0,0,0|2,0,0]=4 1655 B9R0.46 CCC(=O)OCNCCO 1f06de0805ea6ede1ea50046dc693666 [1,0,1,0,0,0|1,0,0]=3 1656 B9R0.46 CCC(=O)OCNCCS f97d7fd5dee28bbec1f5640f6f55d6db [1,0,1,0,0,0|1,1,0]=4 1657 B9R0.46 CCC(=O)OCOCC#N 42a5ece0bd83f0ee5dfea8c4127e0f61 [1,0,1,0,0,0|1,0,1]=4 1658 B9R0.46 CCC(=O)OCOCCF e5fb342926bb871d1cb290b830b4ffb8 [1,0,1,0,0,0|1,0,0]=3 1659 B9R0.46 CCC(=O)OCOCCS 6f4d5e6c17478e3865487606bb3e4321 [1,0,1,0,0,0|1,0,0]=3 1660 B9R0.46 CCC(=O)OCOCOC b6e9338ebc927d2f6211f21a32802dfc [1,0,1,0,0,0|1,0,0]=3 1661 B9R0.46 CCCCCNC(=O)CC 849a8920618781fdb82a0336e223971a [1,0,1,0,0,0|1,0,0]=3 1662 B9R0.46 CCCCCNC(=O)CF a05eb2568b07d5cb7d8de0ce30087de3 [1,0,1,0,0,0|2,0,0]=4 1663 B9R0.46 CCCCCNC(=O)CO ec7a3042859a9f12ba052c0da8e4a7aa [1,0,1,0,0,0|2,0,0]=4 1664 B9R0.46 CCCCCNC(=O)CS 03156480cccef12f02d921dd33cd4590 [1,0,1,0,0,0|2,0,0]=4 1665 B9R0.46 CCCCCOC(C)CC fc1eb2247bb34f4c011b4f7d0e4c7945 [1,0,1,0,0,0|1,0,1]=4 1666 B9R0.46 CCCCCO[C@@H](C)CC c4a51e5bded663ac6b4a49e50238da1d [1,0,1,0,0,0|1,0,1]=4 1667 B9R0.46 CCCCCO[C@H](C)CC 114a1823e1afabcf8603ed51c782914a [1,0,1,0,0,0|1,0,1]=4 1668 B9R0.46 CCCCNCC(=O)CC b2e0d743393b788f6d80972415374097 [1,0,1,0,0,0|2,0,0]=4 1669 B9R0.46 CCCCOCC(=O)CC 389316566cd1a1fc2f85978e15274242 [1,0,1,0,0,0|2,0,0]=4 1670 B9R0.46 CCCNCCC(=O)NC 15c9bd5d976b45d01c0fa363e53c356e [1,0,1,0,0,0|2,0,0]=4 1671 B9R0.46 CCCNCCC(=O)OC 05bc030a2f2408fd65b5ffca8abeab98 [1,0,1,0,0,0|2,0,0]=4 1672 B9R0.46 CCCNCCS(=O)CC 35a572faf6496587285f91527b039120 [1,0,1,0,0,0|2,0,0]=4 1673 B9R0.46 CCCNCOC(=O)CC 5135722cfe6a14d8256a85f8111be929 [1,0,1,0,0,0|1,0,0]=3 1674 B9R0.46 CCCNCOC(=O)OC f670b6fcf3cafadb01eab83cce01794d [1,0,1,0,0,0|2,0,0]=4 1675 B9R0.46 CCCOCCC(=O)NC 08e49cdbe7f26a9ed53ba2c0be49d187 [1,0,1,0,0,0|1,0,0]=3 1676 B9R0.46 CCCOCCC(=O)OC 630bff407b7c5972cdb6361bdad86547 [1,0,1,0,0,0|1,0,0]=3 1677 B9R0.46 CCCOCCC(C)CC d32230cb97bcbaa35141057e4fc42013 [1,0,1,0,0,0|1,0,1]=4 1678 B9R0.46 CCCOCCC(S)CC 52c7b7912eb2ffdf0f6b5f6ebf04c230 [1,0,1,0,0,0|0,1,1]=4 1679 B9R0.46 CCCOCCN(C)CC ef40f415dbe0e1aad15447a1a2d09d21 [1,0,1,0,0,0|2,0,0]=4 1680 B9R0.46 CCCOCCS(=O)CC df836a83d60347b60939b06320da5af3 [1,0,1,0,0,0|1,0,0]=3 1681 B9R0.46 CCCOCC[C@@H](C)CC 5c7be05a753d139dee133c45d7518c1b [1,0,1,0,0,0|1,0,1]=4 1682 B9R0.46 CCCOCOC(=O)CC fc12ca63d515d86d2f674d2f74a06865 [1,0,1,0,0,0|0,0,0]=2 1683 B9R0.46 CCCOCOC(=O)OC f08733c900934115c08d74dfad3e1662 [1,0,1,0,0,0|1,0,0]=3 1684 B9R0.46 CCN(C)CCCCCO cc23bd2adbd47cdaf3363f05e9df12a8 [1,0,1,0,0,0|2,0,0]=4 1685 B9R0.46 CCNCCNC(=O)CC d05b1a7e2d3cebad7ef561e08a9f68d4 [1,0,1,0,0,0|2,0,0]=4 1686 B9R0.46 CCOCCCC(=O)NC 8b277ae760d242e65f64127caa0bf565 [1,0,1,0,0,0|2,0,0]=4 1687 B9R0.46 CCOCCNC(=O)CC bb89549179010db70c29ee3b9f4248d0 [1,0,1,0,0,0|1,0,0]=3 1688 B9R0.46 CCOCCNC(=O)CF d41b8e9912d9ad97fdf97596beae9298 [1,0,1,0,0,0|2,0,0]=4 1689 B9R0.46 CCOCCNC(=O)CO d9af89bf0c14e4934e6283e7e3b7f7b7 [1,0,1,0,0,0|2,0,0]=4 1690 B9R0.46 CCOCCNC(=O)CS 7901659e876ad5469c108978c39208e8 [1,0,1,0,0,0|2,0,0]=4 1691 B9R0.46 CCOCCOC(=O)CC cbe8829b561f0b4f11227dbb7fca44b4 [1,0,1,0,0,0|0,0,0]=2 1692 B9R0.46 CCOCCOC(=O)OC b297131086651eb5dcd01a50837d46c4 [1,0,1,0,0,0|1,0,0]=3 1693 B9R0.46 CCOCCOC(C)CC 8ffead10c60181691df31d8ade4e4ae1 [1,0,1,0,0,0|1,0,1]=4 1694 B9R0.46 CCOCCO[C@@H](C)CC 3b26474e70fe44798dc53e7bf758b859 [1,0,1,0,0,0|1,0,1]=4 1695 B9R0.46 CCOCCO[C@H](C)CC 06cae5bafa67b8d9d3e512875d68b6c2 [1,0,1,0,0,0|1,0,1]=4 1696 B9R0.46 CCOCOCC(=O)CC a6933b2b2a32c7e2b806bc01fa6f7247 [1,0,1,0,0,0|2,0,0]=4 1697 B9R0.46 CCS(=O)CCNCCO 80f9000fb14e6d13c5c9e53876d91e4e [1,0,1,0,0,0|2,0,0]=4 1698 B9R0.46 CCS(=O)CCOCCF 8ef95104d3c4736cf32403e8715cd43e [1,0,1,0,0,0|2,0,0]=4 1699 B9R0.46 CCS(=O)CCOCCS 80b519a41b8db15a5367ed5720948bdd [1,0,1,0,0,0|2,0,0]=4 1700 B9R0.46 CCS(=O)CCOCOC cc45f556806623d703d038131bce054a [1,0,1,0,0,0|2,0,0]=4 1701 B9R0.46 CCSCCNC(=O)CC 70f4cbcf01905cc3c094d724b73e5668 [1,0,1,0,0,0|1,1,0]=4 1702 B9R0.46 CNC(=O)CCNCCO 98df73f33e1b075bda1acbb74fe1c8df [1,0,1,0,0,0|2,0,0]=4 1703 B9R0.46 CNC(=O)CCOCCF b2e22a035cc2bd25c7b85b567f74cd31 [1,0,1,0,0,0|2,0,0]=4 1704 B9R0.46 CNC(=O)CCOCCS 067360fe45250b4deb2a92820d379203 [1,0,1,0,0,0|2,0,0]=4 1705 B9R0.46 CNC(=O)CCOCOC 00bdc051d7b098bed36277179c4c7787 [1,0,1,0,0,0|2,0,0]=4 1706 B9R0.46 CNC(=O)CCOCSC 32815e6ae018d6bf0c0d70259f25dc15 [1,0,1,0,0,0|2,0,0]=4 1707 B9R0.46 CNC(=O)CNCCCO 04620384c25840fda6cec1980d6e4534 [1,0,1,0,0,0|2,0,0]=4 1708 B9R0.46 COC(=O)CCCNCO 7f4c543538d7d8c02923f8e5ee512b7d [1,0,1,0,0,0|2,0,0]=4 1709 B9R0.46 COC(=O)CCNCCO 370144453eebf725a732ab3ac8cea44b [1,0,1,0,0,0|2,0,0]=4 1710 B9R0.46 COC(=O)CCOCCF 628582c7630374a94e4bced8359c4233 [1,0,1,0,0,0|2,0,0]=4 1711 B9R0.46 COC(=O)CCOCCS 20528c74e4da9192ce01c8b31c16dba2 [1,0,1,0,0,0|2,0,0]=4 1712 B9R0.46 COC(=O)CCOCSC f8c9563c56621b9e36b8626b322b47d8 [1,0,1,0,0,0|2,0,0]=4 1713 B9R0.46 COC(=O)CNCCCO 46abbcbf049316d92b11742c7ee09635 [1,0,1,0,0,0|2,0,0]=4 1714 B9R0.46 COC(=O)OCCOCF e98dd05af7d2c94f94e4f3d0e2ed855c [1,0,1,0,0,0|2,0,0]=4 1715 B9R0.46 COC(=O)OCNCCO b043b1f4c8b6ead733606d48fba1c12c [1,0,1,0,0,0|2,0,0]=4 1716 B9R0.46 COC(=O)OCOCCF d50173eb55ebfa5b25ba82997eed753c [1,0,1,0,0,0|2,0,0]=4 1717 B9R0.46 COC(=O)OCOCCS 04092d40ea56244b727f94fb9a6b6f65 [1,0,1,0,0,0|2,0,0]=4 1718 B9R0.46 COCOCCC(=O)OC 6aede0cdfec6dbd64f8c4300c142c36f [1,0,1,0,0,0|2,0,0]=4 1719 B9R0.46 COCOCOC(=O)OC 831dc3cd656f1065c91c21085ad03026 [1,0,1,0,0,0|2,0,0]=4 1720 B9R0.46 O=C(CF)NCCCCO 55742d922757adee17ba8d48239de065 [1,0,1,0,0,0|2,0,0]=4 1721 B9R0.46 O=C(CO)CNCCCO 3c1be4b73536b5d9eb97bb93f1f5b814 [1,0,1,0,0,0|2,0,0]=4 1722 B9R0.46 O=C(CO)NCCCCO 063fc2727d5485e0a8fd8539cfb094c8 [1,0,1,0,0,0|2,0,0]=4 1723 B9R0.46 O=C(CS)NCCCCO 4fcea8da1f2ecdfd0c739dabea0c409c [1,0,1,0,0,0|2,0,0]=4 1724 B9R0.5 CCC#CCC(C)OCC cd178134daf5ea88a7b4ed0ccc35f11c [1,0,1,0,0,0|1,0,1]=4 1725 B9R0.5 CCCCCC(C)OCC 730550df732f69eef1e6a549de510b2c [1,0,1,0,0,0|1,0,1]=4 1726 B9R0.5 CCCCC[C@@H](C)OCC 8f2bb2e64349b01f8c7137850e01df92 [1,0,1,0,0,0|1,0,1]=4 1727 B9R0.5 CCCCC[C@H](C)OCC 2cf9a829d5eb89110544892bd459dee4 [1,0,1,0,0,0|1,0,1]=4 1728 B9R0.5 CCCNCC(C)OCC 67b61dd333dbaac4f86976019539379e [1,0,1,0,0,0|1,0,1]=4 1729 B9R0.5 CCCNCC(O)CCC 3d957147f5d37c2bce44ac77f80f84a5 [1,0,1,0,0,0|1,0,1]=4 1730 B9R0.5 CCCOCC(C)CCC 991f1db54286263be3e664fb478a931d [1,0,1,0,0,0|1,0,1]=4 1731 B9R0.5 CCCOCC(C)OCC a9309e87d325b6f2b1644b3d0636499f [1,0,1,0,0,0|0,0,1]=3 1732 B9R0.5 CCCOCC(C)OCF 3c217a0a0555b3f9e34d23a6269a5c80 [1,0,1,0,0,0|1,0,1]=4 1733 B9R0.5 CCCOC[C@@H](O)CCO 8f4ac1d9a59c7be3b1d0e4ed72d56dee [1,0,1,0,0,0|1,0,1]=4 1734 B9R0.5 CCOC(C)COCCF dd36371eacdbc99004d10c271349acd4 [1,0,1,0,0,0|1,0,1]=4 1735 B9R0.5 CCOC(C)COCCS c7c2bcc8f3e03e9f47223219f81c8b1f [1,0,1,0,0,0|1,0,1]=4 1736 B9R0.5 CCOC(C)COCOC 85153869453556ba60238e00dabccc4f [1,0,1,0,0,0|1,0,1]=4 1737 B9R0.5 CCOC(C)COCSC 5bca448d87a75d6304bc9a4f11e6dc4e [1,0,1,0,0,0|1,0,1]=4 1738 B9R0.48 CC(=O)NCC(C)OCF b0f4bcee091e9ec82fc9f31c12a11230 [1,0,1,0,0,0|2,0,0]=4 1739 B9R0.48 CC(=O)OCC(C)OCF d945c8dd292c0b146df582fcf02d66be [1,0,1,0,0,0|1,0,0]=3 1740 B9R0.48 CCCC(O)CNC(=O)C 5b570a4d674c9d38425ae4777e887a42 [1,0,1,0,0,0|1,0,0]=3 1741 B9R0.48 CCCN(C)COC(=O)C 0353bc7482d98b3c935ad94681e2352d [1,0,1,0,0,0|2,0,0]=4 1742 B9R0.48 CCOC(C)CCC(=O)O 31641a6cc61a92f98818e768ef37979d [1,0,1,0,0,0|2,0,0]=4 1743 B9R0.48 CCOC(C)CNC(=O)C 217fca33332c664f1a507b96c62f402a [1,0,1,0,0,0|1,0,0]=3 1744 B9R0.48 CCOC(C)COC(=O)C 9e93393c063eba810753fb5603d4fc7e [1,0,1,0,0,0|0,0,0]=2 1745 B9R0.48 CCOC(C)COC(C)C e07f597429e2078ea5e59e54a6fef850 [1,0,1,0,0,0|1,0,1]=4 1746 B9R0.48 CCO[C@@H](C)COC(C)C e2051b844f248f8adf76905a514be0bd [1,0,1,0,0,0|1,0,1]=4 1747 B9R0.48 COCC(O)CNC(=O)C b9e4b5e9625177a365a4bdbe35bd87be [1,0,1,0,0,0|2,0,0]=4 1748 B9R0.48 COC[C@@H](O)CNC(=O)C 77bae3eb71a3b0890035e84a8c0ee4ab [1,0,1,0,0,0|2,0,0]=4 1749 B9R1.12 CCCOC1CCCC1 8b31bdd2ae6636509668964f17d3af12 [2,0,0,0,0,0|1,0,1]=4 1750 B9R1.12 CCCOC1CCCO1 4e4ce5597ea66ad501ec25fa53d020dd [2,0,0,0,0,0|0,0,1]=3 1751 B9R1.12 CCNCC1CCCC1 5a3ad05440161202bff87c340c2ae6eb [2,0,0,0,0,0|2,0,0]=4 1752 B9R1.12 CCNCC1CCCO1 0d10918d6022ab0ba029f9bc507ef0d5 [2,0,0,0,0,0|1,0,0]=3 1753 B9R1.12 CCNC[C@@H]1CCCO1 b1829889cbf982f3fcb1bb0335d251c8 [2,0,0,0,0,0|1,0,0]=3 1754 B9R1.12 CCNC[C@H]1CCCO1 5696667f73ca7c93f1dd7a4fdf14dc92 [2,0,0,0,0,0|1,0,0]=3 1755 B9R1.12 CCOCC1C=CCC1 608a599d2ce1d9806fd4dc0424859b06 [2,0,0,0,0,0|1,0,1]=4 1756 B9R1.12 CCOCC1CCCC1 78dfb99153363e6ae71186392081c4c4 [2,0,0,0,0,0|1,0,0]=3 1757 B9R1.12 CCOCC1CCCO1 2054eb6e81b646f33dc6d98216be64f2 [2,0,0,0,0,0|0,0,0]=2 1758 B9R1.12 CCOCC1CCCS1 fda5a0c4a41f4031af715e57eedde033 [2,0,0,0,0,0|0,1,0]=3 1759 B9R1.12 CCOCC1CCOC1 081b8a302e395d21423b992decfc7864 [2,0,0,0,0,0|2,0,0]=4 1760 B9R1.12 CCOCN1CCCC1 10706d052d0b8a1bdaf6406298dca6b2 [2,0,0,0,0,0|2,0,0]=4 1761 B9R1.12 CCOC[C@@H]1CCCO1 a2ec9082c3cefa87960b2eb598c83c97 [2,0,0,0,0,0|0,0,0]=2 1762 B9R1.12 CCOC[C@@H]1CCOC1 110af67d4a3e1691dca41b1082ecc779 [2,0,0,0,0,0|2,0,0]=4 1763 B9R1.12 CCOC[C@H]1CCCO1 2cdc5ffd4542ac26ce370875427cfda2 [2,0,0,0,0,0|0,0,0]=2 1764 B9R1.12 CCOC[C@H]1CCOC1 324f1ca870799e717de7b33cf11a0c3d [2,0,0,0,0,0|2,0,0]=4 1765 B9R1.12 COCOC1CCCO1 20e6e3930a8f26f1a2205045bfbc4b80 [2,0,0,0,0,0|1,0,1]=4 1766 B9R1.12 CSCOC1CCCO1 821393188cd42b944a93875485042f3d [2,0,0,0,0,0|1,0,1]=4 1767 B9R1.12 FCCOC1CCCO1 68089a96fc2763d6f90ba264b52bfdb0 [2,0,0,0,0,0|1,0,1]=4 1768 B9R1.12 FCNCC1CCCO1 665c9adebd19ef617d641f3c589abe88 [2,0,0,0,0,0|2,0,0]=4 1769 B9R1.12 FCNC[C@@H]1CCCO1 809275c33906a737f7ac2333e68726e9 [2,0,0,0,0,0|2,0,0]=4 1770 B9R1.12 FCNC[C@H]1CCCO1 2273dc9fe4fc65ee4398b187540ff460 [2,0,0,0,0,0|2,0,0]=4 1771 B9R1.12 FCOCC1CCCC1 adc3b963cccb9f54cfa066ef371e1987 [2,0,0,0,0,0|2,0,0]=4 1772 B9R1.12 FCOCC1CCCO1 3da5144201bb64495a12aa51835dee04 [2,0,0,0,0,0|1,0,0]=3 1773 B9R1.12 FCOCC1CCCS1 958c12abf2f34560c53c811677d00d7b [2,0,0,0,0,0|1,1,0]=4 1774 B9R1.12 FCOC[C@@H]1CCCO1 008ba7c0caf0f25668fb12124f9e8a74 [2,0,0,0,0,0|1,0,0]=3 1775 B9R1.12 FCOC[C@H]1CCCO1 853f0b635f936733b4ad9f22b8c231e9 [2,0,0,0,0,0|1,0,0]=3 1776 B9R1.12 O=CCOC1CCCO1 b12387ccaf578e9136cfdda5442c6ed5 [2,0,0,0,0,0|2,0,0]=4 1777 B9R1.12 O=CNCC1CCCC1 07bc0016cbba20adfd4b5def8fc2be28 [2,0,0,0,0,0|2,0,0]=4 1778 B9R1.12 O=CNCC1CCCO1 119dc507c9398e42b1f4ed984596ee10 [2,0,0,0,0,0|1,0,0]=3 1779 B9R1.12 O=CNC[C@@H]1CCCO1 1db6e6cf4b42f513cad73704b19cd2ea [2,0,0,0,0,0|1,0,0]=3 1780 B9R1.12 O=CNC[C@H]1CCCO1 d67473c99765cbcf463c4cc54c44cf84 [2,0,0,0,0,0|1,0,0]=3 1781 B9R1.12 OCNCC1CCCO1 7c0145316512c0419865b607461c30ec [2,0,0,0,0,0|2,0,0]=4 1782 B9R1.12 OCNC[C@@H]1CCCO1 31a00fae912ba8548490b36aab3d2de9 [2,0,0,0,0,0|2,0,0]=4 1783 B9R1.12 OCNC[C@H]1CCCO1 a07951c9126dda0c80fe24218d274d55 [2,0,0,0,0,0|2,0,0]=4 1784 B9R1.12 SCCOC1CCCO1 8dbb3fe838b96ce29ae716c47c93ca97 [2,0,0,0,0,0|1,0,1]=4 1785 B11R0.9 CCC(CC)CNC(=O)CCF abbc506ac77ace67ec31a71ae7f2a197 [0,1,1,0,0,0|2,0,0]=4 1786 B11R0.9 CCC(CC)CNC(=O)CCO b5a49d7a050950237a095136de52b2b1 [0,1,1,0,0,0|2,0,0]=4 1787 B11R0.9 CCC(CC)CNC(=O)CCS 81d5548186548d2cc43ed2bf708b827a [0,1,1,0,0,0|2,0,0]=4 1788 B11R0.9 CCC(CC)CNC(=O)COC d83c15755c4f2677ae725f488f9e123e [0,1,1,0,0,0|2,0,0]=4 1789 B11R0.9 CCC(CC)CNC(=O)CSC 87231d301d7bd21b5165573dd191b89a [0,1,1,0,0,0|2,0,0]=4 1790 B11R0.9 CCC(COC(C)COC)OC 5df35af6e3a469af9cec4adbf7a3407f [0,1,1,0,0,0|1,0,1]=4 1791 B11R0.9 CCCC(=O)NCC(CC)CC 88f7d3af06e3e46748b0bc5bea460361 [0,1,1,0,0,0|2,0,0]=4 1792 B11R0.9 CCCC(=O)NCC(OC)OC 6e8df676079f75dffe5ded86912aa4d0 [0,1,1,0,0,0|2,0,0]=4 1793 B11R0.9 CCCC(=O)NC[C@H](CO)OC 0c68ae8701dfe669332a0ea07cec0670 [0,1,1,0,0,0|2,0,0]=4 1794 B11R0.9 CCCC(=S)OCC(CC)CC 0335927c07870e41d73accceee110f90 [0,1,1,0,0,0|1,1,0]=4 1795 B11R0.9 CCCC(=S)OCC(OC)OC 35082ca7678e09b2aed7e8e77129762e [0,1,1,0,0,0|1,1,0]=4 1796 B11R0.9 CCCC(C)OCC(CC)OC e5d5ff8183d778e4f4c2ec49c6e44e11 [0,1,1,0,0,0|1,0,1]=4 1797 B11R0.9 COC(CNC(=O)CCF)OC 6aabab0324ef56579793153e1afaeb80 [0,1,1,0,0,0|2,0,0]=4 1798 B11R0.9 COC(CNC(=O)CCO)OC ab31a7bb68ff7b19398f7598917bcf9f [0,1,1,0,0,0|2,0,0]=4 1799 B11R0.9 COC(CNC(=O)CCS)OC 2048e704cca9bdaa1c2d45d75863f793 [0,1,1,0,0,0|2,0,0]=4 1800 B11R0.9 COC(CNC(=O)CSC)OC 3389dabd0017e8b51cb81de2c2edaca9 [0,1,1,0,0,0|2,0,0]=4 1801 B11R0.9 COCC(=O)NCC(OC)OC 3a7b00c929d86b7ff0b642a9382bc4b3 [0,1,1,0,0,0|2,0,0]=4 1802 B11R0.9 COCC(=O)NC[C@H](CO)OC 11af36717c185db7ce7f598cee5255cf [0,1,1,0,0,0|2,0,0]=4 1803 B11R0.9 CO[C@@H](CO)CNC(=O)CCF 1f05600de5a59923a65b783ce0a4508d [0,1,1,0,0,0|2,0,0]=4 1804 B11R0.9 CO[C@@H](CO)CNC(=O)CCO a701e3d2919259f96e0e8fc8df645cee [0,1,1,0,0,0|2,0,0]=4 1805 B11R0.9 CO[C@@H](CO)CNC(=O)CCS 0f0dcf2ba5a40737ed126e3bcd464d0e [0,1,1,0,0,0|2,0,0]=4 1806 B11R0.9 CO[C@@H](CO)CNC(=O)CSC 80448bd0b6c34423f1437d8d5c004cef [0,1,1,0,0,0|2,0,0]=4 1807 B11R0.21 CCC(CC)CNC(=O)C(C)F 1435e077fb8005b0e68f42c82ea9ccf8 [0,1,1,0,0,0|2,0,0]=4 1808 B11R0.21 CCC(CC)CNC(=O)C(C)O 2c5a244c8f1ac9eea62155ff45d6b42d [0,1,1,0,0,0|2,0,0]=4 1809 B11R0.21 CCC(CC)CNC(=O)C(C)S f215b47b31e2b257db716d8da3c373c5 [0,1,1,0,0,0|2,0,0]=4 1810 B11R0.21 CCC(CC)CNC(=O)[C@@H](C)F ae9cbc3baa939ede6e227d1338b0585c [0,1,1,0,0,0|2,0,0]=4 1811 B11R0.21 CCC(CC)CNC(=O)[C@@H](C)O bc165bd0f509705e5fec1b02f4841f0a [0,1,1,0,0,0|2,0,0]=4 1812 B11R0.21 CCC(CC)CNC(=O)[C@H](C)F 4b550874c035ce8c8ffd76b4b6b07fc1 [0,1,1,0,0,0|2,0,0]=4 1813 B11R0.21 CCC(CC)CNC(=O)[C@H](C)O 09b08b2771905257a9f64fdb6ab47bad [0,1,1,0,0,0|2,0,0]=4 1814 B11R0.21 CCC(COC(C)C(C)C)OC eae7b52bb0b93171616daf0b1c39cc6d [0,1,1,0,0,0|1,0,1]=4 1815 B11R0.21 COC(CNC(=O)C(C)F)OC 777e48d5dc2efa3e96f93714519f9994 [0,1,1,0,0,0|2,0,0]=4 1816 B11R0.21 COC(CNC(=O)C(C)O)OC 3e77d3deb76216b349f8a3dc9cb0d4c0 [0,1,1,0,0,0|2,0,0]=4 1817 B11R0.21 COC(CNC(=O)C(C)S)OC e4153bc3d2ffa1d9a970ea9adbe7d7d6 [0,1,1,0,0,0|2,0,0]=4 1818 B11R0.21 COC(CNC(=O)[C@@H](C)F)OC 216843c221232a645a76d1f425f5bc9c [0,1,1,0,0,0|2,0,0]=4 1819 B11R0.21 COC(CNC(=O)[C@@H](C)O)OC 9051092ad06662e5bfc4dd8108f89807 [0,1,1,0,0,0|2,0,0]=4 1820 B11R0.21 COC(CNC(=O)[C@H](C)F)OC c9f0d09531ce81fbce4610137c575edd [0,1,1,0,0,0|2,0,0]=4 1821 B11R0.21 COC(CNC(=O)[C@H](C)O)OC b47e598f5eda3c180c416d72b936e605 [0,1,1,0,0,0|2,0,0]=4 1822 B11R0.21 CO[C@@H](CO)CNC(=O)C(C)F 1d608f062367363191caf8668c96e742 [0,1,1,0,0,0|2,0,0]=4 1823 B11R0.21 CO[C@@H](CO)CNC(=O)C(C)O 709a6bb72cd09795994b94e4ba111aa2 [0,1,1,0,0,0|2,0,0]=4 1824 B11R0.21 CO[C@@H](CO)CNC(=O)C(C)S 3bba42f0890ccf73fb475efc70125a35 [0,1,1,0,0,0|2,0,0]=4 1825 B11R0.21 CO[C@@H](CO)CNC(=O)[C@@H](C)F b0b035a716665734d7b238f9feb76d2d [0,1,1,0,0,0|2,0,0]=4 1826 B11R0.21 CO[C@@H](CO)CNC(=O)[C@@H](C)O bb652b51bca82148dc30774af55c6589 [0,1,1,0,0,0|2,0,0]=4 1827 B11R0.21 CO[C@@H](CO)CNC(=O)[C@H](C)F b5bde01c5412213e29f57ec4c4ae15fa [0,1,1,0,0,0|2,0,0]=4 1828 B11R0.21 CO[C@@H](CO)CNC(=O)[C@H](C)O ed60e6c82531d87c967428f9e9a7ddf8 [0,1,1,0,0,0|2,0,0]=4 1829 B11R0.65 CCC(=O)N(C)CC(OC)OC f09663f53165da040da2277ff7baf716 [0,1,1,0,0,0|2,0,0]=4 1830 B11R0.90 CCC(=O)NCC(CC)N(C)C c2db034953d699f4fb96413c911261f0 [0,1,1,0,0,0|2,0,0]=4 1831 B11R0.90 CCC(=O)OCN(CC)C(C)C c64297acbb404c525cc5793d327db62a [0,1,1,0,0,0|2,0,0]=4 1832 B11R0.90 CCC(C)OC[C@H](OC)C(C)C b01c7ee0b1e31be7145a5dddfe1e91b9 [0,1,1,0,0,0|1,0,1]=4 1833 B11R0.113 CCC(=O)NC(C)C(OC)OC 356625b10c4643cc3b46270a8db94e4e [0,1,1,0,0,0|2,0,0]=4 1834 B11R0.134 CCC(=O)CNC(CC)COC 715103dd64d7715410f26c273a61c6b4 [0,1,1,0,0,0|2,0,0]=4 1835 B11R0.134 CCC(=O)COC(CC)COC 73c271fa8d841c34b68a8d25596af78f [0,1,1,0,0,0|2,0,0]=4 1836 B11R0.134 CCC(=O)OCN(CC)CCCl c9ea2c4f9470178ff8a59fe5096147aa [0,1,1,0,0,0|2,0,0]=4 1837 B11R0.134 CCC(=O)OCN(CC)CCO d5349b5c13b62e3812bc4fa983bcf003 [0,1,1,0,0,0|2,0,0]=4 1838 B11R0.134 CCCN(CC)COC(=O)CC 5e0e4624e4eb047fa54b1c298fa071a5 [0,1,1,0,0,0|2,0,0]=4 1839 B11R0.134 CCOC(CC)COC(C)CC 7d431575223e54a1860e725eba466c07 [0,1,1,0,0,0|1,0,1]=4 1840 B11R0.134 CCOC(CC)CO[C@@H](C)CC 83a0f0b7434aaa93e57f2d9dd0f11b9c [0,1,1,0,0,0|1,0,1]=4 1841 B11R0.134 CCOC(CC)CO[C@H](C)CC df29cace276622b9613ea8ca5b56dc00 [0,1,1,0,0,0|1,0,1]=4 1842 B11R0.264 CCC(=O)NCC(C)(OC)OC 98bfb3539a6e617c16679f6fb5bcecb0 [0,1,1,0,0,0|2,0,0]=4 1843 B11R0.264 CCC(=O)NCC(O)(CC)CC 3c554cbe3328ab2f8b84b7f564c946a9 [0,1,1,0,0,0|2,0,0]=4 1844 B11R0.314 CCC(C=O)OCC(CC)OC f15024a5acb15e52abe035c2fe7a3e0c [0,1,1,0,0,0|0,0,1]=3 1845 B11R0.314 CCC(C=O)OCC(OC)OC 551067e25c88f224d154358b0704e65f [0,1,1,0,0,0|1,0,1]=4 1846 B11R0.314 CCC(CC)COC(C=O)CC 23345423eb1bf327783c7253f235e772 [0,1,1,0,0,0|1,0,1]=4 1847 B11R0.314 CCC(COC(CC)CC)OC 4f7b4847c469c45ac93e67d8612719e6 [0,1,1,0,0,0|1,0,1]=4 1848 B11R0.4 C#CCC(=O)NCCCCCO 936e488b36ab67e3f609266f5ee20932 [0,1,1,0,0,0|1,0,1]=4 1849 B11R0.4 C#CCC(=O)NCCOCCC 077fb72f25c4c238d24975e14fa19b8b [0,1,1,0,0,0|1,0,1]=4 1850 B11R0.4 C#CCOCCOC(=O)CCC 3fce535dccc5c7087dfa1c84ea2e8dd4 [0,1,1,0,0,0|0,0,2]=4 1851 B11R0.4 C/C=C/C(=O)NCCCCCO 41b75d86fd8969e697df5b2792cef688 [0,1,1,0,0,0|1,0,1]=4 1852 B11R0.4 C/C=C/C(=O)NCCOCCC 962cb3f7927c09a58d16a2f7de5f658e [0,1,1,0,0,0|1,0,1]=4 1853 B11R0.4 C=CCC(=O)NCCCCCO 5ec753bcff99b57c19bd3fcdd35bd6ec [0,1,1,0,0,0|1,0,1]=4 1854 B11R0.4 C=CCC(=O)NCCOCCC 5ad2560a6adfd80a20d436b4c454c60b [0,1,1,0,0,0|1,0,1]=4 1855 B11R0.4 C=CCOCCOC(=O)CCC da1424bc3a835e06abf1bfd5a696af0f [0,1,1,0,0,0|0,0,2]=4 1856 B11R0.4 CC#CC(=O)NCCCCCO 4ba47ba37ee59700702d311d485092eb [0,1,1,0,0,0|1,0,1]=4 1857 B11R0.4 CC#CC(=O)NCCOCCC cbf30a1a6c0e2a19cacd50850a5609a7 [0,1,1,0,0,0|1,0,1]=4 1858 B11R0.4 CCCC(=O)CNCCCCO ad77a490abf61282724383d41a85bcf1 [0,1,1,0,0,0|2,0,0]=4 1859 B11R0.4 CCCC(=O)NCCCCCCl b271418140b6e6dcb073001e7c2d35c7 [0,1,1,0,0,0|2,0,0]=4 1860 B11R0.4 CCCC(=O)NCCCCCO a305ba074b2c53f5334878718cbd2dcc [0,1,1,0,0,0|1,0,0]=3 1861 B11R0.4 CCCC(=O)NCCOCCO c416674579040a9fe04904aab89dff3d [0,1,1,0,0,0|2,0,0]=4 1862 B11R0.4 CCCC(=O)NCCOCCS 6ca54d0f9b87926c2dba1a852e56ff53 [0,1,1,0,0,0|2,0,0]=4 1863 B11R0.4 CCCC(=O)NCCSCCO 913753d71944599194dccc52077a2788 [0,1,1,0,0,0|2,0,0]=4 1864 B11R0.4 CCCC(=O)OCCOCC#N 5359e397320d5650be54b63e5d29e8dd [0,1,1,0,0,0|1,0,1]=4 1865 B11R0.4 CCCC(=O)OCCOCC=O 886fc19ae6332205f62832bfed07a97d [0,1,1,0,0,0|1,0,1]=4 1866 B11R0.4 CCCC(=O)OCCOCCF 41623b129df8b661e0661c46ca996455 [0,1,1,0,0,0|1,0,0]=3 1867 B11R0.4 CCCC(=O)OCCOCCS e90aaa69baefd496d90e54eb86ac96d3 [0,1,1,0,0,0|1,0,0]=3 1868 B11R0.4 CCCC(=O)OCCOCOC b7d59abffd1800995f07b9169f358dd9 [0,1,1,0,0,0|1,0,0]=3 1869 B11R0.4 CCCC(=O)OCCOCSC 395a57442bac60125264ec8041b1e3ee [0,1,1,0,0,0|1,0,0]=3 1870 B11R0.4 CCCC(=O)OCNCCCCl 63da45e077f6d5a8d6ce9b8e705a2044 [0,1,1,0,0,0|2,0,0]=4 1871 B11R0.4 CCCC(=O)OCNCCCO 9409798fe2f3d69dc3eb685e1892a1db [0,1,1,0,0,0|1,0,0]=3 1872 B11R0.4 CCCC(=O)OCOCCCF 7f139c47c4a36b3b54bd8d562fd79349 [0,1,1,0,0,0|2,0,0]=4 1873 B11R0.4 CCCC(=O)OCOCCCS 02dbc01f116bf4da9d509fac1ef64237 [0,1,1,0,0,0|1,1,0]=4 1874 B11R0.4 CCCC(=S)OCCCCCF 13c1e0d733b0db29547037cd5aa9451d [0,1,1,0,0,0|1,1,0]=4 1875 B11R0.4 CCCC(=S)OCCOCOC 0cd4a6843b6938b837893ea7a2fec102 [0,1,1,0,0,0|1,1,0]=4 1876 B11R0.4 CCCCCCNC(=O)CCC 86ff0f5e9c808359785c4d555716a0c6 [0,1,1,0,0,0|2,0,0]=4 1877 B11R0.4 CCCCCCNC(=O)CCF 0e16ccb662e7e0ac93051a877f48470e [0,1,1,0,0,0|2,0,0]=4 1878 B11R0.4 CCCCCCNC(=O)CCO c087b3675c7cb5dcfde9fa6dcbdb3e38 [0,1,1,0,0,0|2,0,0]=4 1879 B11R0.4 CCCCCCNC(=O)CCS e76f3d6d22ed4cd16bf2a3f98e737a89 [0,1,1,0,0,0|2,0,0]=4 1880 B11R0.4 CCCCCCNC(=O)COC 714e5a0281995088b6f3f1f962d227b2 [0,1,1,0,0,0|2,0,0]=4 1881 B11R0.4 CCCCCCNC(=O)CSC c9cc6aa932351aac48e1944e9ae4f49e [0,1,1,0,0,0|2,0,0]=4 1882 B11R0.4 CCCCCCOC(=S)CCC ebc5344eafa6dd48024f5c5c5e052730 [0,1,1,0,0,0|1,1,0]=4 1883 B11R0.4 CCCCNCOC(=O)CCC cc2e2e110e13b6e9f5212bb3d4681698 [0,1,1,0,0,0|2,0,0]=4 1884 B11R0.4 CCCCNCOC(=O)OCC ca409d7539df0c74dbd07384dd478520 [0,1,1,0,0,0|2,0,0]=4 1885 B11R0.4 CCCCNCOC(=O)SCC 2bb2d25fa2ef25941c49a8e888b29c57 [0,1,1,0,0,0|2,0,0]=4 1886 B11R0.4 CCCCOCOC(=O)CCC b2403cfdcf9e3272dd7d915ff636f487 [0,1,1,0,0,0|2,0,0]=4 1887 B11R0.4 CCCCOCOC(=O)OCC f9445a123e97e58df2bd304b13c696ca [0,1,1,0,0,0|2,0,0]=4 1888 B11R0.4 CCCCOCOC(=O)SCC 9fbe2d42309e989a4135a7d0aa7273eb [0,1,1,0,0,0|2,0,0]=4 1889 B11R0.4 CCCNCCCC(=O)OCC f6461f8e22f3d933186943d4b183108e [0,1,1,0,0,0|2,0,0]=4 1890 B11R0.4 CCCOC/C=C/C(=O)OCC eb2db8ead3cadf07a1fb09848b46fde0 [0,1,1,0,0,0|1,0,1]=4 1891 B11R0.4 CCCOCC#CC(=O)OCC 9f2ce8ce08fcd592a9f55aedb9f23f85 [0,1,1,0,0,0|1,0,1]=4 1892 B11R0.4 CCCOCC=CC(=O)OCC db7b1613a79a54a86c235feccadf2aff [0,1,1,0,0,0|1,0,1]=4 1893 B11R0.4 CCCOCCCC(=O)OCC 44f3c08715c24b28a3685ca7f9c36e30 [0,1,1,0,0,0|1,0,0]=3 1894 B11R0.4 CCCOCCNC(=O)CC#N 90f94545c2fd5f5f89c0686df57d1c9f [0,1,1,0,0,0|1,0,1]=4 1895 B11R0.4 CCCOCCNC(=O)CC=O 1794d59db3e03926cabc8d046b49f050 [0,1,1,0,0,0|1,0,1]=4 1896 B11R0.4 CCCOCCNC(=O)CCC 95c055b4347bfd7bfa9c570d9719ea75 [0,1,1,0,0,0|1,0,0]=3 1897 B11R0.4 CCCOCCNC(=O)CCF 784976a9f6c554bfef5890d22be8c3ae [0,1,1,0,0,0|1,0,0]=3 1898 B11R0.4 CCCOCCNC(=O)CCO 6d308239c94ac8e860e2d79889c8facb [0,1,1,0,0,0|1,0,0]=3 1899 B11R0.4 CCCOCCNC(=O)CCS 0b663011faafdf6c4131448ce79c937a [0,1,1,0,0,0|1,0,0]=3 1900 B11R0.4 CCCOCCNC(=O)COC 6067c71ef34c0399492ad8122c06202c [0,1,1,0,0,0|1,0,0]=3 1901 B11R0.4 CCCOCCNC(=O)CON a7918d286952c9dd1f121c3571c9c3dc [0,1,1,0,0,0|2,0,0]=4 1902 B11R0.4 CCCOCCNC(=O)CSC 6996763b3846009de64b111c96742018 [0,1,1,0,0,0|1,0,0]=3 1903 B11R0.4 CCCOCCOC(=O)CCC 94efe85d85fae3af0976a73792f0222f [0,1,1,0,0,0|0,0,0]=2 1904 B11R0.4 CCCOCCOC(=S)CCC 95a4dad7fc3b1d357922e071080ce62e [0,1,1,0,0,0|0,1,0]=3 1905 B11R0.4 CCCOCCOC(C)CCC 0718f8788045b926ec65216173e53bce [0,1,1,0,0,0|1,0,1]=4 1906 B11R0.4 CCCOCCOC(C)COC cec5c66a369cad4235e8aa9e9b8a796d [0,1,1,0,0,0|1,0,1]=4 1907 B11R0.4 CCCOCCOC(C)CSC 70a657ea0fecb74167fdc2758b57d321 [0,1,1,0,0,0|1,0,1]=4 1908 B11R0.4 CCCOCCO[C@@H](C)CCC 42bbc03cca2630aa13580adad71d1be6 [0,1,1,0,0,0|1,0,1]=4 1909 B11R0.4 CCCOCCO[C@@H](C)COC a6157ed930c35332a3027c7c7d259ba7 [0,1,1,0,0,0|1,0,1]=4 1910 B11R0.4 CCCOCCO[C@H](C)CCC 28ee10e8884a7bb06ea5329ce5b20582 [0,1,1,0,0,0|1,0,1]=4 1911 B11R0.4 CCCOCCO[C@H](C)COC 47c57d860028f2344e3996a8f123f214 [0,1,1,0,0,0|1,0,1]=4 1912 B11R0.4 CCNC(=O)CCNCCCO 1907e010da6f85eee7e5206941d1acbc [0,1,1,0,0,0|2,0,0]=4 1913 B11R0.4 CCNC(=O)CNCCCCO 311d18be60be25a5eec54d328336a9aa [0,1,1,0,0,0|2,0,0]=4 1914 B11R0.4 CCOC(=O)CCCNCCO 6cab9fdd8c1a3159e64bec0608483f43 [0,1,1,0,0,0|2,0,0]=4 1915 B11R0.4 CCOC(=O)CCCOCCF 909acc390bbb1ceea04a19919f52152b [0,1,1,0,0,0|2,0,0]=4 1916 B11R0.4 CCOC(=O)CCCOCCS 78b20295e211bf8850dff862a4729f37 [0,1,1,0,0,0|2,0,0]=4 1917 B11R0.4 CCOC(=O)CCCOCOC 5bf104d8710e6b32f35db6c9e133e980 [0,1,1,0,0,0|2,0,0]=4 1918 B11R0.4 CCOC(=O)CCCOCSC a236b3de67b8591907dc1349d6aacabc [0,1,1,0,0,0|2,0,0]=4 1919 B11R0.4 CCOC(=O)CCNCCCO 51aaffebe3df7434f9d32c43a0c6dace [0,1,1,0,0,0|2,0,0]=4 1920 B11R0.4 CCOC(=O)CNCCCCO 5567fb2e0fc75fd72e36e84016c9b7ee [0,1,1,0,0,0|2,0,0]=4 1921 B11R0.4 CCOC(=O)OCNCCCCl 99fe24b384b58a410e6bfa30610beaa5 [0,1,1,0,0,0|2,0,0]=4 1922 B11R0.4 CCOC(=O)OCNCCCO 330dbb4caf05da61276fa56cf672bb8b [0,1,1,0,0,0|1,0,0]=3 1923 B11R0.4 CCOC(=O)OCOCCCF fc56c56d10bb392ab3a26c4a4efed42f [0,1,1,0,0,0|2,0,0]=4 1924 B11R0.4 CCOC(=O)OCOCCCS 0cd9d99fb7c1a1ce68b9ca8aa9a51cb1 [0,1,1,0,0,0|1,1,0]=4 1925 B11R0.4 CCSC(=O)OCNCCCCl 535f129593e99d1a27f812d2c7ee6a65 [0,1,1,0,0,0|2,0,0]=4 1926 B11R0.4 CCSC(=O)OCNCCCO 9d741fb4834d423e6169079ba7ef1cd6 [0,1,1,0,0,0|1,0,0]=3 1927 B11R0.4 CCSC(=O)OCOCCCF 3140bc2f2c56e9d1c1d617e4e45d6e83 [0,1,1,0,0,0|2,0,0]=4 1928 B11R0.4 CCSC(=O)OCOCCCS e5c9a822fe890620e9494b6f368c605a [0,1,1,0,0,0|1,1,0]=4 1929 B11R0.4 COCC(=O)NCCCCCCl aa42ab5e3ec51e9d22abf292fda9d7f1 [0,1,1,0,0,0|2,0,0]=4 1930 B11R0.4 COCC(=O)NCCCCCO 1fa76c874db0b7688d7ddf0c18481da7 [0,1,1,0,0,0|1,0,0]=3 1931 B11R0.4 COCC(=O)NCCOCCO ec901c359a18893923bed9542042abcc [0,1,1,0,0,0|2,0,0]=4 1932 B11R0.4 COCC(=O)NCCOCCS 499d65c1411b4b71c3842ba403959a06 [0,1,1,0,0,0|2,0,0]=4 1933 B11R0.4 COCC(=O)NCCSCCO 630bdba9dfa544004ddcf8c7d9a02dd0 [0,1,1,0,0,0|2,0,0]=4 1934 B11R0.4 CSCC(=O)NCCCCCCl 153370af97ea55da31f34111d9910241 [0,1,1,0,0,0|2,0,0]=4 1935 B11R0.4 CSCC(=O)NCCCCCO 584ef44ada0c9d4aac91f1399dffe5da [0,1,1,0,0,0|1,0,0]=3 1936 B11R0.4 CSCC(=O)NCCOCCO 01a93ba8cb55f786ab34bf434f14ea02 [0,1,1,0,0,0|2,0,0]=4 1937 B11R0.4 CSCC(=O)NCCOCCS d95cdeef56438878cef69e7c32bbca9d [0,1,1,0,0,0|2,0,0]=4 1938 B11R0.4 CSCC(=O)NCCSCCO 183a78443aa4ed28b16102303d5d0c59 [0,1,1,0,0,0|2,0,0]=4 1939 B11R0.4 N#CCC(=O)NCCCCCO 34f23097a2345e6f8e9a934506e28458 [0,1,1,0,0,0|1,0,1]=4 1940 B11R0.4 NOCC(=O)NCCCCCO 9a2ec76919528a1ba5eade29d6db9ef1 [0,1,1,0,0,0|2,0,0]=4 1941 B11R0.4 O=C(CCF)NCCCCCCl d995f4d5f51bafa5b1ecfd4430e209d9 [0,1,1,0,0,0|2,0,0]=4 1942 B11R0.4 O=C(CCF)NCCCCCO e449485f2ca23e4c1d3e7def1a274e73 [0,1,1,0,0,0|1,0,0]=3 1943 B11R0.4 O=C(CCF)NCCOCCO 464096bc46e82136215796ff85dcca0a [0,1,1,0,0,0|2,0,0]=4 1944 B11R0.4 O=C(CCF)NCCOCCS a1d651c5c7210c4f7f26fc42f255f686 [0,1,1,0,0,0|2,0,0]=4 1945 B11R0.4 O=C(CCF)NCCSCCO 8d76da1cb55f4ef52fd1753d28f66524 [0,1,1,0,0,0|2,0,0]=4 1946 B11R0.4 O=C(CCO)NCCCCCCl 5cefc3da5dae80b8a6093512df3bf750 [0,1,1,0,0,0|2,0,0]=4 1947 B11R0.4 O=C(CCO)NCCCCCO 32b75911b963a5b740609c2714e64ebe [0,1,1,0,0,0|1,0,0]=3 1948 B11R0.4 O=C(CCO)NCCOCCO e434b1654562fb7bcdc17490c4383c5e [0,1,1,0,0,0|2,0,0]=4 1949 B11R0.4 O=C(CCO)NCCOCCS 9d3865008726eec88d9ccbce5c564fd7 [0,1,1,0,0,0|2,0,0]=4 1950 B11R0.4 O=C(CCO)NCCSCCO 126ae5295eca2c199be4f2e2426a48a0 [0,1,1,0,0,0|2,0,0]=4 1951 B11R0.4 O=C(CCS)NCCCCCCl a8be7c114ab26d5fca0f87b64cd024dd [0,1,1,0,0,0|2,0,0]=4 1952 B11R0.4 O=C(CCS)NCCCCCO 6656c75fa5d58dd15c7bf0d6670be4e4 [0,1,1,0,0,0|1,0,0]=3 1953 B11R0.4 O=C(CCS)NCCOCCO 03cac5faf52317a602bba4f9a0e2480e [0,1,1,0,0,0|2,0,0]=4 1954 B11R0.4 O=C(CCS)NCCOCCS 19a2f4e5ccbdfd6a0fcfc86dbdf44551 [0,1,1,0,0,0|2,0,0]=4 1955 B11R0.4 O=C(CCS)NCCSCCO f3c79169baaf09ba31a26b6eb332b251 [0,1,1,0,0,0|2,0,0]=4 1956 B11R0.4 O=CCC(=O)NCCCCCO ea9b46916e4def28d71644379ff5d685 [0,1,1,0,0,0|1,0,1]=4 1957 B11R0.40 C#CCCCCCNC(=O)CC 449808cf27b16643fb1a620ed3fbd125 [0,1,1,0,0,0|2,0,0]=4 1958 B11R0.40 C#CCCCCOCC(=O)CC 8d57b8360839278d2bab65faa292c4a6 [0,1,1,0,0,0|1,0,1]=4 1959 B11R0.40 C#CCCCNCOC(=O)CC c2af761bf07d9d888da4ab52d1800a3c [0,1,1,0,0,0|1,0,1]=4 1960 B11R0.40 C#CCCCOCOC(=O)CC 3077055c6fa4297cc82b8c96acb0c8cb [0,1,1,0,0,0|1,0,1]=4 1961 B11R0.40 C#CCCOCCNC(=O)CC e06e09fb619c9db4da48a6b4f890a1a1 [0,1,1,0,0,0|1,0,1]=4 1962 B11R0.40 C#CCCOCCOC(=O)CC 92d93f5726297337cf908a5cf1a498e5 [0,1,1,0,0,0|0,0,1]=3 1963 B11R0.40 C#CCCOCCOC(=O)OC 8d4f66917a5d23d32e7a9c8a68520273 [0,1,1,0,0,0|1,0,1]=4 1964 B11R0.40 C#CCOCCOCC(=O)CC 60559d6ea0f38375daa8bbb0d71640a8 [0,1,1,0,0,0|0,0,2]=4 1965 B11R0.40 C/C=C/COCCNC(=O)CC 695105d37345a5f25605e63716db52d1 [0,1,1,0,0,0|1,0,1]=4 1966 B11R0.40 C/C=C/COCCOC(=O)CC 693dff3e3c0f1a5c67200f91481060b7 [0,1,1,0,0,0|0,0,1]=3 1967 B11R0.40 C/C=C/COCCOC(=O)OC bf5d881ba3458cd7f9b620f685466ab8 [0,1,1,0,0,0|1,0,1]=4 1968 B11R0.40 C/C=C\COCCNC(=O)CC bee95a5be504e757a61700b966b08afa [0,1,1,0,0,0|1,0,1]=4 1969 B11R0.40 C/C=C\COCCOC(=O)CC 71a3984a427621a9baf9cafe648966d0 [0,1,1,0,0,0|0,0,1]=3 1970 B11R0.40 C/C=C\COCCOC(=O)OC 88d7ae1532f97d27f7063a48e0dc4cbd [0,1,1,0,0,0|1,0,1]=4 1971 B11R0.40 C=C(CC)CNCCCCCO 815b582a1ea24efe6d5a9c772fe2a8f4 [0,1,1,0,0,0|2,0,0]=4 1972 B11R0.40 C=C(CC)CNCCOCCC 8c5995205687decdd9c6b44c44bec432 [0,1,1,0,0,0|2,0,0]=4 1973 B11R0.40 C=C(CC)COCCCCCC 212d40314ce0351be00200277ccfea95 [0,1,1,0,0,0|2,0,0]=4 1974 B11R0.40 C=C(CC)COCCOCCC 9f1dc0066bb832519e15e6cdedd618ca [0,1,1,0,0,0|1,0,0]=3 1975 B11R0.40 C=C(CC)COCCOCCF 2a181a2aec74cc96d1dc713c0e88940a [0,1,1,0,0,0|2,0,0]=4 1976 B11R0.40 C=C(CC)COCCOCCS ad069970e9705a622dd52c99d20ae373 [0,1,1,0,0,0|2,0,0]=4 1977 B11R0.40 C=C(CC)COCCSCCC b878f859e07ea9e49f889f5f8c8b8cdc [0,1,1,0,0,0|1,1,0]=4 1978 B11R0.40 C=C(COCCOCCC)OC e9e22309f5066dadc128b2745a271c60 [0,1,1,0,0,0|2,0,0]=4 1979 B11R0.40 C=CC(=O)OCCNCCCO dd3403c8ee077572d8f69633e6412407 [0,1,1,0,0,0|0,0,2]=4 1980 B11R0.40 C=CC(=O)OCCOCCCC caa08cd7b5d55cba49fcdf2c0960b55d [0,1,1,0,0,0|0,0,2]=4 1981 B11R0.40 C=CC(=O)OCCOCCCF f42a94e4f2a865c37527325b1798e592 [0,1,1,0,0,0|0,0,2]=4 1982 B11R0.40 C=CC(=O)OCCOCCCS 941f6961f75e9f93568193363ceadd24 [0,1,1,0,0,0|0,0,2]=4 1983 B11R0.40 C=CC(=O)OCCOCCOC c72b47398c468339ba12d2769291607a [0,1,1,0,0,0|0,0,2]=4 1984 B11R0.40 C=CC(=O)OCCOCCSC caa883601f0b531519d6ac2967fad8cd [0,1,1,0,0,0|0,0,2]=4 1985 B11R0.40 C=CC(=O)OCCOCOCC 2ef12538b3725f827b39e6bda2d3b7c1 [0,1,1,0,0,0|0,0,2]=4 1986 B11R0.40 C=CCCCCCNC(=O)CC 26c14c6db596a82a3f1a5ba949ac12f2 [0,1,1,0,0,0|2,0,0]=4 1987 B11R0.40 C=CCCCCOCC(=O)CC 23552c039cd37fdf08ab0585dd01cccb [0,1,1,0,0,0|1,0,1]=4 1988 B11R0.40 C=CCCCNCOC(=O)CC 174c404b1c60985f43c628144af8311c [0,1,1,0,0,0|1,0,1]=4 1989 B11R0.40 C=CCCCOCOC(=O)CC 556a6f38b95cc3d8222612ee9026e92f [0,1,1,0,0,0|1,0,1]=4 1990 B11R0.40 C=CCCOCCNC(=O)CC 711adee8c5f35e56329c11365b4d5af9 [0,1,1,0,0,0|1,0,1]=4 1991 B11R0.40 C=CCCOCCOC(=O)CC bdc1e5d4e527e0ec1b84ef4c9d6a3729 [0,1,1,0,0,0|0,0,1]=3 1992 B11R0.40 C=CCCOCCOC(=O)OC 9f4ad0a1ed4320c39dc956830989f093 [0,1,1,0,0,0|1,0,1]=4 1993 B11R0.40 C=CCOCCOCC(=O)CC d7a5b2c0a0a27cc023943c4b24851a6b [0,1,1,0,0,0|0,0,2]=4 1994 B11R0.40 CC/C=C/CCOCC(=O)CC 5dd2e8d1d699073d1052090261a24f09 [0,1,1,0,0,0|1,0,1]=4 1995 B11R0.40 CC/C=C/COCOC(=O)CC e1a7cc8411ef692a8fb06c7a3bb97575 [0,1,1,0,0,0|1,0,1]=4 1996 B11R0.40 CC/C=C\CCOCC(=O)CC 8b7645a2c7d49be789738e918c3d3344 [0,1,1,0,0,0|1,0,1]=4 1997 B11R0.40 CC/C=C\COCOC(=O)CC 3ccb612101f4acc0c599cde04fa05432 [0,1,1,0,0,0|1,0,1]=4 1998 B11R0.40 CCC#CCCOCC(=O)CC 2033846b851cc5e783cfd1039f29f002 [0,1,1,0,0,0|1,0,1]=4 1999 B11R0.40 CCC#CCOCOC(=O)CC 3fff30d35b2504c8c40b52fe4886aae6 [0,1,1,0,0,0|1,0,1]=4 2000 B11R0.40 CCC(=O)CCCCNCCBr 5c9de39dbbb4f1622cb326ee2015afd4 [0,1,1,0,0,0|2,0,0]=4 2001 B11R0.40 CCC(=O)CCCCNCCF 1538830991ecbdde18b3f8a838eefc29 [0,1,1,0,0,0|2,0,0]=4 2002 B11R0.40 CCC(=O)CCCCNCCI 331d09a8ea3b8560fec2bf0c9ad0f12d [0,1,1,0,0,0|2,0,0]=4 2003 B11R0.40 CCC(=O)CCCCNCCO 4d78d7a77bab056eb08607fc74a12822 [0,1,1,0,0,0|1,0,0]=3 2004 B11R0.40 CCC(=O)CCCCNCCS a282f7b8b2c585a15b8c264e494832ce [0,1,1,0,0,0|1,1,0]=4 2005 B11R0.40 CCC(=O)CCCCOCCF a108d0d1fdedcb8697b81d2fe0293fb2 [0,1,1,0,0,0|2,0,0]=4 2006 B11R0.40 CCC(=O)CCCCOCCS e3ae9bf83285fded75c6a70492a2fac2 [0,1,1,0,0,0|1,1,0]=4 2007 B11R0.40 CCC(=O)CCCCOCOC 3aa42905db5ec08d21fdd342e9bc3739 [0,1,1,0,0,0|2,0,0]=4 2008 B11R0.40 CCC(=O)CNCCCCCCl 169847daaa232a59c508e79ce465d1e5 [0,1,1,0,0,0|2,0,0]=4 2009 B11R0.40 CCC(=O)CNCCCCCO 91c7de1de227e0265fc520775d22d8c8 [0,1,1,0,0,0|1,0,0]=3 2010 B11R0.40 CCC(=O)CNCCCCOC d5b6790bb3d7512c23a539ebe949f5a7 [0,1,1,0,0,0|2,0,0]=4 2011 B11R0.40 CCC(=O)CNCCOCCO b84e37e3cbeaf008ad23d3e20c820351 [0,1,1,0,0,0|2,0,0]=4 2012 B11R0.40 CCC(=O)CNCCOCCS 7f7b17dd03dd9c9db535ab68ec645c6e [0,1,1,0,0,0|2,0,0]=4 2013 B11R0.40 CCC(=O)CNCCSCCO 182303c19caeb0480b2108c06138082a [0,1,1,0,0,0|2,0,0]=4 2014 B11R0.40 CCC(=O)COCCCCC#N 96dd12dcfbfb8ce5eeab8de2efa6064a [0,1,1,0,0,0|1,0,1]=4 2015 B11R0.40 CCC(=O)COCCCCC=O d174ca8045989a651d141835d8302276 [0,1,1,0,0,0|0,0,2]=4 2016 B11R0.40 CCC(=O)COCCCCCF 4d534a6cf979caa0f2da56f2652dc1d0 [0,1,1,0,0,0|1,0,0]=3 2017 B11R0.40 CCC(=O)COCCCCOC 4661f8c22c4d0285a2d318daa5b937e6 [0,1,1,0,0,0|2,0,0]=4 2018 B11R0.40 CCC(=O)COCCCCSC 973dc3a8bf4d40d91f3f7ce58aa6fa50 [0,1,1,0,0,0|2,0,0]=4 2019 B11R0.40 CCC(=O)COCCOCC#N 27375ee892323333009e4b28d3bb1628 [0,1,1,0,0,0|1,0,1]=4 2020 B11R0.40 CCC(=O)COCCOCC=O 778bf2cb08dc292d14f3034c21d38b05 [0,1,1,0,0,0|1,0,1]=4 2021 B11R0.40 CCC(=O)COCCOCCF bcee19a6a5f7cba3ac3fb75f4b06d4b6 [0,1,1,0,0,0|1,0,0]=3 2022 B11R0.40 CCC(=O)COCCOCCS f2075402719ebcb33bfca392fe4f983c [0,1,1,0,0,0|1,0,0]=3 2023 B11R0.40 CCC(=O)COCCOCOC f6dd702fb7ca8442f692b028a84fe9e3 [0,1,1,0,0,0|1,0,0]=3 2024 B11R0.40 CCC(=O)COCOCCOC 7d3ffbf96952313966899c8e44aaa320 [0,1,1,0,0,0|2,0,0]=4 2025 B11R0.40 CCC(=O)NCCCCCC#N eea036afc69a0defe4fee8f7e13d4bac [0,1,1,0,0,0|2,0,0]=4 2026 B11R0.40 CCC(=O)NCCCCCCCl c12f1575728cff95c45926a5cd979a80 [0,1,1,0,0,0|2,0,0]=4 2027 B11R0.40 CCC(=O)NCCCCCCO e5b240676bd8c501c6689b9f6771a132 [0,1,1,0,0,0|1,0,0]=3 2028 B11R0.40 CCC(=O)NCCCCCOC 179b4dfc9da292e65446bd9e0bb45f8b [0,1,1,0,0,0|1,0,0]=3 2029 B11R0.40 CCC(=O)NCCCOCCO a7f35d5704fe0da1324768d13dad71b6 [0,1,1,0,0,0|1,0,0]=3 2030 B11R0.40 CCC(=O)NCCNCCCF a537c2892d0287f98dac7fc3f602da9b [0,1,1,0,0,0|2,0,0]=4 2031 B11R0.40 CCC(=O)NCCNCCCO 868b3740d73f909c52f81b11dca71773 [0,1,1,0,0,0|1,0,0]=3 2032 B11R0.40 CCC(=O)NCCNCCCS dfb62a14a0ceb3523f25244fd4c80401 [0,1,1,0,0,0|1,1,0]=4 2033 B11R0.40 CCC(=O)NCCNCCOC c245c71a8b604422a7045c4ee9c13dc7 [0,1,1,0,0,0|2,0,0]=4 2034 B11R0.40 CCC(=O)NCCNCCSC 99e549783d62ab23d53aa9f9c5e4997f [0,1,1,0,0,0|2,0,0]=4 2035 B11R0.40 CCC(=O)NCCOCCC#N a47d22ff2500456f803e48d9ff8209b1 [0,1,1,0,0,0|1,0,1]=4 2036 B11R0.40 CCC(=O)NCCOCCC=O e40b54ecafd604732d3834f930056c99 [0,1,1,0,0,0|1,0,1]=4 2037 B11R0.40 CCC(=O)NCCOCCCF f29a3e0d47ecb3cee85424198b78cbd8 [0,1,1,0,0,0|1,0,0]=3 2038 B11R0.40 CCC(=O)NCCOCCCO 90516e70b01a032c68f6e42e015df8be [0,1,1,0,0,0|1,0,0]=3 2039 B11R0.40 CCC(=O)NCCOCCCS 3e2bc2ac898c20225c8cef321bad5498 [0,1,1,0,0,0|1,0,0]=3 2040 B11R0.40 CCC(=O)NCCOCCOC 50b2bfa3c5d337e371918ef2f05d28ad [0,1,1,0,0,0|1,0,0]=3 2041 B11R0.40 CCC(=O)NCCOCCON 108dec11fcaec9fbf9ce20ebc370e2d1 [0,1,1,0,0,0|2,0,0]=4 2042 B11R0.40 CCC(=O)NCCOCCSC 25b4de23267199d94168f2e243a41471 [0,1,1,0,0,0|1,0,0]=3 2043 B11R0.40 CCC(=O)NCCSSCCO 4be4fd7af99183a0601a91079621a683 [0,1,1,0,0,0|2,0,0]=4 2044 B11R0.40 CCC(=O)OCCOC/C=C/Cl fb4a2a0e5581a6c7e973a73efbf3b555 [0,1,1,0,0,0|0,0,2]=4 2045 B11R0.40 CCC(=O)OCCOC/C=C\Cl d3cd7bc315497f93a945d980823ef7df [0,1,1,0,0,0|0,0,2]=4 2046 B11R0.40 CCC(=O)OCCOCCC#N 84e3645a7d52884731c835edd5609d98 [0,1,1,0,0,0|0,0,1]=3 2047 B11R0.40 CCC(=O)OCCOCCC=O 9def7cd3bfd4ef261d6ba454e44e61ce [0,1,1,0,0,0|0,0,1]=3 2048 B11R0.40 CCC(=O)OCCOCCCF fd99852891544bbecd7f01f790bb3807 [0,1,1,0,0,0|0,0,0]=2 2049 B11R0.40 CCC(=O)OCCOCCCS 49d51fd3c9ff165a7be6bb0d6a01c1b8 [0,1,1,0,0,0|0,0,0]=2 2050 B11R0.40 CCC(=O)OCCOCCOC 10cd358447e04560f35ee77c32dda02e [0,1,1,0,0,0|0,0,0]=2 2051 B11R0.40 CCC(=O)OCCOCCSC ee19bf4570dabcc2010b5e608c212eac [0,1,1,0,0,0|0,0,0]=2 2052 B11R0.40 CCC(=O)OCCOCSC#N 501f5ad26c507053051b5d5c7804a987 [0,1,1,0,0,0|1,0,1]=4 2053 B11R0.40 CCC(=O)OCNCC#CCO acdd8e910eb64a2a1f1328f84bc98a84 [0,1,1,0,0,0|0,0,2]=4 2054 B11R0.40 CCC(=O)OCNCCCC#N 0fa82748f90b3286e6c3e6f1e68031fa [0,1,1,0,0,0|1,0,1]=4 2055 B11R0.40 CCC(=O)OCNCCCCCl fd419a031f81d4e47d265352059f46f7 [0,1,1,0,0,0|1,0,0]=3 2056 B11R0.40 CCC(=O)OCNCCCCO 300e493bbfef3682e31e8cdf3d8e52a4 [0,1,1,0,0,0|0,0,0]=2 2057 B11R0.40 CCC(=O)OCNCCCCS 4cf14a63075835f23282b6c25cdbae25 [0,1,1,0,0,0|0,1,0]=3 2058 B11R0.40 CCC(=O)OCNCCCOC 10d46cb1a4bb5bcd6613b867a649546b [0,1,1,0,0,0|1,0,0]=3 2059 B11R0.40 CCC(=O)OCNCCCSC 83860f88d7963bb33ce3d377db093161 [0,1,1,0,0,0|1,1,0]=4 2060 B11R0.40 CCC(=O)OCOCCCC#N 24eb537e112d03b1c64be3e9db43ef1e [0,1,1,0,0,0|1,0,1]=4 2061 B11R0.40 CCC(=O)OCOCCCC=O ce9043e3ace24d71d72f838120f1a02a [0,1,1,0,0,0|0,0,2]=4 2062 B11R0.40 CCC(=O)OCOCCCCF 2da5f348849cf441720d8745c29938bb [0,1,1,0,0,0|1,0,0]=3 2063 B11R0.40 CCC(=O)OCOCCCCS 5f92db6ce995048498683cec8397e506 [0,1,1,0,0,0|0,1,0]=3 2064 B11R0.40 CCC(=O)OCOCCCOC 1bc3a2de1ea9ba30e8e276b0a82ebcff [0,1,1,0,0,0|1,0,0]=3 2065 B11R0.40 CCC(=O)OCOCCCSC e4c29711e69d1c851009c68d74b91722 [0,1,1,0,0,0|1,1,0]=4 2066 B11R0.40 CCC(C)OCCCCCOC d3c41196d7b06f94ec35caa1098e8de8 [0,1,1,0,0,0|1,0,1]=4 2067 B11R0.40 CCC(C)OCCOCCOC 745cebd4f891d44bdf8b3ac02dbc5486 [0,1,1,0,0,0|1,0,1]=4 2068 B11R0.40 CCC/C=C/COCC(=O)CC b700ba62ba6c38d302c79149d95acbbe [0,1,1,0,0,0|1,0,1]=4 2069 B11R0.40 CCC/C=C\COCC(=O)CC cceeecf8b274f561ec9658dba7c792f4 [0,1,1,0,0,0|1,0,1]=4 2070 B11R0.40 CCCC#CCOCC(=O)CC 2f3cf0bcb7e2d71b159703c99fc28167 [0,1,1,0,0,0|1,0,1]=4 2071 B11R0.40 CCCCCCCNC(=O)CC 686f1ce47fd62528159d592ae6144fd0 [0,1,1,0,0,0|2,0,0]=4 2072 B11R0.40 CCCCCCNCC(=O)CC c8e5732d0f65da9c5c5b2a092b9f01ac [0,1,1,0,0,0|2,0,0]=4 2073 B11R0.40 CCCCCCOCC(=O)CC adcf10a6b79c1dbe703e4ef32ea4d479 [0,1,1,0,0,0|1,0,0]=3 2074 B11R0.40 CCCCCCOCC(=O)NC 36fff55613dedf0508c95b9965e07157 [0,1,1,0,0,0|2,0,0]=4 2075 B11R0.40 CCCCCCOCC(=O)OC 09bff5c54ea2c2317e4ffa1248f416e4 [0,1,1,0,0,0|2,0,0]=4 2076 B11R0.40 CCCCCNCOC(=O)CC 738d6b861ce276b5e51842c47cb9a606 [0,1,1,0,0,0|1,0,0]=3 2077 B11R0.40 CCCCCNCOC(=O)OC 1a984734eabc63cd259d87fe0f6d0e3a [0,1,1,0,0,0|2,0,0]=4 2078 B11R0.40 CCCCCOCOC(=O)CC 1566d44e71376e77797064cfeb4bdbd4 [0,1,1,0,0,0|1,0,0]=3 2079 B11R0.40 CCCCCOCOC(=O)OC 8437c1266fb81e44453bd4eda59a8fa6 [0,1,1,0,0,0|2,0,0]=4 2080 B11R0.40 CCCCNCCNC(=O)CC eafd4f313dd1c9da61b2b14982bece7b [0,1,1,0,0,0|2,0,0]=4 2081 B11R0.40 CCCCOCCCC(=O)NC c2d274710c85b38a446478cdb547f403 [0,1,1,0,0,0|2,0,0]=4 2082 B11R0.40 CCCCOCCCC(=O)OC 2c00c25d55f4aed289459825ca6caf67 [0,1,1,0,0,0|2,0,0]=4 2083 B11R0.40 CCCCOCCNC(=O)CC e75a887cb4393e27da632a529a3d90a7 [0,1,1,0,0,0|1,0,0]=3 2084 B11R0.40 CCCCOCCNC(=O)CF bb586d0c0eed4b850113097bb31ae11b [0,1,1,0,0,0|2,0,0]=4 2085 B11R0.40 CCCCOCCNC(=O)CO 46d63bbe6e95cb3021fbf39dbedf64e4 [0,1,1,0,0,0|2,0,0]=4 2086 B11R0.40 CCCCOCCNC(=O)CS 38f4e9916264f14dafa72c5b17761622 [0,1,1,0,0,0|2,0,0]=4 2087 B11R0.40 CCCCOCCOC(=O)CC 6522276dd406ffc521118952ffb4c4ea [0,1,1,0,0,0|0,0,0]=2 2088 B11R0.40 CCCCOCCOC(=O)OC b231bf275b01e991c727c5357c04f648 [0,1,1,0,0,0|1,0,0]=3 2089 B11R0.40 CCCCOCCOC(C)CC 9237fbaad0e6eb5b12988b27db98ec5d [0,1,1,0,0,0|1,0,1]=4 2090 B11R0.40 CCCCOCCO[C@@H](C)CC ac5e59820a6738b0baf48e009e2aad88 [0,1,1,0,0,0|1,0,1]=4 2091 B11R0.40 CCCCOCCO[C@H](C)CC 6083ee7fb818d25b55dc69dba9f01eb6 [0,1,1,0,0,0|1,0,1]=4 2092 B11R0.40 CCCCOCOCC(=O)CC 89e908693e91dd0d0e69177990ed0083 [0,1,1,0,0,0|2,0,0]=4 2093 B11R0.40 CCCNCCCCC(=O)CC a0ca041e30af7810958502bfc4beeb26 [0,1,1,0,0,0|2,0,0]=4 2094 B11R0.40 CCCNCCOCC(=O)OC 7d542560aee618cccb8ce15c1eff67f0 [0,1,1,0,0,0|2,0,0]=4 2095 B11R0.40 CCCOCCCCC(=O)CC 177be31e74ea458cdea2086674fce0ec [0,1,1,0,0,0|1,0,0]=3 2096 B11R0.40 CCCOCCCCC(=O)OC c38c96dc4e6815105987ed08074c5cd5 [0,1,1,0,0,0|2,0,0]=4 2097 B11R0.40 CCCOCCCNC(=O)CC fec3893936a6956cbc39d82258f1e626 [0,1,1,0,0,0|1,0,0]=3 2098 B11R0.40 CCCOCCCNC(=O)CF fc2af4890836849f256d8addfbd4945e [0,1,1,0,0,0|2,0,0]=4 2099 B11R0.40 CCCOCCCNC(=O)CO a47934e78a1d20ef948dc30f597ef7f9 [0,1,1,0,0,0|2,0,0]=4 2100 B11R0.40 CCCOCCCNC(=O)CS bd8dcd4cb86e719aa06d2c9d0f72a033 [0,1,1,0,0,0|2,0,0]=4 2101 B11R0.40 CCCOCCCOC(C)CC 65dadc350a089cb55b32eca1a8ca8def [0,1,1,0,0,0|1,0,1]=4 2102 B11R0.40 CCCOCCCO[C@@H](C)CC 1520e6898f1e09a243debe9a16ce82b6 [0,1,1,0,0,0|1,0,1]=4 2103 B11R0.40 CCCOCCCO[C@H](C)CC 81eba50f21619d4a0f525d5776243815 [0,1,1,0,0,0|1,0,1]=4 2104 B11R0.40 CCCOCCNCC(=O)CC af6d8ece5f96f6d5993dca91750c6331 [0,1,1,0,0,0|1,0,0]=3 2105 B11R0.40 CCCOCCNCC(=O)CO 47b079dfc4b06824587236598da16550 [0,1,1,0,0,0|2,0,0]=4 2106 B11R0.40 CCCOCCNCC(=O)NC 31d2582b75dee5c561ae8d9d18b5f73a [0,1,1,0,0,0|2,0,0]=4 2107 B11R0.40 CCCOCCNCC(=O)OC dc4681ef40747337e3903e762819be10 [0,1,1,0,0,0|2,0,0]=4 2108 B11R0.40 CCCOCCOCC(=O)CC 723ec6dd1a32570a19662d1e12346296 [0,1,1,0,0,0|0,0,0]=2 2109 B11R0.40 CCCOCCOCC(=O)NC faa395813f7f435b9e71ac3a336b018c [0,1,1,0,0,0|1,0,0]=3 2110 B11R0.40 CCCOCCOCC(=O)OC 64aebb87f3244a9d7b7f06c29592a387 [0,1,1,0,0,0|1,0,0]=3 2111 B11R0.40 CCCOCCOCC(C)CC 23905675ad629848afe996f6fa1e1c10 [0,1,1,0,0,0|1,0,1]=4 2112 B11R0.40 CCCOCCOC[C@@H](C)CC 39e30c9a0cf88fea98437a4adfd5cf63 [0,1,1,0,0,0|1,0,1]=4 2113 B11R0.40 CCCOCCOC[C@H](C)CC b7e63a66c91877105cd7467b3c5962af [0,1,1,0,0,0|1,0,1]=4 2114 B11R0.40 CCCSCCOCC(=O)CC d2067d23d0e94c02b501473ae1f752be [0,1,1,0,0,0|0,1,0]=3 2115 B11R0.40 CCCSCCOCC(=O)NC d89728054d6897369246b7981ce18df3 [0,1,1,0,0,0|1,1,0]=4 2116 B11R0.40 CCCSCCOCC(=O)OC bfd9150e07503b75f145ebf21333d513 [0,1,1,0,0,0|1,1,0]=4 2117 B11R0.40 CCOCCCOCC(=O)CC 9c1461ad3db61a1f493b386fb087b9cc [0,1,1,0,0,0|2,0,0]=4 2118 B11R0.40 CCOCCNCOC(=O)CC b9cda3479778ac26f76ee010a4b2aea6 [0,1,1,0,0,0|2,0,0]=4 2119 B11R0.40 CCOCCOCOC(=O)CC 14b11f2a6b785936e749c9107d004c86 [0,1,1,0,0,0|2,0,0]=4 2120 B11R0.40 CCOCNCCNC(=O)CC 92ef620ca64edb4512dde14248c77942 [0,1,1,0,0,0|2,0,0]=4 2121 B11R0.40 CCOCOCCCC(=O)NC 012982faa3a83b15cdc051351f5c0aca [0,1,1,0,0,0|2,0,0]=4 2122 B11R0.40 CCOCOCCNC(=O)CC fa84f7d85431dcb094a94f1a9c364114 [0,1,1,0,0,0|1,0,0]=3 2123 B11R0.40 CCOCOCCOC(=O)CC e36de657352983cd47255495a86710eb [0,1,1,0,0,0|0,0,0]=2 2124 B11R0.40 CCOCOCCOC(=O)OC f54b3c8afccb92210f71af931469dca3 [0,1,1,0,0,0|1,0,0]=3 2125 B11R0.40 CCS(=O)CCNCCCCO 587b83a495da00510370d6bc639df1d0 [0,1,1,0,0,0|2,0,0]=4 2126 B11R0.40 CCSCCCCNC(=O)CC ea0f6528589aacf58e162b969c059b14 [0,1,1,0,0,0|2,0,0]=4 2127 B11R0.40 CCSCCCOCC(=O)CC e95eea67d707e354332756055989bd1d [0,1,1,0,0,0|2,0,0]=4 2128 B11R0.40 CCSCCNCOC(=O)CC 779cf15527d11c34f7080beed0f4e784 [0,1,1,0,0,0|2,0,0]=4 2129 B11R0.40 CCSCCOCOC(=O)CC 90c649268e17812b1f38a63ed301bdb0 [0,1,1,0,0,0|2,0,0]=4 2130 B11R0.40 CC[C@@H](C)OCCCCCOC 5952ed8f891c20aa2ee0d3f1b0b418a5 [0,1,1,0,0,0|1,0,1]=4 2131 B11R0.40 CC[C@@H](C)OCCOCCOC 39d810aa828b5770d20c6f4a44b87798 [0,1,1,0,0,0|1,0,1]=4 2132 B11R0.40 CC[C@H](C)OCCCCCOC 9bff236a30712ca117b6c2482be3ef66 [0,1,1,0,0,0|1,0,1]=4 2133 B11R0.40 CC[C@H](C)OCCOCCOC b8f71b2a8a014113b92673f673b1990a [0,1,1,0,0,0|1,0,1]=4 2134 B11R0.40 CNC(=O)CCCNCCCO 379fba8165b6223b47704a60ed42b7bd [0,1,1,0,0,0|2,0,0]=4 2135 B11R0.40 CNC(=O)CCCOCCCF cc4d5aded868bb3b806e82b702664796 [0,1,1,0,0,0|2,0,0]=4 2136 B11R0.40 CNC(=O)CCCOCCCS 8c7fe610e81e73e93c9203c0dc25d782 [0,1,1,0,0,0|2,0,0]=4 2137 B11R0.40 CNC(=O)CCCOCCOC 679110e3bc325cfc067b9e066fb8fd05 [0,1,1,0,0,0|2,0,0]=4 2138 B11R0.40 CNC(=O)CCCOCCSC 57b0429c7fad297937b249ddbc6c5318 [0,1,1,0,0,0|2,0,0]=4 2139 B11R0.40 CNC(=O)CCNCCCCO 5832dd33e1f03dc5d18f2150910928a4 [0,1,1,0,0,0|2,0,0]=4 2140 B11R0.40 CNC(=O)CNCCCCCO 728cf07c565537ba2c1fca79a62d199b [0,1,1,0,0,0|2,0,0]=4 2141 B11R0.40 CNC(=O)COCCCCCF 30a06aacc12e6be93a441e8da3712845 [0,1,1,0,0,0|2,0,0]=4 2142 B11R0.40 CNC(=O)COCCOCCF e978906ffb68d7d3044fd71d3757e50a [0,1,1,0,0,0|2,0,0]=4 2143 B11R0.40 CNC(=O)COCCOCCS 5680cae754ed52496afb8d6066e6f451 [0,1,1,0,0,0|2,0,0]=4 2144 B11R0.40 CNC(=O)COCCOCOC ef2eeb5a2225a904ba243ffe0d22f4eb [0,1,1,0,0,0|2,0,0]=4 2145 B11R0.40 COC(=O)CCCCCNCO af7eaee93a3fef3c4544e48a16c6e56f [0,1,1,0,0,0|2,0,0]=4 2146 B11R0.40 COC(=O)CCCCNCCO e7f0e01865858a91030334a948df571f [0,1,1,0,0,0|2,0,0]=4 2147 B11R0.40 COC(=O)CCCNCCCO ae78a0866713110e761cbc6c0669803d [0,1,1,0,0,0|2,0,0]=4 2148 B11R0.40 COC(=O)CCCOCCCF ad4a657375774e174695b5c380767605 [0,1,1,0,0,0|2,0,0]=4 2149 B11R0.40 COC(=O)CCCOCCCS 614db15c725c13d73ce896e4a3526258 [0,1,1,0,0,0|2,0,0]=4 2150 B11R0.40 COC(=O)CCCOCCSC a532869a6a9d1335d72148f96ad99d09 [0,1,1,0,0,0|2,0,0]=4 2151 B11R0.40 COC(=O)CCNCCCCO 01547e1a5ff564f49609eb19c19b3246 [0,1,1,0,0,0|2,0,0]=4 2152 B11R0.40 COC(=O)CNCCCCCO 5569fb90468880f109cc36d64e9a9a82 [0,1,1,0,0,0|2,0,0]=4 2153 B11R0.40 COC(=O)COCCCCCF cba36326a78ca1f965959e137fb7ac72 [0,1,1,0,0,0|2,0,0]=4 2154 B11R0.40 COC(=O)COCCNCCO cb74cd831122e9df4bb8add78cdc15bb [0,1,1,0,0,0|2,0,0]=4 2155 B11R0.40 COC(=O)COCCOCCF ff3128386a5c1cb228a59813ed3d26ec [0,1,1,0,0,0|2,0,0]=4 2156 B11R0.40 COC(=O)COCCOCCS af887c5e10625673873df556ffb66edd [0,1,1,0,0,0|2,0,0]=4 2157 B11R0.40 COC(=O)COCCOCSC ca5bcabc5c9d48c8703ea3dd54208e5d [0,1,1,0,0,0|2,0,0]=4 2158 B11R0.40 COC(=O)OCCOCCC#N 4807cf37f3400b9cbbc22c210df22d0b [0,1,1,0,0,0|1,0,1]=4 2159 B11R0.40 COC(=O)OCCOCCC=O c14a8a8f03d23e64fdd81895e1d20180 [0,1,1,0,0,0|1,0,1]=4 2160 B11R0.40 COC(=O)OCCOCCCF de029e7ac1644d7e90d3b7c22ec5348b [0,1,1,0,0,0|1,0,0]=3 2161 B11R0.40 COC(=O)OCCOCCCS 89fffcc0bbee4cf534fff47521a1b7a2 [0,1,1,0,0,0|1,0,0]=3 2162 B11R0.40 COC(=O)OCCOCCSC 2ceeed8cd5b255e33d51f776445a31a4 [0,1,1,0,0,0|1,0,0]=3 2163 B11R0.40 COC(=O)OCNCCCCCl 4e9a14e548c308432e06e6dbfef901f0 [0,1,1,0,0,0|2,0,0]=4 2164 B11R0.40 COC(=O)OCNCCCCO 0ccd9717301e3cf82ebb5da45eb3604c [0,1,1,0,0,0|1,0,0]=3 2165 B11R0.40 COC(=O)OCNCCCCS 426dd4d42947f05957ddb7ca13ef8bef [0,1,1,0,0,0|1,1,0]=4 2166 B11R0.40 COC(=O)OCOCCCCF fca55a25cec8b0cea6dae367d2cdc8ec [0,1,1,0,0,0|2,0,0]=4 2167 B11R0.40 COC(=O)OCOCCCCS 385d9b18da918b0f0f3955a95adbad26 [0,1,1,0,0,0|1,1,0]=4 2168 B11R0.40 COCCCCCNC(=O)CF 58c05577724475f7a35f76a9992cbd8f [0,1,1,0,0,0|2,0,0]=4 2169 B11R0.40 COCCCCCNC(=O)CO 60d8072e5d6484d79910c980a11ba8d6 [0,1,1,0,0,0|2,0,0]=4 2170 B11R0.40 COCCCCCNC(=O)CS 2428285461875cbb3b6f98e666423f1f [0,1,1,0,0,0|2,0,0]=4 2171 B11R0.40 COCCCNCOC(=O)OC 2b18f33f90e6c5cc10697137b589f815 [0,1,1,0,0,0|2,0,0]=4 2172 B11R0.40 COCCCOCOC(=O)OC dfb6df9693f75e83ed062be54f66691e [0,1,1,0,0,0|2,0,0]=4 2173 B11R0.40 COCCOCCCC(=O)OC 99cf3628ca871405b6cc15b92d3d5b58 [0,1,1,0,0,0|2,0,0]=4 2174 B11R0.40 COCCOCCNC(=O)CF 297bb554b88c2972c64c4f74d0ca6961 [0,1,1,0,0,0|2,0,0]=4 2175 B11R0.40 COCCOCCNC(=O)CO aaadd15e543e97b3bf897ccdb075b841 [0,1,1,0,0,0|2,0,0]=4 2176 B11R0.40 COCCOCCNC(=O)CS e17c36da00b85ceebc47f2422dc3d35c [0,1,1,0,0,0|2,0,0]=4 2177 B11R0.40 COCCOCCOC(=O)OC 25c20c3eee60a7db8df16c9461ecbcb8 [0,1,1,0,0,0|1,0,0]=3 2178 B11R0.40 COCOCCOCC(=O)OC 82f079e871292a54857bdc4b3014d475 [0,1,1,0,0,0|2,0,0]=4 2179 B11R0.40 O=C(CF)NCCCCCCO 8c114271c45c570e7d1f57d6af9f0d9c [0,1,1,0,0,0|2,0,0]=4 2180 B11R0.40 O=C(CF)NCCCOCCO df321f5a98a2ca7501fd65e2d60a5b23 [0,1,1,0,0,0|2,0,0]=4 2181 B11R0.40 O=C(CF)NCCOCCCO 14361695bc3d1824eca1c0f1898e239a [0,1,1,0,0,0|2,0,0]=4 2182 B11R0.40 O=C(CO)CNCCCCCO dd2db0edcecc3767d3c9d40443d3d1ae [0,1,1,0,0,0|2,0,0]=4 2183 B11R0.40 O=C(CO)NCCCCCCO 7bfceec3914389840f05d685c72f8368 [0,1,1,0,0,0|2,0,0]=4 2184 B11R0.40 O=C(CO)NCCCOCCO 84add8aa3fae2f4a90b7821d81dafdbe [0,1,1,0,0,0|2,0,0]=4 2185 B11R0.40 O=C(CO)NCCOCCCO c6dedfc2c323ed2d6523e6392736be15 [0,1,1,0,0,0|2,0,0]=4 2186 B11R0.40 O=C(CS)NCCCCCCO 5f868e1a513d6d1d3d8daa69afcc9a00 [0,1,1,0,0,0|2,0,0]=4 2187 B11R0.40 O=C(CS)NCCCOCCO 35caf8c392ed8e9c99b4fc1462697bca [0,1,1,0,0,0|2,0,0]=4 2188 B11R0.40 O=C(CS)NCCOCCCO 43256d269bc07f2502a348bdc84b2967 [0,1,1,0,0,0|2,0,0]=4 2189 B11R0.42 C#CCOCCOC(=O)C(C)C 889382869787ea103d3e62a492cde783 [0,1,1,0,0,0|0,0,2]=4 2190 B11R0.42 C=C(C)C(=O)NCCCCCO 4180611146fbbfd156339952c00ed33b [0,1,1,0,0,0|1,0,1]=4 2191 B11R0.42 C=C(C)C(=O)NCCOCCC bdb7cdea81dfc20119be7d3295848957 [0,1,1,0,0,0|1,0,1]=4 2192 B11R0.42 C=C(C)C(=O)OCCNCCC 2b5d273011d92fe87ae1c522efa06b3c [0,1,1,0,0,0|1,0,1]=4 2193 B11R0.42 C=C(C)C(=O)OCCNCCO 853f6de388085ad08e9f23dc5eda0caa [0,1,1,0,0,0|1,0,1]=4 2194 B11R0.42 C=C(C)C(=O)OCCOCCC f2aa711736d9d61fb0257e6b53903659 [0,1,1,0,0,0|0,0,1]=3 2195 B11R0.42 C=C(C)C(=O)OCCOCCF 87110c44f11dca9ed63ab182cc07c0d3 [0,1,1,0,0,0|1,0,1]=4 2196 B11R0.42 C=C(C)C(=O)OCCOCCS 7f5d123d7e2ecc1b4fcea1a35258e30d [0,1,1,0,0,0|1,0,1]=4 2197 B11R0.42 C=C(C)C(=O)OCCOCOC 5c8822177ad300914606486dcbe056ab [0,1,1,0,0,0|1,0,1]=4 2198 B11R0.42 C=C(C)C(=O)OCCOCSC 23401118b79ee0948ab1f8f27e426e63 [0,1,1,0,0,0|1,0,1]=4 2199 B11R0.42 C=CCOCCOC(=O)C(C)C 11b4f4e15025dbe3ba6fd32be5332e28 [0,1,1,0,0,0|0,0,2]=4 2200 B11R0.42 CC(=O)C(=O)NCCCCCO 28e907c50b388737fc62d14cbaaf3e94 [0,1,1,0,0,0|1,0,1]=4 2201 B11R0.42 CC(C)C(=O)CNCCCCO 1ecd9491242c9ad1aed57a6351d2c67c [0,1,1,0,0,0|2,0,0]=4 2202 B11R0.42 CC(C)C(=O)NCCCNCO 86bc1a05ee492b427d8f639f66d7ecbd [0,1,1,0,0,0|2,0,0]=4 2203 B11R0.42 CC(C)C(=O)OCCOCC#N a09a5c88009f659e67bcc2eb0915db92 [0,1,1,0,0,0|1,0,1]=4 2204 B11R0.42 CC(C)C(=O)OCCOCC=O 8a312b46135b25e807fe5552f5e51fb7 [0,1,1,0,0,0|1,0,1]=4 2205 B11R0.42 CC(C)C(=O)OCCOCCF becb46f71cd0a99600816aa2ec3f7a09 [0,1,1,0,0,0|1,0,0]=3 2206 B11R0.42 CC(C)C(=O)OCCOCCS fdeda43271821e0b6aeb89a7d9d1db9a [0,1,1,0,0,0|1,0,0]=3 2207 B11R0.42 CC(C)C(=O)OCNCCCCl 5d4cd757ed22dbd6170a5365da87aaba [0,1,1,0,0,0|2,0,0]=4 2208 B11R0.42 CC(C)C(=O)OCNCCCO d652e18ee89f6bc546ca6d6a36457259 [0,1,1,0,0,0|1,0,0]=3 2209 B11R0.42 CC(C)C(=O)OCOCCCF b64630f34bc6c6787d9370ac1e5d43b5 [0,1,1,0,0,0|2,0,0]=4 2210 B11R0.42 CC(C)C(=O)OCOCCCS 778440d37648f42e81d2dec6d81c90fe [0,1,1,0,0,0|1,1,0]=4 2211 B11R0.42 CC(F)C(=O)NCCCCCCl bee2a212126c5b827d6c3bfc18bb9daa [0,1,1,0,0,0|2,0,0]=4 2212 B11R0.42 CC(F)C(=O)NCCCCCO 655329cf71103340a1c96a571825f242 [0,1,1,0,0,0|1,0,0]=3 2213 B11R0.42 CC(F)C(=O)NCCOCCO 9b8ea47590cb917b9cc6c1dbe3dedacd [0,1,1,0,0,0|2,0,0]=4 2214 B11R0.42 CC(F)C(=O)NCCOCCS fed21346c41f2f2b6ea723cae4b67889 [0,1,1,0,0,0|2,0,0]=4 2215 B11R0.42 CC(F)C(=O)NCCSCCO f00c242a071a8a2688f99080f418c775 [0,1,1,0,0,0|2,0,0]=4 2216 B11R0.42 CC(O)C(=O)NCCCCCCl 1d7397d58dff05afba7602fff5a412cc [0,1,1,0,0,0|2,0,0]=4 2217 B11R0.42 CC(O)C(=O)NCCCCCO 9cb0edbf2f795c793c30dd6b720404a3 [0,1,1,0,0,0|1,0,0]=3 2218 B11R0.42 CC(O)C(=O)NCCOCCO 68cad983dde6c49d8e07884bf9e38e30 [0,1,1,0,0,0|2,0,0]=4 2219 B11R0.42 CC(O)C(=O)NCCOCCS 6e39c4a933f88ae5b87aa0b52640907c [0,1,1,0,0,0|2,0,0]=4 2220 B11R0.42 CC(O)C(=O)NCCSCCO 20f66edaf7d580c458cbe8b9ad501dd4 [0,1,1,0,0,0|2,0,0]=4 2221 B11R0.42 CC(S)C(=O)NCCCCCCl b411952a2eef50d41979b34d56a14ac2 [0,1,1,0,0,0|2,0,0]=4 2222 B11R0.42 CC(S)C(=O)NCCCCCO b189f72e50032b63e78e4a8e979b461c [0,1,1,0,0,0|1,0,0]=3 2223 B11R0.42 CC(S)C(=O)NCCOCCO 909dad02c59867e886bb40df19ff3112 [0,1,1,0,0,0|2,0,0]=4 2224 B11R0.42 CC(S)C(=O)NCCOCCS 00f977f528842172e29c5f3400d418bc [0,1,1,0,0,0|2,0,0]=4 2225 B11R0.42 CC(S)C(=O)NCCSCCO 475d5f4960bb30e37c9bf71f81732c75 [0,1,1,0,0,0|2,0,0]=4 2226 B11R0.42 CCCCCCNC(=O)C(C)F 6879fb44d984d62306eb19467505f520 [0,1,1,0,0,0|2,0,0]=4 2227 B11R0.42 CCCCCCNC(=O)C(C)O c9999e663477499f337d15f0fc5dc538 [0,1,1,0,0,0|2,0,0]=4 2228 B11R0.42 CCCCCCNC(=O)C(C)S dc529f00ff798a00fad813e24d3714d8 [0,1,1,0,0,0|2,0,0]=4 2229 B11R0.42 CCCCCCNC(=O)[C@@H](C)F c4c684c39982719c5c269be93e10fe82 [0,1,1,0,0,0|2,0,0]=4 2230 B11R0.42 CCCCCCNC(=O)[C@@H](C)O ba2fa53987cf1c1dd463ca418a499b6b [0,1,1,0,0,0|2,0,0]=4 2231 B11R0.42 CCCCCCNC(=O)[C@H](C)F 204d2655ac98577465d8cd3e50ef917b [0,1,1,0,0,0|2,0,0]=4 2232 B11R0.42 CCCCCCNC(=O)[C@H](C)O 74171bc3104db1cb9ab901270291150d [0,1,1,0,0,0|2,0,0]=4 2233 B11R0.42 CCCCNCOC(=O)C(C)C 1f15ec4454500f1ff5936653de618666 [0,1,1,0,0,0|2,0,0]=4 2234 B11R0.42 CCCCOCOC(=O)C(C)C f2f1cb7941a1a460a2293d201b26c30d [0,1,1,0,0,0|2,0,0]=4 2235 B11R0.42 CCCOCCCC(=O)N(C)C e44e860c6266acc551625ca7ca79ac86 [0,1,1,0,0,0|2,0,0]=4 2236 B11R0.42 CCCOCCNC(=O)C(=O)C ad0cbc05777cd31baa3bb05ba09cc6bc [0,1,1,0,0,0|1,0,1]=4 2237 B11R0.42 CCCOCCNC(=O)C(C)F 950c8686aacfba5baca1f4f0ada76eef [0,1,1,0,0,0|1,0,0]=3 2238 B11R0.42 CCCOCCNC(=O)C(C)O f6aff21434aaea962861abc3a0e02bda [0,1,1,0,0,0|1,0,0]=3 2239 B11R0.42 CCCOCCNC(=O)C(C)S 731a70809379210fbe8d9901c61b2f18 [0,1,1,0,0,0|1,0,0]=3 2240 B11R0.42 CCCOCCNC(=O)C(F)F 1ebbfa3f2c75208140f7ecfbe9d2b109 [0,1,1,0,0,0|2,0,0]=4 2241 B11R0.42 CCCOCCNC(=O)C(O)O 788d176b4c6e63f29c1fb2eaabf8145c [0,1,1,0,0,0|2,0,0]=4 2242 B11R0.42 CCCOCCNC(=O)[C@@H](C)F 1a38329dd2d505456f35546f45374734 [0,1,1,0,0,0|1,0,0]=3 2243 B11R0.42 CCCOCCNC(=O)[C@@H](C)O 9ae38f12097083a9fd612ba86af5ea03 [0,1,1,0,0,0|1,0,0]=3 2244 B11R0.42 CCCOCCNC(=O)[C@H](C)F a754ddfa8cfb3bdc66127031e92ef743 [0,1,1,0,0,0|1,0,0]=3 2245 B11R0.42 CCCOCCNC(=O)[C@H](C)O 491620d4f789ce3d0bfa23e27e51ffff [0,1,1,0,0,0|1,0,0]=3 2246 B11R0.42 CCCOCCOC(=O)C(C)C 18acbd40de983c60d8c14c656cc35337 [0,1,1,0,0,0|0,0,0]=2 2247 B11R0.42 CCCOCCOC(C)C(C)C 77b704d965e2e08e6d5de9ba5a926cc3 [0,1,1,0,0,0|1,0,1]=4 2248 B11R0.42 CCCOCCOC(C)C(C)S 73c0db0d804377d78c18340369ccb548 [0,1,1,0,0,0|1,0,1]=4 2249 B11R0.42 CCCOCCO[C@@H](C)C(C)C e0a437c6c534d3cbb70a25c62161bd7c [0,1,1,0,0,0|1,0,1]=4 2250 B11R0.42 CCCOCCO[C@H](C)C(C)C 5f2d7eab33dd91f60c5b25b2924d8229 [0,1,1,0,0,0|1,0,1]=4 2251 B11R0.42 COCOCCOC(=O)C(C)C a9a1cbc4a86061f526ae32120fadce09 [0,1,1,0,0,0|1,0,0]=3 2252 B11R0.42 CSCOCCOC(=O)C(C)C 3c28ed623a459ad775d2d0cf81d74d06 [0,1,1,0,0,0|1,0,0]=3 2253 B11R0.42 C[C@@H](F)C(=O)NCCCCCCl c96fd94676b566a57ea60d7fa4bf96b3 [0,1,1,0,0,0|2,0,0]=4 2254 B11R0.42 C[C@@H](F)C(=O)NCCCCCO fa007439eadc064c40308d885ff94390 [0,1,1,0,0,0|1,0,0]=3 2255 B11R0.42 C[C@@H](F)C(=O)NCCOCCO 20ddc39e3ffd66ed39dcfc3f36eefae9 [0,1,1,0,0,0|2,0,0]=4 2256 B11R0.42 C[C@@H](F)C(=O)NCCOCCS a3c74f40b25967b3975abcca4e687cee [0,1,1,0,0,0|2,0,0]=4 2257 B11R0.42 C[C@@H](F)C(=O)NCCSCCO f6d43144dfc30812b05504eb9af10ec0 [0,1,1,0,0,0|2,0,0]=4 2258 B11R0.42 C[C@@H](O)C(=O)NCCCCCCl ca0478b3ebe4a349053fcf0b233deaa5 [0,1,1,0,0,0|2,0,0]=4 2259 B11R0.42 C[C@@H](O)C(=O)NCCCCCO daff82b7b6a319ea46c4313c28e0b309 [0,1,1,0,0,0|1,0,0]=3 2260 B11R0.42 C[C@@H](O)C(=O)NCCOCCO b83370f95172405d3292d4a2b6d6255c [0,1,1,0,0,0|2,0,0]=4 2261 B11R0.42 C[C@@H](O)C(=O)NCCOCCS c983d49e06c3d3f90b086b357b958542 [0,1,1,0,0,0|2,0,0]=4 2262 B11R0.42 C[C@@H](O)C(=O)NCCSCCO fcfd602600e4cd090090ac4a4e77089e [0,1,1,0,0,0|2,0,0]=4 2263 B11R0.42 C[C@H](F)C(=O)NCCCCCCl 0361510a5a15545e8472c1b503b848dc [0,1,1,0,0,0|2,0,0]=4 2264 B11R0.42 C[C@H](F)C(=O)NCCCCCO 00b8a369d9183eb9301f96163ed1c00a [0,1,1,0,0,0|1,0,0]=3 2265 B11R0.42 C[C@H](F)C(=O)NCCOCCO aca26610951aa8438c3b57c4aa0eb672 [0,1,1,0,0,0|2,0,0]=4 2266 B11R0.42 C[C@H](F)C(=O)NCCOCCS 70537775f13618561626141800449715 [0,1,1,0,0,0|2,0,0]=4 2267 B11R0.42 C[C@H](F)C(=O)NCCSCCO 5b99a27d368387055bd67ed9defce99c [0,1,1,0,0,0|2,0,0]=4 2268 B11R0.42 C[C@H](O)C(=O)NCCCCCCl b198c5e593686f57cfe8d8eaca3d63f9 [0,1,1,0,0,0|2,0,0]=4 2269 B11R0.42 C[C@H](O)C(=O)NCCCCCO 2754ab274d78f6b8089b15a04c6351ae [0,1,1,0,0,0|1,0,0]=3 2270 B11R0.42 C[C@H](O)C(=O)NCCOCCO f6901e473d399157fec57a6c606cc597 [0,1,1,0,0,0|2,0,0]=4 2271 B11R0.42 C[C@H](O)C(=O)NCCOCCS b58fc20904c5a95eb01cf7d63dd3bb61 [0,1,1,0,0,0|2,0,0]=4 2272 B11R0.42 C[C@H](O)C(=O)NCCSCCO a02464a673028e94f5ba04acd6eeab22 [0,1,1,0,0,0|2,0,0]=4 2273 B11R0.42 O=C(NCCCCCO)C(F)F 0fdbddcfccfac65b3b869a39329d6a2d [0,1,1,0,0,0|2,0,0]=4 2274 B11R0.42 O=C(NCCCCCO)C(O)O 51f183e240d5dc9b6da5a1bca6dd68a5 [0,1,1,0,0,0|2,0,0]=4 2275 B11R0.49 CCCOCCCS(=O)(=O)CC ac9f966f61ab698cffc14e8ab8b75c03 [0,1,1,0,0,0|2,0,0]=4 2276 B11R0.70 CCC(=O)CNC(C)CCCO 62f1651b636a1311533189797e8c2d08 [0,1,1,0,0,0|2,0,0]=4 2277 B11R0.70 CCC(=O)CN[C@H](C)CCCO a66aa7e90d12814efe7cec5b9f9d770c [0,1,1,0,0,0|2,0,0]=4 2278 B11R0.70 CCC(=O)NC[C@H](C)CCCO 234894eebeab2afe5b5d965193c1a7db [0,1,1,0,0,0|1,0,0]=3 2279 B11R0.70 CCC(=O)OCN(C)CCCO d8f1998e41bb1a13d9456e54db5af1ff [0,1,1,0,0,0|1,0,0]=3 2280 B11R0.70 CCCCC(O)CNC(=O)CC a18614707b31b705fea3a9214509c6d7 [0,1,1,0,0,0|2,0,0]=4 2281 B11R0.70 CCCCN(C)COC(=O)CC a4ec5d7fca2c7352b40f0edbfdecad4d [0,1,1,0,0,0|2,0,0]=4 2282 B11R0.70 CCCOC(C)CCC(=O)OC fb37d2dab98ad3681fa9792c014dd77f [0,1,1,0,0,0|2,0,0]=4 2283 B11R0.70 COC(=O)OCN(C)CCCO 84076b202f882fd5a3d576c1fdc682bd [0,1,1,0,0,0|2,0,0]=4 2284 B11R0.70 C[C@H](CCCO)CNC(=O)CF e46decf5631859192b78c2f9471ae0c5 [0,1,1,0,0,0|2,0,0]=4 2285 B11R0.70 C[C@H](CCCO)CNC(=O)CO 5bae356ab1dc33c30828a685e21e46ff [0,1,1,0,0,0|2,0,0]=4 2286 B11R0.70 C[C@H](CCCO)CNC(=O)CS 7bff403e3da2fd4e282f1d90aeec4cef [0,1,1,0,0,0|2,0,0]=4 2287 B11R0.106 C=CC(=O)OCCOC(C)CC fdebac3a5f9e52d0aefb997e91eb14ae [0,1,1,0,0,0|0,0,2]=4 2288 B11R0.106 C=CC(=O)OCCO[C@@H](C)CC 1afbb5a54485c17bc40e22ce4e8dc85b [0,1,1,0,0,0|0,0,2]=4 2289 B11R0.106 C=CC(=O)OCCO[C@H](C)CC cf66d98eaff05de93732d1dd407220e0 [0,1,1,0,0,0|0,0,2]=4 2290 B11R0.106 C=CC(C)OCCOC(=O)CC a924be487d3dc2da2dc8b0988e4c33bb [0,1,1,0,0,0|0,0,2]=4 2291 B11R0.106 CC(CO)CCCNC(=O)CF 87cc40bee2d0266e45a7db3ef6f799dd [0,1,1,0,0,0|2,0,0]=4 2292 B11R0.106 CC(CO)CCCNC(=O)CO 4fd5aa4b80b612cd5f45925631ff504c [0,1,1,0,0,0|2,0,0]=4 2293 B11R0.106 CC(CO)CCCNC(=O)CS c786c5473bf61b22c247c4c3a09c3729 [0,1,1,0,0,0|2,0,0]=4 2294 B11R0.106 CCC(=O)CNCCC(C)CO de7858bdb5cb93f9193a1ebce405355b [0,1,1,0,0,0|2,0,0]=4 2295 B11R0.106 CCC(=O)CNCCC(O)CO 2a7812246949f8fb9885a477da51593f [0,1,1,0,0,0|2,0,0]=4 2296 B11R0.106 CCC(=O)CNCC[C@@H](C)CO 733127e79966a497c10994db90dcafb8 [0,1,1,0,0,0|2,0,0]=4 2297 B11R0.106 CCC(=O)NCCCC(C)CO 49083233765dcd6fceddfbcf416dbeca [0,1,1,0,0,0|1,0,0]=3 2298 B11R0.106 CCC(=O)NCCNC(C)CC c19ce562c189cf20a9e164027f672ff6 [0,1,1,0,0,0|2,0,0]=4 2299 B11R0.106 CCC(=O)NCCNC(C)CO 666b1243ffcf82a72f078549bc404f37 [0,1,1,0,0,0|2,0,0]=4 2300 B11R0.106 CCC(=O)NCCN[C@@H](C)CO c6648dc44478ca75697f08c69257b604 [0,1,1,0,0,0|2,0,0]=4 2301 B11R0.106 CCC(=O)NCCN[C@H](C)CO c88a088309bd78bdf2dd14e4f1929843 [0,1,1,0,0,0|2,0,0]=4 2302 B11R0.106 CCC(=O)NCCOC(C)CC 4e9d1cf376ae5ce4fce8a6afee6ba7d3 [0,1,1,0,0,0|1,0,0]=3 2303 B11R0.106 CCC(=O)OCCOC(C)C=O 1101bd5ab3acbfa0cf588226ddd9cc35 [0,1,1,0,0,0|1,0,1]=4 2304 B11R0.106 CCC(=O)OCCOC(C)CC f0ea60d04e18431aabc16e7fa3a3fc58 [0,1,1,0,0,0|0,0,0]=2 2305 B11R0.106 CCC(=O)OCCO[C@H](C)C=O fd075dbec6101dca39f5cdae25d59356 [0,1,1,0,0,0|1,0,1]=4 2306 B11R0.106 CCC(=O)OCNCC(Br)CBr 98c42bd78272ec7b5ed81d80fd59b09d [0,1,1,0,0,0|2,0,0]=4 2307 B11R0.106 CCC(=O)OCNCC(C)CC c960546a8b37c5b51fa943577cfeee1b [0,1,1,0,0,0|2,0,0]=4 2308 B11R0.106 CCC(=O)OCNCC(C)CO c1d5b81f4db3737dd6ed5b49db133844 [0,1,1,0,0,0|1,0,0]=3 2309 B11R0.106 CCC(=O)OCNCC(F)CO 3b700c23a40f0b4b3ad96d9d407e2354 [0,1,1,0,0,0|1,0,0]=3 2310 B11R0.106 CCC(=O)OCNCC(O)CC 56956f9574949527a8f07f4cef135a87 [0,1,1,0,0,0|2,0,0]=4 2311 B11R0.106 CCC(=O)OCNCC(O)CO c826995644d31658bb8ef9bd160dbdc6 [0,1,1,0,0,0|1,0,0]=3 2312 B11R0.106 CCC(=O)OCNC[C@@H](C)CC 4bdb3fde5edb0494917cb3b200ccee10 [0,1,1,0,0,0|2,0,0]=4 2313 B11R0.106 CCC(=O)OCNC[C@@H](F)CO 91faf6e50818e4b2369f95da877e9e95 [0,1,1,0,0,0|1,0,0]=3 2314 B11R0.106 CCC(=O)OCNC[C@@H](O)CO ed8832dcb67eb1fae3b94495c25038e2 [0,1,1,0,0,0|1,0,0]=3 2315 B11R0.106 CCC(=O)OCNC[C@H](C)CO bd6d5a25b9b324a8dd57261e50be24c4 [0,1,1,0,0,0|1,0,0]=3 2316 B11R0.106 CCC(=O)OCNC[C@H](F)CO ae56b7e93b6ac2caab79285500c6339f [0,1,1,0,0,0|1,0,0]=3 2317 B11R0.106 CCC(=O)OCNC[C@H](O)CC 849e04181d91d7ea77286e5c7efa79a7 [0,1,1,0,0,0|2,0,0]=4 2318 B11R0.106 CCC(=O)OCNC[C@H](O)CO fb6fea33ca14b90b3c893c04880f0301 [0,1,1,0,0,0|1,0,0]=3 2319 B11R0.106 CCC(=O)OCOCC(Br)CBr d8d1d530b7a5879bb3942007db69a072 [0,1,1,0,0,0|2,0,0]=4 2320 B11R0.106 CCC(=O)OCOCC(C)CC 1c501e6259176ad2eeffac7244c7b2dd [0,1,1,0,0,0|2,0,0]=4 2321 B11R0.106 CCC(=O)OCOCC(Cl)CCl 30717e88ff1d483f28699b01d44e0e65 [0,1,1,0,0,0|2,0,0]=4 2322 B11R0.106 CCC(=O)OCOCC(S)CS a96ec43226c63cc93f546e10ca2dda16 [0,1,1,0,0,0|1,1,0]=4 2323 B11R0.106 CCC(=O)OCOC[C@@H](C)CC 82d3d51a6e30691b0a0763bf89f5029b [0,1,1,0,0,0|2,0,0]=4 2324 B11R0.106 CCC(=O)OCOC[C@H](C)CC 8859bddfd5e16eee958f0fceb8404582 [0,1,1,0,0,0|2,0,0]=4 2325 B11R0.106 CCC(C)OCCCC(=O)NC 3d3e5ede5e8c790869c978f84d4c7698 [0,1,1,0,0,0|2,0,0]=4 2326 B11R0.106 CCC(C)OCCCC(=O)OC 73c7d02713528c817e16ae2787ad1215 [0,1,1,0,0,0|2,0,0]=4 2327 B11R0.106 CCC(C)OCCOC(=O)OC a61ba394d28b03b1b7a19d066f8dfa4b [0,1,1,0,0,0|1,0,0]=3 2328 B11R0.106 CC[C@@H](C)OCCCC(=O)NC ded55f681798d1e5fe0f3edbd3e0796a [0,1,1,0,0,0|2,0,0]=4 2329 B11R0.106 CC[C@@H](C)OCCCC(=O)OC 20116c6b5ae76c3d034784de4d52563a [0,1,1,0,0,0|2,0,0]=4 2330 B11R0.106 CC[C@H](C)OCCCC(=O)NC baa577cdd8f609816df37c2bc6f399c8 [0,1,1,0,0,0|2,0,0]=4 2331 B11R0.106 CC[C@H](C)OCCCC(=O)OC e611334dbefda70672866dae633c5dd0 [0,1,1,0,0,0|2,0,0]=4 2332 B11R0.106 COC(=O)OCNCC(C)CO 7fa76b5fa049fe48e65947825c1922ae [0,1,1,0,0,0|2,0,0]=4 2333 B11R0.106 COC(=O)OCNCC(F)CO abe9bb9c9541beef0f30450c12910346 [0,1,1,0,0,0|2,0,0]=4 2334 B11R0.106 COC(=O)OCNCC(O)CO baed861f426fd2bac8d91670f990c3f5 [0,1,1,0,0,0|2,0,0]=4 2335 B11R0.106 COC(=O)OCNC[C@@H](F)CO f43e2314faf48e9986892cc3e834974b [0,1,1,0,0,0|2,0,0]=4 2336 B11R0.106 COC(=O)OCNC[C@@H](O)CO cfb01eb6812ee34755f79f796ce9368d [0,1,1,0,0,0|2,0,0]=4 2337 B11R0.106 COC(=O)OCNC[C@H](C)CO ce78dd8a27a6084d36694b366ea157b2 [0,1,1,0,0,0|2,0,0]=4 2338 B11R0.106 COC(=O)OCNC[C@H](F)CO c2bf0371a06b3752d6c9ba11aec15cc0 [0,1,1,0,0,0|2,0,0]=4 2339 B11R0.106 COC(=O)OCNC[C@H](O)CO ac778b9ba644f555303e93c1604bf495 [0,1,1,0,0,0|2,0,0]=4 2340 B11R0.111 C=C(Br)COCCOC(=O)CC 7fa6a52c6d2beb29016b4a6642d63abe [0,1,1,0,0,0|0,0,2]=4 2341 B11R0.111 C=C(C)COCCNC(=O)CC fa29038b08a55587ba2da2f1318b5935 [0,1,1,0,0,0|1,0,1]=4 2342 B11R0.111 C=C(C)COCCOC(=O)CC 26c19060adc18fa244b68c345c541864 [0,1,1,0,0,0|0,0,1]=3 2343 B11R0.111 C=C(C)COCCOC(=O)OC 0aea5e6920edddb9de3b7462cdf37130 [0,1,1,0,0,0|1,0,1]=4 2344 B11R0.111 C=C(Cl)COCCOC(=O)CC 189eb734f116e5107a4335d0fc4237e7 [0,1,1,0,0,0|0,0,2]=4 2345 B11R0.111 C=C(F)COCCOC(=O)CC dfeec893f080d4a79970cbe6978df714 [0,1,1,0,0,0|0,0,2]=4 2346 B11R0.111 C=CC(=O)OCCOCC(C)C 6f74e9a0b4020c944af92dcb9baef909 [0,1,1,0,0,0|0,0,2]=4 2347 B11R0.111 C=CC(=O)OCCOCC(C)F 8d516d4613fa62b22a1c44345c994d38 [0,1,1,0,0,0|0,0,2]=4 2348 B11R0.111 C=CC(=O)OCCOCC(C)S a915a8bba0950d2bb4108743ce314480 [0,1,1,0,0,0|0,0,2]=4 2349 B11R0.111 C=CC(=O)OCCOC[C@@H](C)F cb149bdb65bc74dfddb759acfd73d5d2 [0,1,1,0,0,0|0,0,2]=4 2350 B11R0.111 C=CC(=O)OCCOC[C@H](C)F 7b3bafdd3576105613dc5841c5651801 [0,1,1,0,0,0|0,0,2]=4 2351 B11R0.111 CCC(=O)NCCCCC(F)F c22d17a9c23e2a43272e55fdeb00c3d6 [0,1,1,0,0,0|2,0,0]=4 2352 B11R0.111 CCC(=O)NCCNCC(C)C 9e7cd0d05bae096c634a0f8af7568858 [0,1,1,0,0,0|2,0,0]=4 2353 B11R0.111 CCC(=O)NCCNCC(C)O bcb24b96d36b0dd9e43ff40f6e1343a8 [0,1,1,0,0,0|2,0,0]=4 2354 B11R0.111 CCC(=O)NCCNC[C@@H](C)O fa1764f1b4a0ecd78ec02e70dbe53f9c [0,1,1,0,0,0|2,0,0]=4 2355 B11R0.111 CCC(=O)NCCNC[C@H](C)O d69bc29251cf0821084a0f19a6558716 [0,1,1,0,0,0|2,0,0]=4 2356 B11R0.111 CCC(=O)NCCOCC(C)C cd60bd5f02d7c30117cc9fe8c3e17d07 [0,1,1,0,0,0|1,0,0]=3 2357 B11R0.111 CCC(=O)NCCOCC(F)F fba4c38cb950e82fbccbc58c9032e0f8 [0,1,1,0,0,0|2,0,0]=4 2358 B11R0.111 CCC(=O)NCCOCN(C)C 568b8f6b68b17fa08a6d7bc1ff4db7b0 [0,1,1,0,0,0|2,0,0]=4 2359 B11R0.111 CCC(=O)OCCOCC(=O)N b9c50ff16ce490597dc3da0da36d6d3b [0,1,1,0,0,0|1,0,1]=4 2360 B11R0.111 CCC(=O)OCCOCC(=O)O bd48d0d5a66fe1fd9e9928b95efdc691 [0,1,1,0,0,0|1,0,1]=4 2361 B11R0.111 CCC(=O)OCCOCC(C)C 50d6d7032a8c30d3c2e4cd419a7563eb [0,1,1,0,0,0|0,0,0]=2 2362 B11R0.111 CCC(=O)OCCOCC(F)F b569d824fe956d414e9cb8e9239f2e87 [0,1,1,0,0,0|1,0,0]=3 2363 B11R0.111 CCC(=O)OCCOCN(C)C f1253985f4ca5350ee8a980076a3c790 [0,1,1,0,0,0|1,0,0]=3 2364 B11R0.111 CCC(=O)OCCOC[N+](=O)[O-] 87e795b6cfe62c5e57c1031de6eea0d6 [0,1,1,0,0,0|2,0,0]=4 2365 B11R0.111 CCC(=O)OCNCCC(=O)O 34a7ea57bcfeba2ff365dcb36293f395 [0,1,1,0,0,0|1,0,1]=4 2366 B11R0.111 CCC(=O)OCNCCC(C)C 3b044d7e60398bd269f208d7f76ce10a [0,1,1,0,0,0|2,0,0]=4 2367 B11R0.111 CCC(=O)OCNCCC(C)O 72635955e54aa2a9b5ca783362017880 [0,1,1,0,0,0|1,0,0]=3 2368 B11R0.111 CCC(=O)OCNCCC(F)F 7e77919f7d28d33411d6674e4ce43837 [0,1,1,0,0,0|2,0,0]=4 2369 B11R0.111 CCC(=O)OCNCCS(=O)O 9d351989aaa121c5eb4ba67a4e001241 [0,1,1,0,0,0|2,0,0]=4 2370 B11R0.111 CCC(=O)OCNCC[C@@H](C)O 4580331c1fcbe45b4aa11fe539413781 [0,1,1,0,0,0|1,0,0]=3 2371 B11R0.111 CCC(=O)OCNCC[C@H](C)O 9213c4d09a55d6c608b8321d4ffc7bdc [0,1,1,0,0,0|1,0,0]=3 2372 B11R0.111 CCC(=O)OCOCCC(=O)O 4142a3713a041e920d2c134c0afba26d [0,1,1,0,0,0|1,0,1]=4 2373 B11R0.111 CCC(=O)OCOCCC(C)C 1b30abcdbd05a31e9531c15fcd74a28e [0,1,1,0,0,0|2,0,0]=4 2374 B11R0.111 CCC(=O)OCOCCC(F)F 11a088835f7fea34d6807a603cd45f18 [0,1,1,0,0,0|2,0,0]=4 2375 B11R0.111 CCC(C)OCCOCC(C)C d2f052664a552a6e13fd772fb7e4b69e [0,1,1,0,0,0|1,0,1]=4 2376 B11R0.111 CC[C@@H](C)OCCOCC(C)C b11c41fd1aebdfc9c73bfd1a48d599bb [0,1,1,0,0,0|1,0,1]=4 2377 B11R0.111 CC[C@H](C)OCCOCC(C)C 84c97c995495c37a2fbc98ee38832635 [0,1,1,0,0,0|1,0,1]=4 2378 B11R0.111 CNC(=O)CCCOCC(C)C 6a92831b29999890c0759ea566d3dccf [0,1,1,0,0,0|2,0,0]=4 2379 B11R0.111 CNC(=O)CCCOCC(C)F 276735f132be6d65d9c9074e7d84f54e [0,1,1,0,0,0|2,0,0]=4 2380 B11R0.111 CNC(=O)CCCOCC(C)S d6a90ff4d6573e23cdebcefe263c9282 [0,1,1,0,0,0|2,0,0]=4 2381 B11R0.111 CNC(=O)CCCOC[C@@H](C)F 623d9e8910e8b1134ad48947a21c4c1d [0,1,1,0,0,0|2,0,0]=4 2382 B11R0.111 CNC(=O)CCCOC[C@H](C)F 512665ddb0264cdd7d71c19c1ea3e8e7 [0,1,1,0,0,0|2,0,0]=4 2383 B11R0.111 COC(=O)CCCOCC(C)C da0ab2a2eb5a7d7593b57e56bc9a7a4d [0,1,1,0,0,0|2,0,0]=4 2384 B11R0.111 COC(=O)CCCOCC(C)F 0384faa71441c661816a188eaf89109d [0,1,1,0,0,0|2,0,0]=4 2385 B11R0.111 COC(=O)CCCOCC(C)S cd9ee67f30b2ddac45fd0cdfb7af51ec [0,1,1,0,0,0|2,0,0]=4 2386 B11R0.111 COC(=O)CCCOC[C@@H](C)F 66d9e6f6e42f9f7a1ae0d759163cbb92 [0,1,1,0,0,0|2,0,0]=4 2387 B11R0.111 COC(=O)CCCOC[C@H](C)F e9161594cead7501de0189b1154e1ca6 [0,1,1,0,0,0|2,0,0]=4 2388 B11R0.111 COC(=O)OCCOCC(C)C c059a298038ebd805d1fbcd46b77f963 [0,1,1,0,0,0|1,0,0]=3 2389 B11R0.111 COC(=O)OCCOCC(F)F 5db299179a0a6dff513a33269d5a3ea2 [0,1,1,0,0,0|2,0,0]=4 2390 B11R0.111 COC(=O)OCCOCN(C)C 2b8c3c7d07e5a82b7d97ca07719a91c7 [0,1,1,0,0,0|2,0,0]=4 2391 B11R0.111 COC(=O)OCNCCC(C)O 93ed9cd7c4dc96cf7a0cae998cccaf83 [0,1,1,0,0,0|2,0,0]=4 2392 B11R0.111 COC(=O)OCNCC[C@@H](C)O 098f810ee0dc57270fd0c04bbf74b980 [0,1,1,0,0,0|2,0,0]=4 2393 B11R0.111 COC(=O)OCNCC[C@H](C)O 44fe14312fae9b263469c03d28c6a2d8 [0,1,1,0,0,0|2,0,0]=4 2394 B11R0.124 C#CC(CC)OCCOCCC 24aa9897269c5453bf9126fa80033173 [0,1,1,0,0,0|1,0,1]=4 2395 B11R0.124 C=CC(CC)OCCOCCC 0552943ca29abdd41975619927c39194 [0,1,1,0,0,0|1,0,1]=4 2396 B11R0.124 CCC(C=O)NCCCCCO 7d507fe54806768df031d7c32f24d43f [0,1,1,0,0,0|1,0,1]=4 2397 B11R0.124 CCC(C=O)OCCOCCF 906164eb6cd4f82fcea3a2df72820bae [0,1,1,0,0,0|1,0,1]=4 2398 B11R0.124 CCC(C=O)OCCOCCS 038c055d2e0968325122ab01abc64409 [0,1,1,0,0,0|1,0,1]=4 2399 B11R0.124 CCCCCCOC(C=O)CC c38fe7c50ce133303202e708cd40e930 [0,1,1,0,0,0|1,0,1]=4 2400 B11R0.124 CCCOCCNC(C=O)CC ffe70eeb1e9cf4282f8a40488d3f9cf6 [0,1,1,0,0,0|1,0,1]=4 2401 B11R0.124 CCCOCCOC(C#N)CC 45162fe855db8046fd9043772bf57efe [0,1,1,0,0,0|1,0,1]=4 2402 B11R0.124 CCCOCCOC(C=O)CC f6aec26e489e8240e620cd57f513bb5f [0,1,1,0,0,0|0,0,1]=3 2403 B11R0.124 CCCOCCOC(CC)CC fec908f4bf4b3045fb11345df5637829 [0,1,1,0,0,0|1,0,1]=4 2404 B11R0.124 CCCSCCOC(C=O)CC 34bb8d18218a22ba351ec0372889a682 [0,1,1,0,0,0|0,1,1]=4 2405 B11R0.142 CCC(=O)C(=O)NCCCCO e6f50dd40821156e7f69b6f050c98eec [0,1,1,0,0,0|2,0,0]=4 2406 B11R0.142 CCC(=O)C(C)NCCCCO d5796009c62c14bbb2b4d15002592403 [0,1,1,0,0,0|2,0,0]=4 2407 B11R0.142 CCC(=O)N(C)CCCCCO f0fce295f0d35e7f07091aeb1036d4c8 [0,1,1,0,0,0|1,0,0]=3 2408 B11R0.142 CCC(=O)N(C)CCOCCO 2d6391d3afcceb39572ba66f5ea8c7e7 [0,1,1,0,0,0|2,0,0]=4 2409 B11R0.142 CCCCCCN(C)C(=O)CC c25fee109e3505330a0f823c56988e5a [0,1,1,0,0,0|2,0,0]=4 2410 B11R0.142 CCCOCCC(C)C(=O)OC 16254c5922c3369c7e34436020a43f8f [0,1,1,0,0,0|2,0,0]=4 2411 B11R0.142 CN(CCCCCO)C(=O)CF 01456f2d92bd76eae24f59a2adbb4adb [0,1,1,0,0,0|2,0,0]=4 2412 B11R0.142 CN(CCCCCO)C(=O)CO 11fb01b4f7ac820aa1f1aa39e8a46285 [0,1,1,0,0,0|2,0,0]=4 2413 B11R0.142 CN(CCCCCO)C(=O)CS 82f7b222edb74cd80dd3f10a919bbab8 [0,1,1,0,0,0|2,0,0]=4 2414 B11R0.154 CCC(=O)CN(C)CCCCO 7c85021e84c149efb729fa34fc09063e [0,1,1,0,0,0|2,0,0]=4 2415 B11R0.154 CCCCCC(C)NC(=O)CC bc630bcd14906e5f8a25eb9d61b6f9fa [0,1,1,0,0,0|2,0,0]=4 2416 B11R0.154 CCCCC[C@H](C)NC(=O)CC 9adb0b9fb15364ba4605e72a32fe384f [0,1,1,0,0,0|2,0,0]=4 2417 B11R0.154 CCCOCC(C)CC(=O)OC 2fdc7d4802e83652201ed75663d8570d [0,1,1,0,0,0|2,0,0]=4 2418 B11R0.154 CCCOCC(C)OC(C)CC 6af984d8f1e6f996d0742e034d861047 [0,1,1,0,0,0|1,0,1]=4 2419 B11R0.154 COC(=O)OC(C)NCCCO 49b061dad558df983f5cc664e14da5ff [0,1,1,0,0,0|2,0,0]=4 2420 B11R0.174 CCC(=O)CNCC(C)CCO ba5a62442c9a0f0ca8823d38c147e1d0 [0,1,1,0,0,0|2,0,0]=4 2421 B11R0.174 CCC(=O)COC[C@@H](O)CCO b221f20533f1392fdbd9199d31a60330 [0,1,1,0,0,0|2,0,0]=4 2422 B11R0.174 CCC(=O)NCCN(C)CCO d282a68b8f5c7bbda454757c4305c11f [0,1,1,0,0,0|2,0,0]=4 2423 B11R0.174 CCCC(=S)OCOC(=O)CC 845ebcc1def87d3b0ee7c2b3643c5ed1 [0,1,1,0,0,0|2,0,0]=4 2424 B11R0.174 COC(=O)OCNC(C)CCO 37b693cf0832ae7acc35d85771e2dd2f [0,1,1,0,0,0|2,0,0]=4 2425 B11R0.174 COC(=O)OCN[C@@H](C)CCO 56ce7fb18111ea83f5d3a0fd9015ff94 [0,1,1,0,0,0|2,0,0]=4 2426 B11R0.174 COC(=O)OCN[C@H](C)CCO eba3ce559208e0f64cc50212cfe25344 [0,1,1,0,0,0|2,0,0]=4 2427 B11R0.62 C#CCC(=O)NCC(C)OCC 99e2a2bc98c7e5ee8bb5e999a4765f53 [0,1,1,0,0,0|1,0,1]=4 2428 B11R0.62 C#CCC(=O)NCC(O)CCC 45a4dbd33d6631a3203687d7c0bfb8bd [0,1,1,0,0,0|1,0,1]=4 2429 B11R0.62 C/C=C/C(=O)NCC(C)OCC 4d924a7836888debc417357f9d2ef5f6 [0,1,1,0,0,0|1,0,1]=4 2430 B11R0.62 C/C=C/C(=O)NCC(O)CCC 8847047ab4e7d423c8aeb358367ea637 [0,1,1,0,0,0|1,0,1]=4 2431 B11R0.62 C=CCC(=O)NCC(C)OCC 46be90596571b91d1606c98aacc59af1 [0,1,1,0,0,0|1,0,1]=4 2432 B11R0.62 C=CCC(=O)NCC(O)CCC 40329ebca85d1e4c87ad858010e315d3 [0,1,1,0,0,0|1,0,1]=4 2433 B11R0.62 CC#CC(=O)NCC(C)OCC ab2ce380db049f16c6b1d049099c5ff9 [0,1,1,0,0,0|1,0,1]=4 2434 B11R0.62 CC#CC(=O)NCC(O)CCC 563e102df7f7e2b69655c9689860489d [0,1,1,0,0,0|1,0,1]=4 2435 B11R0.62 CCCC(=O)NCC(C)OCC 5402a150bb43f858f655038d2be6e996 [0,1,1,0,0,0|1,0,0]=3 2436 B11R0.62 CCCC(=O)NCC(O)CCC 4a65aec58a4bf3eeef8107bd670efb46 [0,1,1,0,0,0|1,0,0]=3 2437 B11R0.62 CCCC(=O)NCC(O)COC f7b7df33f807eed4834850641dbcc898 [0,1,1,0,0,0|2,0,0]=4 2438 B11R0.62 CCCC(=O)NC[C@H](O)COC 3191e9796c2bc6098082cc8668d7706f [0,1,1,0,0,0|2,0,0]=4 2439 B11R0.62 CCCC(=O)OCN(C)CCC 3f81cb354cfe83830751d858b6d8e501 [0,1,1,0,0,0|2,0,0]=4 2440 B11R0.62 CCCC(=S)OCC(C)CCC e073cff525470b00703e360819cad89b [0,1,1,0,0,0|1,1,0]=4 2441 B11R0.62 CCCC(=S)OC[C@@H](O)CCO 2949f1c59e5c5a185240b76bfc9dfc7b [0,1,1,0,0,0|1,1,0]=4 2442 B11R0.62 CCCC(C)OCC(C)OCC 868017a7a3d8a80dad77097e8bdc9871 [0,1,1,0,0,0|1,0,1]=4 2443 B11R0.62 CCCC(O)CNC(=O)CC#N 24374e8e66d1e36214c60897e48c36d1 [0,1,1,0,0,0|1,0,1]=4 2444 B11R0.62 CCCC(O)CNC(=O)CC=O 7b80dbfab7bcc30d469e3c08a964ed17 [0,1,1,0,0,0|1,0,1]=4 2445 B11R0.62 CCCC(O)CNC(=O)CCF 86d0c022d84ddeb4c1d0cf549484e865 [0,1,1,0,0,0|1,0,0]=3 2446 B11R0.62 CCCC(O)CNC(=O)CCO 974ffa0a02f5d2419682d501ed47d0b4 [0,1,1,0,0,0|1,0,0]=3 2447 B11R0.62 CCCC(O)CNC(=O)CCS 5437c42a35a9875549c9f63bd20c014f [0,1,1,0,0,0|1,0,0]=3 2448 B11R0.62 CCCC(O)CNC(=O)COC 6ba64c6ad6e43d7f14cae1e4e516b59e [0,1,1,0,0,0|1,0,0]=3 2449 B11R0.62 CCCC(O)CNC(=O)CON 8c943c1d0d4c8e7ada6ad5784017892d [0,1,1,0,0,0|2,0,0]=4 2450 B11R0.62 CCCC(O)CNC(=O)CSC d401cb41b399bfffc0b2977ed25b6354 [0,1,1,0,0,0|1,0,0]=3 2451 B11R0.62 CCCN(C)COC(=O)OCC c05e4893d29622f6fc5984c750d7a60e [0,1,1,0,0,0|2,0,0]=4 2452 B11R0.62 CCCN(C)COC(=O)SCC 1cf50c2c9a3cf95e5a77194f9b4a228d [0,1,1,0,0,0|2,0,0]=4 2453 B11R0.62 CCOC(C)CNC(=O)CC#N e8111880c49a83b2666d959a3125a9af [0,1,1,0,0,0|1,0,1]=4 2454 B11R0.62 CCOC(C)CNC(=O)CC=O 8977f3a5651d8cbfd9cc893c0f70b628 [0,1,1,0,0,0|1,0,1]=4 2455 B11R0.62 CCOC(C)CNC(=O)CCF 9f9e5842627c2f100d01d35b2804c156 [0,1,1,0,0,0|1,0,0]=3 2456 B11R0.62 CCOC(C)CNC(=O)CCO 9b626c53ae0ec0ebea9e28c587c9d0d8 [0,1,1,0,0,0|1,0,0]=3 2457 B11R0.62 CCOC(C)CNC(=O)CCS 3851040f14158b6fce997ad4593e9fce [0,1,1,0,0,0|1,0,0]=3 2458 B11R0.62 CCOC(C)CNC(=O)COC 0b035c1dbe10491a8897c4225dde9498 [0,1,1,0,0,0|1,0,0]=3 2459 B11R0.62 CCOC(C)CNC(=O)CON df9427b539e4550bcb4a7400eed6e696 [0,1,1,0,0,0|2,0,0]=4 2460 B11R0.62 CCOC(C)CNC(=O)CSC cd443a08c125798f62fe7dfc07c6ccf4 [0,1,1,0,0,0|1,0,0]=3 2461 B11R0.62 CCOC(C)COC(C)COC d0defbc23a31e8036ce72377e6d5c8a4 [0,1,1,0,0,0|1,0,1]=4 2462 B11R0.62 COCC(=O)NCC(O)COC 0af4e990b19ae563ee0119a1bfff3eed [0,1,1,0,0,0|2,0,0]=4 2463 B11R0.62 COCC(=O)NC[C@H](O)COC 22ed97162a19e15aa15c530c280a7860 [0,1,1,0,0,0|2,0,0]=4 2464 B11R0.62 COCC(O)CNC(=O)CCF fa710020662c96d822ac5fdf19829a09 [0,1,1,0,0,0|2,0,0]=4 2465 B11R0.62 COCC(O)CNC(=O)CCO 229f52ea3925ddc8781fadd9d1d3af5d [0,1,1,0,0,0|2,0,0]=4 2466 B11R0.62 COCC(O)CNC(=O)CCS ac3ef4dcfd1d4fc4022048ce2d9ad751 [0,1,1,0,0,0|2,0,0]=4 2467 B11R0.62 COCC(O)CNC(=O)CSC d1e63b394f3eea47e3e1c4ccd8c28318 [0,1,1,0,0,0|2,0,0]=4 2468 B11R0.62 COC[C@@H](O)CNC(=O)CCF fa974a490605fc99b8d4f15dee80bad9 [0,1,1,0,0,0|2,0,0]=4 2469 B11R0.62 COC[C@@H](O)CNC(=O)CCO 568596228eb297468dd810c0dab0c7fc [0,1,1,0,0,0|2,0,0]=4 2470 B11R0.62 COC[C@@H](O)CNC(=O)CCS 2caf8bc0f6422790ac220804f96b8e49 [0,1,1,0,0,0|2,0,0]=4 2471 B11R0.62 COC[C@@H](O)CNC(=O)CSC e839402850c44921bcfcdeb78ef257be [0,1,1,0,0,0|2,0,0]=4 2472 B11R0.100 CCC(=O)NCC(C)(O)COC 78f84d2c08e400368454bee54b0ffe25 [0,1,1,0,0,0|2,0,0]=4 2473 B11R0.100 CCCC(C)(O)CNC(=O)CC 38bdb4cf841452f2304adfb0af375a19 [0,1,1,0,0,0|1,0,0]=3 2474 B11R0.100 CCCC(C)(O)CNC(=O)CF d9a5c9078d9b29a0b8cbcd11c8ce60cf [0,1,1,0,0,0|2,0,0]=4 2475 B11R0.100 CCCC(C)(O)CNC(=O)CO d90804dfbf18e72283b4c7ecb72504a3 [0,1,1,0,0,0|2,0,0]=4 2476 B11R0.100 CCCC(C)(O)CNC(=O)CS 4d316ee37ca4fa053055fc5203edefaf [0,1,1,0,0,0|2,0,0]=4 2477 B11R0.100 CCOC(C)(C)COC(C)CC 4e546059a969a049e0b04f6d7e769fbd [0,1,1,0,0,0|1,0,1]=4 2478 B11R0.107 CC(C)CC(O)CNC(=O)CF db8ecd841a576cea33f6a58533c6d85f [0,1,1,0,0,0|2,0,0]=4 2479 B11R0.107 CC(C)CC(O)CNC(=O)CO 05e31cda24a3b160f752a837ac68b1d6 [0,1,1,0,0,0|2,0,0]=4 2480 B11R0.107 CC(C)CC(O)CNC(=O)CS e63555ea9303b61983cd883c99868a3d [0,1,1,0,0,0|2,0,0]=4 2481 B11R0.107 CCC(=O)NCC(O)CC(C)C a9d196a3f6fd66df88417dc9fd4b8553 [0,1,1,0,0,0|1,0,0]=3 2482 B11R0.107 CCC(=O)NCC(O)CN(C)C e46247c6517ce016ba130a6ca8c75df6 [0,1,1,0,0,0|2,0,0]=4 2483 B11R0.107 CCC(=O)OCN(C)CC(C)C 4f6abf96ca71967482838e67af3ef6c7 [0,1,1,0,0,0|2,0,0]=4 2484 B11R0.107 CCC(=O)OCN(C)CC(C)O 014d7e3fbdfa9aa7b7fb087ef602ddb1 [0,1,1,0,0,0|2,0,0]=4 2485 B11R0.107 CCC(=O)OCN(C)C[C@H](C)O feac153f50dcea5d93efd370cc5d93a9 [0,1,1,0,0,0|2,0,0]=4 2486 B11R0.107 COC(=O)CCC(C)OC(C)C ff9bdd990833332effcd028c616ca818 [0,1,1,0,0,0|2,0,0]=4 2487 B11R0.120 CCC(=O)OCN(C)C(C)CC 2d4d8c2ba4262f456f90d66889b1a3c8 [0,1,1,0,0,0|2,0,0]=4 2488 B11R0.141 C=C(C)C(=O)NCC(C)OCC f235d37aca44e7c787d60eb34c248866 [0,1,1,0,0,0|1,0,1]=4 2489 B11R0.141 C=C(C)C(=O)NCC(O)CCC 177ac21a41cb1a813cc1c33cf1be6e5c [0,1,1,0,0,0|1,0,1]=4 2490 B11R0.141 C=C(C)C(=O)OCC(C)OCC 729a7fefe652445df94af2e8924ae930 [0,1,1,0,0,0|0,0,1]=3 2491 B11R0.141 C=C(C)C(=O)OCC(C)OCF 1756a003393768680661834cce5811e7 [0,1,1,0,0,0|1,0,1]=4 2492 B11R0.141 CCCC(O)CNC(=O)C(=O)C e379b892f28f7db5371ac8f89610abcd [0,1,1,0,0,0|1,0,1]=4 2493 B11R0.141 CCCC(O)CNC(=O)C(C)F c9d4cf480af89abe9b670e58da45e219 [0,1,1,0,0,0|1,0,0]=3 2494 B11R0.141 CCCC(O)CNC(=O)C(C)O b0a60974fdc2fd4af2053f490994c618 [0,1,1,0,0,0|1,0,0]=3 2495 B11R0.141 CCCC(O)CNC(=O)C(C)S b23dee64360055c600c2173a0d459641 [0,1,1,0,0,0|1,0,0]=3 2496 B11R0.141 CCCC(O)CNC(=O)C(F)F 337f1562ac68410d3ec56d5ace114e5a [0,1,1,0,0,0|2,0,0]=4 2497 B11R0.141 CCCC(O)CNC(=O)C(O)O dc6d4a893977002a06de9b8a479973d9 [0,1,1,0,0,0|2,0,0]=4 2498 B11R0.141 CCCC(O)CNC(=O)[C@@H](C)F 208945b685546104327a5a76d9ecd4a1 [0,1,1,0,0,0|1,0,0]=3 2499 B11R0.141 CCCC(O)CNC(=O)[C@@H](C)O 2d78837799babd9c6ca58e74951df8cd [0,1,1,0,0,0|1,0,0]=3 2500 B11R0.141 CCCC(O)CNC(=O)[C@H](C)F 2f6002ac91068dfd578f945bc5d964f8 [0,1,1,0,0,0|1,0,0]=3 2501 B11R0.141 CCCC(O)CNC(=O)[C@H](C)O de4e99e07e14ba35bb6c5852825a4a84 [0,1,1,0,0,0|1,0,0]=3 2502 B11R0.141 CCCN(C)COC(=O)C(C)C 2f24674e0def1369f3c6397f715782ec [0,1,1,0,0,0|2,0,0]=4 2503 B11R0.141 CCOC(C)CNC(=O)C(=O)C 1f621df53ca19d08783f6ed5d3cb2e69 [0,1,1,0,0,0|1,0,1]=4 2504 B11R0.141 CCOC(C)CNC(=O)C(C)F 55a3b6a35ffdc99181d978b4760a542e [0,1,1,0,0,0|1,0,0]=3 2505 B11R0.141 CCOC(C)CNC(=O)C(C)O 14084540ca124ec96cff3972bae5596f [0,1,1,0,0,0|1,0,0]=3 2506 B11R0.141 CCOC(C)CNC(=O)C(C)S fdbc6bb4d6030dca04c838bfaa0bb533 [0,1,1,0,0,0|1,0,0]=3 2507 B11R0.141 CCOC(C)CNC(=O)C(F)F 6fac36f1427f3789366d86a09a2ec7d2 [0,1,1,0,0,0|2,0,0]=4 2508 B11R0.141 CCOC(C)CNC(=O)C(O)O 5c299e6cf00712086d6c32e987e5f928 [0,1,1,0,0,0|2,0,0]=4 2509 B11R0.141 CCOC(C)CNC(=O)[C@@H](C)F 92911724cd65419401ba268445e76bb4 [0,1,1,0,0,0|1,0,0]=3 2510 B11R0.141 CCOC(C)CNC(=O)[C@@H](C)O 68a36f5ba0b38118e223206b3374da80 [0,1,1,0,0,0|1,0,0]=3 2511 B11R0.141 CCOC(C)CNC(=O)[C@H](C)F b10ed692a9c9493e3ff90bcbf2b0c39e [0,1,1,0,0,0|1,0,0]=3 2512 B11R0.141 CCOC(C)CNC(=O)[C@H](C)O 1cfbf400b6dc589f7b6472f5ff8ce275 [0,1,1,0,0,0|1,0,0]=3 2513 B11R0.141 CCOC(C)COC(C)C(C)C ae93dd1713642c1dedb2c157e2d4dfdd [0,1,1,0,0,0|1,0,1]=4 2514 B11R0.141 COCC(O)CNC(=O)C(C)F dff467c427075d8fb7927ab905f75977 [0,1,1,0,0,0|2,0,0]=4 2515 B11R0.141 COCC(O)CNC(=O)C(C)O ccf8aa1bcae06066f5b5d4d2cd35f331 [0,1,1,0,0,0|2,0,0]=4 2516 B11R0.141 COCC(O)CNC(=O)C(C)S 60099409e9f11d0b6e1f210879431034 [0,1,1,0,0,0|2,0,0]=4 2517 B11R0.141 COCC(O)CNC(=O)[C@@H](C)F 15236dcd6fcf7c4df1e2bb4f0d29d917 [0,1,1,0,0,0|2,0,0]=4 2518 B11R0.141 COCC(O)CNC(=O)[C@@H](C)O 210cf65213623e49c69fc9743a7470b0 [0,1,1,0,0,0|2,0,0]=4 2519 B11R0.141 COCC(O)CNC(=O)[C@H](C)F ff1493689b5e7f64ca3270642586d332 [0,1,1,0,0,0|2,0,0]=4 2520 B11R0.141 COCC(O)CNC(=O)[C@H](C)O 4434a62206264f8eaeefdb11d87c7057 [0,1,1,0,0,0|2,0,0]=4 2521 B11R0.141 COC[C@@H](O)CNC(=O)C(C)F 77697905f283c5c73766a867617c4cc0 [0,1,1,0,0,0|2,0,0]=4 2522 B11R0.141 COC[C@@H](O)CNC(=O)C(C)O 85291281f5bbfd595f648a36cd58dabd [0,1,1,0,0,0|2,0,0]=4 2523 B11R0.141 COC[C@@H](O)CNC(=O)C(C)S 3e3b1d00cdfbae36252d20961c205a9d [0,1,1,0,0,0|2,0,0]=4 2524 B11R0.141 COC[C@@H](O)CNC(=O)[C@@H](C)F 373024cc41e5862570fc231e4acc7291 [0,1,1,0,0,0|2,0,0]=4 2525 B11R0.141 COC[C@@H](O)CNC(=O)[C@@H](C)O f9a75d3620f22507675b281fd7f4bde1 [0,1,1,0,0,0|2,0,0]=4 2526 B11R0.141 COC[C@@H](O)CNC(=O)[C@H](C)F f177dfd963d56a5e4aff5a2c65546b0b [0,1,1,0,0,0|2,0,0]=4 2527 B11R0.141 COC[C@@H](O)CNC(=O)[C@H](C)O c30afb11d16576554baae7b0c664219f [0,1,1,0,0,0|2,0,0]=4 2528 B11R0.187 CCC(=O)N(C)CC(O)COC 9a05199a9fbdf40c24ec20f190feff5a [0,1,1,0,0,0|2,0,0]=4 2529 B11R0.187 CCOC(C)CN(C)C(=O)CC dc3d31dfeb503db509b739921fb0f590 [0,1,1,0,0,0|1,0,0]=3 2530 B11R0.187 CCOC(C)CN(C)C(=O)CF 4da96fc382329692ae86cd301bbfa5c1 [0,1,1,0,0,0|2,0,0]=4 2531 B11R0.187 CCOC(C)CN(C)C(=O)CO cdbb0dafd1945e5627e87fb38b1cd50a [0,1,1,0,0,0|2,0,0]=4 2532 B11R0.187 CCOC(C)CN(C)C(=O)CS bbfefdba0ecdd75625bca70a99366c49 [0,1,1,0,0,0|2,0,0]=4 2533 B11R1.4 BrCCNCCC1CCCO1 c0a083a4101a7d4c27a65fbae63ac17d [1,1,0,0,0,0|2,0,0]=4 2534 B11R1.4 C#CCCOCC1CCCO1 9c0e66d5c7bdbd768feef8da67c3de16 [1,1,0,0,0,0|0,0,2]=4 2535 B11R1.4 C#CCCOC[C@@H]1CCCO1 812306d800a6adce2f267984d451e804 [1,1,0,0,0,0|0,0,2]=4 2536 B11R1.4 C#CCCOC[C@H]1CCCO1 7120cf2cdb06147be0229a3d084782ae [1,1,0,0,0,0|0,0,2]=4 2537 B11R1.4 C/C=C/CNCC1CCCO1 222a6fc94a9973804a3ada1b4b93d4bb [1,1,0,0,0,0|1,0,1]=4 2538 B11R1.4 C/C=C/CNC[C@@H]1CCCO1 289edb849788cb6743e17644bc8f7e9c [1,1,0,0,0,0|1,0,1]=4 2539 B11R1.4 C/C=C/CNC[C@H]1CCCO1 609e919167fb26df9b3d0b71adf3ac1c [1,1,0,0,0,0|1,0,1]=4 2540 B11R1.4 C/C=C/COCC1CCCC1 a109e759f4dc3df0028b516281227c4b [1,1,0,0,0,0|1,0,1]=4 2541 B11R1.4 C/C=C/COCC1CCCO1 6a0d5331bd1a0f9b0bf753e5fb13b702 [1,1,0,0,0,0|0,0,1]=3 2542 B11R1.4 C/C=C/COCC1CCCS1 6cf06f833317a921f821b35f2bdb9744 [1,1,0,0,0,0|0,1,1]=4 2543 B11R1.4 C/C=C/COC[C@@H]1CCCO1 1777ddcf43fce2627f7f3c7797620c9e [1,1,0,0,0,0|0,0,1]=3 2544 B11R1.4 C/C=C/COC[C@H]1CCCO1 c625a6602d9e2243dd1d747509d897bc [1,1,0,0,0,0|0,0,1]=3 2545 B11R1.4 C/C=C\CNCC1CCCO1 be618fa33e62aa7c5eab6f53f0d3278d [1,1,0,0,0,0|1,0,1]=4 2546 B11R1.4 C/C=C\CNC[C@@H]1CCCO1 1f08db53f44b3b011a456bc3660fa5b7 [1,1,0,0,0,0|1,0,1]=4 2547 B11R1.4 C/C=C\CNC[C@H]1CCCO1 2705e42569b3a168af63ee1c8d67105a [1,1,0,0,0,0|1,0,1]=4 2548 B11R1.4 C/C=C\COCC1CCCC1 b0c52cd416b1ccb88aeee041a9b13644 [1,1,0,0,0,0|1,0,1]=4 2549 B11R1.4 C/C=C\COCC1CCCO1 4bdffdae38377839b9babf38b80c4672 [1,1,0,0,0,0|0,0,1]=3 2550 B11R1.4 C/C=C\COCC1CCCS1 210c27e692d0b90316ea44f5db8af0eb [1,1,0,0,0,0|0,1,1]=4 2551 B11R1.4 C/C=C\COC[C@@H]1CCCO1 3b66c75ac0a7237e19b1d696907cb9c4 [1,1,0,0,0,0|0,0,1]=3 2552 B11R1.4 C/C=C\COC[C@H]1CCCO1 2ebc75f448e76e562e6a859ffd7b46cb [1,1,0,0,0,0|0,0,1]=3 2553 B11R1.4 C=CCCOCC1CCCO1 e9547269df10b458973381b2a960ee1f [1,1,0,0,0,0|0,0,2]=4 2554 B11R1.4 C=CCCOC[C@@H]1CCCO1 963c8c78278b45ed30b73852e890f858 [1,1,0,0,0,0|0,0,2]=4 2555 B11R1.4 C=CCCOC[C@H]1CCCO1 41380c10708d509b282942d04d9e94cb [1,1,0,0,0,0|0,0,2]=4 2556 B11R1.4 CC#CCOCC1CCCO1 5aa8bf1cff99afe5bed22c2d50dd8530 [1,1,0,0,0,0|0,0,2]=4 2557 B11R1.4 CC/C=C/CNC1CCCC1 59de48df724d02ca8afb579334e260e1 [1,1,0,0,0,0|2,0,0]=4 2558 B11R1.4 CC/C=C/COC1CCCC1 22f1a97617cf69c83dda239e5f114c0f [1,1,0,0,0,0|2,0,0]=4 2559 B11R1.4 CC/C=C/COC1CCCO1 fcb332c7f10d2c1e2c40d9dca815d1de [1,1,0,0,0,0|1,0,0]=3 2560 B11R1.4 CC/C=C\COC1CCCC1 091a743790bd53272236b12a8a7729cc [1,1,0,0,0,0|2,0,0]=4 2561 B11R1.4 CC=CCNCC1CCCO1 a37df501a64cfc27f30b5b11b8c7085b [1,1,0,0,0,0|1,0,1]=4 2562 B11R1.4 CC=CCOCC1CCCC1 8d2de38ac431ab6769c703e25b42b621 [1,1,0,0,0,0|1,0,1]=4 2563 B11R1.4 CC=CCOCC1CCCO1 a8e4c778047dd0bae7dc052c50405b67 [1,1,0,0,0,0|0,0,1]=3 2564 B11R1.4 CCC#CCOC1CCCO1 0836fc7f6c213658ffd9317d731199a3 [1,1,0,0,0,0|1,0,1]=4 2565 B11R1.4 CCCCCOC1CCCO1 4fcbb7f6db51b6632373c914ef3e210b [1,1,0,0,0,0|1,0,1]=4 2566 B11R1.4 CCCCNCC1CCCO1 5d381b028ebc3f6431ec0eb23ad96dad [1,1,0,0,0,0|1,0,1]=4 2567 B11R1.4 CCCCNC[C@@H]1CCCO1 40dda0a054e0f6d4dfaa5e4acfc3764d [1,1,0,0,0,0|1,0,1]=4 2568 B11R1.4 CCCCNC[C@H]1CCCO1 853017986931ae50dc82e6512a1e6233 [1,1,0,0,0,0|1,0,1]=4 2569 B11R1.4 CCCCOCC1CCCC1 5d7d52a8e3864fa84e0735eddb42e7ca [1,1,0,0,0,0|1,0,1]=4 2570 B11R1.4 CCCCOCC1CCCO1 0862079b3487ea18c32c1e28ed491ec7 [1,1,0,0,0,0|0,0,1]=3 2571 B11R1.4 CCCCOCC1CCCS1 f709349bfbc3122f056b12f6f926e50a [1,1,0,0,0,0|0,1,1]=4 2572 B11R1.4 CCCCOC[C@@H]1CCCO1 db05d7cd3184532e54140a366489df45 [1,1,0,0,0,0|0,0,1]=3 2573 B11R1.4 CCCCOC[C@H]1CCCO1 e5dcfa56095b26c5f6b49e16a96ea7d8 [1,1,0,0,0,0|0,0,1]=3 2574 B11R1.4 CCCNCCC1CCCO1 16ccc3766cb64abb779cf31870fdd1b1 [1,1,0,0,0,0|1,0,1]=4 2575 B11R1.4 CCCOCCC1CCCC1 787081f1fdbda17248ae4c818980f2e7 [1,1,0,0,0,0|1,0,1]=4 2576 B11R1.4 CCCOCCC1CCCO1 0bafcd2daa31466cb920a9ddb84cb9da [1,1,0,0,0,0|0,0,1]=3 2577 B11R1.4 CCOCCOC1CCCO1 b0ad09391e5328612b72dfdb37cec42d [1,1,0,0,0,0|2,0,0]=4 2578 B11R1.4 CCOCNCC1CCCO1 79bd9dd90ba358ccba26c11bf3fee7a9 [1,1,0,0,0,0|1,0,1]=4 2579 B11R1.4 CCOCNC[C@@H]1CCCO1 4797db02add42ddd726dd979e028b26a [1,1,0,0,0,0|1,0,1]=4 2580 B11R1.4 CCOCNC[C@H]1CCCO1 d1a1cb69f076699fe55c5c2ad6c11144 [1,1,0,0,0,0|1,0,1]=4 2581 B11R1.4 CCOCOCC1CCCC1 f11de0c351dc85a7ba0f8d0d4e967aff [1,1,0,0,0,0|1,0,1]=4 2582 B11R1.4 CCOCOCC1CCCO1 1cb31ec50d09f82dae75ebae945630a6 [1,1,0,0,0,0|0,0,1]=3 2583 B11R1.4 CCOCOCC1CCCS1 43b71fa719ecf86c8b76ef0ec484744a [1,1,0,0,0,0|0,1,1]=4 2584 B11R1.4 CCOCOC[C@@H]1CCCO1 344be4f60a898a063ae103633a8489f4 [1,1,0,0,0,0|0,0,1]=3 2585 B11R1.4 CCOCOC[C@H]1CCCO1 72c1f519132345ca691996db4b9b9513 [1,1,0,0,0,0|0,0,1]=3 2586 B11R1.4 CCSCCOC1CCCO1 4a9929986a979c7643bb1f72c35f2070 [1,1,0,0,0,0|2,0,0]=4 2587 B11R1.4 COCCNCC1CCCO1 f1c6a4f018db81c8de1ca2b8a4f58241 [1,1,0,0,0,0|1,0,1]=4 2588 B11R1.4 COCCNC[C@@H]1CCCO1 b955ea033c61ef3215b739aef9ddfbbf [1,1,0,0,0,0|1,0,1]=4 2589 B11R1.4 COCCNC[C@H]1CCCO1 5fef1325977611ab297316380d839ac5 [1,1,0,0,0,0|1,0,1]=4 2590 B11R1.4 COCCOCC1CCCC1 ae41cff914790c1527889061fc5b0d54 [1,1,0,0,0,0|1,0,1]=4 2591 B11R1.4 COCCOCC1CCCO1 1ce1879d94a2f0b74de16ab001c0394c [1,1,0,0,0,0|0,0,1]=3 2592 B11R1.4 COCCOCC1CCCS1 fb76911815bdf3e44e15b1719b2f8130 [1,1,0,0,0,0|0,1,1]=4 2593 B11R1.4 COCCOC[C@@H]1CCCO1 9b724152160aee4e02d4398211b1ac54 [1,1,0,0,0,0|0,0,1]=3 2594 B11R1.4 COCCOC[C@H]1CCCO1 d73f3630462599e690ed2f7f5dc1ac78 [1,1,0,0,0,0|0,0,1]=3 2595 B11R1.4 COCNCCC1CCCO1 9a0232c431ae1bcf9d059906ea761a03 [1,1,0,0,0,0|2,0,0]=4 2596 B11R1.4 COCOCCC1CCCO1 98106163cd8c8b33957912ea6da0516f [1,1,0,0,0,0|1,0,1]=4 2597 B11R1.4 CSCCNCC1CCCO1 5d4fc8976047398a47e72a8a5d24b98e [1,1,0,0,0,0|1,0,1]=4 2598 B11R1.4 CSCCNC[C@@H]1CCCO1 472826f46b6dcbd38ae02d18d8687cae [1,1,0,0,0,0|1,0,1]=4 2599 B11R1.4 CSCCNC[C@H]1CCCO1 4e5a49e4fdee6f5edbd429479a83d6ff [1,1,0,0,0,0|1,0,1]=4 2600 B11R1.4 CSCCOCC1CCCC1 29a6f4c60f43d72cc4d1ff9907b37f0b [1,1,0,0,0,0|1,0,1]=4 2601 B11R1.4 CSCCOCC1CCCO1 376bd3025414ae8fdf8ccc8da9863fdd [1,1,0,0,0,0|0,0,1]=3 2602 B11R1.4 CSCCOCC1CCCS1 4b38b7a4824c954c2087211468e78a38 [1,1,0,0,0,0|0,1,1]=4 2603 B11R1.4 CSCCOC[C@@H]1CCCO1 19b369ae718c5519ac5c16ffad609884 [1,1,0,0,0,0|0,0,1]=3 2604 B11R1.4 CSCCOC[C@H]1CCCO1 6347360c5092e5837d9723eb0642ac6b [1,1,0,0,0,0|0,0,1]=3 2605 B11R1.4 CSCNCCC1CCCO1 33cfe764811b18cdfe79adce2892c2b0 [1,1,0,0,0,0|2,0,0]=4 2606 B11R1.4 CSCOCCC1CCCO1 f234f9e56974e09368af8575207cdce0 [1,1,0,0,0,0|1,0,1]=4 2607 B11R1.4 Cl/C=C/COCC1CCCO1 5b4fb773353a1981c83c2a41f16951ff [1,1,0,0,0,0|1,0,1]=4 2608 B11R1.4 Cl/C=C/COC[C@@H]1CCCO1 fd693d78f0c524b6bf2cc503d30898d7 [1,1,0,0,0,0|1,0,1]=4 2609 B11R1.4 Cl/C=C/COC[C@H]1CCCO1 5f88f8b4d0ab6af0b2fb0cd21d2d8c68 [1,1,0,0,0,0|1,0,1]=4 2610 B11R1.4 Cl/C=C\COCC1CCCO1 8d88ae3fa01e58eb858850c6af90c2a6 [1,1,0,0,0,0|1,0,1]=4 2611 B11R1.4 Cl/C=C\COC[C@@H]1CCCO1 05620f0d5b8459f477faf071d7ea59a3 [1,1,0,0,0,0|1,0,1]=4 2612 B11R1.4 Cl/C=C\COC[C@H]1CCCO1 1978499c8b24f9d596797104828a90dc [1,1,0,0,0,0|1,0,1]=4 2613 B11R1.4 ClC=CCOCC1CCCO1 ad606528b050abe54b5e5ad81893bd81 [1,1,0,0,0,0|1,0,1]=4 2614 B11R1.4 ClCCCNCC1CCCO1 4e552f25ccb518e2c27aed9928a8ea28 [1,1,0,0,0,0|1,0,1]=4 2615 B11R1.4 FCCCNCC1CCCO1 31d37c2be125a6437318c1fe81bbc145 [1,1,0,0,0,0|1,0,1]=4 2616 B11R1.4 FCCCNC[C@@H]1CCCO1 58898ba9f8930c1a8bc01e6668ee7370 [1,1,0,0,0,0|1,0,1]=4 2617 B11R1.4 FCCCNC[C@H]1CCCO1 52756df4534f1dec2ae6c1cfc888d278 [1,1,0,0,0,0|1,0,1]=4 2618 B11R1.4 FCCCOCC1CCCC1 90db026f29caada687147a5f57cb9dee [1,1,0,0,0,0|1,0,1]=4 2619 B11R1.4 FCCCOCC1CCCO1 6d5299ad50c4f7a2ca1eb6c774102842 [1,1,0,0,0,0|0,0,1]=3 2620 B11R1.4 FCCCOCC1CCCS1 a365ca114918eb5d8675c208176b2395 [1,1,0,0,0,0|0,1,1]=4 2621 B11R1.4 FCCCOC[C@@H]1CCCO1 444231d54a2dc4d2b3f0d3b53120761a [1,1,0,0,0,0|0,0,1]=3 2622 B11R1.4 FCCCOC[C@H]1CCCO1 58135f1e0eccc4e94209a292b16840db [1,1,0,0,0,0|0,0,1]=3 2623 B11R1.4 FCCNCCC1CCCO1 a3d73c71bd8ff99249be076e2dba7985 [1,1,0,0,0,0|2,0,0]=4 2624 B11R1.4 FCCOCCC1CCCO1 b3337743ac442e3cb86ab0a0cbfc5962 [1,1,0,0,0,0|1,0,1]=4 2625 B11R1.4 ICCNCCC1CCCO1 3b588dcaf765ca6d8058558ed1175eb7 [1,1,0,0,0,0|2,0,0]=4 2626 B11R1.4 N#CCCOCC1CCCO1 1966b2c22a4877f72f04aa61af83bdc6 [1,1,0,0,0,0|0,0,2]=4 2627 B11R1.4 N#CCCOC[C@@H]1CCCO1 5dadde89ce5b939716894f5751739432 [1,1,0,0,0,0|0,0,2]=4 2628 B11R1.4 N#CCCOC[C@H]1CCCO1 d68e0e1da9436b8c09cd78d25f3b97c6 [1,1,0,0,0,0|0,0,2]=4 2629 B11R1.4 O=CCCOCC1CCCO1 0112edb00192dbe10474933731c58da7 [1,1,0,0,0,0|0,0,2]=4 2630 B11R1.4 O=CCCOC[C@@H]1CCCO1 dd1d276249682978d17d9dd6359625db [1,1,0,0,0,0|0,0,2]=4 2631 B11R1.4 O=CCCOC[C@H]1CCCO1 322766ff0154e17926b8ba61c199e358 [1,1,0,0,0,0|0,0,2]=4 2632 B11R1.4 OCCCNCC1CCCO1 9b7bbcf71b32bf8227aa0c63ca744a8c [1,1,0,0,0,0|1,0,1]=4 2633 B11R1.4 OCCCNC[C@@H]1CCCO1 f574b2ada6ddbe87f78b330c3f10856c [1,1,0,0,0,0|1,0,1]=4 2634 B11R1.4 OCCCNC[C@H]1CCCO1 19ba165d64649875173e26444a23725e [1,1,0,0,0,0|1,0,1]=4 2635 B11R1.4 OCCNCCC1CCCO1 ebbc41d2d98547f43619a37a5170a3e0 [1,1,0,0,0,0|2,0,0]=4 2636 B11R1.4 SCCCNCC1CCCO1 e58940cefbbc45b26d9694745794c605 [1,1,0,0,0,0|1,0,1]=4 2637 B11R1.4 SCCCNC[C@@H]1CCCO1 3bf0c46d909e703587e42c273e8bd15c [1,1,0,0,0,0|1,0,1]=4 2638 B11R1.4 SCCCNC[C@H]1CCCO1 fbec23e6563db7ebded7c6f15b9f9c4a [1,1,0,0,0,0|1,0,1]=4 2639 B11R1.4 SCCCOCC1CCCC1 ae80ab892b5a8d24d91965a9b0c43c5b [1,1,0,0,0,0|1,0,1]=4 2640 B11R1.4 SCCCOCC1CCCO1 f62114df2d600bcfc8eaf17f81c08646 [1,1,0,0,0,0|0,0,1]=3 2641 B11R1.4 SCCCOCC1CCCS1 5991c1c4c1e10b14b1fe028f166bee63 [1,1,0,0,0,0|0,1,1]=4 2642 B11R1.4 SCCCOC[C@@H]1CCCO1 b26a6a8df291eb7ddef5d8d2c8bddb34 [1,1,0,0,0,0|0,0,1]=3 2643 B11R1.4 SCCCOC[C@H]1CCCO1 a54cf16c8e034aa1b8202b30f8e4db90 [1,1,0,0,0,0|0,0,1]=3 2644 B11R1.4 SCCNCCC1CCCO1 c757e149cd5d735618f1d459bd85820f [1,1,0,0,0,0|2,0,0]=4 2645 B11R1.4 SCCOCCC1CCCO1 a35aa355bd74b038afbefb4022497197 [1,1,0,0,0,0|1,0,1]=4 2646 B11R1.27 CC1CCC(O1)COCCF 1c413b20a42caec92df5871a5ebe9060 [1,1,0,0,0,0|1,0,1]=4 2647 B11R1.27 CC1CCC(O1)COCCS b572ab71cb2d94e94696cc79ba7c16e9 [1,1,0,0,0,0|1,0,1]=4 2648 B11R1.27 CCCOCC1CCC(=O)O1 e9e82695e85d6e35f1d9b435b1472756 [1,1,0,0,0,0|0,0,2]=4 2649 B11R1.27 CCCOCC1CCC(C1)C 819058e3ecf0d52c49ee3a150c8e2ef6 [1,1,0,0,0,0|1,0,1]=4 2650 B11R1.27 CCCOCC1CCC(C1)F 87719ac22c4738670ba9dd72d068fc80 [1,1,0,0,0,0|1,0,1]=4 2651 B11R1.27 CCCOCC1CCC(O1)C 7245c0506fa318f9ec0ffb8bd206fb82 [1,1,0,0,0,0|0,0,1]=3 2652 B11R1.27 CCCOC[C@@H]1CCC(=O)O1 451cbd28723ca3d63ce2083daa5f1a8b [1,1,0,0,0,0|0,0,2]=4 2653 B11R1.27 CCCOC[C@@H]1CC[C@@H](O1)C dc1d7f544da463b9fa3fdd86a4095b16 [1,1,0,0,0,0|0,0,1]=3 2654 B11R1.27 CCCOC[C@@H]1CC[C@H](C1)F 9e171726fdb5a6aa8e0186feddd222a7 [1,1,0,0,0,0|1,0,1]=4 2655 B11R1.27 CCCOC[C@H]1CCC(=O)O1 ba98c0589f5943fe8be2745df7bb5cb9 [1,1,0,0,0,0|0,0,2]=4 2656 B11R1.27 CCCOC[C@H]1CC[C@H](C1)F 849cfd95241dd12aab96c1eb141af76e [1,1,0,0,0,0|1,0,1]=4 2657 B11R1.27 COCOCC1CCC(O1)C b86580239ae6f55d3e76bf6a67d04949 [1,1,0,0,0,0|1,0,1]=4 2658 B11R1.27 COCOC[C@@H]1CC[C@@H](O1)C 8b9fb183ff5c8c6c471418940919a792 [1,1,0,0,0,0|1,0,1]=4 2659 B11R1.27 CSCOCC1CCC(O1)C 80d2f9ecc7f9ccf057baaf55753ca301 [1,1,0,0,0,0|1,0,1]=4 2660 B11R1.27 CSCOC[C@@H]1CC[C@@H](O1)C d2fb52c0a1db763a55bde8d82de02d07 [1,1,0,0,0,0|1,0,1]=4 2661 B11R1.27 C[C@H]1CC[C@H](O1)COCCF e6194d905dff7c4a56813bb870a42536 [1,1,0,0,0,0|1,0,1]=4 2662 B11R1.27 C[C@H]1CC[C@H](O1)COCCS ae1d0659f14d013b4d33940a9e6fcac4 [1,1,0,0,0,0|1,0,1]=4 2663 B11R1.29 CCCNC(C)C1CCCO1 0f26469986da9d5f5d15b5588f945473 [1,1,0,0,0,0|1,0,1]=4 2664 B11R1.29 CCCN[C@@H](C)[C@@H]1CCCO1 a474011f5148542904d53f21f159ec0a [1,1,0,0,0,0|1,0,1]=4 2665 B11R1.29 CCCOC(C)C1CCCC1 f54ecb6e7152619579e8912e760516aa [1,1,0,0,0,0|1,0,1]=4 2666 B11R1.29 CCCO[C@H](C)[C@H]1CCCO1 70091228d1070c2012e2367279973562 [1,1,0,0,0,0|0,0,1]=3 2667 B11R1.29 COCO[C@H](C)[C@H]1CCCO1 516491ed6c833416fd0c4a1dd01136cf [1,1,0,0,0,0|1,0,1]=4 2668 B11R1.29 CSCO[C@H](C)[C@H]1CCCO1 6c32e35e12d85994e8682fa7cf838c5c [1,1,0,0,0,0|1,0,1]=4 2669 B11R1.29 C[C@@H](OCCF)[C@H]1CCCO1 b0f4311ae0360a56e95fd2438f440d01 [1,1,0,0,0,0|1,0,1]=4 2670 B11R1.29 C[C@@H](OCCS)[C@H]1CCCO1 c95253b6a9b6b6125d463ec13721e08a [1,1,0,0,0,0|1,0,1]=4 2671 B11R1.30 CCCN(C)CC1CCCO1 5bc1260d30b51ebc8759e4aa87245857 [1,1,0,0,0,0|1,0,1]=4 2672 B11R1.172 C=C(C)COCC1CCCO1 1394345bb9cd68cafef92bac10b3019c [1,1,0,0,0,0|0,0,2]=4 2673 B11R1.172 C=C(C)COC[C@@H]1CCCO1 30960248dd862893c63fe447a63ea1b8 [1,1,0,0,0,0|0,0,2]=4 2674 B11R1.172 C=C(C)COC[C@H]1CCCO1 ff1192d1f7dd4916e627fdb599b29565 [1,1,0,0,0,0|0,0,2]=4 2675 B11R1.172 CC(=O)COCC1CCCO1 2c3e1702a47218da12df3ef7a9f9a5a2 [1,1,0,0,0,0|0,0,2]=4 2676 B11R1.172 CC(C)CNCC1CCCO1 c8bb9b14f50eb7d86d4352d15527e664 [1,1,0,0,0,0|1,0,1]=4 2677 B11R1.172 CC(C)CNC[C@@H]1CCCO1 1a6a360093e0f61c768f77e6be81912d [1,1,0,0,0,0|1,0,1]=4 2678 B11R1.172 CC(C)CNC[C@H]1CCCO1 d14e84a1e0c884d66e855bad7cbd3f00 [1,1,0,0,0,0|1,0,1]=4 2679 B11R1.172 CC(C)COCC1CCCC1 a4568b2e8bf0af295d42d4309f6c7194 [1,1,0,0,0,0|1,0,1]=4 2680 B11R1.172 CC(C)COCC1CCCO1 c19245966df133d3e6673bed483ce5b3 [1,1,0,0,0,0|0,0,1]=3 2681 B11R1.172 CC(C)COCC1CCCS1 ebc5f63a6c129bcbb5418bda0490a190 [1,1,0,0,0,0|0,1,1]=4 2682 B11R1.172 CC(C)COC[C@@H]1CCCO1 0f50d1f0b8334ac8e38fa3b7001eaebc [1,1,0,0,0,0|0,0,1]=3 2683 B11R1.172 CC(C)COC[C@H]1CCCO1 ae13e38116dc44a8d85b3ba78240236b [1,1,0,0,0,0|0,0,1]=3 2684 B11R1.172 CC(C)NCCC1CCCO1 3564f9f26464fb29d67b8556d9c32352 [1,1,0,0,0,0|2,0,0]=4 2685 B11R1.172 CC(C)OCCC1CCCO1 545d12f0549e5a9e403f4161275f31ae [1,1,0,0,0,0|2,0,0]=4 2686 B11R1.172 CC(F)COCC1CCCC1 dcb6fb80664e4ade78bd17c5ebf20ed5 [1,1,0,0,0,0|1,0,1]=4 2687 B11R1.172 CC(F)COCC1CCCO1 7e96e923a93cea7a74e8cefcb07e9410 [1,1,0,0,0,0|0,0,1]=3 2688 B11R1.172 CC(O)CNCC1CCCO1 2f429a5a820f62234066f1327fddb7aa [1,1,0,0,0,0|1,0,1]=4 2689 B11R1.172 CC(O)CNC[C@@H]1CCCO1 cd252f4db35c96b8fcb9fb0122bf96f5 [1,1,0,0,0,0|1,0,1]=4 2690 B11R1.172 CC(O)CNC[C@H]1CCCO1 e67d50fb7ea2de51b4e28c4ec7677bf9 [1,1,0,0,0,0|1,0,1]=4 2691 B11R1.172 CC(S)COCC1CCCC1 e420e20ebb4cd17abe651606ab660b4a [1,1,0,0,0,0|1,0,1]=4 2692 B11R1.172 CC(S)COCC1CCCO1 c6fa18606075cdf47c69ae7bc5662241 [1,1,0,0,0,0|0,0,1]=3 2693 B11R1.172 CN(C)COCC1CCCO1 59333351334ec457a768dc7465ab46fd [1,1,0,0,0,0|1,0,1]=4 2694 B11R1.172 CN(C)COC[C@@H]1CCCO1 f3f59641decf02211d6c40a80e58f8e5 [1,1,0,0,0,0|1,0,1]=4 2695 B11R1.172 CN(C)COC[C@H]1CCCO1 fc4fee13794b0c8d197b5d6616cb13c0 [1,1,0,0,0,0|1,0,1]=4 2696 B11R1.172 C[C@@H](F)COCC1CCCC1 ef04540a3052c1c3b1e04a0342b97fb5 [1,1,0,0,0,0|1,0,1]=4 2697 B11R1.172 C[C@@H](F)COCC1CCCO1 0c6781b9aecb1867dbf0d7d34d62fcf8 [1,1,0,0,0,0|0,0,1]=3 2698 B11R1.172 C[C@@H](O)CNCC1CCCO1 0ef386de7c28dfd30305c630e088beaa [1,1,0,0,0,0|1,0,1]=4 2699 B11R1.172 C[C@@H](O)CNC[C@@H]1CCCO1 a03faa5897767e6da81d61348b5f99ca [1,1,0,0,0,0|1,0,1]=4 2700 B11R1.172 C[C@@H](O)CNC[C@H]1CCCO1 b63ee975238fc0480db8d4f9c00f9ac2 [1,1,0,0,0,0|1,0,1]=4 2701 B11R1.172 C[C@H](F)COCC1CCCC1 4676f0369cc636d85558583120f0ada7 [1,1,0,0,0,0|1,0,1]=4 2702 B11R1.172 C[C@H](F)COCC1CCCO1 f2a77aab7ab906a3b33ebe9e562661cb [1,1,0,0,0,0|0,0,1]=3 2703 B11R1.172 C[C@H](O)CNCC1CCCO1 cf62be0ee91fa9c23037b510344e4095 [1,1,0,0,0,0|1,0,1]=4 2704 B11R1.172 C[C@H](O)CNC[C@@H]1CCCO1 994f643fb2ada1fcc12af26ba2d7b6cd [1,1,0,0,0,0|1,0,1]=4 2705 B11R1.172 C[C@H](O)CNC[C@H]1CCCO1 43c98fa20a2352d4f1b7613374e13b90 [1,1,0,0,0,0|1,0,1]=4 2706 B11R1.172 FC(F)COCC1CCCO1 03fe176761c2f6390b2066774e943a6a [1,1,0,0,0,0|1,0,1]=4 2707 B11R1.172 FC(F)COC[C@@H]1CCCO1 ed351f69e2adfc9b8bc9ad681bcde6f8 [1,1,0,0,0,0|1,0,1]=4 2708 B11R1.172 FC(F)COC[C@H]1CCCO1 dc95876c5bbf6f8885fdc83ec029e5fb [1,1,0,0,0,0|1,0,1]=4 2709 B11R1.180 CC1CCOC1COCCF 7d56ae2d9a90b995c71c5a31cd114a07 [1,1,0,0,0,0|1,0,1]=4 2710 B11R1.180 CC1CCOC1COCCS 0ae89a8a61952cd06a98718bf2c884e9 [1,1,0,0,0,0|1,0,1]=4 2711 B11R1.180 CCCOCC1CCCC1=O 38a6f11d54d34dd53e14f1182522173f [1,1,0,0,0,0|1,0,1]=4 2712 B11R1.180 CCCOCC1CCCC1C 118ed8d287625874ba26030881e3da78 [1,1,0,0,0,0|1,0,1]=4 2713 B11R1.180 CCCOCC1CCCN1C bf8e443012ae9dc1d87b802b881d0e7f [1,1,0,0,0,0|1,0,1]=4 2714 B11R1.180 CCCOCC1OCCC1C 57feccde124dd0fb0c06be2cf8c20256 [1,1,0,0,0,0|0,0,1]=3 2715 B11R1.180 CCCOC[C@@H]1CCCN1C 4eaaca3fec96583d7f11678f9d67e935 [1,1,0,0,0,0|1,0,1]=4 2716 B11R1.180 CCCOC[C@@H]1CCC[C@H]1F eaf7c020b285e2fbc01d608fed6ac578 [1,1,0,0,0,0|1,0,1]=4 2717 B11R1.180 CCCOC[C@H]1CCCN1C 3b4dfbc6f049122810edfeee80233f50 [1,1,0,0,0,0|1,0,1]=4 2718 B11R1.180 COCOCC1OCCC1C 540c73777186eeb637d1e640e6efae32 [1,1,0,0,0,0|1,0,1]=4 2719 B11R1.180 CSCOCC1OCCC1C 5befe00e8e2adb066c4f35ca6534458c [1,1,0,0,0,0|1,0,1]=4 2720 B11R1.756 CC1(CCCO1)COCCF eacc7ba4900697bb2bd6fed9cd50be4d [1,1,0,0,0,0|1,0,1]=4 2721 B11R1.756 CC1(CCCO1)COCCS f530f36d814fd703c1163ed7104a2f73 [1,1,0,0,0,0|1,0,1]=4 2722 B11R1.756 CCCNCC1(CCCO1)C df049434889ef2af7afe1f2986951d62 [1,1,0,0,0,0|1,0,1]=4 2723 B11R1.756 CCCOCC1(CCCC1)C 66e7e52d8350cdd447e8de4a1eea16a9 [1,1,0,0,0,0|1,0,1]=4 2724 B11R1.756 CCCOCC1(CCCC1)F 847f78730f13688811393e9d8de8b4aa [1,1,0,0,0,0|1,0,1]=4 2725 B11R1.756 CCCOCC1(CCCO1)C c9db85dc12fe3f43dca5c29908cc8e6f [1,1,0,0,0,0|0,0,1]=3 2726 B11R1.756 COCOCC1(CCCO1)C 181e965780e6f9141aeca3bc9e9310f0 [1,1,0,0,0,0|1,0,1]=4 2727 B11R1.756 CSCOCC1(CCCO1)C 927e51b56bc2b23bf252eb5ad1456b3a [1,1,0,0,0,0|1,0,1]=4 2728 B11R1.35 CC(=O)C(C)OC1CCCO1 7d9633acc7c4bda2675b556a59eb4f43 [1,1,0,0,0,0|2,0,0]=4 2729 B11R1.35 CC(=O)N(C)CC1CCCC1 4331ec178c73bb27884454afbc84991d [1,1,0,0,0,0|2,0,0]=4 2730 B11R1.35 CC(=O)N(C)CC1CCCO1 e9834d1142ccfa3036fccae2fbfd4479 [1,1,0,0,0,0|1,0,0]=3 2731 B11R1.75 CC(=O)NCC1CCC(C1)O a017fd720f27c83b6928197b660f1770 [1,1,0,0,0,0|2,0,0]=4 2732 B11R1.75 CC(=O)OCN1CCC(C1)C 4541ec918bbeb0efbcd3b04d76137cc1 [1,1,0,0,0,0|2,0,0]=4 2733 B11R1.75 CC(=O)OCN1CCC(C1)F cccc7c342b12107f52744691ecc5b92f [1,1,0,0,0,0|2,0,0]=4 2734 B11R1.75 CC(=O)OCN1CCC(C1)O 8005a3f5b8790dd588058985ec279b02 [1,1,0,0,0,0|2,0,0]=4 2735 B11R1.75 CC(=O)OCN1CC[C@@H](C1)F b94acd63203e6f37347939f1b9f759dc [1,1,0,0,0,0|2,0,0]=4 2736 B11R1.75 CC(=O)OCN1CC[C@@H](C1)O 39f23717e59822f9687fc1acc40a5881 [1,1,0,0,0,0|2,0,0]=4 2737 B11R1.75 CC(=O)OCN1CC[C@H](C1)F db4d48f139bfe05ff5cae0e55a956520 [1,1,0,0,0,0|2,0,0]=4 2738 B11R1.75 CC(=O)OCN1CC[C@H](C1)O aec3a736eb9048971dfd033d90f2d079 [1,1,0,0,0,0|2,0,0]=4 2739 B11R1.75 CC(C)OCC1CCC(O1)C 444328f2da6d3e95d1e2442b2f5102c7 [1,1,0,0,0,0|1,0,1]=4 2740 B11R1.75 CC(C)OC[C@@H]1CC[C@@H](O1)C 824583ce31df72ac6d80e5c7315b1941 [1,1,0,0,0,0|1,0,1]=4 2741 B11R1.77 CC(=O)NC(C)C1CCCC1 c960b6f043c3790824ae164342defbdd [1,1,0,0,0,0|2,0,0]=4 2742 B11R1.77 CC(=O)NC(C)C1CCCO1 9684d155bd02ad67149b8b97ab821cf8 [1,1,0,0,0,0|1,0,0]=3 2743 B11R1.77 CC(=O)N[C@@H](C)[C@@H]1CCCO1 b70e3004baba944a3c27471d8b178418 [1,1,0,0,0,0|1,0,0]=3 2744 B11R1.77 CC(C)O[C@H](C)[C@H]1CCCO1 90aa28152da84cf654ebdc7930d1c9fa [1,1,0,0,0,0|1,0,1]=4 2745 B11R1.90 CC(=O)NCC1CCCC1O c742412c82108bc2a7c8d8d13a8e3bff [1,1,0,0,0,0|2,0,0]=4 2746 B11R1.90 CC(=O)NCC1CCCN1C 0b1bca6c0f46f7cbd974bfca60d60e98 [1,1,0,0,0,0|2,0,0]=4 2747 B11R1.90 CC(=O)NC[C@@H]1CCCN1C 44117fe2bcc8ddb8bd974df5072f799d [1,1,0,0,0,0|2,0,0]=4 2748 B11R1.90 CC(=O)NC[C@H]1CCCN1C 5974ed54a84d47be6f8cdd58624f19b0 [1,1,0,0,0,0|2,0,0]=4 2749 B11R1.90 CC(=O)OCN1CCCC1C e1206aa7bf532f6eda3cb28910b45932 [1,1,0,0,0,0|2,0,0]=4 2750 B11R1.90 CC(=O)OCN1CCCC1O 6376014e460c68bfdfef254e87dd2260 [1,1,0,0,0,0|2,0,0]=4 2751 B11R1.90 CC(=O)OCN1CCC[C@@H]1C 4345c5e09fb225bd93485b0af7507a8f [1,1,0,0,0,0|2,0,0]=4 2752 B11R1.90 CC(=O)OCN1CCC[C@H]1C 3a5542a1ee98723342b848946d8d6382 [1,1,0,0,0,0|2,0,0]=4 2753 B11R1.90 CC(C)OCC1OCCC1C 400bdb539cb7c6ee84668e33b1f3a983 [1,1,0,0,0,0|1,0,1]=4 2754 B11R1.713 CC(=O)NCC1(CCCC1)C 49068df105a1e0093927b3a155969870 [1,1,0,0,0,0|2,0,0]=4 2755 B11R1.713 CC(=O)NCC1(CCCC1)F d70d368862fa97a0d78df4be5956ed5e [1,1,0,0,0,0|2,0,0]=4 2756 B11R1.713 CC(=O)NCC1(CCCC1)O a55896964c7a3e433580ab1c03e4096c [1,1,0,0,0,0|2,0,0]=4 2757 B11R1.713 CC(=O)NCC1(CCCO1)C 93cf2f0ace2021141f7fcfdf0142ce17 [1,1,0,0,0,0|1,0,0]=3 2758 B11R1.713 CC(C)OCC1(CCCO1)C cfa5e14e8a991e631c6736a9ea948769 [1,1,0,0,0,0|1,0,1]=4 2759 B11R1.31 CCC(=O)N(C)C1CCCC1 466f3d17aababce35bd34e46ab953309 [0,1,0,0,1,0|2,0,0]=4 2760 B11R1.39 CCC(=O)CN1CCC(C1)C 4b62eac999b61819057d4873038e482b [0,1,0,0,1,0|2,0,0]=4 2761 B11R1.39 CCC(=O)CN1CCC(C1)F 81e5b038c07550789728f481eb77b8af [0,1,0,0,1,0|2,0,0]=4 2762 B11R1.39 CCC(=O)CN1CCC(C1)O d2dda679da94d6b5eec1cdfef7de2dd0 [0,1,0,0,1,0|2,0,0]=4 2763 B11R1.39 CCC(=O)CN1CC[C@@H](C1)F 5a1bd1515b66cd16982653d33318ec1d [0,1,0,0,1,0|2,0,0]=4 2764 B11R1.39 CCC(=O)CN1CC[C@@H](C1)O c8d66e8068c8bc83f85fc0221e2a0ac1 [0,1,0,0,1,0|2,0,0]=4 2765 B11R1.39 CCC(=O)CN1CC[C@H](C1)F 713a2964ef84319c92a12db1222cf20a [0,1,0,0,1,0|2,0,0]=4 2766 B11R1.39 CCC(=O)CN1CC[C@H](C1)O 3caaa72fd54713c14234206caecf2b9e [0,1,0,0,1,0|2,0,0]=4 2767 B11R1.39 CCC(=O)NC1CCC(C1)C 21439a0044bd9f8d3e3de3f351f77a96 [0,1,0,0,1,0|2,0,0]=4 2768 B11R1.39 CCC(=O)NC1CCC(C1)O 53a2b0322e45799d213627ef8b2f41fb [0,1,0,0,1,0|2,0,0]=4 2769 B11R1.39 CCC(=O)N[C@@H]1CC[C@@H](C1)O 25043137900e8da95a50aa186f03b9f5 [0,1,0,0,1,0|2,0,0]=4 2770 B11R1.39 CCC(=O)N[C@@H]1CC[C@H](C1)O 1346197d709eac1a30ab17f65834af94 [0,1,0,0,1,0|2,0,0]=4 2771 B11R1.39 CCC(=O)N[C@H]1CC[C@@H](C1)O 0be45546b62a38604688bd55677245a7 [0,1,0,0,1,0|2,0,0]=4 2772 B11R1.39 CCC(=O)N[C@H]1CC[C@H](C1)O c9a94329d6ea57b82bbe053062c75e55 [0,1,0,0,1,0|2,0,0]=4 2773 B11R1.84 CCC(C=O)OC1CCCC1 63b574a2e2a518454ace8e3bfcb4a2c1 [0,1,0,0,1,0|1,0,1]=4 2774 B11R1.84 CCC(C=O)OC1CCCO1 86d306178fb9b7765128fd4ede2cdbb9 [0,1,0,0,1,0|0,0,1]=3 2775 B11R1.84 CCC(CC)OC1CCCO1 aa7ec05ad6eedb28b1415af53c9382ab [0,1,0,0,1,0|1,0,1]=4 2776 B11R1.84 CCN(C=O)CC1CCCO1 90e76466bf41574fa0955e8ae2ccb8fb [0,1,0,0,1,0|1,0,0]=3 2777 B11R1.84 CCN(CC)CC1CCCO1 95add7531d95fc2cf34cfab24eca1a87 [0,1,0,0,1,0|2,0,0]=4 2778 B11R1.84 CCN(CF)CC1CCCO1 a96e47a82287455891aecfed535a4344 [0,1,0,0,1,0|2,0,0]=4 2779 B11R1.84 CCN(CO)CC1CCCO1 575261f0196e12fb59c84e204cb73a0f [0,1,0,0,1,0|1,0,1]=4 2780 B11R1.228 CCC(=O)CN1CCCC1C 2d36f414b06a9d1b55e1af6cba137dab [0,1,0,0,1,0|2,0,0]=4 2781 B11R1.228 CCC(=O)CN1CCCC1O 9b0509cc2b041b23ffd9a58aadb53124 [0,1,0,0,1,0|2,0,0]=4 2782 B11R1.228 CCC(=O)CN1CCC[C@@H]1C b7575d72ac60a5bdc9b498426c391697 [0,1,0,0,1,0|2,0,0]=4 2783 B11R1.228 CCC(=O)CN1CCC[C@H]1C fdba0def75e7161dd804c0c5c627099c [0,1,0,0,1,0|2,0,0]=4 2784 B11R1.228 CCC(=O)NC1CCCC1O 01de627d23e41f13a1c7baeffc36a9e5 [0,1,0,0,1,0|2,0,0]=4 2785 B11R1.228 CCC(=O)N[C@@H]1CCC[C@@H]1O 41b1cda875f5a8026c0e7b04a1fe0abc [0,1,0,0,1,0|2,0,0]=4 2786 B11R1.228 CCC(=O)N[C@@H]1CCC[C@H]1O 9f11c0577fa3011c0f54373a6aa6eaf6 [0,1,0,0,1,0|2,0,0]=4 2787 B11R1.228 CCC(=O)N[C@H]1CCC[C@@H]1O a913ca3fd120db7f95862456e02aa591 [0,1,0,0,1,0|2,0,0]=4 2788 B11R1.228 CCC(=O)N[C@H]1CCC[C@H]1O 14fa599c03ed82f32840dae4c12b46c7 [0,1,0,0,1,0|2,0,0]=4 2789 B11R1.895 CCC(=O)NC1(CCCC1)C 53578151ae545be8b336e470b91dd9af [0,1,0,0,1,0|2,0,0]=4 2790 B11R1.895 CCN(C)CC1(CCCO1)C dfa3c0235be93f7fb650ddd57cbe6b80 [0,1,0,0,1,0|2,0,0]=4 2791 B11R1.170 C#CC(CC)OCC1CCC1 54bba1c5098fb27a97a0bd1e8954bf9b [0,1,0,0,1,0|1,0,1]=4 2792 B11R1.170 C#CC(CC)OCC1CCO1 d3e24bf7a39147636b103048ba050fad [0,1,0,0,1,0|1,0,1]=4 2793 B11R1.170 C#CC(CC)OC[C@@H]1CCO1 5a353f6845fef5ae2ec2522cdab06d61 [0,1,0,0,1,0|1,0,1]=4 2794 B11R1.170 C#CC(CC)OC[C@H]1CCO1 7bcabadbdbd1685ee739108f1f0fafaa [0,1,0,0,1,0|1,0,1]=4 2795 B11R1.170 C=CC(CC)OCC1CCC1 f0e1194c7a52c521d054dcd06182065d [0,1,0,0,1,0|1,0,1]=4 2796 B11R1.170 C=CC(CC)OCC1CCO1 4c61b098e3c2ed1f7439d2b599f701fb [0,1,0,0,1,0|1,0,1]=4 2797 B11R1.170 C=CC(CC)OC[C@@H]1CCO1 c3a047f5347dcc4259b484c052e8276f [0,1,0,0,1,0|1,0,1]=4 2798 B11R1.170 C=CC(CC)OC[C@H]1CCO1 3f5dc2c0a6630edfa18a043bfb338439 [0,1,0,0,1,0|1,0,1]=4 2799 B11R1.170 CCC(C#N)OCC1CCC1 450c98d21d6f6f0007aaf72e88460621 [0,1,0,0,1,0|1,0,1]=4 2800 B11R1.170 CCC(C#N)OCC1CCO1 55df9ab4c5d0be4960b01052d6ec5bc2 [0,1,0,0,1,0|1,0,1]=4 2801 B11R1.170 CCC(C#N)OC[C@@H]1CCO1 01d184bd985ec6bca11f0e17b75b8099 [0,1,0,0,1,0|1,0,1]=4 2802 B11R1.170 CCC(C#N)OC[C@H]1CCO1 6a2d2f05b7fe988dba6a78fe4b8d7ea4 [0,1,0,0,1,0|1,0,1]=4 2803 B11R1.170 CCC(C=O)NCC1CCC1 72644047befd648bfb1937731d213ef1 [0,1,0,0,1,0|1,0,1]=4 2804 B11R1.170 CCC(C=O)NCC1CCO1 6fef8388dee588d82bbe8f3c23f83c20 [0,1,0,0,1,0|1,0,1]=4 2805 B11R1.170 CCC(C=O)NC[C@@H]1CCO1 3460cb7eee89bde1007e93d04958e744 [0,1,0,0,1,0|1,0,1]=4 2806 B11R1.170 CCC(C=O)NC[C@H]1CCO1 ee39a635f847822c8a0b057efcb39f60 [0,1,0,0,1,0|1,0,1]=4 2807 B11R1.170 CCC(C=O)OCC1CCC1 bc8441c9ac2f9fe88b5fc780917b333a [0,1,0,0,1,0|0,0,1]=3 2808 B11R1.170 CCC(C=O)OCC1CCO1 19da5da6dda1a1ef47bec9fcbe0aa898 [0,1,0,0,1,0|0,0,1]=3 2809 B11R1.170 CCC(C=O)OCC1COC1 0f1d4f73309aea835dea03a14cc8aa11 [0,1,0,0,1,0|1,0,1]=4 2810 B11R1.170 CCC(C=O)OCC1CSC1 209d2847c19355829170e670c0eb77ba [0,1,0,0,1,0|1,0,1]=4 2811 B11R1.170 CCC(C=O)OC[C@@H]1CCO1 a3aa643eac2f2d3d153b171884519f4b [0,1,0,0,1,0|0,0,1]=3 2812 B11R1.170 CCC(C=O)OC[C@H]1CCO1 177592be8e5398086e99eca46f746c4e [0,1,0,0,1,0|0,0,1]=3 2813 B11R1.170 CCC(CC)OCC1CCC1 320b0a4fe52b3014dde21b6d67ba3887 [0,1,0,0,1,0|1,0,1]=4 2814 B11R1.170 CCC(CC)OCC1CCO1 85af1491733649220d966b16c2cd4683 [0,1,0,0,1,0|1,0,1]=4 2815 B11R1.170 CCC(CC)OC[C@@H]1CCO1 8cdbd08754cf38b94006f47c97a3f947 [0,1,0,0,1,0|1,0,1]=4 2816 B11R1.170 CCC(CC)OC[C@H]1CCO1 148a58dbff9cf9fe1fcf5e1f1bc54b71 [0,1,0,0,1,0|1,0,1]=4 2817 B11R1.196 CCC(=O)CN(C)C1CCC1 df2b4601e2738ba1895a5391f9c41a24 [0,1,0,0,1,0|2,0,0]=4 2818 B11R1.196 CCC(=O)NC(C)C1COC1 52ec0677969790dde724b26c11ed9b20 [0,1,0,0,1,0|2,0,0]=4 2819 B11R1.196 CCC(=O)N[C@@H](C)C1COC1 fa5d3cd168c24b861a254d6d6523f3ba [0,1,0,0,1,0|2,0,0]=4 2820 B11R1.196 CCC(=O)N[C@H](C)C1COC1 b473ab4999840277b0cf88f7958c0a56 [0,1,0,0,1,0|2,0,0]=4 2821 B11R1.196 CCC(C)OC(C)C1CCC1 4c973507c37e53fc6c24aea83c3652b5 [0,1,0,0,1,0|1,0,1]=4 2822 B11R1.196 CCC(C)O[C@@H](C)C1CCC1 f74ffe382f7d4715377a861a063b8c38 [0,1,0,0,1,0|1,0,1]=4 2823 B11R1.223 CCC(=O)CNC1CCC1F cf05e7bfe89c8fd1ed50d922dd4e6cd4 [0,1,0,0,1,0|2,0,0]=4 2824 B11R1.223 CCC(=O)CNC1CCC1O 41a141875f36dbe4af8557a6032c4182 [0,1,0,0,1,0|2,0,0]=4 2825 B11R1.223 CCC(=O)CN[C@@H]1CC[C@@H]1O 37449bad3f9524bd125fd2d88b1b89fe [0,1,0,0,1,0|2,0,0]=4 2826 B11R1.223 CCC(=O)CN[C@@H]1CC[C@H]1C a8bc64d29c0a05022b6529f0429434ad [0,1,0,0,1,0|2,0,0]=4 2827 B11R1.223 CCC(=O)CN[C@@H]1CC[C@H]1O 6fc2dc91a2dd4d5161eacab1e07f4993 [0,1,0,0,1,0|2,0,0]=4 2828 B11R1.223 CCC(=O)CN[C@H]1CC[C@@H]1O e4f55aa95bce87a9ad69196f03a00a79 [0,1,0,0,1,0|2,0,0]=4 2829 B11R1.223 CCC(=O)CN[C@H]1CC[C@H]1C aec74fc52f158fa0328dbfb0fd3a9d65 [0,1,0,0,1,0|2,0,0]=4 2830 B11R1.223 CCC(=O)CN[C@H]1CC[C@H]1O ac49064c9093d69e591021351fe7f4ed [0,1,0,0,1,0|2,0,0]=4 2831 B11R1.223 CCC(=O)NCC1CCN1C 91dc0d0c07e7c84744d12eaecec3fa57 [0,1,0,0,1,0|2,0,0]=4 2832 B11R1.223 CCC(C)OCC1CCC1F f764af5a060b90f8a744359ee4fee269 [0,1,0,0,1,0|1,0,1]=4 2833 B11R1.224 CCC(=O)CNC1CC(C1)F d0ba832adec3b32c16fc292c775ca3bc [0,1,0,0,1,0|2,0,0]=4 2834 B11R1.224 CCC(=O)CNC1CC(C1)O 7265dd0ebaad844ca8ac68ecd248f90f [0,1,0,0,1,0|2,0,0]=4 2835 B11R1.224 CCC(=O)CN[C@H]1C[C@@H](C1)F c03e29c022793bb76c558637a7e80228 [0,1,0,0,1,0|2,0,0]=4 2836 B11R1.224 CCC(=O)CN[C@H]1C[C@@H](C1)O 1ace5e9b5b4a64724123c64adff4a580 [0,1,0,0,1,0|2,0,0]=4 2837 B11R1.224 CCC(=O)CN[C@H]1C[C@H](C1)F 2ae73737fa57389a42f41bf4505276f8 [0,1,0,0,1,0|2,0,0]=4 2838 B11R1.224 CCC(=O)CN[C@H]1C[C@H](C1)O 641fd729b2064b6aa8d1f6f12171bce4 [0,1,0,0,1,0|2,0,0]=4 2839 B11R1.224 CCC(=O)COC1CC(C1)C 56dadbb9436843657b0250c394ebe877 [0,1,0,0,1,0|2,0,0]=4 2840 B11R1.224 CCC(=O)COC1CC(C1)F 309bc3c03930223fab2ab9f8b84559b0 [0,1,0,0,1,0|2,0,0]=4 2841 B11R1.224 CCC(=O)CO[C@H]1C[C@@H](C1)F 848550200fd0cf5abcec22762a31d7ca [0,1,0,0,1,0|2,0,0]=4 2842 B11R1.224 CCC(=O)CO[C@H]1C[C@H](C1)F 06887cbab744537955d3712527cbaea5 [0,1,0,0,1,0|2,0,0]=4 2843 B11R1.224 CCC(=O)NCC1CC(C1)O ebfa1199604f3d7ce9f432209d07d7c4 [0,1,0,0,1,0|1,0,0]=3 2844 B11R1.224 CCC(=O)NCC1CN(C1)C 4b844df2e103cb2027b0335126c96f20 [0,1,0,0,1,0|2,0,0]=4 2845 B11R1.224 CCC(=O)NC[C@H]1C[C@@H](C1)O 85ad5acd7b2ac1b42e7b9bca1ef3667a [0,1,0,0,1,0|1,0,0]=3 2846 B11R1.224 CCC(=O)NC[C@H]1C[C@H](C1)O 6a370f59837baedd2762021bff976a84 [0,1,0,0,1,0|1,0,0]=3 2847 B11R1.224 CCC(=O)OCN1CC(C1)F d811764ce7b538f385cd7d567c70550c [0,1,0,0,1,0|1,0,0]=3 2848 B11R1.224 CCC(=O)OCN1CC(C1)O ca9f3e994b6a4483b1e23713e4dbd58f [0,1,0,0,1,0|1,0,0]=3 2849 B11R1.224 CCC(C)OCC1CC(C1)C 76ec408df6f6f4f6cae6751ac7e17a0e [0,1,0,0,1,0|1,0,1]=4 2850 B11R1.224 CCC(C)OCC1CC(C1)F 8d735e5dde88af32b33db822a5a68a72 [0,1,0,0,1,0|1,0,1]=4 2851 B11R1.224 CCC(C)OC[C@H]1C[C@@H](C1)C 91b04774104ed559d0a13f088664a9cb [0,1,0,0,1,0|1,0,1]=4 2852 B11R1.224 CCC(C)OC[C@H]1C[C@H](C1)F bf95197f0be8e45bc6ad5ee88cbc6e2f [0,1,0,0,1,0|1,0,1]=4 2853 B11R1.224 CC[C@@H](C)OCC1CC(C1)C 8b633e9f75acdd3321b7de2db31fb39a [0,1,0,0,1,0|1,0,1]=4 2854 B11R1.224 CC[C@@H](C)OC[C@H]1C[C@H](C1)F 1e8ee0d0ad647d7a9f09280d5918482b [0,1,0,0,1,0|1,0,1]=4 2855 B11R1.224 CC[C@H](C)OCC1CC(C1)C aeac1154ae36c79a65c02196dbed8a94 [0,1,0,0,1,0|1,0,1]=4 2856 B11R1.224 CC[C@H](C)OC[C@H]1C[C@H](C1)F 5c526af8dc8c383f770191cde6692d3b [0,1,0,0,1,0|1,0,1]=4 2857 B11R1.224 COC(=O)OCN1CC(C1)F 83b534136c27e3544f17f38ade901fa7 [0,1,0,0,1,0|2,0,0]=4 2858 B11R1.224 COC(=O)OCN1CC(C1)O ab70a6c9b0205c298f22f3b0196fb63d [0,1,0,0,1,0|2,0,0]=4 2859 B11R1.224 O=C(CF)NCC1CC(C1)O c947091508d767ae81123bbb73110fe2 [0,1,0,0,1,0|2,0,0]=4 2860 B11R1.224 O=C(CF)NC[C@H]1C[C@@H](C1)O 6e1b70a5ac9b3f35b392938f9c19ff86 [0,1,0,0,1,0|2,0,0]=4 2861 B11R1.224 O=C(CF)NC[C@H]1C[C@H](C1)O 578ae3a632521623119945d63e87b66c [0,1,0,0,1,0|2,0,0]=4 2862 B11R1.224 O=C(CO)NCC1CC(C1)O 7e438be291ee31fa24aa618775a6a488 [0,1,0,0,1,0|2,0,0]=4 2863 B11R1.224 O=C(CO)NC[C@H]1C[C@@H](C1)O 731be315f986d79fecaba017bda0c63c [0,1,0,0,1,0|2,0,0]=4 2864 B11R1.224 O=C(CO)NC[C@H]1C[C@H](C1)O 337edeefe58bcdf9693d56473bad23eb [0,1,0,0,1,0|2,0,0]=4 2865 B11R1.224 O=C(CS)NCC1CC(C1)O d922e11f1ecd0fcd5075cce9167e5794 [0,1,0,0,1,0|2,0,0]=4 2866 B11R1.224 O=C(CS)NC[C@H]1C[C@@H](C1)O ba2f627c1e74a0e993e54b772e5dd773 [0,1,0,0,1,0|2,0,0]=4 2867 B11R1.224 O=C(CS)NC[C@H]1C[C@H](C1)O 6a8e42d18b6a8db929b93b963221ad30 [0,1,0,0,1,0|2,0,0]=4 2868 B11R1.289 C#CCC(=O)NCC1CCC1 0acda64149afbd376cc50967ac4260a4 [0,1,0,0,1,0|1,0,1]=4 2869 B11R1.289 C#CCC(=O)NCC1CCO1 f0a40d635217449793ee11c7a39cb1c0 [0,1,0,0,1,0|1,0,1]=4 2870 B11R1.289 C#CCC(=O)NC[C@@H]1CCO1 827caa3ac3922d548d5119bb37c51fa4 [0,1,0,0,1,0|1,0,1]=4 2871 B11R1.289 C#CCC(=O)NC[C@H]1CCO1 bddd9fe70f2d25efcbfd541ac376aa08 [0,1,0,0,1,0|1,0,1]=4 2872 B11R1.289 C/C=C/C(=O)NCC1CCC1 533ec5bdbb5c2001b88d2e81d1e7a135 [0,1,0,0,1,0|1,0,1]=4 2873 B11R1.289 C/C=C/C(=O)NCC1CCO1 bb508a8998a844dc252d79b9379b876f [0,1,0,0,1,0|1,0,1]=4 2874 B11R1.289 C/C=C/C(=O)NC[C@@H]1CCO1 aa780311ee5d4da5e9c3d49794064e9e [0,1,0,0,1,0|1,0,1]=4 2875 B11R1.289 C/C=C/C(=O)NC[C@H]1CCO1 700270ba47e018d88cb2843ab4910b3a [0,1,0,0,1,0|1,0,1]=4 2876 B11R1.289 C=CCC(=O)NCC1CCC1 f7a53eaa0d3c8b680094677cd35680b9 [0,1,0,0,1,0|1,0,1]=4 2877 B11R1.289 C=CCC(=O)NCC1CCO1 47670a317480df3260cdfa222170e82a [0,1,0,0,1,0|1,0,1]=4 2878 B11R1.289 C=CCC(=O)NC[C@@H]1CCO1 742be8f45227086c09f6a2850cc6d694 [0,1,0,0,1,0|1,0,1]=4 2879 B11R1.289 C=CCC(=O)NC[C@H]1CCO1 d87af39ea1af6bec227a0c099de07a54 [0,1,0,0,1,0|1,0,1]=4 2880 B11R1.289 CC#CC(=O)NCC1CCC1 4cea417be346f9ba54f6830c0f8b7c86 [0,1,0,0,1,0|1,0,1]=4 2881 B11R1.289 CC#CC(=O)NCC1CCO1 6ddbc89d902a15651499bd416cd81dd5 [0,1,0,0,1,0|1,0,1]=4 2882 B11R1.289 CC#CC(=O)NC[C@@H]1CCO1 bb1671b123fd71ee59ab78f0e794ec95 [0,1,0,0,1,0|1,0,1]=4 2883 B11R1.289 CC#CC(=O)NC[C@H]1CCO1 1458775e79f1af94693e0ef25a38f2db [0,1,0,0,1,0|1,0,1]=4 2884 B11R1.289 CCCC(=O)CNC1CCC1 0a027979d7e0dc7f8a13d9142e42d7a3 [0,1,0,0,1,0|2,0,0]=4 2885 B11R1.289 CCCC(=O)COC1CCC1 44522e1d7d14576fcecac67218dbbfb2 [0,1,0,0,1,0|2,0,0]=4 2886 B11R1.289 CCCC(=O)NCC1CCC1 5b5629fcb62edf562f55605727998243 [0,1,0,0,1,0|1,0,0]=3 2887 B11R1.289 CCCC(=O)NCC1CCO1 c88cd3184f6f7df2e7d195783849ec29 [0,1,0,0,1,0|1,0,0]=3 2888 B11R1.289 CCCC(=O)NCC1COC1 8c7d8e7d6e0ff5c9b81378f621bcdb8c [0,1,0,0,1,0|2,0,0]=4 2889 B11R1.289 CCCC(=O)NC[C@@H]1CCO1 6ebf05f92fe3c48e393397e70ae0299f [0,1,0,0,1,0|1,0,0]=3 2890 B11R1.289 CCCC(=O)NC[C@H]1CCO1 673ab8561ba0f9f686e4c23f9923819b [0,1,0,0,1,0|1,0,0]=3 2891 B11R1.289 CCCC(=O)OCN1CCC1 7349536bcaaf6321025597a599bb215a [0,1,0,0,1,0|1,0,0]=3 2892 B11R1.289 CCCC(=S)OCC1CCC1 cb7b37bc0b934052223a44a5747503af [0,1,0,0,1,0|0,1,0]=3 2893 B11R1.289 CCCC(=S)OCC1CCO1 023ba35ad3bb53d5767bdfdf7c02f931 [0,1,0,0,1,0|0,1,0]=3 2894 B11R1.289 CCCC(=S)OCC1COC1 8a84931f323fbfa3dac1f8acf45d0b39 [0,1,0,0,1,0|1,1,0]=4 2895 B11R1.289 CCCC(=S)OC[C@@H]1CCO1 09754b0a55fab1dbd7359797d250de45 [0,1,0,0,1,0|0,1,0]=3 2896 B11R1.289 CCCC(=S)OC[C@H]1CCO1 26f3ad0afb0eef31ce5bb553d2fc5db5 [0,1,0,0,1,0|0,1,0]=3 2897 B11R1.289 CCCC(C)OCC1CCC1 1d8c48dd62df9c51371993a06ea5d123 [0,1,0,0,1,0|1,0,1]=4 2898 B11R1.289 CCCC(C)OCC1CCO1 6612467398ed61398e5680aa30a32c2a [0,1,0,0,1,0|1,0,1]=4 2899 B11R1.289 CCCC(C)OC[C@@H]1CCO1 514a4609289410b71e916296d1827e32 [0,1,0,0,1,0|1,0,1]=4 2900 B11R1.289 CCCC(C)OC[C@H]1CCO1 a7816d049a4d1ce96d60e121ef1151b9 [0,1,0,0,1,0|1,0,1]=4 2901 B11R1.289 CCC[C@@H](C)OCC1CCC1 00c9de97494c916ac5742d7905a149a2 [0,1,0,0,1,0|1,0,1]=4 2902 B11R1.289 CCC[C@@H](C)OCC1CCO1 744855d7af4ac2a1329d89e35e00df67 [0,1,0,0,1,0|1,0,1]=4 2903 B11R1.289 CCC[C@@H](C)OC[C@@H]1CCO1 6fb84bdca16abb971b500e66b56b5706 [0,1,0,0,1,0|1,0,1]=4 2904 B11R1.289 CCC[C@@H](C)OC[C@H]1CCO1 dae85b7e480152e6dc7c379643f579fd [0,1,0,0,1,0|1,0,1]=4 2905 B11R1.289 CCC[C@H](C)OCC1CCC1 efe93e1795c996e65f94a70456d391e4 [0,1,0,0,1,0|1,0,1]=4 2906 B11R1.289 CCC[C@H](C)OCC1CCO1 55280c4d3dc0ca584c0d9f579a06b88b [0,1,0,0,1,0|1,0,1]=4 2907 B11R1.289 CCC[C@H](C)OC[C@@H]1CCO1 9e3947d6f15833097ef9d0f8c1f9a7ba [0,1,0,0,1,0|1,0,1]=4 2908 B11R1.289 CCC[C@H](C)OC[C@H]1CCO1 8cb235999cfca8bdee44d2fc5963362a [0,1,0,0,1,0|1,0,1]=4 2909 B11R1.289 CCNC(=O)CCN1CCC1 885968a1ad271fc45253bacbded90f9a [0,1,0,0,1,0|2,0,0]=4 2910 B11R1.289 CCNC(=O)CNC1CCC1 7a5196f02f7e2814f39d1675c93441e3 [0,1,0,0,1,0|2,0,0]=4 2911 B11R1.289 CCNC(=O)COC1CCC1 7fef597923c8f47d7eebc4f2ebb4796b [0,1,0,0,1,0|2,0,0]=4 2912 B11R1.289 CCOC(=O)CNC1CCC1 1cd679d4045b00d64456d8178835dcbc [0,1,0,0,1,0|2,0,0]=4 2913 B11R1.289 CCOC(=O)COC1CCC1 d0887e2272bbe8eb1c33dd0cab0a9e49 [0,1,0,0,1,0|2,0,0]=4 2914 B11R1.289 CCOC(=O)OCN1CCC1 b4ba06c5be4a450f28ac2456685a0352 [0,1,0,0,1,0|1,0,0]=3 2915 B11R1.289 CCSC(=O)OCN1CCC1 d3abc7a4b7ec118f0fea98bd634cedbc [0,1,0,0,1,0|1,0,0]=3 2916 B11R1.289 COCC(=O)CNC1CCC1 cd4e20785b5a2ae96480f8f1954b3bb7 [0,1,0,0,1,0|2,0,0]=4 2917 B11R1.289 COCC(=O)COC1CCC1 8df271acb42091b390deaf136f543eeb [0,1,0,0,1,0|2,0,0]=4 2918 B11R1.289 COCC(=O)NCC1CCC1 86b57a680b488a69d3083da1998befd3 [0,1,0,0,1,0|1,0,0]=3 2919 B11R1.289 COCC(=O)NCC1CCO1 ec569996f35c60e4dcc6a1ab53f8de25 [0,1,0,0,1,0|1,0,0]=3 2920 B11R1.289 COCC(=O)NCC1COC1 425b7b65a180e307362c8444e2f01aa2 [0,1,0,0,1,0|2,0,0]=4 2921 B11R1.289 COCC(=O)NC[C@@H]1CCO1 d7e2775bd0d591c3403df6da2aca0985 [0,1,0,0,1,0|1,0,0]=3 2922 B11R1.289 COCC(=O)NC[C@H]1CCO1 d71959809606fc6ec1d2378ef8708ba7 [0,1,0,0,1,0|1,0,0]=3 2923 B11R1.289 COCC(C)OCC1CCC1 80fc755b7771971ae47d66ec487ef7b2 [0,1,0,0,1,0|1,0,1]=4 2924 B11R1.289 COCC(C)OCC1CCO1 7caa584a3ee8910fe3782348ba082510 [0,1,0,0,1,0|1,0,1]=4 2925 B11R1.289 COCC(C)OC[C@@H]1CCO1 9159a1f2698b2099f201c36ca42e56b8 [0,1,0,0,1,0|1,0,1]=4 2926 B11R1.289 COCC(C)OC[C@H]1CCO1 41b0d308812bbc754b3c429c6e241c77 [0,1,0,0,1,0|1,0,1]=4 2927 B11R1.289 COC[C@@H](C)OCC1CCC1 b7d2c3aa1e4b6ce1c4e128385c20c648 [0,1,0,0,1,0|1,0,1]=4 2928 B11R1.289 COC[C@@H](C)OCC1CCO1 bcc04de96ba75627f46d36fb7e13c893 [0,1,0,0,1,0|1,0,1]=4 2929 B11R1.289 COC[C@@H](C)OC[C@@H]1CCO1 e8387f19699330a21a2be9625f8bd682 [0,1,0,0,1,0|1,0,1]=4 2930 B11R1.289 COC[C@@H](C)OC[C@H]1CCO1 1cd648ff263ab477fe243bba5e725ee5 [0,1,0,0,1,0|1,0,1]=4 2931 B11R1.289 COC[C@H](C)OCC1CCC1 86ddb957295028ffa01440bf5e3d5bce [0,1,0,0,1,0|1,0,1]=4 2932 B11R1.289 COC[C@H](C)OCC1CCO1 bf64262a0ea11ca73a9023683f140e76 [0,1,0,0,1,0|1,0,1]=4 2933 B11R1.289 COC[C@H](C)OC[C@@H]1CCO1 96decd04283d55fd58ac4a97ef16c229 [0,1,0,0,1,0|1,0,1]=4 2934 B11R1.289 COC[C@H](C)OC[C@H]1CCO1 c5db218329f4a120b9d29b8744b65741 [0,1,0,0,1,0|1,0,1]=4 2935 B11R1.289 CSCC(=O)NCC1CCC1 9a7df6e00fdc16b86c1fb9a63b2707d6 [0,1,0,0,1,0|1,0,0]=3 2936 B11R1.289 CSCC(=O)NCC1CCO1 697b8155c269b4515574e726bcf91423 [0,1,0,0,1,0|1,0,0]=3 2937 B11R1.289 CSCC(=O)NCC1COC1 59ba0a3a98810e385d64a5d5b7622dfc [0,1,0,0,1,0|2,0,0]=4 2938 B11R1.289 CSCC(=O)NC[C@@H]1CCO1 fb5cbdf8aca9dba21e77b89ba9eb10fb [0,1,0,0,1,0|1,0,0]=3 2939 B11R1.289 CSCC(=O)NC[C@H]1CCO1 482d7153bfeace483ac8253ad46ef8e7 [0,1,0,0,1,0|1,0,0]=3 2940 B11R1.289 CSCC(C)OCC1CCC1 c40d0a8029b8814e469467ef32bbbfef [0,1,0,0,1,0|1,0,1]=4 2941 B11R1.289 CSCC(C)OCC1CCO1 369ae786cf502ce3d8835c15545a06f1 [0,1,0,0,1,0|1,0,1]=4 2942 B11R1.289 CSCC(C)OC[C@@H]1CCO1 c31dbfe02fcd56704cd4b13cc2372db0 [0,1,0,0,1,0|1,0,1]=4 2943 B11R1.289 CSCC(C)OC[C@H]1CCO1 334733190d5b3b02e3397e0ce7a5dcfa [0,1,0,0,1,0|1,0,1]=4 2944 B11R1.289 N#CCC(=O)NCC1CCC1 538d60d2383bfb0a8802f299fc3e4653 [0,1,0,0,1,0|1,0,1]=4 2945 B11R1.289 N#CCC(=O)NCC1CCO1 d8654e6c00bb41f53d18eef7c65fa817 [0,1,0,0,1,0|1,0,1]=4 2946 B11R1.289 N#CCC(=O)NC[C@@H]1CCO1 64810bc0a9079ec06d208192c18d369a [0,1,0,0,1,0|1,0,1]=4 2947 B11R1.289 N#CCC(=O)NC[C@H]1CCO1 030f695085e0aef7d597b6804a23d4a3 [0,1,0,0,1,0|1,0,1]=4 2948 B11R1.289 NOCC(=O)NCC1CCC1 e05201cd643a7e604a0ac31c8561617c [0,1,0,0,1,0|2,0,0]=4 2949 B11R1.289 NOCC(=O)NCC1CCO1 deb3906ec78ea16a20878ee489400204 [0,1,0,0,1,0|2,0,0]=4 2950 B11R1.289 NOCC(=O)NC[C@@H]1CCO1 dc9225969c3ac9263e3b2f2911549d0d [0,1,0,0,1,0|2,0,0]=4 2951 B11R1.289 NOCC(=O)NC[C@H]1CCO1 c873879701e29caaf2ec3a5b5f851d84 [0,1,0,0,1,0|2,0,0]=4 2952 B11R1.289 O=C(CCF)NCC1CCC1 bca3155db107b87329f534d87492db5a [0,1,0,0,1,0|1,0,0]=3 2953 B11R1.289 O=C(CCF)NCC1CCO1 434053e26b27ae597bbad4d3fb1b525b [0,1,0,0,1,0|1,0,0]=3 2954 B11R1.289 O=C(CCF)NCC1COC1 76bf99fcc2c23bac95c464ba07dfffd6 [0,1,0,0,1,0|2,0,0]=4 2955 B11R1.289 O=C(CCF)NC[C@@H]1CCO1 3fb2192cc0bfef94102b8af85013071b [0,1,0,0,1,0|1,0,0]=3 2956 B11R1.289 O=C(CCF)NC[C@H]1CCO1 88559ffdad1c8fad5bdbc91a8beaa5d8 [0,1,0,0,1,0|1,0,0]=3 2957 B11R1.289 O=C(CCO)NCC1CCC1 d95457829de025432eb08e1c586d06bc [0,1,0,0,1,0|1,0,0]=3 2958 B11R1.289 O=C(CCO)NCC1CCO1 d8441532e5203c45b5afa7bf3abe0fab [0,1,0,0,1,0|1,0,0]=3 2959 B11R1.289 O=C(CCO)NCC1COC1 cf240569310e146a2bc2f0d0877c0ddb [0,1,0,0,1,0|2,0,0]=4 2960 B11R1.289 O=C(CCO)NC[C@@H]1CCO1 069272b9b774879e96eeca34a2f5f3ce [0,1,0,0,1,0|1,0,0]=3 2961 B11R1.289 O=C(CCO)NC[C@H]1CCO1 78666732e0270f9f03d7513d6ae18ffb [0,1,0,0,1,0|1,0,0]=3 2962 B11R1.289 O=C(CCS)NCC1CCC1 fad23bfd302e09ca569e288772e49946 [0,1,0,0,1,0|1,0,0]=3 2963 B11R1.289 O=C(CCS)NCC1CCO1 f4d4baffebe2a40a3fe3ee969f8b2579 [0,1,0,0,1,0|1,0,0]=3 2964 B11R1.289 O=C(CCS)NCC1COC1 59227a0fec53fcab869f365a2ea6b2b2 [0,1,0,0,1,0|2,0,0]=4 2965 B11R1.289 O=C(CCS)NC[C@@H]1CCO1 4f9b32351645225f203f4d9cc80ac173 [0,1,0,0,1,0|1,0,0]=3 2966 B11R1.289 O=C(CCS)NC[C@H]1CCO1 1b887caa7824a7259cdf8107d45ecc11 [0,1,0,0,1,0|1,0,0]=3 2967 B11R1.289 O=CCC(=O)NCC1CCC1 47a2cd6f66ed8d19171e3fa53a2c2935 [0,1,0,0,1,0|1,0,1]=4 2968 B11R1.289 O=CCC(=O)NCC1CCO1 11ec84861a4a963e2051a3c05bd48be5 [0,1,0,0,1,0|1,0,1]=4 2969 B11R1.289 O=CCC(=O)NC[C@@H]1CCO1 71bb01f75a2a14588399a54eb4d8d049 [0,1,0,0,1,0|1,0,1]=4 2970 B11R1.289 O=CCC(=O)NC[C@H]1CCO1 eaabf7bc4f5da3b9f6aab18bc9a70750 [0,1,0,0,1,0|1,0,1]=4 2971 B11R1.293 CCC(=O)C(=O)NC1CCC1 1760c91a023f7fe8e1cfa19149b86613 [0,1,0,0,1,0|2,0,0]=4 2972 B11R1.293 CCC(=O)C(C)NC1CCC1 a5531106cc974342b2b45eaaaf000daa [0,1,0,0,1,0|2,0,0]=4 2973 B11R1.293 CCC(=O)C(C)OC1CCC1 3bd9f9b42ee4fb5256ea4338e00ef1e4 [0,1,0,0,1,0|2,0,0]=4 2974 B11R1.293 CCC(=O)N(C)CC1CCC1 7929f97a9032c1d74007a9833ce7f80b [0,1,0,0,1,0|1,0,0]=3 2975 B11R1.293 CCC(=O)N(C)CC1COC1 7906250dcb8b0ed576a4e9bd4be5084b [0,1,0,0,1,0|2,0,0]=4 2976 B11R1.293 CN(CC1CCC1)C(=O)CF aac56012725a386c7abc668ce355de08 [0,1,0,0,1,0|2,0,0]=4 2977 B11R1.293 CN(CC1CCC1)C(=O)CO d7bb9b9c76f50eac9bf67941eee7bf7c [0,1,0,0,1,0|2,0,0]=4 2978 B11R1.293 CN(CC1CCC1)C(=O)CS b7b5ac77900a626435be34b5b4d4c712 [0,1,0,0,1,0|2,0,0]=4 2979 B11R1.332 C=C(C)C(=O)NCC1CCC1 c9fd705b8155aac7b1a2eb045b7a4c15 [0,1,0,0,1,0|1,0,1]=4 2980 B11R1.332 C=C(C)C(=O)NCC1CCO1 f0b19778be044e3f725a5a9807c86e09 [0,1,0,0,1,0|1,0,1]=4 2981 B11R1.332 C=C(C)C(=O)NC[C@@H]1CCO1 96d32ac569a1af79ec1bdbe826173c8b [0,1,0,0,1,0|1,0,1]=4 2982 B11R1.332 C=C(C)C(=O)NC[C@H]1CCO1 cd338cc3542d10b6f07b7d70911f42d9 [0,1,0,0,1,0|1,0,1]=4 2983 B11R1.332 CC(=O)C(=O)NCC1CCC1 1725dc5f107131ba71e6a9d744031eeb [0,1,0,0,1,0|1,0,1]=4 2984 B11R1.332 CC(=O)C(=O)NCC1CCO1 919fca795dc73df67579fddb54e8a188 [0,1,0,0,1,0|1,0,1]=4 2985 B11R1.332 CC(=O)C(=O)NC[C@@H]1CCO1 f877083795dba8332eb035b371e5ec91 [0,1,0,0,1,0|1,0,1]=4 2986 B11R1.332 CC(=O)C(=O)NC[C@H]1CCO1 7bacb3690649433a54216ecbf901198f [0,1,0,0,1,0|1,0,1]=4 2987 B11R1.332 CC(C)C(=O)CNC1CCC1 d8426863daac7acf8b58d11ac95492db [0,1,0,0,1,0|2,0,0]=4 2988 B11R1.332 CC(C)C(=O)COC1CCC1 bee70ac6d377fd178bd77a998ef40f27 [0,1,0,0,1,0|2,0,0]=4 2989 B11R1.332 CC(C)C(=O)OCN1CCC1 4c9ba07985cb207f8faa2cab5859446f [0,1,0,0,1,0|1,0,0]=3 2990 B11R1.332 CC(C)C(C)OCC1CCC1 93ea03cd96e818d0f35dfe0b7148f035 [0,1,0,0,1,0|1,0,1]=4 2991 B11R1.332 CC(C)C(C)OCC1CCO1 76e243a9ff788d9464cea289ee067a82 [0,1,0,0,1,0|1,0,1]=4 2992 B11R1.332 CC(C)C(C)OC[C@@H]1CCO1 3e778e3af4ce8e8f5540eb9e4bc831f8 [0,1,0,0,1,0|1,0,1]=4 2993 B11R1.332 CC(C)C(C)OC[C@H]1CCO1 a84b239aa31cd15ab4f33a0f386e2886 [0,1,0,0,1,0|1,0,1]=4 2994 B11R1.332 CC(C)[C@@H](C)OCC1CCC1 c67e0546f7514891081022771bac6049 [0,1,0,0,1,0|1,0,1]=4 2995 B11R1.332 CC(C)[C@@H](C)OCC1CCO1 0212841071b4b98a94efa6e98ac5468d [0,1,0,0,1,0|1,0,1]=4 2996 B11R1.332 CC(C)[C@@H](C)OC[C@@H]1CCO1 fd857653b8f817af6f67f6719d212c7e [0,1,0,0,1,0|1,0,1]=4 2997 B11R1.332 CC(C)[C@@H](C)OC[C@H]1CCO1 3e83d18deef82faaffb7d9bda5b0376b [0,1,0,0,1,0|1,0,1]=4 2998 B11R1.332 CC(C)[C@H](C)OCC1CCC1 883444a942b8121db52d49608145a1d2 [0,1,0,0,1,0|1,0,1]=4 2999 B11R1.332 CC(C)[C@H](C)OCC1CCO1 60164245857284249e8ab4f67aaa486c [0,1,0,0,1,0|1,0,1]=4 3000 B11R1.332 CC(C)[C@H](C)OC[C@@H]1CCO1 ee6c83ef43b1cfb172d87fbc7f15b947 [0,1,0,0,1,0|1,0,1]=4 3001 B11R1.332 CC(C)[C@H](C)OC[C@H]1CCO1 db362bffbd52e009b178fe73d79653da [0,1,0,0,1,0|1,0,1]=4 3002 B11R1.332 CC(F)C(=O)NCC1CCC1 4d2b81c21bf6cc39bfb9646ef23d95dc [0,1,0,0,1,0|1,0,0]=3 3003 B11R1.332 CC(F)C(=O)NCC1CCO1 c1a33c71fc43fe3cf987b8eb88cd4895 [0,1,0,0,1,0|1,0,0]=3 3004 B11R1.332 CC(F)C(=O)NCC1COC1 6aca49d0fe7e0620d956c429e9bcc6b1 [0,1,0,0,1,0|2,0,0]=4 3005 B11R1.332 CC(F)C(=O)NC[C@@H]1CCO1 9b1829b5bb17139388eefde15e30588e [0,1,0,0,1,0|1,0,0]=3 3006 B11R1.332 CC(F)C(=O)NC[C@H]1CCO1 57a899899caf3398698a887c5d493873 [0,1,0,0,1,0|1,0,0]=3 3007 B11R1.332 CC(O)C(=O)NCC1CCC1 90c762f6da964ff36c3cda46ec058734 [0,1,0,0,1,0|1,0,0]=3 3008 B11R1.332 CC(O)C(=O)NCC1CCO1 0201c58a54623694f6d7df2b75bf4963 [0,1,0,0,1,0|1,0,0]=3 3009 B11R1.332 CC(O)C(=O)NCC1COC1 28809f2dc5b80a82513db918c3611109 [0,1,0,0,1,0|2,0,0]=4 3010 B11R1.332 CC(O)C(=O)NC[C@@H]1CCO1 b21f65e46653a6b6b3611f35f9192d53 [0,1,0,0,1,0|1,0,0]=3 3011 B11R1.332 CC(O)C(=O)NC[C@H]1CCO1 e7967db5e78dbf3b84d1f6f39bdd4a7a [0,1,0,0,1,0|1,0,0]=3 3012 B11R1.332 CC(S)C(=O)NCC1CCC1 f311934b17255518166cd48febcb86da [0,1,0,0,1,0|1,0,0]=3 3013 B11R1.332 CC(S)C(=O)NCC1CCO1 12d6de3c774ee78c8789d4d592d7a096 [0,1,0,0,1,0|1,0,0]=3 3014 B11R1.332 CC(S)C(=O)NCC1COC1 bd8c9022649b25a319c7f27a5b4074e8 [0,1,0,0,1,0|2,0,0]=4 3015 B11R1.332 CC(S)C(=O)NC[C@@H]1CCO1 95edaaf61dde0aa9721b4b2dce762b45 [0,1,0,0,1,0|1,0,0]=3 3016 B11R1.332 CC(S)C(=O)NC[C@H]1CCO1 e2c21ba3917b4ada37231d48e8e905d5 [0,1,0,0,1,0|1,0,0]=3 3017 B11R1.332 CC(S)C(C)OCC1CCC1 70250efdd83ba13ac4de99af2a004b3e [0,1,0,0,1,0|1,0,1]=4 3018 B11R1.332 CC(S)C(C)OCC1CCO1 505291c61959792797ba1d4aa456b99d [0,1,0,0,1,0|1,0,1]=4 3019 B11R1.332 CC(S)C(C)OC[C@@H]1CCO1 76fa0067681064df9c68b12a2f2b9fa2 [0,1,0,0,1,0|1,0,1]=4 3020 B11R1.332 CC(S)C(C)OC[C@H]1CCO1 4b67d7beabff8029d10bc1cec3f05401 [0,1,0,0,1,0|1,0,1]=4 3021 B11R1.332 C[C@@H](F)C(=O)NCC1CCC1 d1df405f1e52a918067b0374a230f0e6 [0,1,0,0,1,0|1,0,0]=3 3022 B11R1.332 C[C@@H](F)C(=O)NCC1CCO1 f62c2b193d8cf611c02747062b68fe5a [0,1,0,0,1,0|1,0,0]=3 3023 B11R1.332 C[C@@H](F)C(=O)NCC1COC1 506d39197e6b0daf28e370eb7ef0dbe5 [0,1,0,0,1,0|2,0,0]=4 3024 B11R1.332 C[C@@H](F)C(=O)NC[C@@H]1CCO1 6383fbfa24fec2d70aa25d0d0b952b27 [0,1,0,0,1,0|1,0,0]=3 3025 B11R1.332 C[C@@H](F)C(=O)NC[C@H]1CCO1 7caeb4a238e1814fc1d4773d40ea9e69 [0,1,0,0,1,0|1,0,0]=3 3026 B11R1.332 C[C@@H](O)C(=O)NCC1CCC1 8a46a6b1e265eaab72514f7e4c659074 [0,1,0,0,1,0|1,0,0]=3 3027 B11R1.332 C[C@@H](O)C(=O)NCC1CCO1 2a13685cb12ede63fbce15a0e2a0f6d0 [0,1,0,0,1,0|1,0,0]=3 3028 B11R1.332 C[C@@H](O)C(=O)NCC1COC1 d218f1d765e0a6246f76c865f4af2411 [0,1,0,0,1,0|2,0,0]=4 3029 B11R1.332 C[C@@H](O)C(=O)NC[C@@H]1CCO1 f965361149018b4e1b527a3a379311bc [0,1,0,0,1,0|1,0,0]=3 3030 B11R1.332 C[C@@H](O)C(=O)NC[C@H]1CCO1 acbd1195714e316b9a00061fe350b5ee [0,1,0,0,1,0|1,0,0]=3 3031 B11R1.332 C[C@H](F)C(=O)NCC1CCC1 c7c49914d333ef75a004edc5f65dbbca [0,1,0,0,1,0|1,0,0]=3 3032 B11R1.332 C[C@H](F)C(=O)NCC1CCO1 bf5db5eb8796b33886f28414cee274f1 [0,1,0,0,1,0|1,0,0]=3 3033 B11R1.332 C[C@H](F)C(=O)NCC1COC1 b16e622a1d98e6cb21824c2496462964 [0,1,0,0,1,0|2,0,0]=4 3034 B11R1.332 C[C@H](F)C(=O)NC[C@@H]1CCO1 4ab837ece3262b0f699949e2866d9238 [0,1,0,0,1,0|1,0,0]=3 3035 B11R1.332 C[C@H](F)C(=O)NC[C@H]1CCO1 4553ada4f046859432d43166ac67994e [0,1,0,0,1,0|1,0,0]=3 3036 B11R1.332 C[C@H](O)C(=O)NCC1CCC1 86f8fb6d5a655136f5e799eb86156656 [0,1,0,0,1,0|1,0,0]=3 3037 B11R1.332 C[C@H](O)C(=O)NCC1CCO1 24710a550de314584c3237c19a426891 [0,1,0,0,1,0|1,0,0]=3 3038 B11R1.332 C[C@H](O)C(=O)NCC1COC1 0e4ec19ee4634aaf737f3b0118030dc4 [0,1,0,0,1,0|2,0,0]=4 3039 B11R1.332 C[C@H](O)C(=O)NC[C@@H]1CCO1 7f28fd1568525f8ca80a0505cc4e8d02 [0,1,0,0,1,0|1,0,0]=3 3040 B11R1.332 C[C@H](O)C(=O)NC[C@H]1CCO1 b5c94d5e0a24248954e14b486baf041c [0,1,0,0,1,0|1,0,0]=3 3041 B11R1.332 O=C(NCC1CCC1)C(F)F 42320bba7e881224889efd5931c9ddfa [0,1,0,0,1,0|2,0,0]=4 3042 B11R1.332 O=C(NCC1CCC1)C(O)O b376fb05eb975c3bb217fcff72832eba [0,1,0,0,1,0|2,0,0]=4 3043 B11R1.332 O=C(NCC1CCO1)C(F)F a0be7dee9de9c8e4d028e11c93e20e5a [0,1,0,0,1,0|2,0,0]=4 3044 B11R1.332 O=C(NCC1CCO1)C(O)O 3062444c2a69e4635fb5c04a6fa5b5d4 [0,1,0,0,1,0|2,0,0]=4 3045 B11R1.332 O=C(NC[C@@H]1CCO1)C(F)F d52ca2b05dba187bd3c85bda5d886392 [0,1,0,0,1,0|2,0,0]=4 3046 B11R1.332 O=C(NC[C@@H]1CCO1)C(O)O 6f0eb9215cf5e0372058ef0c544bc6a8 [0,1,0,0,1,0|2,0,0]=4 3047 B11R1.332 O=C(NC[C@H]1CCO1)C(F)F f1ce9c20abf8a48e84e54309b648073e [0,1,0,0,1,0|2,0,0]=4 3048 B11R1.332 O=C(NC[C@H]1CCO1)C(O)O 1d2d3d5e4b04f08fa9869a26bf21089f [0,1,0,0,1,0|2,0,0]=4 3049 B11R1.859 CC1(CCO1)CNC(=O)CF 7862742ac7e208dd749a0f35be266159 [0,1,0,0,1,0|2,0,0]=4 3050 B11R1.859 CC1(CCO1)CNC(=O)CO b1e423951af3e64322ca103315b2b557 [0,1,0,0,1,0|2,0,0]=4 3051 B11R1.859 CC1(CCO1)CNC(=O)CS 7ae56f4369924639ba95a8cd6c080024 [0,1,0,0,1,0|2,0,0]=4 3052 B11R1.859 CCC(=O)CNC1(CCC1)C ad2aeb4da56660808acb36f8003f7e19 [0,1,0,0,1,0|2,0,0]=4 3053 B11R1.859 CCC(=O)NCC1(CCC1)O decc8b5bc4a841d105249b60c886fb74 [0,1,0,0,1,0|1,0,0]=3 3054 B11R1.859 CCC(=O)NCC1(CCO1)C 9e2a548c476cf996d2b8b5c400c0dc14 [0,1,0,0,1,0|1,0,0]=3 3055 B11R1.859 CCC(=O)NCC1(COC1)C e6acd19eb8fdc4c906aac0d4e7cc4580 [0,1,0,0,1,0|2,0,0]=4 3056 B11R1.859 CCC(=O)NCC1(COC1)F fac86ec030fd8da043e6ecae618ec4bc [0,1,0,0,1,0|2,0,0]=4 3057 B11R1.859 CCC(=O)NCC1(COC1)O 26a14b0855e82920d3539027232e2194 [0,1,0,0,1,0|2,0,0]=4 3058 B11R1.859 CCC(=O)NC[C@@]1(CCO1)C 4cd6d2154f01d2655d912c086597bee5 [0,1,0,0,1,0|1,0,0]=3 3059 B11R1.859 CCC(C)OCC1(CCC1)C 789436171d60bf083ece1f402e55272d [0,1,0,0,1,0|1,0,1]=4 3060 B11R1.859 CCC(C)OCC1(CCC1)F 7d35ef34a837fdffafe365becada1a9c [0,1,0,0,1,0|1,0,1]=4 3061 B11R1.859 CCC(C)OCC1(CCO1)C 622e28a0c3411ddcbc0ef07f1e182a75 [0,1,0,0,1,0|1,0,1]=4 3062 B11R1.859 CCC(C)OC[C@@]1(CCO1)C 2d691b84a6d3e6d3caaf4f981a57af3b [0,1,0,0,1,0|1,0,1]=4 3063 B11R1.859 CCC(C)OC[C@]1(CCO1)C 2ed13439e552b11f0ea2f01d5460eab3 [0,1,0,0,1,0|1,0,1]=4 3064 B11R1.859 CC[C@@H](C)OCC1(CCC1)C 728446538918d7db82300ee00cf58546 [0,1,0,0,1,0|1,0,1]=4 3065 B11R1.859 CC[C@H](C)OCC1(CCC1)C a1004dbd37753eda1cfbc0c5f70effb8 [0,1,0,0,1,0|1,0,1]=4 3066 B11R1.859 C[C@]1(CCO1)CNC(=O)CF 1ae629336205f8c5a0aa5741864e556e [0,1,0,0,1,0|2,0,0]=4 3067 B11R1.859 C[C@]1(CCO1)CNC(=O)CO d5fbcaf6745b0bcf0230d9901b086f33 [0,1,0,0,1,0|2,0,0]=4 3068 B11R1.859 C[C@]1(CCO1)CNC(=O)CS 61e8d37e003356764f668b9c5eb3e411 [0,1,0,0,1,0|2,0,0]=4 3069 B11R1.859 O=C(CF)NCC1(CCC1)O 71383b4fba9ed1e54d78a0c6a4b6f85b [0,1,0,0,1,0|2,0,0]=4 3070 B11R1.859 O=C(CO)NCC1(CCC1)O 78f3b808a5b84dc6e4a79d0ee4eec225 [0,1,0,0,1,0|2,0,0]=4 3071 B11R1.859 O=C(CS)NCC1(CCC1)O 1ff5ad3f720a6c0e5705dd7facf78875 [0,1,0,0,1,0|2,0,0]=4 3072 B13R1.11 CCC(=O)CN(C)C1CCCOC1 45546101237b9f39b1cf0a569468cc34 [0,1,0,0,0,1|2,0,0]=4 3073 B13R1.11 CCC(=O)NC(C)C1CCCCC1 177bafe9e4d7aa97cd322aab6ef3ea0b [0,1,0,0,0,1|2,0,0]=4 3074 B13R1.11 CCC(=O)NC(C)C1CCOCC1 f55339d261186490cd23cc92a989c743 [0,1,0,0,0,1|2,0,0]=4 3075 B13R1.11 CCC(=O)N[C@@H](C)C1CCCCC1 a31fe692a5ce1b3bfab023dc24d025f9 [0,1,0,0,0,1|2,0,0]=4 3076 B13R1.11 CCC(=O)N[C@@H](C)C1CCOCC1 122fa81f5288a1f078492a781789c0e3 [0,1,0,0,0,1|2,0,0]=4 3077 B13R1.11 CCC(=O)N[C@H](C)C1CCCCC1 900f98a9935dc8f1788ea919e61dfd14 [0,1,0,0,0,1|2,0,0]=4 3078 B13R1.11 CCC(=O)N[C@H](C)C1CCOCC1 e80a32b8e1468a2f437b2f825057e1a7 [0,1,0,0,0,1|2,0,0]=4 3079 B13R1.11 COC(=O)OC(C)N1CCCOC1 b0b46eae94980e7cbc6d0dcdfe4e37af [0,1,0,0,0,1|2,0,0]=4 3080 B13R1.14 CCC(=O)NCC1CCC(CC1)C da4cca74552dd7ab52bc9044211fd911 [0,1,0,0,0,1|2,0,0]=4 3081 B13R1.14 CCC(=O)NCC1CCC(CC1)Cl 7a2ec446928c175cf59ecf4ddfd132c6 [0,1,0,0,0,1|2,0,0]=4 3082 B13R1.14 CCC(=O)NCC1CCC(CC1)O 73436326141d09337207f7a56ce090db [0,1,0,0,0,1|2,0,0]=4 3083 B13R1.14 CCC(=O)NCC1CCN(CC1)C 7aafd8bfd2e46d565563e869daab899c [0,1,0,0,0,1|2,0,0]=4 3084 B13R1.14 CCC(=O)NCC1CNC(=O)CO1 c86457ae28ceedaf5379baed54214636 [0,1,0,0,0,1|1,0,1]=4 3085 B13R1.14 CCC(=O)NC[C@H]1CC[C@@H](CC1)F 0130ac96b92ed3b84ad210ffdde2f5f3 [0,1,0,0,0,1|2,0,0]=4 3086 B13R1.14 CCC(=O)NC[C@H]1CC[C@@H](CC1)O 322c13699e31d3e839e410314b237054 [0,1,0,0,0,1|2,0,0]=4 3087 B13R1.14 CCC(=O)NC[C@H]1CC[C@H](CC1)F 7a9a673f04b1d3bd810ee841419715f0 [0,1,0,0,0,1|2,0,0]=4 3088 B13R1.14 CCC(=O)OCN1CCC(CC1)C e85188d1f82193019400f53782f7166d [0,1,0,0,0,1|2,0,0]=4 3089 B13R1.14 CCC(=O)OCN1CCC(CC1)Cl 37b0c424472fc21c23fd760e8877474a [0,1,0,0,0,1|2,0,0]=4 3090 B13R1.14 CCC(=O)OCN1CCC(CC1)F 21a0c82cb03bc186d35ca7d07205a313 [0,1,0,0,0,1|2,0,0]=4 3091 B13R1.14 CCC(=O)OCN1CCC(CC1)I 4c9380b89c298a02af634a7a8283fa9f [0,1,0,0,0,1|2,0,0]=4 3092 B13R1.14 CCC(=O)OCN1CCC(CC1)O f3d41971e8f24d39004ec79d418d1fdd [0,1,0,0,0,1|2,0,0]=4 3093 B13R1.14 CCC(=O)OCN1CCN(CC1)C 2ad4963bde51b46b54f584764c185377 [0,1,0,0,0,1|2,0,0]=4 3094 B13R1.15 CCC(=O)CNC1COCC(C1)O a5729637a17c82e7302b08ea453783b8 [0,1,0,0,0,1|2,0,0]=4 3095 B13R1.15 CCC(=O)CN[C@@H]1COC[C@@H](C1)O 73c21120cd5fb32265804b01555ee49b [0,1,0,0,0,1|2,0,0]=4 3096 B13R1.15 CCC(=O)CN[C@H]1COC[C@H](C1)O 678a7ca835bd11e1b6f59ffefb4f6fbd [0,1,0,0,0,1|2,0,0]=4 3097 B13R1.15 CCC(=O)NCC1CCCC(=O)N1 dfc81ecccc1f53b1f568249c9fec31ab [0,1,0,0,0,1|2,0,0]=4 3098 B13R1.15 CCC(=O)NCC1CCCC(C1)C 163effbc17b7c01699cb208b394c417d [0,1,0,0,0,1|2,0,0]=4 3099 B13R1.15 CCC(=O)NCC1CCCC(C1)O 962517b04465f6490823f5d8bb50238e [0,1,0,0,0,1|2,0,0]=4 3100 B13R1.15 CCC(=O)NCC1CCCN(C1)C d220235575bbd9010cb08376a9d98484 [0,1,0,0,0,1|2,0,0]=4 3101 B13R1.15 CCC(=O)NCC1CN(CCO1)C f067378bbfbe462339331cdf09297020 [0,1,0,0,0,1|1,0,0]=3 3102 B13R1.15 CCC(=O)NC[C@@H]1CCCN(C1)C 52bb327500c82227b3951508efa358b9 [0,1,0,0,0,1|2,0,0]=4 3103 B13R1.15 CCC(=O)NC[C@@H]1CN(CCO1)C 98d4ccb9b050a4eb4b74aa7efab217a4 [0,1,0,0,0,1|1,0,0]=3 3104 B13R1.15 CCC(=O)NC[C@H]1CCCN(C1)C 1354195503cc87234b612a7490e15096 [0,1,0,0,0,1|2,0,0]=4 3105 B13R1.15 CCC(=O)NC[C@H]1CCC[C@H](C1)O 52b86f3c5e83f65c0be450e994b73d61 [0,1,0,0,0,1|2,0,0]=4 3106 B13R1.15 CCC(=O)NC[C@H]1CN(CCO1)C c1c95cfb495efafad5374b27f1285c64 [0,1,0,0,0,1|1,0,0]=3 3107 B13R1.15 CCC(=O)OCN1CCCC(=O)C1 a360c36c186d6f08f5d97f4672726413 [0,1,0,0,0,1|2,0,0]=4 3108 B13R1.15 CCC(=O)OCN1CCCC(C1)C 95f9d9fa5554972c30b7dd64368fe939 [0,1,0,0,0,1|2,0,0]=4 3109 B13R1.15 CCC(=O)OCN1CCCC(C1)F 073e537a1a47ee7632c55cf7edef21bd [0,1,0,0,0,1|2,0,0]=4 3110 B13R1.15 CCC(=O)OCN1CCCC(C1)O 7f8c709249f6170c3c8912cfaf6ce18a [0,1,0,0,0,1|2,0,0]=4 3111 B13R1.15 CCC(=O)OCN1CCC[C@@H](C1)C 5dbb86970aa88975185a12f4684afb01 [0,1,0,0,0,1|2,0,0]=4 3112 B13R1.15 CCC(=O)OCN1CCC[C@@H](C1)F 3f46028814e07c8978feee18bc222f2b [0,1,0,0,0,1|2,0,0]=4 3113 B13R1.15 CCC(=O)OCN1CCC[C@@H](C1)O 5a06ee3a6005feac8f8585bbf425553a [0,1,0,0,0,1|2,0,0]=4 3114 B13R1.15 CCC(=O)OCN1CCC[C@H](C1)C ddca5b8aa68e05678bb759d5c60d0991 [0,1,0,0,0,1|2,0,0]=4 3115 B13R1.15 CCC(=O)OCN1CCC[C@H](C1)F 155f2d277f560366599ab22db0994ec3 [0,1,0,0,0,1|2,0,0]=4 3116 B13R1.15 CCC(=O)OCN1CCC[C@H](C1)O 9f3839d6077a3c4d681fae5ed9e9e343 [0,1,0,0,0,1|2,0,0]=4 3117 B13R1.15 CCC(=O)OCN1CCOC(C1)C b4953ef67d67bba6719438772215d892 [0,1,0,0,0,1|2,0,0]=4 3118 B13R1.15 CCC(=O)OCN1CCO[C@@H](C1)C 809876baab856363f74fe634e0ffe54f [0,1,0,0,0,1|2,0,0]=4 3119 B13R1.15 CCC(=O)OCN1CCO[C@H](C1)C 1c2e6a090f052367b8953fa741ac491f [0,1,0,0,0,1|2,0,0]=4 3120 B13R1.15 CCC(C)OCC1CN(CCO1)C 5b69a5edbd28b97a1ce983aaa64e1bb2 [0,1,0,0,0,1|1,0,1]=4 3121 B13R1.15 CCC(C)OC[C@@H]1CN(CCO1)C fd4d0ab45a6442504cdcd38cccd503ec [0,1,0,0,0,1|1,0,1]=4 3122 B13R1.15 CCC(C)OC[C@H]1CN(CCO1)C c85d683cdb31a2c0982beb73f138bdb0 [0,1,0,0,0,1|1,0,1]=4 3123 B13R1.15 CN1CCOC(C1)CNC(=O)CF ca99c752887a70d82a94aa1bf595108b [0,1,0,0,0,1|2,0,0]=4 3124 B13R1.15 CN1CCOC(C1)CNC(=O)CO 3477c6d0bf880367614a6ec9dd2aa8c7 [0,1,0,0,0,1|2,0,0]=4 3125 B13R1.15 CN1CCOC(C1)CNC(=O)CS 9ec61ad1180af3a9fa68cdcf8ab571c2 [0,1,0,0,0,1|2,0,0]=4 3126 B13R1.15 CN1CCO[C@@H](C1)CNC(=O)CF 30ee100aecb7c0200056c9e1eceacddf [0,1,0,0,0,1|2,0,0]=4 3127 B13R1.15 CN1CCO[C@@H](C1)CNC(=O)CO be92df142dc761cd14df18d38b12f230 [0,1,0,0,0,1|2,0,0]=4 3128 B13R1.15 CN1CCO[C@@H](C1)CNC(=O)CS 59667b8f61bf14c8299fa49bbb2ff3d0 [0,1,0,0,0,1|2,0,0]=4 3129 B13R1.15 CN1CCO[C@H](C1)CNC(=O)CF bf7e6c62e8c3a3a1133c9ff0d7769d81 [0,1,0,0,0,1|2,0,0]=4 3130 B13R1.15 CN1CCO[C@H](C1)CNC(=O)CO cd178b6f8c8653fa86d8315a56b12f1e [0,1,0,0,0,1|2,0,0]=4 3131 B13R1.15 CN1CCO[C@H](C1)CNC(=O)CS 2ca10dd390cf2e8c0435914476a4f3b9 [0,1,0,0,0,1|2,0,0]=4 3132 B13R1.42 C#CCC(=O)NCC1CCCCO1 2063d4519e40e12a45ec8d373286af6d [0,1,0,0,0,1|1,0,1]=4 3133 B13R1.42 C#CCC(=O)NCC1CCCOC1 d5293387a1e7d581d76ca560adb98d28 [0,1,0,0,0,1|1,0,1]=4 3134 B13R1.42 C#CCC(=O)NCC1COCCO1 80bce455c8af9ff8f4e94cee82cdc740 [0,1,0,0,0,1|1,0,1]=4 3135 B13R1.42 C#CCC(=O)NC[C@@H]1CCCOC1 1efd25487fe9b32e8ef1e1414696e9b2 [0,1,0,0,0,1|1,0,1]=4 3136 B13R1.42 C#CCC(=O)NC[C@H]1CCCOC1 b226eee7e11c8b00d67818149b51a2ba [0,1,0,0,0,1|1,0,1]=4 3137 B13R1.42 C#CCC(=O)NC[C@H]1COCCO1 71db44f86193fd6026e75c91eac2e190 [0,1,0,0,0,1|1,0,1]=4 3138 B13R1.42 C/C=C/C(=O)NCC1CCCCO1 0d325944b6b07aed2dfd1f79437e1eed [0,1,0,0,0,1|1,0,1]=4 3139 B13R1.42 C/C=C/C(=O)NCC1CCCOC1 7700c3ebe7ca8f1b213c4b153806fce5 [0,1,0,0,0,1|1,0,1]=4 3140 B13R1.42 C/C=C/C(=O)NCC1COCCO1 5023487308cf5cfae0e7d7231ce19630 [0,1,0,0,0,1|1,0,1]=4 3141 B13R1.42 C/C=C/C(=O)NC[C@@H]1CCCOC1 bf0c7aca9c3b9bfa99fac4517197189f [0,1,0,0,0,1|1,0,1]=4 3142 B13R1.42 C/C=C/C(=O)NC[C@H]1CCCOC1 65bc78f92a205af4468d00384652a04a [0,1,0,0,0,1|1,0,1]=4 3143 B13R1.42 C/C=C/C(=O)NC[C@H]1COCCO1 45bba39cf9cbee62f6df18058cef8582 [0,1,0,0,0,1|1,0,1]=4 3144 B13R1.42 C=CCC(=O)NCC1CCCCO1 11eb1ed8a639fc4f586ece66aabc405e [0,1,0,0,0,1|1,0,1]=4 3145 B13R1.42 C=CCC(=O)NCC1CCCOC1 6148eae80d473f2a30230f6c9b32273c [0,1,0,0,0,1|1,0,1]=4 3146 B13R1.42 C=CCC(=O)NCC1COCCO1 f3939afa538dcb94f8e8b0f84732d567 [0,1,0,0,0,1|1,0,1]=4 3147 B13R1.42 C=CCC(=O)NC[C@@H]1CCCOC1 1ce095bbf1ef675e7c7d8b82acadce14 [0,1,0,0,0,1|1,0,1]=4 3148 B13R1.42 C=CCC(=O)NC[C@H]1CCCOC1 2907e4bc02c0160e986376c731be0293 [0,1,0,0,0,1|1,0,1]=4 3149 B13R1.42 C=CCC(=O)NC[C@H]1COCCO1 709fc0580a9fb248ea8e5f41e8687fcf [0,1,0,0,0,1|1,0,1]=4 3150 B13R1.42 CC#CC(=O)NCC1CCCCO1 bbd400997a380365b69a80cf5b1f5df1 [0,1,0,0,0,1|1,0,1]=4 3151 B13R1.42 CC#CC(=O)NCC1CCCOC1 779e409fe4b1f2a8cc10045c305ca91c [0,1,0,0,0,1|1,0,1]=4 3152 B13R1.42 CC#CC(=O)NCC1COCCO1 d0b98ac848292391512e7c65689677e1 [0,1,0,0,0,1|1,0,1]=4 3153 B13R1.42 CC#CC(=O)NC[C@@H]1CCCOC1 3e2c4bbfdd4a5f5fcb1e7e09d2b42ad2 [0,1,0,0,0,1|1,0,1]=4 3154 B13R1.42 CC#CC(=O)NC[C@H]1CCCOC1 a05e18b755b2d8950553e00cfe63a685 [0,1,0,0,0,1|1,0,1]=4 3155 B13R1.42 CC#CC(=O)NC[C@H]1COCCO1 f6c2da71320a78926f900d795418cb45 [0,1,0,0,0,1|1,0,1]=4 3156 B13R1.42 CCCC(=O)CNC1CCCOC1 af397dbcf231999291578128b2c13111 [0,1,0,0,0,1|2,0,0]=4 3157 B13R1.42 CCCC(=O)CN[C@@H]1CCCOC1 e2f53cdd432734bf3d2714107a423aad [0,1,0,0,0,1|2,0,0]=4 3158 B13R1.42 CCCC(=O)CN[C@H]1CCCOC1 2acde4f8ca77b43789880892ed58232d [0,1,0,0,0,1|2,0,0]=4 3159 B13R1.42 CCCC(=O)COC1CCCCO1 a32ac0feb8e185eed9db8e85bcecb338 [0,1,0,0,0,1|2,0,0]=4 3160 B13R1.42 CCCC(=O)COC1CCCOC1 1af5d638a645679008be71e8ffdcb105 [0,1,0,0,0,1|2,0,0]=4 3161 B13R1.42 CCCC(=O)CO[C@@H]1CCCOC1 db30755d3729a9d6b58d37ed57d7f7bf [0,1,0,0,0,1|2,0,0]=4 3162 B13R1.42 CCCC(=O)CO[C@H]1CCCOC1 2703596e68e9055a23d74ca0cf4ae37c [0,1,0,0,0,1|2,0,0]=4 3163 B13R1.42 CCCC(=O)NCC1CCCCC1 59b0c8cf3d107cd6e9dc3ad64411b33f [0,1,0,0,0,1|2,0,0]=4 3164 B13R1.42 CCCC(=O)NCC1CCCCO1 df1714756174a1120fa300610cfcd7af [0,1,0,0,0,1|1,0,0]=3 3165 B13R1.42 CCCC(=O)NCC1CCCOC1 ac3600b0ff9b9e8fb1374777f901793b [0,1,0,0,0,1|1,0,0]=3 3166 B13R1.42 CCCC(=O)NCC1CCOCC1 e599d9ef53656fc3c78d83244efc1955 [0,1,0,0,0,1|2,0,0]=4 3167 B13R1.42 CCCC(=O)NCC1CCSCC1 4e9b9ecc3b1bfa45e079a2731055a416 [0,1,0,0,0,1|2,0,0]=4 3168 B13R1.42 CCCC(=O)NCC1COCCO1 4b3889350c53d27478d8a1cfce1b6f89 [0,1,0,0,0,1|1,0,0]=3 3169 B13R1.42 CCCC(=O)NC[C@@H]1CCCOC1 8a0daad8a060e7b69c2a7aa99a2e0665 [0,1,0,0,0,1|1,0,0]=3 3170 B13R1.42 CCCC(=O)NC[C@H]1CCCOC1 69ddaac84ff58be7a590029cd7eb5243 [0,1,0,0,0,1|1,0,0]=3 3171 B13R1.42 CCCC(=O)NC[C@H]1COCCO1 37b571ff2bf4e8f441dac591c1ffc8c8 [0,1,0,0,0,1|1,0,0]=3 3172 B13R1.42 CCCC(=O)OCN1CCCOC1 b5dae6b5822b9b89e1d1b0890a9d803f [0,1,0,0,0,1|1,0,0]=3 3173 B13R1.42 CCCC(=O)OCN1CCCSC1 0e6788b80f43cb7d34382259a5f11fbb [0,1,0,0,0,1|1,1,0]=4 3174 B13R1.42 CCCC(=O)OCN1CCOCC1 0f841d2b166e2910b3c31a8ba4824608 [0,1,0,0,0,1|2,0,0]=4 3175 B13R1.42 CCCC(=O)OCN1CCSCC1 87acf1ce4a6baae51b21e5cf02ea6c20 [0,1,0,0,0,1|2,0,0]=4 3176 B13R1.42 CCCC(=S)OCC1CCCCC1 8683bea1dccdfbd48602a3b60ab7a997 [0,1,0,0,0,1|1,1,0]=4 3177 B13R1.42 CCCC(=S)OCC1CCCCO1 40459cb618b121d1cba8181437cd8856 [0,1,0,0,0,1|0,1,0]=3 3178 B13R1.42 CCCC(=S)OCC1CCCOC1 51320a54aa3c7d8f15e6409f4c55af1a [0,1,0,0,0,1|0,1,0]=3 3179 B13R1.42 CCCC(=S)OCC1CCOCC1 c957b0111362e7a29f2d794a5213d0cb [0,1,0,0,0,1|1,1,0]=4 3180 B13R1.42 CCCC(=S)OCC1CCSCC1 e9e4f98b37e0095122b0a68085669721 [0,1,0,0,0,1|1,1,0]=4 3181 B13R1.42 CCCC(=S)OCC1COCCO1 dbced04586e9abdbb9238f3156de0c1f [0,1,0,0,0,1|0,1,0]=3 3182 B13R1.42 CCCC(C)OCC1CCCCO1 347271c2c9d8667803fb24459feb7631 [0,1,0,0,0,1|1,0,1]=4 3183 B13R1.42 CCCC(C)OCC1CCCOC1 804d664aa8999afeabdb7d9061066896 [0,1,0,0,0,1|1,0,1]=4 3184 B13R1.42 CCCC(C)OCC1COCCO1 aaf00d3aa92de48dbcf7c8145ede6d14 [0,1,0,0,0,1|1,0,1]=4 3185 B13R1.42 CCCC(C)OC[C@@H]1CCCCO1 e9e61482053826b8243619f4023d40ec [0,1,0,0,0,1|1,0,1]=4 3186 B13R1.42 CCCC(C)OC[C@@H]1CCCOC1 3893fb780e2a9f270dc08eac6aa706f5 [0,1,0,0,0,1|1,0,1]=4 3187 B13R1.42 CCCC(C)OC[C@@H]1COCCO1 cdbde0249db20233e346bc42d5876ce8 [0,1,0,0,0,1|1,0,1]=4 3188 B13R1.42 CCCC(C)OC[C@H]1CCCCO1 d348f30bbe1f8289be409adf7bb96241 [0,1,0,0,0,1|1,0,1]=4 3189 B13R1.42 CCCC(C)OC[C@H]1CCCOC1 e269481617fa4b5a2519026462950b4d [0,1,0,0,0,1|1,0,1]=4 3190 B13R1.42 CCCC(C)OC[C@H]1COCCO1 57c94735ef5dec94599fbec595e59ffd [0,1,0,0,0,1|1,0,1]=4 3191 B13R1.42 CCC[C@@H](C)OCC1CCCCO1 d0f9ba8b22a630a1a085ee8e90db6c0f [0,1,0,0,0,1|1,0,1]=4 3192 B13R1.42 CCC[C@@H](C)OCC1CCCOC1 a15e4da226898a8b64d607dfbed8859b [0,1,0,0,0,1|1,0,1]=4 3193 B13R1.42 CCC[C@@H](C)OCC1COCCO1 26d83cf409f210c4e2de53ffb3990ca6 [0,1,0,0,0,1|1,0,1]=4 3194 B13R1.42 CCC[C@H](C)OCC1CCCCO1 8034cab91c5971951026532bef133dfc [0,1,0,0,0,1|1,0,1]=4 3195 B13R1.42 CCC[C@H](C)OCC1CCCOC1 45214dbafd58612ba22635047108fd6a [0,1,0,0,0,1|1,0,1]=4 3196 B13R1.42 CCC[C@H](C)OCC1COCCO1 d69b05c883c37e34101ce356548ea4fc [0,1,0,0,0,1|1,0,1]=4 3197 B13R1.42 CCNC(=O)CCN1CCCOC1 894bbc15648b8a8ab22e4dadfe913292 [0,1,0,0,0,1|2,0,0]=4 3198 B13R1.42 CCNC(=O)CNC1CCCCO1 1b2ad4ad0a2e3a026df1e5b9470f29cd [0,1,0,0,0,1|2,0,0]=4 3199 B13R1.42 CCNC(=O)CNC1CCCOC1 ac8c9201075e2be5951c0bbe8c49e6d8 [0,1,0,0,0,1|2,0,0]=4 3200 B13R1.42 CCNC(=O)CN[C@@H]1CCCOC1 bcd344d727fcd35b2664051cfce3d907 [0,1,0,0,0,1|2,0,0]=4 3201 B13R1.42 CCNC(=O)CN[C@H]1CCCOC1 e38fc2b81144c67d7aa6c9e62d9a97d7 [0,1,0,0,0,1|2,0,0]=4 3202 B13R1.42 CCNC(=O)COC1CCCCO1 d7952717f4ce5c2fc6d809f93118e136 [0,1,0,0,0,1|2,0,0]=4 3203 B13R1.42 CCNC(=O)COC1CCCOC1 ecf8faf0648c77404583e72c839e8938 [0,1,0,0,0,1|2,0,0]=4 3204 B13R1.42 CCNC(=O)CO[C@@H]1CCCOC1 982ff9a5562f11ad931dfa53ea14b272 [0,1,0,0,0,1|2,0,0]=4 3205 B13R1.42 CCNC(=O)CO[C@H]1CCCOC1 7374ba782aa29f94dc1cbccc3f2644b3 [0,1,0,0,0,1|2,0,0]=4 3206 B13R1.42 CCOC(=O)CNC1CCCCO1 0bfd26db8c83b08a7e5cc6df4db09cfd [0,1,0,0,0,1|2,0,0]=4 3207 B13R1.42 CCOC(=O)CNC1CCCOC1 a2d6ccc73f0ff1da6860bf5eceac41e7 [0,1,0,0,0,1|2,0,0]=4 3208 B13R1.42 CCOC(=O)CN[C@@H]1CCCOC1 bbd57003c6d84fd5a8eddadda8f52bd8 [0,1,0,0,0,1|2,0,0]=4 3209 B13R1.42 CCOC(=O)CN[C@H]1CCCOC1 ba8f5729d96f4ea22b8c4d4e021c9c05 [0,1,0,0,0,1|2,0,0]=4 3210 B13R1.42 CCOC(=O)COC1CCCCO1 4a746dee98bf248e9802f49e141ae8c9 [0,1,0,0,0,1|2,0,0]=4 3211 B13R1.42 CCOC(=O)COC1CCCOC1 bc2ba4a68a1cd320da0e56f2b1b10d8f [0,1,0,0,0,1|2,0,0]=4 3212 B13R1.42 CCOC(=O)CO[C@@H]1CCCOC1 c30ea1447a2dbbf9f445c370ff92a87d [0,1,0,0,0,1|2,0,0]=4 3213 B13R1.42 CCOC(=O)CO[C@H]1CCCOC1 6822f6dfe16fa7120e401058c9646a5b [0,1,0,0,0,1|2,0,0]=4 3214 B13R1.42 CCOC(=O)OCN1CCCOC1 928df74b0b199b52a38a04685208592e [0,1,0,0,0,1|1,0,0]=3 3215 B13R1.42 CCOC(=O)OCN1CCCSC1 824e867a84b4bdf0c76a043b6e134a41 [0,1,0,0,0,1|1,1,0]=4 3216 B13R1.42 CCOC(=O)OCN1CCOCC1 ac8ea41adabb36186350e8cd2399ee82 [0,1,0,0,0,1|2,0,0]=4 3217 B13R1.42 CCOC(=O)OCN1CCSCC1 7f26ef680c29bd29e5ac83b0a0a2a08b [0,1,0,0,0,1|2,0,0]=4 3218 B13R1.42 CCSC(=O)OCN1CCCOC1 c216a77ed77435b07be97396d5abf322 [0,1,0,0,0,1|1,0,0]=3 3219 B13R1.42 CCSC(=O)OCN1CCCSC1 c85ece9ab590b0f3d03f5e47203c606a [0,1,0,0,0,1|1,1,0]=4 3220 B13R1.42 CCSC(=O)OCN1CCOCC1 e8df0dcd7b271998578b3d2beefccde9 [0,1,0,0,0,1|2,0,0]=4 3221 B13R1.42 CCSC(=O)OCN1CCSCC1 436d320acfbb29526b425182e2e39e46 [0,1,0,0,0,1|2,0,0]=4 3222 B13R1.42 COCC(=O)CNC1CCCOC1 38a2208c912ee397c904838c67b73298 [0,1,0,0,0,1|2,0,0]=4 3223 B13R1.42 COCC(=O)CN[C@@H]1CCCOC1 4c2e5070a8a9efa9f37830d29ab30bac [0,1,0,0,0,1|2,0,0]=4 3224 B13R1.42 COCC(=O)CN[C@H]1CCCOC1 5dba56e4e1eabb816ca01194b995c206 [0,1,0,0,0,1|2,0,0]=4 3225 B13R1.42 COCC(=O)COC1CCCCO1 1f8a286df220a06cc1d6aee76ad16bad [0,1,0,0,0,1|2,0,0]=4 3226 B13R1.42 COCC(=O)COC1CCCOC1 df39e028fd568665ff87e04e4671b644 [0,1,0,0,0,1|2,0,0]=4 3227 B13R1.42 COCC(=O)CO[C@@H]1CCCOC1 4c149039aa407204ecf5afafcacee6f7 [0,1,0,0,0,1|2,0,0]=4 3228 B13R1.42 COCC(=O)CO[C@H]1CCCOC1 5d5aac08716ccc5feb51998ffcf47252 [0,1,0,0,0,1|2,0,0]=4 3229 B13R1.42 COCC(=O)NCC1CCCCC1 ad6e42bc2ef1d6829ace656e5c21cef6 [0,1,0,0,0,1|2,0,0]=4 3230 B13R1.42 COCC(=O)NCC1CCCCO1 dda92f910d9988c28f12fd56f4a1d7e0 [0,1,0,0,0,1|1,0,0]=3 3231 B13R1.42 COCC(=O)NCC1CCCOC1 0906a33310941436c322e2a22792763c [0,1,0,0,0,1|1,0,0]=3 3232 B13R1.42 COCC(=O)NCC1CCOCC1 9ddcc36755551b49fcbf9fc750775b47 [0,1,0,0,0,1|2,0,0]=4 3233 B13R1.42 COCC(=O)NCC1CCSCC1 76f8e27b743e2963850a08e823ae271c [0,1,0,0,0,1|2,0,0]=4 3234 B13R1.42 COCC(=O)NCC1COCCO1 72624f9a7e1e9ff51f2694c21153109c [0,1,0,0,0,1|1,0,0]=3 3235 B13R1.42 COCC(=O)NC[C@@H]1CCCOC1 ee07a29e4b079667b1641b415abd0478 [0,1,0,0,0,1|1,0,0]=3 3236 B13R1.42 COCC(=O)NC[C@H]1CCCOC1 0574954d4ebda96fdce3575c89fa6826 [0,1,0,0,0,1|1,0,0]=3 3237 B13R1.42 COCC(=O)NC[C@H]1COCCO1 85e5434355509da27824bbb6da39d0b9 [0,1,0,0,0,1|1,0,0]=3 3238 B13R1.42 COCC(C)OCC1CCCCO1 5c61646a5a81d0b4e979a2d599bea6e6 [0,1,0,0,0,1|1,0,1]=4 3239 B13R1.42 COCC(C)OCC1CCCOC1 237e889647503c25ec3a5251bb7c4a73 [0,1,0,0,0,1|1,0,1]=4 3240 B13R1.42 COCC(C)OCC1COCCO1 354534e0770526a0a82ee814d09b93b1 [0,1,0,0,0,1|1,0,1]=4 3241 B13R1.42 COCC(C)OC[C@@H]1CCCCO1 262bbae1e355c65051bdfa373bdd6d01 [0,1,0,0,0,1|1,0,1]=4 3242 B13R1.42 COCC(C)OC[C@@H]1CCCOC1 d48712613ea523cf5ed0723b1fb1d866 [0,1,0,0,0,1|1,0,1]=4 3243 B13R1.42 COCC(C)OC[C@@H]1COCCO1 4781bbd9471b3c199aa5fb71f264114d [0,1,0,0,0,1|1,0,1]=4 3244 B13R1.42 COCC(C)OC[C@H]1CCCCO1 7341d64ee0ba9f4d00834d61c41cf306 [0,1,0,0,0,1|1,0,1]=4 3245 B13R1.42 COCC(C)OC[C@H]1CCCOC1 b848edfda0eede303ce87081491fd364 [0,1,0,0,0,1|1,0,1]=4 3246 B13R1.42 COCC(C)OC[C@H]1COCCO1 146a98f3f4a4c2ab724a33c2fb531fc4 [0,1,0,0,0,1|1,0,1]=4 3247 B13R1.42 COC[C@@H](C)OCC1CCCCO1 246661052bc894c606364d1f4004da80 [0,1,0,0,0,1|1,0,1]=4 3248 B13R1.42 COC[C@@H](C)OCC1CCCOC1 25ff598206b6b6ee02d061688646c118 [0,1,0,0,0,1|1,0,1]=4 3249 B13R1.42 COC[C@@H](C)OCC1COCCO1 bab5b8a1e8fd21a4ae95ae03659ebc4b [0,1,0,0,0,1|1,0,1]=4 3250 B13R1.42 COC[C@H](C)OCC1CCCCO1 422a69b9269d096a4799c8fe8056174f [0,1,0,0,0,1|1,0,1]=4 3251 B13R1.42 COC[C@H](C)OCC1CCCOC1 252f0ca828f6778e0d6f9c00c26c82c7 [0,1,0,0,0,1|1,0,1]=4 3252 B13R1.42 COC[C@H](C)OCC1COCCO1 e0d3fdbfb9df78c276066ec19e2869df [0,1,0,0,0,1|1,0,1]=4 3253 B13R1.42 CSCC(=O)NCC1CCCCC1 988bcd760780281a29da94faddaae8c1 [0,1,0,0,0,1|2,0,0]=4 3254 B13R1.42 CSCC(=O)NCC1CCCCO1 426b536cb822859195261455bf4db1d5 [0,1,0,0,0,1|1,0,0]=3 3255 B13R1.42 CSCC(=O)NCC1CCCOC1 74f8e741a7035cc64e9fbd8beb32d7d1 [0,1,0,0,0,1|1,0,0]=3 3256 B13R1.42 CSCC(=O)NCC1CCOCC1 d98213ea0d26d68fb0eb06700c96cf7d [0,1,0,0,0,1|2,0,0]=4 3257 B13R1.42 CSCC(=O)NCC1CCSCC1 0d36fa3fbd74b9327a1c6f286203b55f [0,1,0,0,0,1|2,0,0]=4 3258 B13R1.42 CSCC(=O)NCC1COCCO1 4ee264270a22d4329b93ebe7150f5c6d [0,1,0,0,0,1|1,0,0]=3 3259 B13R1.42 CSCC(=O)NC[C@@H]1CCCOC1 d039b0a201fc48cc17b543896c4662c5 [0,1,0,0,0,1|1,0,0]=3 3260 B13R1.42 CSCC(=O)NC[C@H]1CCCOC1 9f8eb1e1b527d93c5bf7a593159e206c [0,1,0,0,0,1|1,0,0]=3 3261 B13R1.42 CSCC(=O)NC[C@H]1COCCO1 37974514889d65273231da8f70eab631 [0,1,0,0,0,1|1,0,0]=3 3262 B13R1.42 CSCC(C)OCC1CCCCO1 1664496c9bd63eda73e066c7b1391ec4 [0,1,0,0,0,1|1,0,1]=4 3263 B13R1.42 CSCC(C)OCC1CCCOC1 e50d83e8675733c8201796662f493ba1 [0,1,0,0,0,1|1,0,1]=4 3264 B13R1.42 CSCC(C)OCC1COCCO1 ebc316d471f7f796ad16f48629e77cfb [0,1,0,0,0,1|1,0,1]=4 3265 B13R1.42 N#CCC(=O)NCC1CCCCO1 d1f13555e3a37ee29520f7e80eb943b0 [0,1,0,0,0,1|1,0,1]=4 3266 B13R1.42 N#CCC(=O)NCC1CCCOC1 a69e497e1636e919e0810867f1359bd4 [0,1,0,0,0,1|1,0,1]=4 3267 B13R1.42 N#CCC(=O)NCC1COCCO1 8ebaef815f19ccbe6e8f2181eb6810aa [0,1,0,0,0,1|1,0,1]=4 3268 B13R1.42 N#CCC(=O)NC[C@@H]1CCCOC1 2730034743c4fc2e2b06305a10a12cb7 [0,1,0,0,0,1|1,0,1]=4 3269 B13R1.42 N#CCC(=O)NC[C@H]1CCCOC1 356fa1620006ddd47bb4143a6add82ef [0,1,0,0,0,1|1,0,1]=4 3270 B13R1.42 N#CCC(=O)NC[C@H]1COCCO1 b8609ecbeb819b607857f437a895e16f [0,1,0,0,0,1|1,0,1]=4 3271 B13R1.42 NOCC(=O)NCC1CCCCO1 c05aa21b22b657f95b2bcbfc7ed69160 [0,1,0,0,0,1|2,0,0]=4 3272 B13R1.42 NOCC(=O)NCC1CCCOC1 945d0c0320d1e82a8ad7870450a6b584 [0,1,0,0,0,1|2,0,0]=4 3273 B13R1.42 NOCC(=O)NCC1COCCO1 909f0a9300a574c112ea7c41604c548f [0,1,0,0,0,1|2,0,0]=4 3274 B13R1.42 NOCC(=O)NC[C@@H]1CCCOC1 e0a5f13fbeca25c0f3460b334bff6046 [0,1,0,0,0,1|2,0,0]=4 3275 B13R1.42 NOCC(=O)NC[C@H]1CCCOC1 cacc60fbdb90366fbe032d6dd9c08153 [0,1,0,0,0,1|2,0,0]=4 3276 B13R1.42 NOCC(=O)NC[C@H]1COCCO1 5dab1b67a522b55c39f3fdcfc1130579 [0,1,0,0,0,1|2,0,0]=4 3277 B13R1.42 O=C(CCF)NCC1CCCCC1 e716cae20052812276d77fd52affe863 [0,1,0,0,0,1|2,0,0]=4 3278 B13R1.42 O=C(CCF)NCC1CCCCO1 f8a35830ed746c17f492427bdf4e11ba [0,1,0,0,0,1|1,0,0]=3 3279 B13R1.42 O=C(CCF)NCC1CCCOC1 7d95aac1fd9785d26c31dc6dfd0a064c [0,1,0,0,0,1|1,0,0]=3 3280 B13R1.42 O=C(CCF)NCC1CCOCC1 24763633c58582858f4c98064411abc3 [0,1,0,0,0,1|2,0,0]=4 3281 B13R1.42 O=C(CCF)NCC1CCSCC1 b82135253dba1325287cb773a2021469 [0,1,0,0,0,1|2,0,0]=4 3282 B13R1.42 O=C(CCF)NCC1COCCO1 edd3105aceeb3533f9af298df3cebe8f [0,1,0,0,0,1|1,0,0]=3 3283 B13R1.42 O=C(CCF)NC[C@@H]1CCCOC1 7e049435b8a8c430a908c6c3290c8b63 [0,1,0,0,0,1|1,0,0]=3 3284 B13R1.42 O=C(CCF)NC[C@H]1CCCOC1 92a827774a3b3eb47bab173152e04bcf [0,1,0,0,0,1|1,0,0]=3 3285 B13R1.42 O=C(CCF)NC[C@H]1COCCO1 c646d2d6191f4f3017bb4653d2c94381 [0,1,0,0,0,1|1,0,0]=3 3286 B13R1.42 O=C(CCO)NCC1CCCCC1 f14387b7fab588f8f722f8c4ac27b758 [0,1,0,0,0,1|2,0,0]=4 3287 B13R1.42 O=C(CCO)NCC1CCCCO1 e40deac4dac46ef8a0e5bd87885f2725 [0,1,0,0,0,1|1,0,0]=3 3288 B13R1.42 O=C(CCO)NCC1CCCOC1 6496b20a68a37c29d7b9f0560176be51 [0,1,0,0,0,1|1,0,0]=3 3289 B13R1.42 O=C(CCO)NCC1CCOCC1 60ed0fdb3bc32fb65c169208f7601011 [0,1,0,0,0,1|2,0,0]=4 3290 B13R1.42 O=C(CCO)NCC1CCSCC1 baa49196f915a07bb71f3e0668df18fb [0,1,0,0,0,1|2,0,0]=4 3291 B13R1.42 O=C(CCO)NCC1COCCO1 1ad9d26111eced76ae3bbec471b4d1a9 [0,1,0,0,0,1|1,0,0]=3 3292 B13R1.42 O=C(CCO)NC[C@@H]1CCCOC1 7f0810a2a98d1ec4a06a107525a0107f [0,1,0,0,0,1|1,0,0]=3 3293 B13R1.42 O=C(CCO)NC[C@H]1CCCOC1 48fc0520da660cf2db6b10ce222a90b1 [0,1,0,0,0,1|1,0,0]=3 3294 B13R1.42 O=C(CCO)NC[C@H]1COCCO1 491903bd52f58ce9ae6bba32d8e9ee4f [0,1,0,0,0,1|1,0,0]=3 3295 B13R1.42 O=C(CCS)NCC1CCCCC1 ccfed2b32e9688355c5ba310de8ce317 [0,1,0,0,0,1|2,0,0]=4 3296 B13R1.42 O=C(CCS)NCC1CCCCO1 72d87899c53c2b5788aa9fb6f1ae66f4 [0,1,0,0,0,1|1,0,0]=3 3297 B13R1.42 O=C(CCS)NCC1CCCOC1 cb2b450d486eb79be106285cb733d4c3 [0,1,0,0,0,1|1,0,0]=3 3298 B13R1.42 O=C(CCS)NCC1CCOCC1 06d3175436618baa1003a2402be5c67a [0,1,0,0,0,1|2,0,0]=4 3299 B13R1.42 O=C(CCS)NCC1CCSCC1 85e82eae8c87580e16665da11b0f712e [0,1,0,0,0,1|2,0,0]=4 3300 B13R1.42 O=C(CCS)NCC1COCCO1 2688ef59de9e2c962c425cbfcde13a9d [0,1,0,0,0,1|1,0,0]=3 3301 B13R1.42 O=C(CCS)NC[C@@H]1CCCOC1 b12e095a215b08ed342df9bb4d7df900 [0,1,0,0,0,1|1,0,0]=3 3302 B13R1.42 O=C(CCS)NC[C@H]1CCCOC1 09c7ee11f20d77892411b57aabc095e6 [0,1,0,0,0,1|1,0,0]=3 3303 B13R1.42 O=C(CCS)NC[C@H]1COCCO1 d6ab6ef343dfe846c39fcc51be6e547e [0,1,0,0,0,1|1,0,0]=3 3304 B13R1.42 O=CCC(=O)NCC1CCCCO1 784dca2631346915cd6982af2a44ddf7 [0,1,0,0,0,1|1,0,1]=4 3305 B13R1.42 O=CCC(=O)NCC1CCCOC1 dbc81140f56da13bffab153f16b4f8ac [0,1,0,0,0,1|1,0,1]=4 3306 B13R1.42 O=CCC(=O)NCC1COCCO1 9e2d5112f7fd8a11995f9ae42065b885 [0,1,0,0,0,1|1,0,1]=4 3307 B13R1.42 O=CCC(=O)NC[C@@H]1CCCOC1 a2f945371d7d8a92617b725f0a7e9924 [0,1,0,0,0,1|1,0,1]=4 3308 B13R1.42 O=CCC(=O)NC[C@H]1CCCOC1 9317bee11782db3d5fa6b2ff9a6049a1 [0,1,0,0,0,1|1,0,1]=4 3309 B13R1.42 O=CCC(=O)NC[C@H]1COCCO1 82ce968b865410a0e4075f9429c9f316 [0,1,0,0,0,1|1,0,1]=4 3310 B13R1.135 CCC(=O)C(=O)NC1CCCOC1 5501ac5a40dddb4a3777be18e3262b1b [0,1,0,0,0,1|2,0,0]=4 3311 B13R1.135 CCC(=O)C(=O)N[C@@H]1CCCOC1 81dfc35dd87076bc4dade9fb377f0bb5 [0,1,0,0,0,1|2,0,0]=4 3312 B13R1.135 CCC(=O)C(=O)N[C@H]1CCCOC1 9673d62dc5dcb0f2f04156e3e073f575 [0,1,0,0,0,1|2,0,0]=4 3313 B13R1.135 CCC(=O)C(C)NC1CCCOC1 3942498203ef283ec0cb15fd59013bfb [0,1,0,0,0,1|2,0,0]=4 3314 B13R1.135 CCC(=O)C(C)N[C@@H]1CCCOC1 083849b5a5a82afbeec8b8d0ce463090 [0,1,0,0,0,1|2,0,0]=4 3315 B13R1.135 CCC(=O)C(C)N[C@H]1CCCOC1 17c2b4fc1e67b85834e95493e89f165b [0,1,0,0,0,1|2,0,0]=4 3316 B13R1.135 CCC(=O)C(C)OC1CCCCO1 64a4014aaf153052785d22339b758d7b [0,1,0,0,0,1|2,0,0]=4 3317 B13R1.135 CCC(=O)C(C)OC1CCCOC1 69eaf2c003040ec8c1cce3b5f4bf9d93 [0,1,0,0,0,1|2,0,0]=4 3318 B13R1.135 CCC(=O)C(C)O[C@@H]1CCCOC1 372b8b60607ee16dcebd43777f253318 [0,1,0,0,0,1|2,0,0]=4 3319 B13R1.135 CCC(=O)C(C)O[C@H]1CCCOC1 2d5c274a6d07d0b7ef38bbc3aa6e8a6f [0,1,0,0,0,1|2,0,0]=4 3320 B13R1.135 CCC(=O)N(C)CC1CCCCC1 215a4c1dca6358035b7531ff635b4027 [0,1,0,0,0,1|2,0,0]=4 3321 B13R1.135 CCC(=O)N(C)CC1CCCCO1 c5630109b971eb22e1a50e59dc78d50a [0,1,0,0,0,1|1,0,0]=3 3322 B13R1.135 CCC(=O)N(C)CC1CCCOC1 4fa701a6f967bb5b77b4256d489c7e65 [0,1,0,0,0,1|1,0,0]=3 3323 B13R1.135 CCC(=O)N(C)CC1CCOCC1 943335ade428d8e8ed26f90b312f6f35 [0,1,0,0,0,1|2,0,0]=4 3324 B13R1.135 CCC(=O)N(C)CC1CCSCC1 92115eaff2f6ce607357ef50bb24a26c [0,1,0,0,0,1|2,0,0]=4 3325 B13R1.135 CCC(=O)N(C)CC1COCCO1 a4517d835ff03aa5627dd196cbdb2315 [0,1,0,0,0,1|1,0,0]=3 3326 B13R1.135 CCC(=O)N(C)C[C@@H]1COCCO1 c3714d6739e617266c26b96bdc73b090 [0,1,0,0,0,1|1,0,0]=3 3327 B13R1.135 CN(CC1CCCCO1)C(=O)CF 70f786380ced0c7a862b6bfbeb54ef81 [0,1,0,0,0,1|2,0,0]=4 3328 B13R1.135 CN(CC1CCCCO1)C(=O)CO 0145361209c63b1c6a54992f8a9fdb1e [0,1,0,0,0,1|2,0,0]=4 3329 B13R1.135 CN(CC1CCCCO1)C(=O)CS 4f64b54b9685a48a7614b416963d4e85 [0,1,0,0,0,1|2,0,0]=4 3330 B13R1.135 CN(CC1CCCOC1)C(=O)CF 288cc8494af6f8f4d3fcd20f98325e76 [0,1,0,0,0,1|2,0,0]=4 3331 B13R1.135 CN(CC1CCCOC1)C(=O)CO e0c94f5e84e3b41d8a194140cae46b66 [0,1,0,0,0,1|2,0,0]=4 3332 B13R1.135 CN(CC1CCCOC1)C(=O)CS bb39d3881801e051bb40c7b86bbc34c0 [0,1,0,0,0,1|2,0,0]=4 3333 B13R1.135 CN(CC1COCCO1)C(=O)CF 45cd38c1e0af59b0f95b2b5a139b1097 [0,1,0,0,0,1|2,0,0]=4 3334 B13R1.135 CN(CC1COCCO1)C(=O)CO 7f235cd5122dfd4614d7ca804ea11031 [0,1,0,0,0,1|2,0,0]=4 3335 B13R1.135 CN(CC1COCCO1)C(=O)CS b77e465c21bb8e4d1505e188a7191910 [0,1,0,0,0,1|2,0,0]=4 3336 B13R1.135 CN(C[C@@H]1COCCO1)C(=O)CF 0e713695a07de949f29c5af19be562a5 [0,1,0,0,0,1|2,0,0]=4 3337 B13R1.135 CN(C[C@@H]1COCCO1)C(=O)CO ac9ea9b68582730d686542321f953cec [0,1,0,0,0,1|2,0,0]=4 3338 B13R1.135 CN(C[C@@H]1COCCO1)C(=O)CS 2132e642bde6bb6069e68154cb033bbf [0,1,0,0,0,1|2,0,0]=4 3339 B13R1.351 C=C(C)C(=O)NCC1CCCCO1 eaf3f6a6c39669b47b4a8b4a77f14536 [0,1,0,0,0,1|1,0,1]=4 3340 B13R1.351 C=C(C)C(=O)NCC1CCCOC1 daea26ef49ac74c66c17b041de71a037 [0,1,0,0,0,1|1,0,1]=4 3341 B13R1.351 C=C(C)C(=O)NCC1COCCO1 7e272ade1c24043b068bb424f64f3357 [0,1,0,0,0,1|1,0,1]=4 3342 B13R1.351 C=C(C)C(=O)NC[C@@H]1CCCOC1 d4a310b53d30aebb7ec170d4d7d62302 [0,1,0,0,0,1|1,0,1]=4 3343 B13R1.351 C=C(C)C(=O)NC[C@H]1CCCOC1 b8142a9961590a20abb1ab0e1b2e3c95 [0,1,0,0,0,1|1,0,1]=4 3344 B13R1.351 C=C(C)C(=O)NC[C@H]1COCCO1 f2df4b39c5c22ce5651a8431744ba2e6 [0,1,0,0,0,1|1,0,1]=4 3345 B13R1.351 CC(=O)C(=O)NCC1CCCCO1 250071f25cca1445a8f0e46eb761c0da [0,1,0,0,0,1|1,0,1]=4 3346 B13R1.351 CC(=O)C(=O)NCC1CCCOC1 f7d2a151167a5cde9ae2a51c925e062e [0,1,0,0,0,1|1,0,1]=4 3347 B13R1.351 CC(=O)C(=O)NCC1COCCO1 ecb199b64da9101cad35cdd078af1836 [0,1,0,0,0,1|1,0,1]=4 3348 B13R1.351 CC(=O)C(=O)NC[C@@H]1CCCOC1 ee9b220235704f7614024091b7918797 [0,1,0,0,0,1|1,0,1]=4 3349 B13R1.351 CC(=O)C(=O)NC[C@H]1CCCOC1 ccdc6e7314210660d4cb9630fddd0de0 [0,1,0,0,0,1|1,0,1]=4 3350 B13R1.351 CC(=O)C(=O)NC[C@H]1COCCO1 0f0d0fc0c6bd620dbfc90a9fce8a851a [0,1,0,0,0,1|1,0,1]=4 3351 B13R1.351 CC(C)C(=O)CNC1CCCOC1 25af18dee71cd9dd942f79a022e4ab46 [0,1,0,0,0,1|2,0,0]=4 3352 B13R1.351 CC(C)C(=O)CN[C@@H]1CCCOC1 c59a715b4fa480c109f0f00cf666b25e [0,1,0,0,0,1|2,0,0]=4 3353 B13R1.351 CC(C)C(=O)CN[C@H]1CCCOC1 31f5573ff10454ba0235bb96e741b126 [0,1,0,0,0,1|2,0,0]=4 3354 B13R1.351 CC(C)C(=O)COC1CCCCO1 1bed3fb1a08252dd0f4b2eb92c8eef29 [0,1,0,0,0,1|2,0,0]=4 3355 B13R1.351 CC(C)C(=O)COC1CCCOC1 7c8d8d450283d8de881689edb43fac97 [0,1,0,0,0,1|2,0,0]=4 3356 B13R1.351 CC(C)C(=O)CO[C@@H]1CCCOC1 defefd91d46fa19406a81c2583c0d263 [0,1,0,0,0,1|2,0,0]=4 3357 B13R1.351 CC(C)C(=O)CO[C@H]1CCCOC1 41323617cb133fdbba4bcd1b21e10b7d [0,1,0,0,0,1|2,0,0]=4 3358 B13R1.351 CC(C)C(=O)OCN1CCCOC1 9c94860a06ba201c84eebd6e9c6c0dad [0,1,0,0,0,1|1,0,0]=3 3359 B13R1.351 CC(C)C(=O)OCN1CCCSC1 dfee1aa66736f442ccb7cb496474f44b [0,1,0,0,0,1|1,1,0]=4 3360 B13R1.351 CC(C)C(=O)OCN1CCOCC1 4c5a8ef4335e2a98ed15152dcc870191 [0,1,0,0,0,1|2,0,0]=4 3361 B13R1.351 CC(C)C(=O)OCN1CCSCC1 d81ea633e1ca0a7d65658689706407a4 [0,1,0,0,0,1|2,0,0]=4 3362 B13R1.351 CC(C)C(C)OCC1CCCCO1 8557b4aa6503792d02055d6ce8149a69 [0,1,0,0,0,1|1,0,1]=4 3363 B13R1.351 CC(C)C(C)OCC1CCCOC1 9c49640a3e6436a5a5c09cc72357cadb [0,1,0,0,0,1|1,0,1]=4 3364 B13R1.351 CC(C)C(C)OCC1COCCO1 6ea4f57658e9f73a6357ac065907e93b [0,1,0,0,0,1|1,0,1]=4 3365 B13R1.351 CC(C)C(C)OC[C@@H]1CCCCO1 070aff4b3bff09dc83fa07aa9253c2e9 [0,1,0,0,0,1|1,0,1]=4 3366 B13R1.351 CC(C)C(C)OC[C@@H]1CCCOC1 b5dd72ba487498da9a372b8c46c3839f [0,1,0,0,0,1|1,0,1]=4 3367 B13R1.351 CC(C)C(C)OC[C@@H]1COCCO1 ad987b0a96a6e27c5cae7f1e4ab43ab2 [0,1,0,0,0,1|1,0,1]=4 3368 B13R1.351 CC(C)C(C)OC[C@H]1CCCCO1 18ed2b5bf1bce1161a5c4e3a10b7c321 [0,1,0,0,0,1|1,0,1]=4 3369 B13R1.351 CC(C)C(C)OC[C@H]1CCCOC1 bf78f512189fdd0cf19c2641004f459f [0,1,0,0,0,1|1,0,1]=4 3370 B13R1.351 CC(C)C(C)OC[C@H]1COCCO1 3fe6beda61e9816ea330db0fdc518ef9 [0,1,0,0,0,1|1,0,1]=4 3371 B13R1.351 CC(C)[C@@H](C)OCC1CCCCO1 6800cfda90c847689efec571a94c3f4f [0,1,0,0,0,1|1,0,1]=4 3372 B13R1.351 CC(C)[C@@H](C)OCC1CCCOC1 fb30c00482a2c85b1e73fd4980bb3307 [0,1,0,0,0,1|1,0,1]=4 3373 B13R1.351 CC(C)[C@@H](C)OCC1COCCO1 95a9238f21e23dda09f7f628dd590f96 [0,1,0,0,0,1|1,0,1]=4 3374 B13R1.351 CC(C)[C@H](C)OCC1CCCCO1 c74a993f2532e7c978f0818f353f6beb [0,1,0,0,0,1|1,0,1]=4 3375 B13R1.351 CC(C)[C@H](C)OCC1CCCOC1 e9750c0f7f5c2cafaa7e2f80c528bef9 [0,1,0,0,0,1|1,0,1]=4 3376 B13R1.351 CC(C)[C@H](C)OCC1COCCO1 3132686eef85b4adea26cb4acb5e3f76 [0,1,0,0,0,1|1,0,1]=4 3377 B13R1.351 CC(F)C(=O)NCC1CCCCC1 f543d45f9df979b6da6fb222c1183ae6 [0,1,0,0,0,1|2,0,0]=4 3378 B13R1.351 CC(F)C(=O)NCC1CCCCO1 5b8af8210aae6caf909103079f9b76b1 [0,1,0,0,0,1|1,0,0]=3 3379 B13R1.351 CC(F)C(=O)NCC1CCCOC1 fc5024bdfdbe3c4ffe08b940d7785d48 [0,1,0,0,0,1|1,0,0]=3 3380 B13R1.351 CC(F)C(=O)NCC1CCOCC1 0871f20bf660fbcbafe72e62a3f5f791 [0,1,0,0,0,1|2,0,0]=4 3381 B13R1.351 CC(F)C(=O)NCC1CCSCC1 aae8e8479fe6d40af42d06156c54718b [0,1,0,0,0,1|2,0,0]=4 3382 B13R1.351 CC(F)C(=O)NCC1COCCO1 a8bf7b01bc33fee82a3dd96cf0091d83 [0,1,0,0,0,1|1,0,0]=3 3383 B13R1.351 CC(F)C(=O)NC[C@@H]1CCCOC1 6165f22b9df7ffb553e6f3daa1f5e6c7 [0,1,0,0,0,1|1,0,0]=3 3384 B13R1.351 CC(F)C(=O)NC[C@H]1CCCOC1 f92e968ea491f600c76e041dc04f262f [0,1,0,0,0,1|1,0,0]=3 3385 B13R1.351 CC(F)C(=O)NC[C@H]1COCCO1 75fb8b51a4bfca1a629e697f52527197 [0,1,0,0,0,1|1,0,0]=3 3386 B13R1.351 CC(O)C(=O)NCC1CCCCC1 c3d39601cc0eba7175331d0acf441cf9 [0,1,0,0,0,1|2,0,0]=4 3387 B13R1.351 CC(O)C(=O)NCC1CCCCO1 9e737e35b8257359dccf71c52171b2e4 [0,1,0,0,0,1|1,0,0]=3 3388 B13R1.351 CC(O)C(=O)NCC1CCCOC1 2396b12686432008467827e6826baeb0 [0,1,0,0,0,1|1,0,0]=3 3389 B13R1.351 CC(O)C(=O)NCC1CCOCC1 9bd86cfa828aeb532729599530c567d3 [0,1,0,0,0,1|2,0,0]=4 3390 B13R1.351 CC(O)C(=O)NCC1CCSCC1 4a26d6943fc44d4fde8657e4ea8e3d96 [0,1,0,0,0,1|2,0,0]=4 3391 B13R1.351 CC(O)C(=O)NCC1COCCO1 df17ce2ababb8cff0f86062bfafd840a [0,1,0,0,0,1|1,0,0]=3 3392 B13R1.351 CC(O)C(=O)NC[C@@H]1CCCOC1 06e84579496cd18e10b3a92c20108edb [0,1,0,0,0,1|1,0,0]=3 3393 B13R1.351 CC(O)C(=O)NC[C@H]1CCCOC1 afb01218c794df31234d3dcd7fa91f63 [0,1,0,0,0,1|1,0,0]=3 3394 B13R1.351 CC(O)C(=O)NC[C@H]1COCCO1 dddc1451573b82571cd8df341dd99c5d [0,1,0,0,0,1|1,0,0]=3 3395 B13R1.351 CC(S)C(=O)NCC1CCCCC1 ff1dc7363c47308dd41d742557eb33c3 [0,1,0,0,0,1|2,0,0]=4 3396 B13R1.351 CC(S)C(=O)NCC1CCCCO1 be203c919852f0a29b20655bf79715dc [0,1,0,0,0,1|1,0,0]=3 3397 B13R1.351 CC(S)C(=O)NCC1CCCOC1 4d45664e21177291e76606db9a2fa621 [0,1,0,0,0,1|1,0,0]=3 3398 B13R1.351 CC(S)C(=O)NCC1CCOCC1 a67640d1c51f659d8ec9eba0e4ded130 [0,1,0,0,0,1|2,0,0]=4 3399 B13R1.351 CC(S)C(=O)NCC1CCSCC1 a0046c5e694194142476a7dbac7d499a [0,1,0,0,0,1|2,0,0]=4 3400 B13R1.351 CC(S)C(=O)NCC1COCCO1 53bbbb4ec8ace3717a7af5c90bc598a3 [0,1,0,0,0,1|1,0,0]=3 3401 B13R1.351 CC(S)C(=O)NC[C@@H]1CCCOC1 6c072a15879854843d08505efe99e283 [0,1,0,0,0,1|1,0,0]=3 3402 B13R1.351 CC(S)C(=O)NC[C@H]1CCCOC1 2a0a0d7ca31baf9084f7d6a9a88efdaf [0,1,0,0,0,1|1,0,0]=3 3403 B13R1.351 CC(S)C(=O)NC[C@H]1COCCO1 0edabc9669ce286b768c116b6f9633df [0,1,0,0,0,1|1,0,0]=3 3404 B13R1.351 CC(S)C(C)OCC1CCCCO1 45a2e6a7f449cfa9314e49fece2a4b36 [0,1,0,0,0,1|1,0,1]=4 3405 B13R1.351 CC(S)C(C)OCC1CCCOC1 f5233eb0ed835be4a88081bc084b0f09 [0,1,0,0,0,1|1,0,1]=4 3406 B13R1.351 CC(S)C(C)OCC1COCCO1 41df96ff2f009c4354124248fe84ca4f [0,1,0,0,0,1|1,0,1]=4 3407 B13R1.351 C[C@@H](F)C(=O)NCC1CCCCC1 900daba94b360448bc597c0fd4914b95 [0,1,0,0,0,1|2,0,0]=4 3408 B13R1.351 C[C@@H](F)C(=O)NCC1CCCCO1 b26d8cf0a27b1fcd1be438fb785a0a91 [0,1,0,0,0,1|1,0,0]=3 3409 B13R1.351 C[C@@H](F)C(=O)NCC1CCCOC1 2cf3a90bcb975220a0dfd5a161d08e3e [0,1,0,0,0,1|1,0,0]=3 3410 B13R1.351 C[C@@H](F)C(=O)NCC1CCOCC1 335861a82f39e089bd1e9f0ed643aee5 [0,1,0,0,0,1|2,0,0]=4 3411 B13R1.351 C[C@@H](F)C(=O)NCC1CCSCC1 077c6a2379f0f3c85a502bccb2be8b9c [0,1,0,0,0,1|2,0,0]=4 3412 B13R1.351 C[C@@H](F)C(=O)NCC1COCCO1 4a61f635cbc9f20d79c6514a284b4081 [0,1,0,0,0,1|1,0,0]=3 3413 B13R1.351 C[C@@H](F)C(=O)NC[C@@H]1CCCOC1 eccd65495ad92ede23d56373cc9287f7 [0,1,0,0,0,1|1,0,0]=3 3414 B13R1.351 C[C@@H](F)C(=O)NC[C@H]1CCCOC1 2fe907468cf34ab7f7317417f731f27c [0,1,0,0,0,1|1,0,0]=3 3415 B13R1.351 C[C@@H](F)C(=O)NC[C@H]1COCCO1 474547f8404054c8bfb19584f4216d1d [0,1,0,0,0,1|1,0,0]=3 3416 B13R1.351 C[C@@H](O)C(=O)NCC1CCCCC1 f418c6e820e5e202d360541da958c52f [0,1,0,0,0,1|2,0,0]=4 3417 B13R1.351 C[C@@H](O)C(=O)NCC1CCCCO1 0ad70ba9f287ec2b3853933815fc572c [0,1,0,0,0,1|1,0,0]=3 3418 B13R1.351 C[C@@H](O)C(=O)NCC1CCCOC1 19caafe04183eee40fdb5fbaaa489bd9 [0,1,0,0,0,1|1,0,0]=3 3419 B13R1.351 C[C@@H](O)C(=O)NCC1CCOCC1 e6fa085f5a16247d0380a006991d2eac [0,1,0,0,0,1|2,0,0]=4 3420 B13R1.351 C[C@@H](O)C(=O)NCC1CCSCC1 909d8e97c475d04c4a4400ef3313c79c [0,1,0,0,0,1|2,0,0]=4 3421 B13R1.351 C[C@@H](O)C(=O)NCC1COCCO1 139ce7833df4311d69490a52346bf28b [0,1,0,0,0,1|1,0,0]=3 3422 B13R1.351 C[C@@H](O)C(=O)NC[C@@H]1CCCOC1 8100c9efaa247f39ce8fbdac7400bed9 [0,1,0,0,0,1|1,0,0]=3 3423 B13R1.351 C[C@@H](O)C(=O)NC[C@H]1CCCOC1 5c16337884509083c255b41b16576d92 [0,1,0,0,0,1|1,0,0]=3 3424 B13R1.351 C[C@@H](O)C(=O)NC[C@H]1COCCO1 d479f82eeff3ec99570f1b683a42814b [0,1,0,0,0,1|1,0,0]=3 3425 B13R1.351 C[C@H](F)C(=O)NCC1CCCCC1 1c825f26c3251c3d074d022634fe9894 [0,1,0,0,0,1|2,0,0]=4 3426 B13R1.351 C[C@H](F)C(=O)NCC1CCCCO1 fd687d625bb6b506e535dd4ec6772d0a [0,1,0,0,0,1|1,0,0]=3 3427 B13R1.351 C[C@H](F)C(=O)NCC1CCCOC1 d62fe809ce83a263a6c6ddd99c9f2085 [0,1,0,0,0,1|1,0,0]=3 3428 B13R1.351 C[C@H](F)C(=O)NCC1CCOCC1 9e2504cb1f31b970b762c33c63f0e035 [0,1,0,0,0,1|2,0,0]=4 3429 B13R1.351 C[C@H](F)C(=O)NCC1CCSCC1 188996549f5f1ee8fcb2b17f357e8625 [0,1,0,0,0,1|2,0,0]=4 3430 B13R1.351 C[C@H](F)C(=O)NCC1COCCO1 e373aaa3e9d987e2c5c69641904be403 [0,1,0,0,0,1|1,0,0]=3 3431 B13R1.351 C[C@H](F)C(=O)NC[C@@H]1CCCOC1 72a48c31667378c9b3887e56a3f70e90 [0,1,0,0,0,1|1,0,0]=3 3432 B13R1.351 C[C@H](F)C(=O)NC[C@H]1CCCOC1 4078c44dded0e883bd1570b3b15ba91d [0,1,0,0,0,1|1,0,0]=3 3433 B13R1.351 C[C@H](F)C(=O)NC[C@H]1COCCO1 44858a571023bf71f9ccf1066c72767c [0,1,0,0,0,1|1,0,0]=3 3434 B13R1.351 C[C@H](O)C(=O)NCC1CCCCC1 9ad32d2ba62bdda02e7aa6d2dab62e86 [0,1,0,0,0,1|2,0,0]=4 3435 B13R1.351 C[C@H](O)C(=O)NCC1CCCCO1 f9787c3b6272381f779f4fca473ec798 [0,1,0,0,0,1|1,0,0]=3 3436 B13R1.351 C[C@H](O)C(=O)NCC1CCCOC1 b1d4717ed300fe1d1706ab67b758dc3e [0,1,0,0,0,1|1,0,0]=3 3437 B13R1.351 C[C@H](O)C(=O)NCC1CCOCC1 e7aed9e4e7e2a6230313929de6ebe7cd [0,1,0,0,0,1|2,0,0]=4 3438 B13R1.351 C[C@H](O)C(=O)NCC1CCSCC1 44016087344f5de2adeec222ecc8e4e2 [0,1,0,0,0,1|2,0,0]=4 3439 B13R1.351 C[C@H](O)C(=O)NCC1COCCO1 84ffff5b2df601db8e8566dd19c92a9b [0,1,0,0,0,1|1,0,0]=3 3440 B13R1.351 C[C@H](O)C(=O)NC[C@@H]1CCCOC1 40f0e9d231d97aec877bfdb4ee68cf5f [0,1,0,0,0,1|1,0,0]=3 3441 B13R1.351 C[C@H](O)C(=O)NC[C@H]1CCCOC1 22bc7351746dcaccfcb2800969078db7 [0,1,0,0,0,1|1,0,0]=3 3442 B13R1.351 C[C@H](O)C(=O)NC[C@H]1COCCO1 1d9b545e3b4d798a481e6ae97dffc5a1 [0,1,0,0,0,1|1,0,0]=3 3443 B13R1.351 O=C(NCC1CCCCO1)C(F)F 18cbf9af3e3e8a4a99fc07644fabc3dd [0,1,0,0,0,1|2,0,0]=4 3444 B13R1.351 O=C(NCC1CCCCO1)C(O)O be08be69397e3f540b6d0d4104fa5228 [0,1,0,0,0,1|2,0,0]=4 3445 B13R1.351 O=C(NCC1CCCOC1)C(F)F 3b2f741078add23f7355ee730f9317bb [0,1,0,0,0,1|2,0,0]=4 3446 B13R1.351 O=C(NCC1CCCOC1)C(O)O 21a4686ec9e3da400d302b21553e55c3 [0,1,0,0,0,1|2,0,0]=4 3447 B13R1.351 O=C(NCC1COCCO1)C(F)F d74b254b26a0d7da2397021117ec1b69 [0,1,0,0,0,1|2,0,0]=4 3448 B13R1.351 O=C(NCC1COCCO1)C(O)O 6b742e8b87a5a7b948bf492a15ab06a7 [0,1,0,0,0,1|2,0,0]=4 3449 B13R1.351 O=C(NC[C@@H]1CCCOC1)C(F)F b71671478e87b71d225e0876b36e9aae [0,1,0,0,0,1|2,0,0]=4 3450 B13R1.351 O=C(NC[C@@H]1CCCOC1)C(O)O ff11482e18bff6d2c680b8f75412129c [0,1,0,0,0,1|2,0,0]=4 3451 B13R1.351 O=C(NC[C@H]1CCCOC1)C(F)F c3afcd399a0cbe44d270a9b902cb3a76 [0,1,0,0,0,1|2,0,0]=4 3452 B13R1.351 O=C(NC[C@H]1CCCOC1)C(O)O 9ed84e507e6d6b78956e7b82bc80da63 [0,1,0,0,0,1|2,0,0]=4 3453 B13R1.351 O=C(NC[C@H]1COCCO1)C(F)F 2b0a5da9a72759603b9eab0f0d4d7f70 [0,1,0,0,0,1|2,0,0]=4 3454 B13R1.351 O=C(NC[C@H]1COCCO1)C(O)O 452a09d81f20d0cebe578cab31a632c8 [0,1,0,0,0,1|2,0,0]=4 3455 B13R1.417 C#CC(CC)OCC1CCCCO1 04ed55a566808be10ba6e2f117368984 [0,1,0,0,0,1|1,0,1]=4 3456 B13R1.417 C#CC(CC)OCC1CCCOC1 75537988cae9b59a00d1552386417422 [0,1,0,0,0,1|1,0,1]=4 3457 B13R1.417 C#CC(CC)OCC1COCCO1 1e1c83ab3b5fbf500ab6fbd661351d74 [0,1,0,0,0,1|1,0,1]=4 3458 B13R1.417 C=CC(CC)OCC1CCCCO1 c5916b27c438e7f5a905805bdbddf16e [0,1,0,0,0,1|1,0,1]=4 3459 B13R1.417 C=CC(CC)OCC1CCCOC1 b89b306c56a3a1da2a9c1ed1dfb70ffe [0,1,0,0,0,1|1,0,1]=4 3460 B13R1.417 C=CC(CC)OCC1COCCO1 f3c98346eb289478f705215ec71f4505 [0,1,0,0,0,1|1,0,1]=4 3461 B13R1.417 CCC(C#N)OCC1CCCCO1 169729e9ab7b52e84d80c8201df80004 [0,1,0,0,0,1|1,0,1]=4 3462 B13R1.417 CCC(C#N)OCC1CCCOC1 0a00d278b24063e36c4a41a5aee24472 [0,1,0,0,0,1|1,0,1]=4 3463 B13R1.417 CCC(C#N)OCC1COCCO1 9bb8aa63af39bf3eb80304013d5bda50 [0,1,0,0,0,1|1,0,1]=4 3464 B13R1.417 CCC(C=O)NCC1CCCCO1 6c8439b31e569a9079962b5b7983ec61 [0,1,0,0,0,1|1,0,1]=4 3465 B13R1.417 CCC(C=O)NCC1CCCOC1 325b41384aa3b7b47ca5da017cc6d1af [0,1,0,0,0,1|1,0,1]=4 3466 B13R1.417 CCC(C=O)NCC1COCCO1 a58a86f6f2241fbdf2e0382eb4bc7bc3 [0,1,0,0,0,1|1,0,1]=4 3467 B13R1.417 CCC(C=O)NC[C@@H]1CCCOC1 72e3f1089883660ebf4338fa3ab660d5 [0,1,0,0,0,1|1,0,1]=4 3468 B13R1.417 CCC(C=O)NC[C@H]1CCCOC1 78a57d034c11a3be2991df813c6cadb4 [0,1,0,0,0,1|1,0,1]=4 3469 B13R1.417 CCC(C=O)NC[C@H]1COCCO1 133cef5d64fb2d16d357ce4a3b057999 [0,1,0,0,0,1|1,0,1]=4 3470 B13R1.417 CCC(C=O)OCC1=CCCCO1 6893cd004f38451251ed712a790269fc [0,1,0,0,0,1|0,0,2]=4 3471 B13R1.417 CCC(C=O)OCC1CCC=CO1 77dedaa794b307841175a482d3fb2a99 [0,1,0,0,0,1|0,0,2]=4 3472 B13R1.417 CCC(C=O)OCC1CCCCC1 b11054ec2a3ac06db1a1919544e67223 [0,1,0,0,0,1|1,0,1]=4 3473 B13R1.417 CCC(C=O)OCC1CCCCO1 18fb529c6a962251a70053b2f8ab1765 [0,1,0,0,0,1|0,0,1]=3 3474 B13R1.417 CCC(C=O)OCC1CCCOC1 8dbb598b39cf90e675926bf300805bde [0,1,0,0,0,1|0,0,1]=3 3475 B13R1.417 CCC(C=O)OCC1CCOCC1 92485dbd860a625fcf26817bdf7b234c [0,1,0,0,0,1|1,0,1]=4 3476 B13R1.417 CCC(C=O)OCC1CCSCC1 953181308702521eaa31dcc187c0ff5f [0,1,0,0,0,1|1,0,1]=4 3477 B13R1.417 CCC(C=O)OCC1COCCO1 c0b91e7b42a1d4061507a0b3864dc69a [0,1,0,0,0,1|0,0,1]=3 3478 B13R1.417 CCC(C=O)OC[C@@H]1CCCCO1 2c9938ed5fc154bbeeb1ea0f9df47d04 [0,1,0,0,0,1|0,0,1]=3 3479 B13R1.417 CCC(C=O)OC[C@@H]1CCCOC1 25ffa6ad29497a4520592b552b213b27 [0,1,0,0,0,1|0,0,1]=3 3480 B13R1.417 CCC(C=O)OC[C@@H]1COCCO1 8cc21bec77abbd955f123667816683b8 [0,1,0,0,0,1|0,0,1]=3 3481 B13R1.417 CCC(C=O)OC[C@H]1CCCCO1 826adc246994b1eb1ffd9654f9a2bc6e [0,1,0,0,0,1|0,0,1]=3 3482 B13R1.417 CCC(C=O)OC[C@H]1CCCOC1 e21fba157794ad77054433c3c1879ba9 [0,1,0,0,0,1|0,0,1]=3 3483 B13R1.417 CCC(C=O)OC[C@H]1COCCO1 23b1eb56148e30438cf06f78ff30f7e5 [0,1,0,0,0,1|0,0,1]=3 3484 B13R1.417 CCC(CC)OCC1CCCCO1 1d5d11b1d7d4d1f08c62263da1b4db4f [0,1,0,0,0,1|1,0,1]=4 3485 B13R1.417 CCC(CC)OCC1CCCOC1 1915001988f103a2553305b436b1d094 [0,1,0,0,0,1|1,0,1]=4 3486 B13R1.417 CCC(CC)OCC1COCCO1 86543d4dbddac9355d238a77444aaaa8 [0,1,0,0,0,1|1,0,1]=4 3487 B13R1.417 CCC(CC)OC[C@@H]1CCCCO1 72ef6965e3018d62447e4c495bb4b293 [0,1,0,0,0,1|1,0,1]=4 3488 B13R1.417 CCC(CC)OC[C@@H]1CCCOC1 868c9e66d1de210637abe0f5c3fa1337 [0,1,0,0,0,1|1,0,1]=4 3489 B13R1.417 CCC(CC)OC[C@@H]1COCCO1 4f55659977c21f3c09b477342db59321 [0,1,0,0,0,1|1,0,1]=4 3490 B13R1.417 CCC(CC)OC[C@H]1CCCCO1 ca45425355c8143216ea5bebfd7ec0d5 [0,1,0,0,0,1|1,0,1]=4 3491 B13R1.417 CCC(CC)OC[C@H]1CCCOC1 234ec3ec6b2b81c1d33c59a865754f03 [0,1,0,0,0,1|1,0,1]=4 3492 B13R1.417 CCC(CC)OC[C@H]1COCCO1 31f2c382e576e96c24386e5302c13b52 [0,1,0,0,0,1|1,0,1]=4 3493 B13R1.528 CCC(=O)CN[C@@H]1COCC[C@@H]1O abf99459a3e73c0c6d9b55c1c861a9ec [0,1,0,0,0,1|2,0,0]=4 3494 B13R1.528 CCC(=O)CN[C@@H]1COCC[C@H]1O 5a3ec80ccccd3aca56d0b71bdf077dc7 [0,1,0,0,0,1|2,0,0]=4 3495 B13R1.528 CCC(=O)CN[C@H]1COCC[C@@H]1O 18bcf48d07d504f8a4f79e62f506151d [0,1,0,0,0,1|2,0,0]=4 3496 B13R1.528 CCC(=O)CN[C@H]1COCC[C@H]1O 577656c659c4710f0a4915040a7cb439 [0,1,0,0,0,1|2,0,0]=4 3497 B13R1.528 CCC(=O)COC1CCCOC1=O 3d16d42325dc732e0cf07033c9957e29 [0,1,0,0,0,1|2,0,0]=4 3498 B13R1.528 CCC(=O)NCC1CCCCC1C 9d00a1ed14ce7970e3d353c5132bcfa1 [0,1,0,0,0,1|2,0,0]=4 3499 B13R1.528 CCC(=O)NCC1CCCCC1O bbd329cbdf59c6f0eb7bad761652be2a [0,1,0,0,0,1|2,0,0]=4 3500 B13R1.528 CCC(=O)NCC1CCCCN1C 107a9ea2e24b422fe74bfe0c5b3100a0 [0,1,0,0,0,1|2,0,0]=4 3501 B13R1.528 CCC(=O)NCC1COCCN1C 1278d67c53764e3fb3cbd57a919dbb54 [0,1,0,0,0,1|2,0,0]=4 3502 B13R1.528 CCC(=O)NCC1CSCCC1O a0ac6e86015ba6a5b221666c6532dc22 [0,1,0,0,0,1|1,1,0]=4 3503 B13R1.528 CCC(=O)NC[C@@H]1COCCN1C d72f473024db463543fb8e847cac2f60 [0,1,0,0,0,1|2,0,0]=4 3504 B13R1.528 CCC(=O)OCN1CCCCC1C 70131268f19c2dd2c9d237f08971de48 [0,1,0,0,0,1|2,0,0]=4 3505 B13R1.528 CCC(=O)OCN1CCCC[C@@H]1C 130150a883d03bc5f3c90c855125716f [0,1,0,0,0,1|2,0,0]=4 3506 B13R1.528 CCC(=O)OCN1CCCC[C@H]1C 493c34b21f4b568a4869c97c862552e8 [0,1,0,0,0,1|2,0,0]=4 3507 B13R1.528 CCC(=O)OCN1CCOCC1C 9979fb7d4f0152f59cef81ba07242132 [0,1,0,0,0,1|2,0,0]=4 3508 B13R1.528 CCC(=O)OCN1CCOC[C@@H]1C c8fd56eee9710198cbb452b4b4ba2143 [0,1,0,0,0,1|2,0,0]=4 3509 B13R1.528 CCC(=O)OCN1CCOC[C@H]1C 70727f08890ac0e8738631e95172e2ba [0,1,0,0,0,1|2,0,0]=4 3510 B13R1.2045 CCC(=O)NCC1(CCCCC1)C be27c8e103ffc20a8c0aea136c50eac0 [0,1,0,0,0,1|2,0,0]=4 3511 B13R1.2045 CCC(=O)NCC1(CCCCC1)O 05f37dc4f86373eb3303a4ed2b8f3d66 [0,1,0,0,0,1|2,0,0]=4 3512 B13R1.2045 CCC(=O)NCC1(CCOCC1)C 4ee89eb5a68bfc136a97aef754d9a5e0 [0,1,0,0,0,1|2,0,0]=4 3513 B13R1.2045 CCC(=O)NCC1(CCOCC1)F 42ff635349e853456422de668cb5d2a5 [0,1,0,0,0,1|2,0,0]=4 3514 B13R1.2045 CCC(=O)NCC1(CCOCC1)O 03e5cf8120a16182ddddc6b1165b8515 [0,1,0,0,0,1|2,0,0]=4 3515 B13R1.2045 CCC(C)OCC1(CCCOC1)F e86b25d53f50e5faea0efbad6217a340 [0,1,0,0,0,1|1,0,1]=4 3516 B13R1.2045 CCC(C)OCC1(COCCO1)C 1739b36fdb9b90f53a8e3e7ddb37a36f [0,1,0,0,0,1|1,0,1]=4 3517 B13R1.2045 CC[C@@H](C)OCC1(COCCO1)C fd2ea15c0c604f9c944110b8ea72e18b [0,1,0,0,0,1|1,0,1]=4 3518 B13R1.2045 CC[C@H](C)OCC1(COCCO1)C 042189c7d687c2db931f895380693506 [0,1,0,0,0,1|1,0,1]=4 3519 B13R1.162 C=C(CC)CNC(C)C1CCCO1 4827d6ac4b3222d5665d87631bbdabc5 [0,1,0,0,0,1|2,0,0]=4 3520 B13R1.162 C=C(CC)CN[C@@H](C)[C@@H]1CCCO1 5b8c913596fdc24998e0cf70c5440013 [0,1,0,0,0,1|2,0,0]=4 3521 B13R1.162 C=C(CC)COC(C)C1CCCC1 7e463efcd7920146353808811fd49c58 [0,1,0,0,0,1|2,0,0]=4 3522 B13R1.162 C=C(CC)CO[C@H](C)[C@H]1CCCO1 b2e44119e97cb1d6cfaed7160e77c221 [0,1,0,0,0,1|1,0,0]=3 3523 B13R1.162 C=C(CO[C@H](C)[C@H]1CCCO1)OC 3a197c98874d0929085a616f4b417843 [0,1,0,0,0,1|2,0,0]=4 3524 B13R1.162 CC(NCC(=O)CO)C1CCCO1 058fe5dc253bc469192771116f7b9d77 [0,1,0,0,0,1|2,0,0]=4 3525 B13R1.162 CCC(=O)CNC(C)C1CCCC1 1d5c2562c08f18ac129ec217b6164d93 [0,1,0,0,0,1|2,0,0]=4 3526 B13R1.162 CCC(=O)CNC(C)C1CCCO1 3a2a3f5ed6551baa267259e1009104db [0,1,0,0,0,1|1,0,0]=3 3527 B13R1.162 CCC(=O)CN[C@@H](C)[C@@H]1CCCO1 ccd9eac6a837f495d824936e860eed2b [0,1,0,0,0,1|1,0,0]=3 3528 B13R1.162 CCC(=O)COC(C)C1CCCC1 e0584f0c61646d1da7c879ad7f975b45 [0,1,0,0,0,1|1,0,0]=3 3529 B13R1.162 CCC(=O)COC(C)C1CCOC1 d9e8f873330629ac03fc4bcaf0721b71 [0,1,0,0,0,1|2,0,0]=4 3530 B13R1.162 CCC(=O)CO[C@H](C)[C@H]1CCCO1 e073010131f31d6e63aad3c322e9cb5d [0,1,0,0,0,1|0,0,0]=2 3531 B13R1.162 CCC(=O)OCN(C)C1CCCC1 47bab96d5635dd24f2e9cb9fa1fa3037 [0,1,0,0,0,1|1,0,0]=3 3532 B13R1.162 CCC(=O)OCN(C)C1CCOC1 1e35c8f189e45cc10f108554aeedee38 [0,1,0,0,0,1|2,0,0]=4 3533 B13R1.162 CCC(=O)OCN(C)[C@@H]1CCOC1 e99439ec6d35378c220340a09db59e94 [0,1,0,0,0,1|2,0,0]=4 3534 B13R1.162 CCC(=O)OCN(C)[C@H]1CCOC1 a0feed116f8b354171b5d0ba4e796b99 [0,1,0,0,0,1|2,0,0]=4 3535 B13R1.162 CCC(C)CO[C@H](C)[C@H]1CCCO1 d0e74a1f4fee5025701fed2f1ceb9910 [0,1,0,0,0,1|1,0,1]=4 3536 B13R1.162 CC[C@@H](C)CO[C@H](C)[C@H]1CCCO1 b931adcec15dcc8b37cea58956a50952 [0,1,0,0,0,1|1,0,1]=4 3537 B13R1.162 CC[C@H](C)CO[C@H](C)[C@H]1CCCO1 ff12766667cb9e0dd514702a46afbb74 [0,1,0,0,0,1|1,0,1]=4 3538 B13R1.162 CNC(=O)CNC(C)C1CCCO1 eef77cc4eeac7ccc6992dc3e31906326 [0,1,0,0,0,1|2,0,0]=4 3539 B13R1.162 CNC(=O)CN[C@@H](C)[C@@H]1CCCO1 7d5be7afa0c1e0dc5a2ee8e638b5d0f9 [0,1,0,0,0,1|2,0,0]=4 3540 B13R1.162 CNC(=O)COC(C)C1CCCC1 b7805977b76d758c5554826760202c9c [0,1,0,0,0,1|2,0,0]=4 3541 B13R1.162 CNC(=O)CO[C@H](C)[C@H]1CCCO1 e542ea05871ae0969de026388c46c3a1 [0,1,0,0,0,1|1,0,0]=3 3542 B13R1.162 COC(=O)CNC(C)C1CCCO1 f0ed1b3a5aeadcc0316599048087568f [0,1,0,0,0,1|2,0,0]=4 3543 B13R1.162 COC(=O)CN[C@@H](C)[C@@H]1CCCO1 c1abf86d7b084e7180effe7a98bc6549 [0,1,0,0,0,1|2,0,0]=4 3544 B13R1.162 COC(=O)COC(C)C1CCCC1 298b65474426fc6aaedfd84b1094fa78 [0,1,0,0,0,1|2,0,0]=4 3545 B13R1.162 COC(=O)CO[C@H](C)[C@H]1CCCO1 17b2942e88627e284fa473448783ffdc [0,1,0,0,0,1|1,0,0]=3 3546 B13R1.162 COC(=O)OCN(C)C1CCCC1 6dbbf270b5e461198e73bf60e853e2a3 [0,1,0,0,0,1|2,0,0]=4 3547 B13R1.162 C[C@H](NCC(=O)CO)[C@@H]1CCCO1 ae485cf8740e187b28f8f9608b8b5c41 [0,1,0,0,0,1|2,0,0]=4 3548 B13R1.252 CCC(F)(F)COCC1CCCO1 12f98c004562beb287f83b0a46b0cb74 [0,1,0,0,0,1|1,0,1]=4 3549 B13R1.252 CCS(=O)(=O)CNCC1CCCO1 b51246c81eb0a72dc421234cf6dd7def [0,1,0,0,0,1|2,0,0]=4 3550 B13R1.252 CCS(=O)(=O)CNC[C@@H]1CCCO1 9dd21e98cb35cc27a641b0fce56166a1 [0,1,0,0,0,1|2,0,0]=4 3551 B13R1.252 CCS(=O)(=O)CNC[C@H]1CCCO1 4c588f5473273b11d89d6618281102a9 [0,1,0,0,0,1|2,0,0]=4 3552 B13R1.252 CNS(=O)(=O)COCC1CCCO1 7a75c1bad9c2b1af4f6de0f4b7492833 [0,1,0,0,0,1|2,0,0]=4 3553 B13R1.252 CNS(=O)(=O)COC[C@@H]1CCCO1 73b6519ce9bac8b186272e61ecdb175c [0,1,0,0,0,1|2,0,0]=4 3554 B13R1.252 CNS(=O)(=O)COC[C@H]1CCCO1 79e0e9e470ec74b12dac68affa785034 [0,1,0,0,0,1|2,0,0]=4 3555 B13R1.404 C#CCC(=O)NCCC1CCCO1 10cc6693ee62c3ba4e7792f3abbf59ac [0,1,0,0,0,1|1,0,1]=4 3556 B13R1.404 C/C=C/C(=O)NCCC1CCCO1 241c3d9df4e5bb6de852d236029aa026 [0,1,0,0,0,1|1,0,1]=4 3557 B13R1.404 C=CCC(=O)NCCC1CCCO1 d8b6cf90485d6b098053a9674c02a3f7 [0,1,0,0,0,1|1,0,1]=4 3558 B13R1.404 C=COC(=O)COCC1CCCO1 3d40af8a00c77d735910a47e1b950a17 [0,1,0,0,0,1|0,0,2]=4 3559 B13R1.404 C=COC(=O)COC[C@@H]1CCCO1 ceff2cc67cb76f28f3ae7b71710658ae [0,1,0,0,0,1|0,0,2]=4 3560 B13R1.404 C=COC(=O)COC[C@H]1CCCO1 ddc4536f5945bbc100dc90efc8fd7475 [0,1,0,0,0,1|0,0,2]=4 3561 B13R1.404 CC#CC(=O)NCCC1CCCO1 62e3c06be220331ee9f5489acf59869c [0,1,0,0,0,1|1,0,1]=4 3562 B13R1.404 CCCC(=O)CNCC1CCCC1 8a5452eb3f72a7e006387139295b58e0 [0,1,0,0,0,1|2,0,0]=4 3563 B13R1.404 CCCC(=O)CNCC1CCCO1 ea61a1d4b7b795dafb0b9b0d554300c7 [0,1,0,0,0,1|1,0,0]=3 3564 B13R1.404 CCCC(=O)CNC[C@@H]1CCCO1 7a24de2393e86df5620f3f502e9ca8b5 [0,1,0,0,0,1|1,0,0]=3 3565 B13R1.404 CCCC(=O)CNC[C@H]1CCCO1 6f7e366d14be27ef834fedfded12acda [0,1,0,0,0,1|1,0,0]=3 3566 B13R1.404 CCCC(=O)COCC1C=CCC1 c8544f48ea825aa689a9884f6d449871 [0,1,0,0,0,1|1,0,1]=4 3567 B13R1.404 CCCC(=O)COCC1CCCC1 014602a036ec148f0dbdedbdd084ced5 [0,1,0,0,0,1|1,0,0]=3 3568 B13R1.404 CCCC(=O)COCC1CCCO1 96729f83085a65e224ff891e8e73548a [0,1,0,0,0,1|0,0,0]=2 3569 B13R1.404 CCCC(=O)COCC1CCCS1 1e20012c70e87b68cf0052c1117ee68f [0,1,0,0,0,1|0,1,0]=3 3570 B13R1.404 CCCC(=O)COCC1CCOC1 9d919d6d800393e266d38ab7b4ee6cab [0,1,0,0,0,1|2,0,0]=4 3571 B13R1.404 CCCC(=O)COCN1CCCC1 37b59cec399abcabbf0902ff9c5724ed [0,1,0,0,0,1|2,0,0]=4 3572 B13R1.404 CCCC(=O)COC[C@@H]1CCCO1 63ce75d1afbcc9acfa42ca43ca50a916 [0,1,0,0,0,1|0,0,0]=2 3573 B13R1.404 CCCC(=O)COC[C@@H]1CCOC1 b87b07da0d606f96d97ca6298ad19ae8 [0,1,0,0,0,1|2,0,0]=4 3574 B13R1.404 CCCC(=O)COC[C@H]1CCCO1 7fa31ee888e5045f6a3b87aa71667124 [0,1,0,0,0,1|0,0,0]=2 3575 B13R1.404 CCCC(=O)COC[C@H]1CCOC1 72897d34d1f4c2f019d6fbc710660bba [0,1,0,0,0,1|2,0,0]=4 3576 B13R1.404 CCCC(=O)NCCC1CCCC1 c3bdd94ec5299cabfc55c5dccaef344f [0,1,0,0,0,1|2,0,0]=4 3577 B13R1.404 CCCC(=O)NCCC1CCCO1 3d77c068c95c051122c44dacd28c21ea [0,1,0,0,0,1|1,0,0]=3 3578 B13R1.404 CCCC(=O)OCNC1CCCC1 ba66bab046af6c5fafd1be60e661de95 [0,1,0,0,0,1|1,0,0]=3 3579 B13R1.404 CCCC(=O)OCNC1CCOC1 50b6fcc9c7b9aa9a3b26b743a0b9b5b3 [0,1,0,0,0,1|2,0,0]=4 3580 B13R1.404 CCCC(=O)OCNC1CCSC1 051179ec2ec1bd319409536f3dca9c53 [0,1,0,0,0,1|2,0,0]=4 3581 B13R1.404 CCCC(=O)OCN[C@@H]1CCOC1 999c8895b94f46bf26fb23bd17fb718f [0,1,0,0,0,1|2,0,0]=4 3582 B13R1.404 CCCC(=O)OCN[C@H]1CCOC1 1fc80e8044a4dde659022aa29a72b523 [0,1,0,0,0,1|2,0,0]=4 3583 B13R1.404 CCCC(=O)OCOC1C=CCC1 26a03bf05907c3159cad969173915ac3 [0,1,0,0,0,1|1,0,1]=4 3584 B13R1.404 CCCC(=O)OCOC1CCCC1 fb63c3af0fd99ce30af085d31ac7b519 [0,1,0,0,0,1|1,0,0]=3 3585 B13R1.404 CCCC(=O)OCOC1CCCO1 2a869c85f0d32eeafa5d8977c78f2483 [0,1,0,0,0,1|0,0,0]=2 3586 B13R1.404 CCCC(=O)OCOC1CCOC1 17f4a4bcb476dfedd71b2af21e05042c [0,1,0,0,0,1|2,0,0]=4 3587 B13R1.404 CCCC(=O)OCOC1CCSC1 efa9f590eb9adc49a3637ad58333c6b9 [0,1,0,0,0,1|2,0,0]=4 3588 B13R1.404 CCCC(=O)OCO[C@@H]1CCOC1 f82e57ff5be0f095c2fc46168fd681d0 [0,1,0,0,0,1|2,0,0]=4 3589 B13R1.404 CCCC(=O)OCO[C@@H]1CCSC1 157c4ef314545273e30bc870c1dcb8f0 [0,1,0,0,0,1|2,0,0]=4 3590 B13R1.404 CCCC(=O)OCO[C@H]1CCOC1 5a7fdf24cc7cf8c46225cdc8b416dd39 [0,1,0,0,0,1|2,0,0]=4 3591 B13R1.404 CCCC(=O)OCO[C@H]1CCSC1 b9e7b989252d8ac1c926db333653b362 [0,1,0,0,0,1|2,0,0]=4 3592 B13R1.404 CCCC(=S)OCCC1CCCC1 7b37d3540b53b365c663b7a7c0bf165e [0,1,0,0,0,1|1,1,0]=4 3593 B13R1.404 CCCC(=S)OCCC1CCCO1 2919ebba1e8c0b5470f3df755f81fe26 [0,1,0,0,0,1|0,1,0]=3 3594 B13R1.404 CCCC(C)COCC1CCCO1 6e12517b0d1ff0d049b9a486ca6b8f59 [0,1,0,0,0,1|1,0,1]=4 3595 B13R1.404 CCCC(C)COC[C@@H]1CCCO1 e14d6dd053d66ee78b6844397001a1c5 [0,1,0,0,0,1|1,0,1]=4 3596 B13R1.404 CCCC(C)COC[C@H]1CCCO1 4ec525293d390e3b3d96c425bb8f039c [0,1,0,0,0,1|1,0,1]=4 3597 B13R1.404 CCCC(C)OCCC1CCCO1 40f5a671873549b2e9cca2f60b71bfd1 [0,1,0,0,0,1|1,0,1]=4 3598 B13R1.404 CCC[C@@H](C)OCCC1CCCO1 7d68de235588ce57655de4afc4380f44 [0,1,0,0,0,1|1,0,1]=4 3599 B13R1.404 CCC[C@H](C)OCCC1CCCO1 bab29a4e93b19ab615d0f477b8bd8110 [0,1,0,0,0,1|1,0,1]=4 3600 B13R1.404 CCNC(=O)CCNC1CCCC1 cf2398b8dad886f8aee6530ebf3d919c [0,1,0,0,0,1|2,0,0]=4 3601 B13R1.404 CCNC(=O)CCOC1CCCC1 7e5d97639f15fefdd895f2a1c09e5168 [0,1,0,0,0,1|2,0,0]=4 3602 B13R1.404 CCNC(=O)CCOC1CCCO1 afea18668288be6666dda3e193ff1b6b [0,1,0,0,0,1|1,0,0]=3 3603 B13R1.404 CCNC(=O)CNCC1CCCC1 18ba008987dc01d1ff7cfb63fb58320b [0,1,0,0,0,1|2,0,0]=4 3604 B13R1.404 CCNC(=O)CNCC1CCCO1 43a88eafd8efeacb3c72d67a5d3ce78a [0,1,0,0,0,1|1,0,0]=3 3605 B13R1.404 CCNC(=O)CNC[C@@H]1CCCO1 46d46c5c65c5075247ce65d74a3850e8 [0,1,0,0,0,1|1,0,0]=3 3606 B13R1.404 CCNC(=O)CNC[C@H]1CCCO1 f694351a8d99fb6c806d4fe8941a53da [0,1,0,0,0,1|1,0,0]=3 3607 B13R1.404 CCNC(=O)COCC1C=CCC1 3c03d8e6a720d6aa9d505e7d3c390b2b [0,1,0,0,0,1|1,0,1]=4 3608 B13R1.404 CCNC(=O)COCC1CCCC1 cf8568bb6b79d436e88c24ee0edbf815 [0,1,0,0,0,1|1,0,0]=3 3609 B13R1.404 CCNC(=O)COCC1CCCO1 7df5fc95eadc32579e4e19c6a5c9c628 [0,1,0,0,0,1|0,0,0]=2 3610 B13R1.404 CCNC(=O)COCC1CCCS1 664d284bf728f3b5fa955d814bf83bc1 [0,1,0,0,0,1|0,1,0]=3 3611 B13R1.404 CCNC(=O)COCC1CCOC1 5bda6a8d5c155be613e245fe5c87e87e [0,1,0,0,0,1|2,0,0]=4 3612 B13R1.404 CCNC(=O)COCN1CCCC1 df54e8c4eb326e0a65ad5e44c67260ea [0,1,0,0,0,1|2,0,0]=4 3613 B13R1.404 CCNC(=O)COC[C@@H]1CCCO1 01c6db32ec27408f1c61bf542e87740c [0,1,0,0,0,1|0,0,0]=2 3614 B13R1.404 CCNC(=O)COC[C@@H]1CCOC1 d9ff1e284ca46d3ac9b596faca804320 [0,1,0,0,0,1|2,0,0]=4 3615 B13R1.404 CCNC(=O)COC[C@H]1CCCO1 5a8d0088daa060efbc8bc6366c5e621c [0,1,0,0,0,1|0,0,0]=2 3616 B13R1.404 CCNC(=O)COC[C@H]1CCOC1 14fdfc8dd94e695d3c97230b08286967 [0,1,0,0,0,1|2,0,0]=4 3617 B13R1.404 CCOC(=O)CCNC1CCCC1 724ced2e3d658ef3982181a3ee42746c [0,1,0,0,0,1|2,0,0]=4 3618 B13R1.404 CCOC(=O)CCOC1CCCC1 5c0220d848fd23a3081986fa09fef8d4 [0,1,0,0,0,1|2,0,0]=4 3619 B13R1.404 CCOC(=O)CCOC1CCCO1 50c5f356b6c3ecb59acc922ab044c119 [0,1,0,0,0,1|1,0,0]=3 3620 B13R1.404 CCOC(=O)CNCC1CCCC1 a270958ce7b4843a1cbd708614b75fa3 [0,1,0,0,0,1|2,0,0]=4 3621 B13R1.404 CCOC(=O)CNCC1CCCO1 7ee50df33225aceb8a0610200f4a9d94 [0,1,0,0,0,1|1,0,0]=3 3622 B13R1.404 CCOC(=O)CNC[C@@H]1CCCO1 789e7dc192fd3f1c8e0835bc50d304c0 [0,1,0,0,0,1|1,0,0]=3 3623 B13R1.404 CCOC(=O)CNC[C@H]1CCCO1 f9ac33c3e19ff0930445db4a0c3f2d84 [0,1,0,0,0,1|1,0,0]=3 3624 B13R1.404 CCOC(=O)COCC1C=CCC1 d3a3e91e77003961815e8450b4a52eee [0,1,0,0,0,1|1,0,1]=4 3625 B13R1.404 CCOC(=O)COCC1CCCC1 fa8fee2a54372431a12f70717e92b180 [0,1,0,0,0,1|1,0,0]=3 3626 B13R1.404 CCOC(=O)COCC1CCCO1 7bdae92d31885c4aaf662db68eaac2d5 [0,1,0,0,0,1|0,0,0]=2 3627 B13R1.404 CCOC(=O)COCC1CCCS1 75dd61e18b5402497bd5d3931297b6ed [0,1,0,0,0,1|0,1,0]=3 3628 B13R1.404 CCOC(=O)COCC1CCOC1 0b642e4ecb08a9ba616c13b52a9833da [0,1,0,0,0,1|2,0,0]=4 3629 B13R1.404 CCOC(=O)COCN1CCCC1 47a1b2c25e6fd54ded9e67172b89758e [0,1,0,0,0,1|2,0,0]=4 3630 B13R1.404 CCOC(=O)COC[C@@H]1CCCO1 c9acbfb684c84432cf74c0e92c30b72d [0,1,0,0,0,1|0,0,0]=2 3631 B13R1.404 CCOC(=O)COC[C@@H]1CCOC1 546d0d90fd73c7d665ebd9a03b20c2d7 [0,1,0,0,0,1|2,0,0]=4 3632 B13R1.404 CCOC(=O)COC[C@H]1CCCO1 1f9014fb6a1e7060ab4f7f56fdc77d0f [0,1,0,0,0,1|0,0,0]=2 3633 B13R1.404 CCOC(=O)COC[C@H]1CCOC1 2b24f6177632626143dcc8b12a77382c [0,1,0,0,0,1|2,0,0]=4 3634 B13R1.404 CCOC(=O)OCNC1CCCC1 a5c8a49800bd9814496293f3bc4751c8 [0,1,0,0,0,1|1,0,0]=3 3635 B13R1.404 CCOC(=O)OCNC1CCOC1 2c917ef6ea6dd718575f573775c05792 [0,1,0,0,0,1|2,0,0]=4 3636 B13R1.404 CCOC(=O)OCNC1CCSC1 132e758d606880ef2d83981047b5912b [0,1,0,0,0,1|2,0,0]=4 3637 B13R1.404 CCOC(=O)OCN[C@@H]1CCOC1 5fd4a975935f31cf7fa63fdce200f685 [0,1,0,0,0,1|2,0,0]=4 3638 B13R1.404 CCOC(=O)OCN[C@H]1CCOC1 4c63fdab40214bd7b7d7241cc4caa0a8 [0,1,0,0,0,1|2,0,0]=4 3639 B13R1.404 CCOC(=O)OCOC1C=CCC1 e51deb777fad58e7a28dbf1129343b64 [0,1,0,0,0,1|1,0,1]=4 3640 B13R1.404 CCOC(=O)OCOC1CCCC1 dadc29ebb2cef1326a155459e8bbd0c9 [0,1,0,0,0,1|1,0,0]=3 3641 B13R1.404 CCOC(=O)OCOC1CCCO1 086ec6557afd7f68f7878afb1d64b9ee [0,1,0,0,0,1|0,0,0]=2 3642 B13R1.404 CCOC(=O)OCOC1CCOC1 7be472ccadb37a2930c8f1f14584bece [0,1,0,0,0,1|2,0,0]=4 3643 B13R1.404 CCOC(=O)OCOC1CCSC1 4bb97d108b080cd66b8fc7250b6f2ca3 [0,1,0,0,0,1|2,0,0]=4 3644 B13R1.404 CCOC(=O)OCO[C@@H]1CCOC1 794b23a01480a3f00758a901ef64972e [0,1,0,0,0,1|2,0,0]=4 3645 B13R1.404 CCOC(=O)OCO[C@@H]1CCSC1 81ed006e7196955b264fc5f256a4626f [0,1,0,0,0,1|2,0,0]=4 3646 B13R1.404 CCOC(=O)OCO[C@H]1CCOC1 17787efb509fae7349191a8eb72bde32 [0,1,0,0,0,1|2,0,0]=4 3647 B13R1.404 CCOC(=O)OCO[C@H]1CCSC1 7b4cd2a0c662cbd90450638623c3c16a [0,1,0,0,0,1|2,0,0]=4 3648 B13R1.404 CCOC(C)COCC1CCCO1 3e9dc87b55cb0c67a26f6aa91724ae5a [0,1,0,0,0,1|1,0,1]=4 3649 B13R1.404 CCSC(=O)OCNC1CCCC1 58102f0dc34e2a214d9c3599d45a4783 [0,1,0,0,0,1|1,0,0]=3 3650 B13R1.404 CCSC(=O)OCNC1CCOC1 9ad683c05a9c47e1f4469cbc3e4ada71 [0,1,0,0,0,1|2,0,0]=4 3651 B13R1.404 CCSC(=O)OCNC1CCSC1 37a56fbb230f7af1fd5b951483afb8af [0,1,0,0,0,1|2,0,0]=4 3652 B13R1.404 CCSC(=O)OCN[C@@H]1CCOC1 c6da8624a68390e83b33fdbfea30273c [0,1,0,0,0,1|2,0,0]=4 3653 B13R1.404 CCSC(=O)OCN[C@H]1CCOC1 2f28d9adf4a95b66a1da71baed6ebcfe [0,1,0,0,0,1|2,0,0]=4 3654 B13R1.404 CCSC(=O)OCOC1C=CCC1 ea4fd9c03b6b9fceeee81c357cd615ad [0,1,0,0,0,1|1,0,1]=4 3655 B13R1.404 CCSC(=O)OCOC1CCCC1 94997a5cb9c519b2b70fefa36f389a80 [0,1,0,0,0,1|1,0,0]=3 3656 B13R1.404 CCSC(=O)OCOC1CCCO1 411553dc48ff302e51597469f855ca8e [0,1,0,0,0,1|0,0,0]=2 3657 B13R1.404 CCSC(=O)OCOC1CCOC1 f3057697c9d50e27819ce00a19fbff5f [0,1,0,0,0,1|2,0,0]=4 3658 B13R1.404 CCSC(=O)OCOC1CCSC1 2bc847ffbb530e47c5389ab183fe72b0 [0,1,0,0,0,1|2,0,0]=4 3659 B13R1.404 CCSC(=O)OCO[C@@H]1CCOC1 6e1ec33525591151cee2f7cd8e3812a8 [0,1,0,0,0,1|2,0,0]=4 3660 B13R1.404 CCSC(=O)OCO[C@@H]1CCSC1 81e9bf44f74c0c5e4321a8d4d0f5c2e6 [0,1,0,0,0,1|2,0,0]=4 3661 B13R1.404 CCSC(=O)OCO[C@H]1CCOC1 27517bf8044a9c39fa551c70d4b911ce [0,1,0,0,0,1|2,0,0]=4 3662 B13R1.404 CCSC(=O)OCO[C@H]1CCSC1 b81c78e6f2c5661b9cb4d3676721a82d [0,1,0,0,0,1|2,0,0]=4 3663 B13R1.404 COCC(=O)CNCC1CCCC1 8ec0033329e311b091b657ae71e74d73 [0,1,0,0,0,1|2,0,0]=4 3664 B13R1.404 COCC(=O)CNCC1CCCO1 c7636f85cccc27862c373d4d0cb277d7 [0,1,0,0,0,1|1,0,0]=3 3665 B13R1.404 COCC(=O)CNC[C@@H]1CCCO1 58700fe842ac7defd5de6994975d4db1 [0,1,0,0,0,1|1,0,0]=3 3666 B13R1.404 COCC(=O)CNC[C@H]1CCCO1 9aacb6f1bce116ed32a2c5babeb230f6 [0,1,0,0,0,1|1,0,0]=3 3667 B13R1.404 COCC(=O)COCC1C=CCC1 c0ea97f865aa45747351512e2e18adeb [0,1,0,0,0,1|1,0,1]=4 3668 B13R1.404 COCC(=O)COCC1CCCC1 91e9cf4ecc330c1b034bfbae6b838514 [0,1,0,0,0,1|1,0,0]=3 3669 B13R1.404 COCC(=O)COCC1CCCO1 7e39e42b86cd3e88a7b3fcae5e7deb11 [0,1,0,0,0,1|0,0,0]=2 3670 B13R1.404 COCC(=O)COCC1CCCS1 729f4e65538e3eee4d0ed77799c61205 [0,1,0,0,0,1|0,1,0]=3 3671 B13R1.404 COCC(=O)COCC1CCOC1 283e4bbcb234a1cad5b30dff61af5801 [0,1,0,0,0,1|2,0,0]=4 3672 B13R1.404 COCC(=O)COCN1CCCC1 1dd645f77b110b9ba86018621d50c90a [0,1,0,0,0,1|2,0,0]=4 3673 B13R1.404 COCC(=O)COC[C@@H]1CCCO1 c365c57e5480f002e442ae414775f383 [0,1,0,0,0,1|0,0,0]=2 3674 B13R1.404 COCC(=O)COC[C@@H]1CCOC1 b5ed2b58cd3025a1d52a89ecc4ceb010 [0,1,0,0,0,1|2,0,0]=4 3675 B13R1.404 COCC(=O)COC[C@H]1CCCO1 cac46ddadcf4dfa48f5051a4822bc13f [0,1,0,0,0,1|0,0,0]=2 3676 B13R1.404 COCC(=O)COC[C@H]1CCOC1 65ea97e486bbb6c5ffdad5268c1d8b58 [0,1,0,0,0,1|2,0,0]=4 3677 B13R1.404 COCC(=O)NCCC1CCCC1 4c28779956abb195d5cb8692b4ba7d11 [0,1,0,0,0,1|2,0,0]=4 3678 B13R1.404 COCC(=O)NCCC1CCCO1 7bfdbb5bf6e5277bfc44ce4a633a8045 [0,1,0,0,0,1|1,0,0]=3 3679 B13R1.404 COCC(C)COCC1CCCO1 2e59a96697eaff3d8c17eb6a107caeab [0,1,0,0,0,1|1,0,1]=4 3680 B13R1.404 COCC(C)OCCC1CCCO1 61a9007316d23bb057c0a89fe4c5df79 [0,1,0,0,0,1|1,0,1]=4 3681 B13R1.404 COC[C@@H](C)OCCC1CCCO1 61925daadb6485e29e47ef56e38119af [0,1,0,0,0,1|1,0,1]=4 3682 B13R1.404 COC[C@H](C)COCC1CCCO1 b222b8b906a68808aefb8f23bf6b478b [0,1,0,0,0,1|1,0,1]=4 3683 B13R1.404 COC[C@H](C)OCCC1CCCO1 f57fed23c95853180ad4c49f7b08bec9 [0,1,0,0,0,1|1,0,1]=4 3684 B13R1.404 CSCC(=O)NCCC1CCCC1 b13d9ce34074fc5b954a4a332b1a041a [0,1,0,0,0,1|2,0,0]=4 3685 B13R1.404 CSCC(=O)NCCC1CCCO1 83ce4ebca3598212774992944cd5ce27 [0,1,0,0,0,1|1,0,0]=3 3686 B13R1.404 CSCC(C)OCCC1CCCO1 5baffda995c5ace81a63c095df7d20b1 [0,1,0,0,0,1|1,0,1]=4 3687 B13R1.404 N#CCC(=O)NCCC1CCCO1 d2301ab6e64d10cd0c25d126fd99b138 [0,1,0,0,0,1|1,0,1]=4 3688 B13R1.404 N#CNC(=O)COCC1CCCO1 9a12f06266f37ed25e9ad52bb7b79ca3 [0,1,0,0,0,1|1,0,1]=4 3689 B13R1.404 NOCC(=O)NCCC1CCCO1 c7cb43440f5aa50f753ebed18815d5df [0,1,0,0,0,1|2,0,0]=4 3690 B13R1.404 O=C(CCF)NCCC1CCCC1 9e4534f752e6db6cc7d6ae8825830ed9 [0,1,0,0,0,1|2,0,0]=4 3691 B13R1.404 O=C(CCF)NCCC1CCCO1 e030f971dc813d86917a17a7962b3378 [0,1,0,0,0,1|1,0,0]=3 3692 B13R1.404 O=C(CCO)NCCC1CCCC1 9b33c03ab6fcfeb6ab1d95f8df8f06fe [0,1,0,0,0,1|2,0,0]=4 3693 B13R1.404 O=C(CCO)NCCC1CCCO1 f6d2169f839f84d7ba7ec7d0ccc965e1 [0,1,0,0,0,1|1,0,0]=3 3694 B13R1.404 O=C(CCS)NCCC1CCCC1 a5d98ce2435c61179a76e7dd99c7158b [0,1,0,0,0,1|2,0,0]=4 3695 B13R1.404 O=C(CCS)NCCC1CCCO1 0b9420a1f1fc196e649a3f09dbf28c1f [0,1,0,0,0,1|1,0,0]=3 3696 B13R1.404 O=C(CNCC1CCCO1)NCO dc2da6bb57cb344a9f0582db88ae0f75 [0,1,0,0,0,1|2,0,0]=4 3697 B13R1.404 O=C(CNC[C@@H]1CCCO1)NCO e7d8e5729e9cf7c884b83ed9f9a53ce1 [0,1,0,0,0,1|2,0,0]=4 3698 B13R1.404 O=C(CNC[C@H]1CCCO1)NCO 5b07d89377d411be8873b96f87f7ac27 [0,1,0,0,0,1|2,0,0]=4 3699 B13R1.404 O=CCC(=O)NCCC1CCCO1 03452ef0714cee5c6ebea5ea00e991cd [0,1,0,0,0,1|1,0,1]=4 3700 B13R1.404 OCC[C@H](O)COCC1CCCO1 426463b2bdc82436595635a8aabe60b8 [0,1,0,0,0,1|0,0,2]=4 3701 B13R1.404 OCC[C@H](O)COC[C@@H]1CCCO1 6ea3ec893d1841ee538335b9d4895f26 [0,1,0,0,0,1|0,0,2]=4 3702 B13R1.404 OCC[C@H](O)COC[C@H]1CCCO1 df3d6a7f039246f67c45266045e5eb89 [0,1,0,0,0,1|0,0,2]=4 3703 B13R1.415 C#CC(CC)OCCC1CCCO1 0ba128dacbd7ded5fc006a1c9789c0b7 [0,1,0,0,0,1|1,0,1]=4 3704 B13R1.415 C=CC(CC)OCCC1CCCO1 bd644905947aa4d698175f2ce904b5e5 [0,1,0,0,0,1|1,0,1]=4 3705 B13R1.415 CCC(C#N)OCCC1CCCO1 375d87179a38203f855575727f785f2d [0,1,0,0,0,1|1,0,1]=4 3706 B13R1.415 CCC(C=O)NCCC1CCCO1 2190eced39235a44e414fdb73492b072 [0,1,0,0,0,1|1,0,1]=4 3707 B13R1.415 CCC(C=O)OCCC1CCCC1 3fa8991a8db3a0aed668ebb9d11b62f3 [0,1,0,0,0,1|1,0,1]=4 3708 B13R1.415 CCC(C=O)OCCC1CCCO1 ed4b9a2de5133d99b13d2d4d9d26885e [0,1,0,0,0,1|0,0,1]=3 3709 B13R1.415 CCC(CC)COCC1CCCO1 83b4ae430db32a6f23d80f256420d8b3 [0,1,0,0,0,1|1,0,1]=4 3710 B13R1.415 CCC(CC)COC[C@@H]1CCCO1 07c2297102837ec62414f97d58b781f6 [0,1,0,0,0,1|1,0,1]=4 3711 B13R1.415 CCC(CC)COC[C@H]1CCCO1 fe4352d8dbdc3a8cb62d8fe3568f33db [0,1,0,0,0,1|1,0,1]=4 3712 B13R1.415 CCC(CC)OCCC1CCCO1 3cd23b75281ce585c231fc054dc4b6dc [0,1,0,0,0,1|1,0,1]=4 3713 B13R1.415 CCC(COCC1CCCO1)OC 2317504ae51336e0d07c8a6278797fef [0,1,0,0,0,1|0,0,2]=4 3714 B13R1.415 CCN(CC)COCC1CCCO1 f6968a18b1310d11b3078803363595e5 [0,1,0,0,0,1|2,0,0]=4 3715 B13R1.545 C=C(CC)CN(C)CC1CCCO1 d101baa047bbbefee0f2462e5b61ac55 [0,1,0,0,0,1|2,0,0]=4 3716 B13R1.545 CCC(=O)CN(C)CC1CCCC1 085942b9cbf7064a4dd8f033830618c0 [0,1,0,0,0,1|2,0,0]=4 3717 B13R1.545 CCC(=O)CN(C)CC1CCCO1 214e52cc9ba83d776719db25636e3866 [0,1,0,0,0,1|1,0,0]=3 3718 B13R1.545 CCC(=O)NC(C)CC1CCCC1 493937037638bf127ac6f0458b714e1c [0,1,0,0,0,1|2,0,0]=4 3719 B13R1.545 CN(CC(=O)CO)CC1CCCO1 1b210d956080477cbd691ea92cfac5db [0,1,0,0,0,1|2,0,0]=4 3720 B13R1.545 CNC(=O)CN(C)CC1CCCO1 fa2b17be34894bc610267da2586e5d57 [0,1,0,0,0,1|2,0,0]=4 3721 B13R1.545 COC(=O)CC(C)OC1CCCO1 66de8c070f2b44f249e2f79b5258875b [0,1,0,0,0,1|2,0,0]=4 3722 B13R1.545 COC(=O)CN(C)CC1CCCO1 f9d883210ea5e8c8dd34ebada566982e [0,1,0,0,0,1|2,0,0]=4 3723 B13R1.545 COC(=O)C[C@H](C)OC1CCCO1 39df6d25e6660ec46aef83411cad7fed [0,1,0,0,0,1|2,0,0]=4 3724 B13R1.545 COC(=O)OC(C)OC1CCCC1 bb6fe90887b5434133ebed88df1b698c [0,1,0,0,0,1|2,0,0]=4 3725 B13R1.545 COC(=O)OC(C)OC1CCCO1 20bbff9f2065f21e02ba19e375c81f6c [0,1,0,0,0,1|1,0,0]=3 3726 B13R1.554 C=C(CC)C(=O)NCC1CCCO1 367665eb1878890623af794eb580492f [0,1,0,0,0,1|2,0,0]=4 3727 B13R1.554 C=C(CC)C(=O)NC[C@@H]1CCCO1 f1786c3a1e763e0cc81975ded368f1b6 [0,1,0,0,0,1|2,0,0]=4 3728 B13R1.554 C=C(CC)C(=O)NC[C@H]1CCCO1 9a35584ddf86ac48f7beba5efa7865e9 [0,1,0,0,0,1|2,0,0]=4 3729 B13R1.554 C=C(COC1CCCO1)C(=O)OC 1478560a2ea49c55aed61fe0c44b4ef2 [0,1,0,0,0,1|2,0,0]=4 3730 B13R1.554 CCC(=O)C(=O)NCC1CCCC1 3bbdeb814879c363ff7fcdec9eda5c2a [0,1,0,0,0,1|2,0,0]=4 3731 B13R1.554 CCC(=O)C(=O)NCC1CCCO1 fe64676d016186a966bb616d89482c26 [0,1,0,0,0,1|1,0,0]=3 3732 B13R1.554 CCC(=O)C(=O)NC[C@@H]1CCCO1 36d1a8b9b7912dd92cd03e860145b1a5 [0,1,0,0,0,1|1,0,0]=3 3733 B13R1.554 CCC(=O)C(=O)NC[C@H]1CCCO1 5eaaf0b9d3898dc38285280652120353 [0,1,0,0,0,1|1,0,0]=3 3734 B13R1.554 CCC(=O)C(C)NCC1CCCC1 fadb1e07bd5ce4a1d6a4fcf78683fa6e [0,1,0,0,0,1|2,0,0]=4 3735 B13R1.554 CCC(=O)C(C)NCC1CCCO1 07f28548fb7e3e77f03a40cd3986a364 [0,1,0,0,0,1|1,0,0]=3 3736 B13R1.554 CCC(=O)C(C)NC[C@@H]1CCCO1 f5a56716bfec541ab6d4f4f5728711c3 [0,1,0,0,0,1|1,0,0]=3 3737 B13R1.554 CCC(=O)C(C)NC[C@H]1CCCO1 ed4f61e6cdde867da1850ebe1a0f7f7d [0,1,0,0,0,1|1,0,0]=3 3738 B13R1.554 CCC(=O)C(C)OCC1C=CCC1 5d188b6617e82cf5e789b9db1686871e [0,1,0,0,0,1|1,0,1]=4 3739 B13R1.554 CCC(=O)C(C)OCC1CCCC1 0b494db3c33296fbbd92b64e9407ec95 [0,1,0,0,0,1|1,0,0]=3 3740 B13R1.554 CCC(=O)C(C)OCC1CCCO1 bebc9e3cc3a6118ab023e53c6b6f25b0 [0,1,0,0,0,1|0,0,0]=2 3741 B13R1.554 CCC(=O)C(C)OCC1CCCS1 28456b398b3ef446656a6ba070e4ebe9 [0,1,0,0,0,1|0,1,0]=3 3742 B13R1.554 CCC(=O)C(C)OCC1CCOC1 acbf4e18e9abfcf1837f106b22057e6b [0,1,0,0,0,1|2,0,0]=4 3743 B13R1.554 CCC(=O)C(C)OCN1CCCC1 857acfc8caaa7cbf42ec3e6686817c90 [0,1,0,0,0,1|2,0,0]=4 3744 B13R1.554 CCC(=O)C(C)OC[C@@H]1CCCO1 3d857ab1f669cdcd4ff96d8a19f28641 [0,1,0,0,0,1|0,0,0]=2 3745 B13R1.554 CCC(=O)C(C)OC[C@@H]1CCOC1 67c21de46e20c9fab24cf85c5333545f [0,1,0,0,0,1|2,0,0]=4 3746 B13R1.554 CCC(=O)C(C)OC[C@H]1CCCO1 1cc16d9d95667a5f5a95cb70c982695b [0,1,0,0,0,1|0,0,0]=2 3747 B13R1.554 CCC(=O)C(C)OC[C@H]1CCOC1 2e8cd6d9e9351b801ea5adc0f0625540 [0,1,0,0,0,1|2,0,0]=4 3748 B13R1.554 CCC(C)C(C)OCC1CCCO1 adfffd1f3ba01e6ddcaaa45fe40e334d [0,1,0,0,0,1|1,0,1]=4 3749 B13R1.554 CNC(=O)C(=O)NCC1CCCO1 daa73bb5858c1527d7a362886e565e06 [0,1,0,0,0,1|2,0,0]=4 3750 B13R1.554 CNC(=O)C(=O)NC[C@@H]1CCCO1 cb987ad367913e54e130add63c8966a4 [0,1,0,0,0,1|2,0,0]=4 3751 B13R1.554 CNC(=O)C(=O)NC[C@H]1CCCO1 826cdf91e6fe050865721987121f6aa1 [0,1,0,0,0,1|2,0,0]=4 3752 B13R1.554 CNC(=O)C(C)NCC1CCCO1 8aed7ceb3090a7ad91636fdd6705d936 [0,1,0,0,0,1|2,0,0]=4 3753 B13R1.554 CNC(=O)C(C)NC[C@@H]1CCCO1 5ab43ba3d37aebc6e8e29a5509eac3a5 [0,1,0,0,0,1|2,0,0]=4 3754 B13R1.554 CNC(=O)C(C)NC[C@H]1CCCO1 62bb0efc2fade7d4dce1ca53b915ba3d [0,1,0,0,0,1|2,0,0]=4 3755 B13R1.554 CNC(=O)C(C)OCC1CCCO1 4f3230ba460aac0f84feca20c9c4ea77 [0,1,0,0,0,1|1,0,0]=3 3756 B13R1.554 CNC(=O)C(C)OC[C@@H]1CCCO1 acaa7ab994842f87861990a2dea1c044 [0,1,0,0,0,1|1,0,0]=3 3757 B13R1.554 CNC(=O)C(C)OC[C@H]1CCCO1 a8e0de83349cb39661593de3562543d2 [0,1,0,0,0,1|1,0,0]=3 3758 B13R1.554 CNC(=O)C(F)NCC1CCCO1 3c362e6047c44def64f3703a4a76d13a [0,1,0,0,0,1|2,0,0]=4 3759 B13R1.554 CNC(=O)C(F)NC[C@@H]1CCCO1 bb365461aa843447ab0c4af39e0fabba [0,1,0,0,0,1|2,0,0]=4 3760 B13R1.554 CNC(=O)C(F)NC[C@H]1CCCO1 722bdce9be550229ce9ba2aeda80d681 [0,1,0,0,0,1|2,0,0]=4 3761 B13R1.554 COC(=O)C(=O)COC1CCCO1 1b40a50f7068425203ba2c8793f3c960 [0,1,0,0,0,1|2,0,0]=4 3762 B13R1.554 COC(=O)C(=O)NCC1CCCO1 35a3650dfd56d41ceb3e023939e517c4 [0,1,0,0,0,1|2,0,0]=4 3763 B13R1.554 COC(=O)C(=O)NC[C@@H]1CCCO1 945b21f3a4cb9282dc80a46cc672fea5 [0,1,0,0,0,1|2,0,0]=4 3764 B13R1.554 COC(=O)C(=O)NC[C@H]1CCCO1 0f05967ccbe7822e9fce71940fe011c0 [0,1,0,0,0,1|2,0,0]=4 3765 B13R1.554 COC(=O)C(C)COC1CCCO1 217c8aab25cd90fcf34bbe716fafa1ed [0,1,0,0,0,1|2,0,0]=4 3766 B13R1.554 COC(=O)C(C)NCC1CCCO1 b78cf6476bccf0ffd49112ece4cc42df [0,1,0,0,0,1|2,0,0]=4 3767 B13R1.554 COC(=O)C(C)NC[C@@H]1CCCO1 b07e646b193677c1a3738b6dc67b25e9 [0,1,0,0,0,1|2,0,0]=4 3768 B13R1.554 COC(=O)C(C)NC[C@H]1CCCO1 3a7bbdc355bc63ef9e561e939c7b3286 [0,1,0,0,0,1|2,0,0]=4 3769 B13R1.554 COC(=O)C(C)OCC1CCCC1 821146585c2c8a487ff308b445c19033 [0,1,0,0,0,1|2,0,0]=4 3770 B13R1.554 COC(=O)C(C)OCC1CCCO1 abc3e859c60561260501197260e1e7f8 [0,1,0,0,0,1|1,0,0]=3 3771 B13R1.554 COC(=O)C(C)OCC1CCCS1 4aa36eb445f939e695ce6ed6e55557b0 [0,1,0,0,0,1|1,1,0]=4 3772 B13R1.554 COC(=O)C(C)OC[C@@H]1CCCO1 85780b5d4f0e32226057a90fff79d030 [0,1,0,0,0,1|1,0,0]=3 3773 B13R1.554 COC(=O)C(C)OC[C@H]1CCCO1 24e4cae313f573484c6922324f9f627c [0,1,0,0,0,1|1,0,0]=3 3774 B13R1.554 COC(=O)[C@@H](C)COC1CCCO1 26165b8b09c86b84afea175e95595473 [0,1,0,0,0,1|2,0,0]=4 3775 B13R1.554 COC(=O)[C@@H](C)NCC1CCCO1 ce914adacf543b1ee1028c4dbb682bd0 [0,1,0,0,0,1|2,0,0]=4 3776 B13R1.554 COC(=O)[C@@H](C)NC[C@@H]1CCCO1 118b9eb8ca35b641eb1fa9a350ae9419 [0,1,0,0,0,1|2,0,0]=4 3777 B13R1.554 COC(=O)[C@@H](C)NC[C@H]1CCCO1 95407e7fc575182517388a6610cb721e [0,1,0,0,0,1|2,0,0]=4 3778 B13R1.554 COC(=O)[C@@H](C)OCC1CCCC1 3a2e737e8b0dbaaa39185ff7ea699d6f [0,1,0,0,0,1|2,0,0]=4 3779 B13R1.554 COC(=O)[C@@H](C)OCC1CCCO1 0f9c84f503c3968820aedcfa5e7efaa7 [0,1,0,0,0,1|1,0,0]=3 3780 B13R1.554 COC(=O)[C@@H](C)OCC1CCCS1 1f10cd25a75ec80de09a876e7e5071df [0,1,0,0,0,1|1,1,0]=4 3781 B13R1.554 COC(=O)[C@@H](C)OC[C@@H]1CCCO1 d658c50fa3a2ef96d5248142d4444727 [0,1,0,0,0,1|1,0,0]=3 3782 B13R1.554 COC(=O)[C@@H](C)OC[C@H]1CCCO1 4db9796a41dc74918a51d8b9e9fb3edd [0,1,0,0,0,1|1,0,0]=3 3783 B13R1.554 COC(=O)[C@H](C)COC1CCCO1 fd65dab352522337123fda92379afcbc [0,1,0,0,0,1|2,0,0]=4 3784 B13R1.554 COC(=O)[C@H](C)NCC1CCCO1 4ec756009f466cc9199cfc217bacdd7c [0,1,0,0,0,1|2,0,0]=4 3785 B13R1.554 COC(=O)[C@H](C)NC[C@@H]1CCCO1 22c2afa1352c3f784c822b39b26b6962 [0,1,0,0,0,1|2,0,0]=4 3786 B13R1.554 COC(=O)[C@H](C)NC[C@H]1CCCO1 3e35abccafe0f56f49df61b408b28d4b [0,1,0,0,0,1|2,0,0]=4 3787 B13R1.554 COC(=O)[C@H](C)OCC1CCCC1 97f8b4cc6c902fc09abf2f322a586224 [0,1,0,0,0,1|2,0,0]=4 3788 B13R1.554 COC(=O)[C@H](C)OCC1CCCO1 f8fbc34bd4cfbbb491356e5bca48bad7 [0,1,0,0,0,1|1,0,0]=3 3789 B13R1.554 COC(=O)[C@H](C)OCC1CCCS1 8fb04d7574ea0bbe4edea60ab5f73a25 [0,1,0,0,0,1|1,1,0]=4 3790 B13R1.554 COC(=O)[C@H](C)OC[C@@H]1CCCO1 45897bb49b8468464458357fcaa6884a [0,1,0,0,0,1|1,0,0]=3 3791 B13R1.554 COC(=O)[C@H](C)OC[C@H]1CCCO1 6ab660092f8f325b23e28094d48392af [0,1,0,0,0,1|1,0,0]=3 3792 B13R1.554 O=C(CS)C(=O)NCC1CCCO1 50f864156117bc16ee671fcf2bbca09c [0,1,0,0,0,1|2,0,0]=4 3793 B13R1.554 O=C(CS)C(=O)NC[C@@H]1CCCO1 330bf00b0b6007ff279c1b04880cba7a [0,1,0,0,0,1|2,0,0]=4 3794 B13R1.554 O=C(CS)C(=O)NC[C@H]1CCCO1 1673c5d59b431ba22142f53a1221726a [0,1,0,0,0,1|2,0,0]=4 3795 B13R1.599 C=C(CC)COCC1CCCC1=O 475f3fe2f23c71691aa31dfcd57db1e0 [0,1,0,0,0,1|2,0,0]=4 3796 B13R1.599 C=C(CC)COCC1CCCC1C 81d87a852d0649e261f7f3900a612b56 [0,1,0,0,0,1|2,0,0]=4 3797 B13R1.599 C=C(CC)COCC1CCCN1C 24110fc5be8735c49d62e6a036ba521d [0,1,0,0,0,1|2,0,0]=4 3798 B13R1.599 C=C(CC)COCC1OCCC1C db1153e730c93cdeeaf6311bce401f03 [0,1,0,0,0,1|1,0,0]=3 3799 B13R1.599 C=C(CC)COC[C@@H]1CCCN1C b160bf4d8b7a36593769f21b2f8d112b [0,1,0,0,0,1|2,0,0]=4 3800 B13R1.599 C=C(CC)COC[C@@H]1CCC[C@H]1F cca35e3d155fc4907b6076e030382f3a [0,1,0,0,0,1|2,0,0]=4 3801 B13R1.599 C=C(CC)COC[C@H]1CCCN1C 7200a825b3f022ce434ce5f803409a1e [0,1,0,0,0,1|2,0,0]=4 3802 B13R1.599 C=C(COCC1OCCC1C)OC 4edfb3e2ec99c51de093258cd64df6eb [0,1,0,0,0,1|2,0,0]=4 3803 B13R1.599 CCC(=O)CNCC1CCCC1O 62c9a07e37c44f4333f7ba8e5f7e93d1 [0,1,0,0,0,1|2,0,0]=4 3804 B13R1.599 CCC(=O)CNCC1CCCN1C 02ffc2a72f4b3d421b6d7710e22aff42 [0,1,0,0,0,1|2,0,0]=4 3805 B13R1.599 CCC(=O)CNC[C@@H]1CCCN1C 794617d6fc1b39d672690a0bae03a912 [0,1,0,0,0,1|2,0,0]=4 3806 B13R1.599 CCC(=O)CNC[C@H]1CCCN1C 934620c736a0950a168d13df60fe763f [0,1,0,0,0,1|2,0,0]=4 3807 B13R1.599 CCC(=O)COCC1CCCC1=O ab24369b063c38041561b816bdd0774b [0,1,0,0,0,1|1,0,0]=3 3808 B13R1.599 CCC(=O)COCC1CCCC1C 2b9add63a8fe98c1c2d5701dd7c01cce [0,1,0,0,0,1|1,0,0]=3 3809 B13R1.599 CCC(=O)COCC1CCCN1C 9d565054daa52d508a137c55de78c116 [0,1,0,0,0,1|1,0,0]=3 3810 B13R1.599 CCC(=O)COCC1CCNC1=O 4a25387c39202d4de15cbc053ecb7972 [0,1,0,0,0,1|2,0,0]=4 3811 B13R1.599 CCC(=O)COCC1COCC1C 9bf9c0063f14129c3e7b26e45d255af4 [0,1,0,0,0,1|2,0,0]=4 3812 B13R1.599 CCC(=O)COCC1OCCC1C 0e3cfb66ae6c6713961bed85b62b60b9 [0,1,0,0,0,1|0,0,0]=2 3813 B13R1.599 CCC(=O)COCN1CCCC1=O 1d3a2b0f93d281b6d32aabfe8f138e51 [0,1,0,0,0,1|2,0,0]=4 3814 B13R1.599 CCC(=O)COC[C@@H]1CCCN1C 653f759b79ced4f6a275ba2c10dd3b26 [0,1,0,0,0,1|1,0,0]=3 3815 B13R1.599 CCC(=O)COC[C@@H]1CCC[C@H]1F 410bee5ff9a2d6c3b6b50cc364fb63af [0,1,0,0,0,1|1,0,0]=3 3816 B13R1.599 CCC(=O)COC[C@@H]1CCO[C@@H]1C 5fc40eb4282a7ce95e8cccf5a96b77d8 [0,1,0,0,0,1|2,0,0]=4 3817 B13R1.599 CCC(=O)COC[C@H]1CCCN1C fcff1b760cd3bcdbadafe8e49da080df [0,1,0,0,0,1|1,0,0]=3 3818 B13R1.599 CCC(=O)NCCC1CCCN1C bbe54528e0c2a7f162ee3617bc75706c [0,1,0,0,0,1|2,0,0]=4 3819 B13R1.599 CCC(=O)NCC[C@@H]1CCCN1C f2b9984a21fcd0eeb97476acb6c583ab [0,1,0,0,0,1|2,0,0]=4 3820 B13R1.599 CCC(=O)NCC[C@H]1CCCN1C efc7c88941deb60fd29044109d9794ce [0,1,0,0,0,1|2,0,0]=4 3821 B13R1.599 CCC(=O)OCNC1CCCC1O 8b7aaacdef67a4de4afef3d19e700c43 [0,1,0,0,0,1|1,0,0]=3 3822 B13R1.599 CCC(=O)OCNC1CCNC1=O a9b9aac1c4ab71a7f5999842ed061776 [0,1,0,0,0,1|2,0,0]=4 3823 B13R1.599 CCC(=O)OCNC1CCSC1=O b8c370ce05e59de1290066ebb5679cbf [0,1,0,0,0,1|2,0,0]=4 3824 B13R1.599 CCC(=O)OCNC1COCC1O 88423e0a6d127860ecf29175870d2ba5 [0,1,0,0,0,1|2,0,0]=4 3825 B13R1.599 CCC(=O)OCN[C@@H]1CCC[C@@H]1O 455e25d00ce40e6899d4280dfee5f081 [0,1,0,0,0,1|1,0,0]=3 3826 B13R1.599 CCC(=O)OCN[C@@H]1CCC[C@H]1O 126438e73282b9289b1ff8c9e925cb3a [0,1,0,0,0,1|1,0,0]=3 3827 B13R1.599 CCC(=O)OCN[C@@H]1CCNC1=O 20ff93370b9af9144ca9e7b2ee2a9ce4 [0,1,0,0,0,1|2,0,0]=4 3828 B13R1.599 CCC(=O)OCN[C@@H]1CCOC1=O 296027f73c698aed6cf8cc07e40b9aac [0,1,0,0,0,1|2,0,0]=4 3829 B13R1.599 CCC(=O)OCN[C@@H]1COC[C@@H]1O 40753ea292b040d13a4b371848dda72b [0,1,0,0,0,1|2,0,0]=4 3830 B13R1.599 CCC(=O)OCN[C@@H]1COC[C@H]1O 37432725e8764cb15785e21d6e51fa43 [0,1,0,0,0,1|2,0,0]=4 3831 B13R1.599 CCC(=O)OCN[C@H]1CCC[C@@H]1O 6a0ca49407b98072799168a4ce6cd23a [0,1,0,0,0,1|1,0,0]=3 3832 B13R1.599 CCC(=O)OCN[C@H]1CCC[C@H]1O 1d5f879f1a0a43aa4bcef8cea74479ec [0,1,0,0,0,1|1,0,0]=3 3833 B13R1.599 CCC(=O)OCN[C@H]1CCNC1=O 4a3839f88a38b2ad93e78ff69a8aafbd [0,1,0,0,0,1|2,0,0]=4 3834 B13R1.599 CCC(=O)OCN[C@H]1CCOC1=O 62411a8abfaae0da55e83245c3db03a2 [0,1,0,0,0,1|2,0,0]=4 3835 B13R1.599 CCC(=O)OCN[C@H]1COC[C@@H]1O b0f45f210c058f0374ea38aaa87efa19 [0,1,0,0,0,1|2,0,0]=4 3836 B13R1.599 CCC(=O)OCN[C@H]1COC[C@H]1F 7afe1e851292b764e446bd6b57f34504 [0,1,0,0,0,1|2,0,0]=4 3837 B13R1.599 CCC(=O)OCN[C@H]1COC[C@H]1O 990ddee8c2e62f3c7d2305eb1a73790e [0,1,0,0,0,1|2,0,0]=4 3838 B13R1.599 CCC(=O)OCOC1CCC=C1Br d5212c05fb325a2b241803950e78f409 [0,1,0,0,0,1|1,0,1]=4 3839 B13R1.599 CCC(=O)OCOC1CCCC1=O 7cc47c5a203167987e75e400b8a67104 [0,1,0,0,0,1|1,0,0]=3 3840 B13R1.599 CCC(=O)OCOC1CCCC1C 9faeb66f86600d876a9321a4ecb5f2cd [0,1,0,0,0,1|1,0,0]=3 3841 B13R1.599 CCC(=O)OCOC1CCNC1=O 4f0facbccebce5e598d632a042417ad6 [0,1,0,0,0,1|2,0,0]=4 3842 B13R1.599 CCC(=O)OCOC1CCOC1=O d4dcedca0869471276d864ce4416a25a [0,1,0,0,0,1|2,0,0]=4 3843 B13R1.599 CCC(=O)OCOC1COCC1C 6f3470c0316abf7ef3447b8997f370a1 [0,1,0,0,0,1|2,0,0]=4 3844 B13R1.599 CCC(=O)OCOC1COCC1F 8754e2b8fc2131ed71d6b0ecc8bd5d39 [0,1,0,0,0,1|2,0,0]=4 3845 B13R1.599 CCC(=O)OCO[C@@H]1CCC[C@@H]1C 0cefcd225eb1515c0da8b98e1c8da039 [0,1,0,0,0,1|1,0,0]=3 3846 B13R1.599 CCC(=O)OCO[C@@H]1CCC[C@H]1C bc61c13f08075b3b8686ffb69a69e6ff [0,1,0,0,0,1|1,0,0]=3 3847 B13R1.599 CCC(=O)OCO[C@@H]1CCC[C@H]1F 279af90a8684b5717bf7bd3e45100f10 [0,1,0,0,0,1|1,0,0]=3 3848 B13R1.599 CCC(=O)OCO[C@@H]1CCNC1=O f907ff033ed8c824b8471effb922118c [0,1,0,0,0,1|2,0,0]=4 3849 B13R1.599 CCC(=O)OCO[C@@H]1CCOC1=O c11390f4a5b8a0afba40525f72ceab5a [0,1,0,0,0,1|2,0,0]=4 3850 B13R1.599 CCC(=O)OCO[C@@H]1COC[C@@H]1C f0df153653d6199b38860821ecadb92a [0,1,0,0,0,1|2,0,0]=4 3851 B13R1.599 CCC(=O)OCO[C@@H]1COC[C@H]1F 7ee2958635ca1dabf326529034a71e61 [0,1,0,0,0,1|2,0,0]=4 3852 B13R1.599 CCC(=O)OCO[C@H]1CCC[C@@H]1C 498bc5dcf9f83e168d2d8c023fe6b853 [0,1,0,0,0,1|1,0,0]=3 3853 B13R1.599 CCC(=O)OCO[C@H]1CCC[C@H]1C 9fe100d1e9636a2148d27ae4492d1b5a [0,1,0,0,0,1|1,0,0]=3 3854 B13R1.599 CCC(=O)OCO[C@H]1CCNC1=O 321f8c72598064ebdfb8130318721977 [0,1,0,0,0,1|2,0,0]=4 3855 B13R1.599 CCC(=O)OCO[C@H]1CCOC1=O 7de8223dbbc284895802ea6bb39a1d91 [0,1,0,0,0,1|2,0,0]=4 3856 B13R1.599 CCC(=O)OCO[C@H]1COC[C@@H]1C 5d2ede674ebad483f99eb8bc2e724b28 [0,1,0,0,0,1|2,0,0]=4 3857 B13R1.599 CCC(=O)OCO[C@H]1COC[C@H]1C 12d624eb32de9761c1c719a2856d988d [0,1,0,0,0,1|2,0,0]=4 3858 B13R1.599 CCC(=O)OCO[C@H]1COC[C@H]1F 937749e1284d47e9d334204feb724137 [0,1,0,0,0,1|2,0,0]=4 3859 B13R1.599 CCC(C)COCC1OCCC1C 8bd68fe6d6601423ea2ebc0d386fb689 [0,1,0,0,0,1|1,0,1]=4 3860 B13R1.599 CC[C@@H](C)COCC1OCCC1C a82789a1bbf75047b2bc7ef236520f1a [0,1,0,0,0,1|1,0,1]=4 3861 B13R1.599 CC[C@H](C)COCC1OCCC1C a0fee4b7101890a6df6f9b9de2f8f1c3 [0,1,0,0,0,1|1,0,1]=4 3862 B13R1.599 CNC(=O)COCC1CCCC1=O a3691a42ae5d4e98445db0b51b8b2746 [0,1,0,0,0,1|2,0,0]=4 3863 B13R1.599 CNC(=O)COCC1CCCC1C e82b9701845281397b583f674b3a6300 [0,1,0,0,0,1|2,0,0]=4 3864 B13R1.599 CNC(=O)COCC1CCCN1C cb22fe2ce09300b77f7aab1366baa8f7 [0,1,0,0,0,1|2,0,0]=4 3865 B13R1.599 CNC(=O)COCC1OCCC1C 19a90bddbd6b0e982113269f0d165365 [0,1,0,0,0,1|1,0,0]=3 3866 B13R1.599 CNC(=O)COC[C@@H]1CCCN1C a6941d76981357ecdd293a4be4bcf342 [0,1,0,0,0,1|2,0,0]=4 3867 B13R1.599 CNC(=O)COC[C@@H]1CCC[C@H]1F 218aebdb4b991cb2a153842edece4359 [0,1,0,0,0,1|2,0,0]=4 3868 B13R1.599 CNC(=O)COC[C@H]1CCCN1C 334dd09e8f8979c0c71fd9237fc106cd [0,1,0,0,0,1|2,0,0]=4 3869 B13R1.599 COC(=O)COCC1CCCC1=O 7eabb6e22960d672122f4d0dad566515 [0,1,0,0,0,1|2,0,0]=4 3870 B13R1.599 COC(=O)COCC1CCCC1C 70ad2bbd60be6e36b77313f00ca53492 [0,1,0,0,0,1|2,0,0]=4 3871 B13R1.599 COC(=O)COCC1CCCN1C 268ed06859cdb37cfc04a8d38412d85c [0,1,0,0,0,1|2,0,0]=4 3872 B13R1.599 COC(=O)COCC1OCCC1C 9cc8e826968ea2ccc6d7a5d29a4d1973 [0,1,0,0,0,1|1,0,0]=3 3873 B13R1.599 COC(=O)COC[C@@H]1CCCN1C b67248b5747f703d48a64bbe0e2a1c79 [0,1,0,0,0,1|2,0,0]=4 3874 B13R1.599 COC(=O)COC[C@@H]1CCC[C@H]1F 0ded22be2fb5461b31f5fc02923a6f08 [0,1,0,0,0,1|2,0,0]=4 3875 B13R1.599 COC(=O)COC[C@H]1CCCN1C e3dfadaddf384a284a65237d0469fe39 [0,1,0,0,0,1|2,0,0]=4 3876 B13R1.599 COC(=O)OCNC1CCCC1O 90d1d0d023b18de67832ec7af0874230 [0,1,0,0,0,1|2,0,0]=4 3877 B13R1.599 COC(=O)OCN[C@@H]1CCC[C@@H]1O fd568fffab038edcd40bdb54b6a7f7e7 [0,1,0,0,0,1|2,0,0]=4 3878 B13R1.599 COC(=O)OCN[C@@H]1CCC[C@H]1O c0d1bc20b65c3b0d5b41ad0fdc8c8efa [0,1,0,0,0,1|2,0,0]=4 3879 B13R1.599 COC(=O)OCN[C@H]1CCC[C@@H]1O 0c2b4a726e543cbdc577559df452df0f [0,1,0,0,0,1|2,0,0]=4 3880 B13R1.599 COC(=O)OCN[C@H]1CCC[C@H]1O 92bd80c4caeb469849650c3b3c6ab680 [0,1,0,0,0,1|2,0,0]=4 3881 B13R1.599 COC(=O)OCOC1CCCC1=O 2b591dee3ff83f2e7e35e1aca92694dd [0,1,0,0,0,1|2,0,0]=4 3882 B13R1.599 COC(=O)OCOC1CCCC1C 84d04f96cb3b74efd61bf33e3b0533ba [0,1,0,0,0,1|2,0,0]=4 3883 B13R1.599 COC(=O)OCO[C@@H]1CCC[C@@H]1C c8a564e4de1396ec36d9af9175ce007a [0,1,0,0,0,1|2,0,0]=4 3884 B13R1.599 COC(=O)OCO[C@@H]1CCC[C@H]1C bbb356dd002ebf3f7a5cc248376918ca [0,1,0,0,0,1|2,0,0]=4 3885 B13R1.599 COC(=O)OCO[C@@H]1CCC[C@H]1F acea41e2e832733f9e0bd105e1204356 [0,1,0,0,0,1|2,0,0]=4 3886 B13R1.599 COC(=O)OCO[C@H]1CCC[C@@H]1C 66b29a320f82e438502d31879b43d84c [0,1,0,0,0,1|2,0,0]=4 3887 B13R1.599 COC(=O)OCO[C@H]1CCC[C@H]1C 7413da54c3620694cb4f388e9f1c1a37 [0,1,0,0,0,1|2,0,0]=4 3888 B13R1.717 C=C(CC)COCC1CCC(=O)O1 41eb5aac24e7fb5b0e226703b70fe2b4 [0,1,0,0,0,1|1,0,1]=4 3889 B13R1.717 C=C(CC)COCC1CCC(C1)C d5ec14241b57a3fa7120191ba49752bd [0,1,0,0,0,1|2,0,0]=4 3890 B13R1.717 C=C(CC)COCC1CCC(C1)F fd039a4c8ab41b1ea2312afb0935246a [0,1,0,0,0,1|2,0,0]=4 3891 B13R1.717 C=C(CC)COCC1CCC(O1)C 296e9c1e26b226e03e21da6cadd1b1ee [0,1,0,0,0,1|1,0,0]=3 3892 B13R1.717 C=C(CC)COC[C@@H]1CCC(=O)O1 c5d363e3c009a4a8775e47876875ec2d [0,1,0,0,0,1|1,0,1]=4 3893 B13R1.717 C=C(CC)COC[C@@H]1CC[C@@H](O1)C 47265b494c627070bf0c14bf8396c798 [0,1,0,0,0,1|1,0,0]=3 3894 B13R1.717 C=C(CC)COC[C@@H]1CC[C@H](C1)F 02cfb0c09fcaf9ed6b1a8b9c74e395b5 [0,1,0,0,0,1|2,0,0]=4 3895 B13R1.717 C=C(CC)COC[C@H]1CCC(=O)O1 865f0d737b5a3b503be0a7b4a83e14f5 [0,1,0,0,0,1|1,0,1]=4 3896 B13R1.717 C=C(CC)COC[C@H]1CC[C@H](C1)F 07eaff3d92e8e47fa11989d5e55f7740 [0,1,0,0,0,1|2,0,0]=4 3897 B13R1.717 C=C(COCC1CCC(O1)C)OC 1d3f9c89ddfaa9603bbb7d653fd93267 [0,1,0,0,0,1|2,0,0]=4 3898 B13R1.717 C=C(COC[C@@H]1CC[C@@H](O1)C)OC 253fba04903af964f99b2e2ce560bc05 [0,1,0,0,0,1|2,0,0]=4 3899 B13R1.717 CCC(=O)CNCC1CCC(C1)O 915d9ed73c3ee5afc1b60286a9586fab [0,1,0,0,0,1|2,0,0]=4 3900 B13R1.717 CCC(=O)COCC1CCC(=O)C1 2b97a1b517bdce3d3978499c41816432 [0,1,0,0,0,1|1,0,1]=4 3901 B13R1.717 CCC(=O)COCC1CCC(=O)N1 ee241c659ebcb0d65bf8860cc4e47120 [0,1,0,0,0,1|1,0,1]=4 3902 B13R1.717 CCC(=O)COCC1CCC(=O)O1 81e95cc18d4e786793823310f850aaa3 [0,1,0,0,0,1|0,0,1]=3 3903 B13R1.717 CCC(=O)COCC1CCC(C1)C 6531f7772f171c9219c75e4f0f881f1d [0,1,0,0,0,1|1,0,0]=3 3904 B13R1.717 CCC(=O)COCC1CCC(C1)F 52b7a5065291489a57ee4dc4b79895d0 [0,1,0,0,0,1|1,0,0]=3 3905 B13R1.717 CCC(=O)COCC1CCC(O1)C 2f11a6655eb5cdf5a510b63449493fee [0,1,0,0,0,1|0,0,0]=2 3906 B13R1.717 CCC(=O)COCC1CCN(C1)C b75394db8bd35e588e3dd5d377691115 [0,1,0,0,0,1|2,0,0]=4 3907 B13R1.717 CCC(=O)COC[C@@H]1CCC(=O)C1 56b566b3acd85fb85f9b9e27bf7a152a [0,1,0,0,0,1|1,0,1]=4 3908 B13R1.717 CCC(=O)COC[C@@H]1CCC(=O)N1 f0ebb4b85eb84ebb6f59c51c63a1f1ec [0,1,0,0,0,1|1,0,1]=4 3909 B13R1.717 CCC(=O)COC[C@@H]1CCC(=O)O1 06279b4e072aff2afd9a9904041c0a75 [0,1,0,0,0,1|0,0,1]=3 3910 B13R1.717 CCC(=O)COC[C@@H]1CCN(C1)C 419987ece68ad36699f8625f1fe6a07b [0,1,0,0,0,1|2,0,0]=4 3911 B13R1.717 CCC(=O)COC[C@@H]1CC[C@@H](O1)C e683247aff35ac125460c3a273a3e1de [0,1,0,0,0,1|0,0,0]=2 3912 B13R1.717 CCC(=O)COC[C@@H]1CC[C@H](C1)F 9d04a475c42b78eb609de229cd529208 [0,1,0,0,0,1|1,0,0]=3 3913 B13R1.717 CCC(=O)COC[C@H]1CCC(=O)N1 b0d6e2624fcebe1d33982ee1dcb3467d [0,1,0,0,0,1|1,0,1]=4 3914 B13R1.717 CCC(=O)COC[C@H]1CCC(=O)O1 00c9e372129e8f11d37480259e2aaca2 [0,1,0,0,0,1|0,0,1]=3 3915 B13R1.717 CCC(=O)COC[C@H]1CCN(C1)C 1d660fc5c65c09ac0e3ab59ef82575c4 [0,1,0,0,0,1|2,0,0]=4 3916 B13R1.717 CCC(=O)COC[C@H]1CC[C@H](C1)F a588c86aa203645a3d67713c75602b6a [0,1,0,0,0,1|1,0,0]=3 3917 B13R1.717 CCC(=O)OCNC1CCC(C1)C 1efb6aa50713184edcfdd6d1baf69cec [0,1,0,0,0,1|1,0,0]=3 3918 B13R1.717 CCC(=O)OCNC1CCC(C1)O 06a3aafd31cbb8caa1d827c2cd987225 [0,1,0,0,0,1|1,0,0]=3 3919 B13R1.717 CCC(=O)OCNC1CCN(C1)C 5962534ec314eb5606532ec97f186380 [0,1,0,0,0,1|2,0,0]=4 3920 B13R1.717 CCC(=O)OCN[C@@H]1C=C[C@@H](C1)O 940f165c26b7c9ecdeb8ec69ab4d2d2b [0,1,0,0,0,1|1,0,1]=4 3921 B13R1.717 CCC(=O)OCN[C@@H]1CCN(C1)C b0c5c2cd6b63866b8eb0cc39636195eb [0,1,0,0,0,1|2,0,0]=4 3922 B13R1.717 CCC(=O)OCN[C@@H]1CC[C@@H](C1)O 499090361cf40ca60e65c58618d3ce5f [0,1,0,0,0,1|1,0,0]=3 3923 B13R1.717 CCC(=O)OCN[C@@H]1CC[C@H](C1)O 48e7952707c70bf9a4ff6662e860bd10 [0,1,0,0,0,1|1,0,0]=3 3924 B13R1.717 CCC(=O)OCN[C@H]1C=C[C@H](C1)O 9c5e4c986758638f4f44ec7f0f80acf2 [0,1,0,0,0,1|1,0,1]=4 3925 B13R1.717 CCC(=O)OCN[C@H]1CCN(C1)C 4554f2a914814730c1103060a2cc6913 [0,1,0,0,0,1|2,0,0]=4 3926 B13R1.717 CCC(=O)OCN[C@H]1CC[C@@H](C1)O aaf66a2f4b5cc30ba637193d149479e1 [0,1,0,0,0,1|1,0,0]=3 3927 B13R1.717 CCC(=O)OCN[C@H]1CC[C@H](C1)O a7eb48302105e6eabe6d83b8f24c88e9 [0,1,0,0,0,1|1,0,0]=3 3928 B13R1.717 CCC(=O)OCOC1CCC(=O)C1 7421b7266e6820b238887d5baa64738f [0,1,0,0,0,1|1,0,1]=4 3929 B13R1.717 CCC(=O)OCOC1CCC(C1)C 8f0d21b3e23c1fcd0b674737dfbdc377 [0,1,0,0,0,1|1,0,0]=3 3930 B13R1.717 CCC(=O)OCOC1CCC(C1)F 1572ca46a1aaa95896b54bee2cc25b23 [0,1,0,0,0,1|1,0,0]=3 3931 B13R1.717 CCC(=O)OCOC1CCN(C1)C a4533e7fb9a780579c2a50da0e9b6e0d [0,1,0,0,0,1|2,0,0]=4 3932 B13R1.717 CCC(=O)OCOC1COC(C1)C 21e4c6a19c68bc88b0ffdbcb1356438c [0,1,0,0,0,1|2,0,0]=4 3933 B13R1.717 CCC(=O)OCO[C@@H]1CCN(C1)C 5abc85ae2d0c8366a906ff6c852adf22 [0,1,0,0,0,1|2,0,0]=4 3934 B13R1.717 CCC(=O)OCO[C@H]1CCN(C1)C 91bef8a578daa7e1ca2b152f9825aa4d [0,1,0,0,0,1|2,0,0]=4 3935 B13R1.717 CCC(C)COCC1CCC(O1)C a1026ce5b4a8bae34f778c95b889b9e0 [0,1,0,0,0,1|1,0,1]=4 3936 B13R1.717 CCC(C)COC[C@@H]1CC[C@@H](O1)C 6879201bb243135480affea5942f3081 [0,1,0,0,0,1|1,0,1]=4 3937 B13R1.717 CC[C@@H](C)COCC1CCC(O1)C e794956362f5be217d491aeba0a25234 [0,1,0,0,0,1|1,0,1]=4 3938 B13R1.717 CC[C@@H](C)COC[C@@H]1CC[C@@H](O1)C 751074abde9da10e736c94cfe63d55ac [0,1,0,0,0,1|1,0,1]=4 3939 B13R1.717 CC[C@H](C)COCC1CCC(O1)C 0dd9aa06a6ea0aa4a07ba5918d94ae0a [0,1,0,0,0,1|1,0,1]=4 3940 B13R1.717 CC[C@H](C)COC[C@@H]1CC[C@@H](O1)C 5dd1317f52b877f539b78336498e52b3 [0,1,0,0,0,1|1,0,1]=4 3941 B13R1.717 CNC(=O)COCC1CCC(=O)O1 c2b99a3a9979b514b25ed5925be47f64 [0,1,0,0,0,1|1,0,1]=4 3942 B13R1.717 CNC(=O)COCC1CCC(C1)C 782bda208f63857424925c3e86f4e72c [0,1,0,0,0,1|2,0,0]=4 3943 B13R1.717 CNC(=O)COCC1CCC(C1)F edba55a10fb03c8ba680a63bd57ddf95 [0,1,0,0,0,1|2,0,0]=4 3944 B13R1.717 CNC(=O)COCC1CCC(O1)C 15dda837cc9c82b9acfc3a5d989a5232 [0,1,0,0,0,1|1,0,0]=3 3945 B13R1.717 CNC(=O)COC[C@@H]1CCC(=O)O1 bff8c70d1740057344abdb11070115ec [0,1,0,0,0,1|1,0,1]=4 3946 B13R1.717 CNC(=O)COC[C@@H]1CC[C@@H](O1)C 3d53f9f6d57aa6843bca71dcfac98eba [0,1,0,0,0,1|1,0,0]=3 3947 B13R1.717 CNC(=O)COC[C@@H]1CC[C@H](C1)F d03e3d797e68c6bdd00fc95816a6bb11 [0,1,0,0,0,1|2,0,0]=4 3948 B13R1.717 CNC(=O)COC[C@H]1CCC(=O)O1 c2f56be49b3bd0152d84813fe83ac50e [0,1,0,0,0,1|1,0,1]=4 3949 B13R1.717 CNC(=O)COC[C@H]1CC[C@H](C1)F 9f9743a2c0a59968cf7274f1404d726c [0,1,0,0,0,1|2,0,0]=4 3950 B13R1.717 COC(=O)COCC1CCC(=O)O1 6cff491d4b77bbcdbeef36a8fefd2a98 [0,1,0,0,0,1|1,0,1]=4 3951 B13R1.717 COC(=O)COCC1CCC(C1)C 9c25a1225e4fee79d336bbade2a44563 [0,1,0,0,0,1|2,0,0]=4 3952 B13R1.717 COC(=O)COCC1CCC(C1)F 8b4bb0cbb9a113203180110ca52ef720 [0,1,0,0,0,1|2,0,0]=4 3953 B13R1.717 COC(=O)COCC1CCC(O1)C 5d591cef212e4de0cc3884674be8a6d8 [0,1,0,0,0,1|1,0,0]=3 3954 B13R1.717 COC(=O)COC[C@@H]1CCC(=O)O1 cf3549367099edb062fe4a5ce7d0e00b [0,1,0,0,0,1|1,0,1]=4 3955 B13R1.717 COC(=O)COC[C@@H]1CC[C@@H](O1)C acd5804634667fab03f179813489d3c1 [0,1,0,0,0,1|1,0,0]=3 3956 B13R1.717 COC(=O)COC[C@@H]1CC[C@H](C1)F cfcb707769ad588b715496b85ac3a150 [0,1,0,0,0,1|2,0,0]=4 3957 B13R1.717 COC(=O)COC[C@H]1CCC(=O)O1 441f7506af11df1026a541fd6b819fd8 [0,1,0,0,0,1|1,0,1]=4 3958 B13R1.717 COC(=O)COC[C@H]1CC[C@H](C1)F 488648b6ac3c15a5f88169dc374c2581 [0,1,0,0,0,1|2,0,0]=4 3959 B13R1.717 COC(=O)OCNC1CCC(C1)C 7b7adbfb1cc8f3d5837f0f996a86da95 [0,1,0,0,0,1|2,0,0]=4 3960 B13R1.717 COC(=O)OCNC1CCC(C1)O f73b8675c4614ce4ee26cf01b8bbe3e7 [0,1,0,0,0,1|2,0,0]=4 3961 B13R1.717 COC(=O)OCN[C@@H]1CC[C@@H](C1)O 84eaa74cf3b25f4b5582fa32a4ec4adb [0,1,0,0,0,1|2,0,0]=4 3962 B13R1.717 COC(=O)OCN[C@@H]1CC[C@H](C1)O 7338d93bfc2f4df4222723b7118fc994 [0,1,0,0,0,1|2,0,0]=4 3963 B13R1.717 COC(=O)OCN[C@H]1CC[C@@H](C1)O ce22ecabeb4cec5549f197f9a4b2871c [0,1,0,0,0,1|2,0,0]=4 3964 B13R1.717 COC(=O)OCN[C@H]1CC[C@H](C1)O 4092f83f11961ae3b004a106c51f84b8 [0,1,0,0,0,1|2,0,0]=4 3965 B13R1.717 COC(=O)OCOC1CCC(C1)C 944335941ac87500bf2bf774410eb0c1 [0,1,0,0,0,1|2,0,0]=4 3966 B13R1.717 COC(=O)OCOC1CCC(C1)F 3b94837e7f8baa943e612b43df1e6d31 [0,1,0,0,0,1|2,0,0]=4 3967 B13R1.1110 C=C(C)C(=O)NCCC1CCCO1 b0148cec32979ce6ff9060986669341c [0,1,0,0,0,1|1,0,1]=4 3968 B13R1.1110 CC(=O)C(=O)CNCC1CCCO1 b1a2692a0fb5c9e381c4cffd49524227 [0,1,0,0,0,1|1,0,1]=4 3969 B13R1.1110 CC(=O)C(=O)CNC[C@@H]1CCCO1 6dd4cb7e5bd10f1884cf28678f118a6a [0,1,0,0,0,1|1,0,1]=4 3970 B13R1.1110 CC(=O)C(=O)CNC[C@H]1CCCO1 38277ba47f5bfae61076ed101b2c9c8d [0,1,0,0,0,1|1,0,1]=4 3971 B13R1.1110 CC(=O)C(=O)COCC1CCCC1 e472454a98e01772b255619c000fbdf9 [0,1,0,0,0,1|1,0,1]=4 3972 B13R1.1110 CC(=O)C(=O)COCC1CCCO1 7f94f27d2ddd0923dda1e8d6a7c03117 [0,1,0,0,0,1|0,0,1]=3 3973 B13R1.1110 CC(=O)C(=O)COCC1CCCS1 459483c5225e3eecfb02f05c04bc5661 [0,1,0,0,0,1|0,1,1]=4 3974 B13R1.1110 CC(=O)C(=O)COC[C@@H]1CCCO1 d76c86161d213dfbfaa172aea2f4b0b4 [0,1,0,0,0,1|0,0,1]=3 3975 B13R1.1110 CC(=O)C(=O)COC[C@H]1CCCO1 9c15f942082708d8161f513117a5839b [0,1,0,0,0,1|0,0,1]=3 3976 B13R1.1110 CC(=O)C(=O)NCCC1CCCO1 4ccf80cae35c31654dd4e0e37c760afa [0,1,0,0,0,1|1,0,1]=4 3977 B13R1.1110 CC(C)C(=O)CNCC1CCCC1 906344fe37f94e5d5cd35e1efcae991c [0,1,0,0,0,1|2,0,0]=4 3978 B13R1.1110 CC(C)C(=O)CNCC1CCCO1 069ba1f3f7ba5845abc133a56f833db2 [0,1,0,0,0,1|1,0,0]=3 3979 B13R1.1110 CC(C)C(=O)CNC[C@@H]1CCCO1 55ffc178e44dd5cfb907ad6e5eac7d1c [0,1,0,0,0,1|1,0,0]=3 3980 B13R1.1110 CC(C)C(=O)CNC[C@H]1CCCO1 07ec10f5691bbefab99d3f756ba5f88e [0,1,0,0,0,1|1,0,0]=3 3981 B13R1.1110 CC(C)C(=O)COCC1C=CCC1 079374f1324ad84171e47435e5435a08 [0,1,0,0,0,1|1,0,1]=4 3982 B13R1.1110 CC(C)C(=O)COCC1CCCC1 8708c7556ee335402395af9b91b87b62 [0,1,0,0,0,1|1,0,0]=3 3983 B13R1.1110 CC(C)C(=O)COCC1CCCO1 be596210ac322f30c876239766dd6bf1 [0,1,0,0,0,1|0,0,0]=2 3984 B13R1.1110 CC(C)C(=O)COCC1CCCS1 2ea1530a8ef895b791590860aab35a6c [0,1,0,0,0,1|0,1,0]=3 3985 B13R1.1110 CC(C)C(=O)COCC1CCOC1 c06810d27125ce848d5f8f3c891861f4 [0,1,0,0,0,1|2,0,0]=4 3986 B13R1.1110 CC(C)C(=O)COCN1CCCC1 ba3d37ba95887101482b7ebb72990c23 [0,1,0,0,0,1|2,0,0]=4 3987 B13R1.1110 CC(C)C(=O)COC[C@@H]1CCCO1 38cb02c3d695766a0ac32264d160d866 [0,1,0,0,0,1|0,0,0]=2 3988 B13R1.1110 CC(C)C(=O)COC[C@@H]1CCOC1 cf11dc2fb81f4ffa2b99c3be5c583684 [0,1,0,0,0,1|2,0,0]=4 3989 B13R1.1110 CC(C)C(=O)COC[C@H]1CCCO1 56456ac9f98605e65e5e9e49d808f3e5 [0,1,0,0,0,1|0,0,0]=2 3990 B13R1.1110 CC(C)C(=O)COC[C@H]1CCOC1 c444d21a5a5c2a9dcf3d53e6bb6fabb6 [0,1,0,0,0,1|2,0,0]=4 3991 B13R1.1110 CC(C)C(=O)NCOC1CCCC1 72cfe03e95d3182d16fe1da475ee11ae [0,1,0,0,0,1|2,0,0]=4 3992 B13R1.1110 CC(C)C(=O)OCNC1CCCC1 fd16db9c5decee9d1f11842450f0f048 [0,1,0,0,0,1|1,0,0]=3 3993 B13R1.1110 CC(C)C(=O)OCNC1CCOC1 e36d2e1ecd1a41735efd56c76d070fbb [0,1,0,0,0,1|2,0,0]=4 3994 B13R1.1110 CC(C)C(=O)OCNC1CCSC1 5648d8a6f6eaed7bd2e78ab40f9f3075 [0,1,0,0,0,1|2,0,0]=4 3995 B13R1.1110 CC(C)C(=O)OCN[C@@H]1CCOC1 be6231da3677c8ec722a65ece37fbd11 [0,1,0,0,0,1|2,0,0]=4 3996 B13R1.1110 CC(C)C(=O)OCN[C@H]1CCOC1 32834aac19f4a05b6c9cc931834c41d9 [0,1,0,0,0,1|2,0,0]=4 3997 B13R1.1110 CC(C)C(=O)OCOC1C=CCC1 fcbbbd36470497aaae924ef60f9ddc43 [0,1,0,0,0,1|1,0,1]=4 3998 B13R1.1110 CC(C)C(=O)OCOC1CCCC1 bcd9f1217a23805aed7e46187ba0cea2 [0,1,0,0,0,1|1,0,0]=3 3999 B13R1.1110 CC(C)C(=O)OCOC1CCCO1 feebfd8b70e23cf413b8a3b8164065b8 [0,1,0,0,0,1|0,0,0]=2 4000 B13R1.1110 CC(C)C(=O)OCOC1CCOC1 13e12c90d298552f713767eb2c0b864e [0,1,0,0,0,1|2,0,0]=4 4001 B13R1.1110 CC(C)C(=O)OCOC1CCSC1 f4352186c2f48d0d0e76d0118465a9b0 [0,1,0,0,0,1|2,0,0]=4 4002 B13R1.1110 CC(C)C(=O)OCO[C@@H]1CCOC1 d32f8a6191d586f03316dc5ddc3f8a64 [0,1,0,0,0,1|2,0,0]=4 4003 B13R1.1110 CC(C)C(=O)OCO[C@@H]1CCSC1 5aafa773b94455d84a465dd192a7086a [0,1,0,0,0,1|2,0,0]=4 4004 B13R1.1110 CC(C)C(=O)OCO[C@H]1CCOC1 852b2d3f7974d74a5439fbf0e5c831ab [0,1,0,0,0,1|2,0,0]=4 4005 B13R1.1110 CC(C)C(=O)OCO[C@H]1CCSC1 485b877d0ba439d467db621ebbfed4dc [0,1,0,0,0,1|2,0,0]=4 4006 B13R1.1110 CC(C)C(C)COCC1CCCO1 44e2a5fab4cec629dc7a800faff879c5 [0,1,0,0,0,1|1,0,1]=4 4007 B13R1.1110 CC(C)C(C)COC[C@@H]1CCCO1 a3f44007490398bf33c2c1203a043c1f [0,1,0,0,0,1|1,0,1]=4 4008 B13R1.1110 CC(C)C(C)COC[C@H]1CCCO1 758e0da31d1cd185d612617dbd37ac8d [0,1,0,0,0,1|1,0,1]=4 4009 B13R1.1110 CC(C)C(C)OCCC1CCCO1 79b5b03bcb3d93808b61e59c7a3bc484 [0,1,0,0,0,1|1,0,1]=4 4010 B13R1.1110 CC(C)[C@@H](C)OCCC1CCCO1 fb8d85a4ef34a4b37fd87f819792d53b [0,1,0,0,0,1|1,0,1]=4 4011 B13R1.1110 CC(C)[C@H](C)OCCC1CCCO1 cd7a135225dd5db34480b972b3628964 [0,1,0,0,0,1|1,0,1]=4 4012 B13R1.1110 CC(F)C(=O)NCCC1CCCC1 2ac54b97fdea4fed50cfe12a0cd3dd71 [0,1,0,0,0,1|2,0,0]=4 4013 B13R1.1110 CC(F)C(=O)NCCC1CCCO1 684c451b3f299c16c9e489237d7f2701 [0,1,0,0,0,1|1,0,0]=3 4014 B13R1.1110 CC(O)C(=O)NCCC1CCCC1 d62d085705996f93a2f8e50bfc14c3ef [0,1,0,0,0,1|2,0,0]=4 4015 B13R1.1110 CC(O)C(=O)NCCC1CCCO1 417b29e57906a077a02692b253d7104b [0,1,0,0,0,1|1,0,0]=3 4016 B13R1.1110 CC(S)C(=O)NCCC1CCCC1 0b40a553ee30d0b92b3aff1d217dcfb6 [0,1,0,0,0,1|2,0,0]=4 4017 B13R1.1110 CC(S)C(=O)NCCC1CCCO1 9abe2b17db3d2994a14f94ba7caad0b1 [0,1,0,0,0,1|1,0,0]=3 4018 B13R1.1110 CC(S)C(C)OCCC1CCCO1 70801eb89ab6f382ad9594ff4fcb8f3d [0,1,0,0,0,1|1,0,1]=4 4019 B13R1.1110 CN(C)C(=O)CCOC1CCCO1 e4c77cf3d0b332a4cfc5838fe6a4e084 [0,1,0,0,0,1|2,0,0]=4 4020 B13R1.1110 CN(C)C(=O)CNCC1CCCO1 2d1bb97e5d96efe3f73f74a5c06c16cf [0,1,0,0,0,1|2,0,0]=4 4021 B13R1.1110 CN(C)C(=O)CNC[C@@H]1CCCO1 5911b3813c0db6b6942c4b5016583895 [0,1,0,0,0,1|2,0,0]=4 4022 B13R1.1110 CN(C)C(=O)CNC[C@H]1CCCO1 10c6d50461fca69eedabce9ac45f26b1 [0,1,0,0,0,1|2,0,0]=4 4023 B13R1.1110 CN(C)C(=O)COCC1CCCC1 356769986b784baf2526739c631c4257 [0,1,0,0,0,1|2,0,0]=4 4024 B13R1.1110 CN(C)C(=O)COCC1CCCO1 380699ff1b9d469a1879942550d5a5ab [0,1,0,0,0,1|1,0,0]=3 4025 B13R1.1110 CN(C)C(=O)COCC1CCCS1 103cf8517dfff02dd72742bebd7f3e2c [0,1,0,0,0,1|1,1,0]=4 4026 B13R1.1110 CN(C)C(=O)COC[C@@H]1CCCO1 bb0592d066f6aee282a1cad04fb2b168 [0,1,0,0,0,1|1,0,0]=3 4027 B13R1.1110 CN(C)C(=O)COC[C@H]1CCCO1 65161b1353ba355b0905e5847b839852 [0,1,0,0,0,1|1,0,0]=3 4028 B13R1.1110 C[C@@H](F)C(=O)NCCC1CCCC1 90fe0e4b4244ec269755a6dd766a281d [0,1,0,0,0,1|2,0,0]=4 4029 B13R1.1110 C[C@@H](F)C(=O)NCCC1CCCO1 986f4cdcc6c151e3c770c49dcce14c71 [0,1,0,0,0,1|1,0,0]=3 4030 B13R1.1110 C[C@@H](O)C(=O)NCCC1CCCC1 05d462f49bd978246d2f97d2d7d3c955 [0,1,0,0,0,1|2,0,0]=4 4031 B13R1.1110 C[C@@H](O)C(=O)NCCC1CCCO1 648d334e3c4537ae5229c760c3a2d7a9 [0,1,0,0,0,1|1,0,0]=3 4032 B13R1.1110 C[C@H](F)C(=O)NCCC1CCCC1 df09af44100550a117b24c1e2e77eb53 [0,1,0,0,0,1|2,0,0]=4 4033 B13R1.1110 C[C@H](F)C(=O)NCCC1CCCO1 75634d6a603eee8b3f5f951ea6cfb7c6 [0,1,0,0,0,1|1,0,0]=3 4034 B13R1.1110 C[C@H](O)C(=O)NCCC1CCCC1 2ac97c54fa73ce9842aebe612641c377 [0,1,0,0,0,1|2,0,0]=4 4035 B13R1.1110 C[C@H](O)C(=O)NCCC1CCCO1 818201c139a9e909d7ef89a211381991 [0,1,0,0,0,1|1,0,0]=3 4036 B13R1.1110 O=C(CNCC1CCCO1)C(F)F d1dda813bdd4a256c0453e37a9b9f850 [0,1,0,0,0,1|2,0,0]=4 4037 B13R1.1110 O=C(CNC[C@@H]1CCCO1)C(F)F 34d428fbbe9cb89bf62f23c5b99e3e2c [0,1,0,0,0,1|2,0,0]=4 4038 B13R1.1110 O=C(CNC[C@H]1CCCO1)C(F)F ada1ae5647048409667ccf41c660964c [0,1,0,0,0,1|2,0,0]=4 4039 B13R1.1110 O=C(COCC1CCCC1)C(F)F 7fcd026c375cb77cadf2151d28c61e1f [0,1,0,0,0,1|2,0,0]=4 4040 B13R1.1110 O=C(COCC1CCCO1)C(F)F 2ce30ee9e5a42eb6f272f2c48deea274 [0,1,0,0,0,1|1,0,0]=3 4041 B13R1.1110 O=C(COCC1CCCS1)C(F)F 246eebc461010cd3371e0b187151d896 [0,1,0,0,0,1|1,1,0]=4 4042 B13R1.1110 O=C(COC[C@@H]1CCCO1)C(F)F 2c6380e961af59784a5fbb0c466ca55e [0,1,0,0,0,1|1,0,0]=3 4043 B13R1.1110 O=C(COC[C@H]1CCCO1)C(F)F 1dfe53060fcf85c68edcbd30ff5a7c73 [0,1,0,0,0,1|1,0,0]=3 4044 B13R1.1110 O=C(NCCC1CCCO1)C(F)F fdf981e1323f7863f23d91ab6dda3f70 [0,1,0,0,0,1|2,0,0]=4 4045 B13R1.1110 O=C(NCCC1CCCO1)C(O)O 447e13dedaa1b7a2a5e3d534b63c2650 [0,1,0,0,0,1|2,0,0]=4 4046 B13R1.1110 O=C(O)C(=O)COCC1CCCO1 aecd38c69716d7d0ec1f0125cdf65e01 [0,1,0,0,0,1|1,0,1]=4 4047 B13R1.1110 O=C(O)C(=O)COC[C@@H]1CCCO1 89a09f32ca5935445b49f22a8be325fc [0,1,0,0,0,1|1,0,1]=4 4048 B13R1.1110 O=C(O)C(=O)COC[C@H]1CCCO1 f47e15d57106e76210021968db78b8d8 [0,1,0,0,0,1|1,0,1]=4 4049 B13R1.2062 C=C(CC)CNCC1(CCCO1)C 783d794d6d6425a3ec34ee91079360bb [0,1,0,0,0,1|2,0,0]=4 4050 B13R1.2062 C=C(CC)COCC1(CCCC1)C a8cd371db7b5f75c36bf1600a0afc313 [0,1,0,0,0,1|2,0,0]=4 4051 B13R1.2062 C=C(CC)COCC1(CCCC1)F 0d77da4f98b3badc8945e0fd7547dfac [0,1,0,0,0,1|2,0,0]=4 4052 B13R1.2062 C=C(CC)COCC1(CCCO1)C baa8717850e8a602c9ff7877b0e97054 [0,1,0,0,0,1|1,0,0]=3 4053 B13R1.2062 C=C(COCC1(CCCO1)C)OC b80dc9b485b855214650ae8293a5ba94 [0,1,0,0,0,1|2,0,0]=4 4054 B13R1.2062 CC1(CCCO1)CNCC(=O)CO fcf9cb8e5c58f940865102b6f75ad7a3 [0,1,0,0,0,1|2,0,0]=4 4055 B13R1.2062 CCC(=O)CNCC1(CCCC1)C 5a6b9857ef6f18b2be2d26f6f8de51c9 [0,1,0,0,0,1|2,0,0]=4 4056 B13R1.2062 CCC(=O)CNCC1(CCCC1)F 30bd335d54a780af71188d01250fb409 [0,1,0,0,0,1|2,0,0]=4 4057 B13R1.2062 CCC(=O)CNCC1(CCCC1)O 5b047224cf0e8000c00c4533bb9e9c4e [0,1,0,0,0,1|2,0,0]=4 4058 B13R1.2062 CCC(=O)CNCC1(CCCO1)C d169e8d65077e37a98b9506c93b02d24 [0,1,0,0,0,1|1,0,0]=3 4059 B13R1.2062 CCC(=O)COCC1(CCCC1)C b09be04ce96434410fd0f619135db87f [0,1,0,0,0,1|1,0,0]=3 4060 B13R1.2062 CCC(=O)COCC1(CCCC1)F d209ec9c7450bbbdde3db16e001343e8 [0,1,0,0,0,1|1,0,0]=3 4061 B13R1.2062 CCC(=O)COCC1(CCCO1)C f400c45501a4e8ec1b5f7c0d9112e84b [0,1,0,0,0,1|0,0,0]=2 4062 B13R1.2062 CCC(=O)COCC1(CCOC1)C d1d0232fd1a369e41fd581339395c119 [0,1,0,0,0,1|2,0,0]=4 4063 B13R1.2062 CCC(=O)COCC1(CCOC1)F 2015d80bfb81660bd3b06bd745a3c003 [0,1,0,0,0,1|2,0,0]=4 4064 B13R1.2062 CCC(=O)COC[C@@]1(CCOC1)C e9602c17a2594744916ca1ead9a3f17d [0,1,0,0,0,1|2,0,0]=4 4065 B13R1.2062 CCC(=O)COC[C@@]1(CCOC1)F 46f8ec77078ca7cf9fdeec28c875fee8 [0,1,0,0,0,1|2,0,0]=4 4066 B13R1.2062 CCC(=O)COC[C@]1(CCOC1)C f1684ced233f69680042bbccf257ee11 [0,1,0,0,0,1|2,0,0]=4 4067 B13R1.2062 CCC(=O)NCCC1(CCCC1)O d32fced94944860b601e7a9939401a11 [0,1,0,0,0,1|2,0,0]=4 4068 B13R1.2062 CCC(=O)OCNC1(CCCC1)C c403cd62a775499017d060f024a3a18f [0,1,0,0,0,1|1,0,0]=3 4069 B13R1.2062 CCC(=O)OCNC1(CCOC1)C fa359da4fb5a9f9c20153e0f653fedf0 [0,1,0,0,0,1|2,0,0]=4 4070 B13R1.2062 CCC(C)COCC1(CCCO1)C 3415b661a8ba11ca5b71edacc96592b2 [0,1,0,0,0,1|1,0,1]=4 4071 B13R1.2062 CC[C@@H](C)COCC1(CCCO1)C 1967cb02c1b128a8471d63c79e9dbac2 [0,1,0,0,0,1|1,0,1]=4 4072 B13R1.2062 CC[C@H](C)COCC1(CCCO1)C 27d48e90e8d1a2844f88ef883302fa9c [0,1,0,0,0,1|1,0,1]=4 4073 B13R1.2062 CNC(=O)CNCC1(CCCO1)C 1f2e24068b88348ed356fe6b1404c979 [0,1,0,0,0,1|2,0,0]=4 4074 B13R1.2062 CNC(=O)COCC1(CCCC1)C 9d5ccf373bbb7ca4a0135339a6eb6d70 [0,1,0,0,0,1|2,0,0]=4 4075 B13R1.2062 CNC(=O)COCC1(CCCC1)F 79e21a52e7464a1d6144ce53cb3c227e [0,1,0,0,0,1|2,0,0]=4 4076 B13R1.2062 CNC(=O)COCC1(CCCO1)C e654cc4f7608d8a6d8ba14adf74549ee [0,1,0,0,0,1|1,0,0]=3 4077 B13R1.2062 COC(=O)CNCC1(CCCO1)C 57bc36a789ce56575652b26ba1ec1b3b [0,1,0,0,0,1|2,0,0]=4 4078 B13R1.2062 COC(=O)COCC1(CCCC1)C 3092e3e9c128f5855175d9f0b2298b6a [0,1,0,0,0,1|2,0,0]=4 4079 B13R1.2062 COC(=O)COCC1(CCCC1)F 2283c1bc942145bd187d0d089df02f76 [0,1,0,0,0,1|2,0,0]=4 4080 B13R1.2062 COC(=O)COCC1(CCCO1)C b01bde14f02c46beb9955d411b2642fa [0,1,0,0,0,1|1,0,0]=3 4081 B13R1.2062 COC(=O)OCNC1(CCCC1)C 380d8f229e599ae846345c14583dc827 [0,1,0,0,0,1|2,0,0]=4 4082 B13R1.33 C#CCC(=O)NC(C)C1CCCO1 0c4b5a27a71d87101da1b324f7c29f32 [0,2,0,0,0,0|1,0,1]=4 4083 B13R1.33 C#CCC(=O)N[C@@H](C)[C@@H]1CCCO1 d68eb664d5b2b055f16cde1c2b434fe0 [0,2,0,0,0,0|1,0,1]=4 4084 B13R1.33 C/C=C/C(=O)NC(C)C1CCCO1 e7097b7dd78e6ad838e1d5e0626021ae [0,2,0,0,0,0|1,0,1]=4 4085 B13R1.33 C/C=C/C(=O)N[C@@H](C)[C@@H]1CCCO1 90e6f808984098c7410cd3005c3b61f3 [0,2,0,0,0,0|1,0,1]=4 4086 B13R1.33 C=CCC(=O)NC(C)C1CCCO1 f6f361bc619d9b6d41c8e90df0f0320d [0,2,0,0,0,0|1,0,1]=4 4087 B13R1.33 C=CCC(=O)N[C@@H](C)[C@@H]1CCCO1 eba9e99e5623f8c1ba8011843ea9ebbd [0,2,0,0,0,0|1,0,1]=4 4088 B13R1.33 CC#CC(=O)NC(C)C1CCCO1 cc9c5d662d125ae5d7d6cbf0b9d2659c [0,2,0,0,0,0|1,0,1]=4 4089 B13R1.33 CC#CC(=O)N[C@@H](C)[C@@H]1CCCO1 833250eb3e321e032fa1eacbb7356d4c [0,2,0,0,0,0|1,0,1]=4 4090 B13R1.33 CC(NC(=O)CC=O)C1CCCO1 216b7a618e87abe4bf3586bae759787c [0,2,0,0,0,0|1,0,1]=4 4091 B13R1.33 CC(NC(=O)CCF)C1CCCC1 5c264dfdc19b94f9cf9b0c5dbc686487 [0,2,0,0,0,0|2,0,0]=4 4092 B13R1.33 CC(NC(=O)CCF)C1CCCO1 afcd2ca11a1d1d7d2c51bfd9958ca5bc [0,2,0,0,0,0|1,0,0]=3 4093 B13R1.33 CC(NC(=O)CCS)C1CCCC1 f3cb50f71d142e26efa67961d3af7a6a [0,2,0,0,0,0|2,0,0]=4 4094 B13R1.33 CC(NC(=O)CCS)C1CCCO1 dbe43e3b439c72adc7ea0026a65bd4f1 [0,2,0,0,0,0|1,0,0]=3 4095 B13R1.33 CC(NC(=O)CON)C1CCCO1 a55990dbd5407b5e2b85afb126dedce4 [0,2,0,0,0,0|2,0,0]=4 4096 B13R1.33 CCCC(=O)NC(C)C1CCCC1 83d78d4b24c0db5517126c423f60f377 [0,2,0,0,0,0|2,0,0]=4 4097 B13R1.33 CCCC(=O)NC(C)C1CCCO1 c5bade17619fc23120fbb7a9adae7f97 [0,2,0,0,0,0|1,0,0]=3 4098 B13R1.33 CCCC(=O)N[C@@H](C)[C@@H]1CCCO1 502e37cf8f55c6c805596b5afb8ac422 [0,2,0,0,0,0|1,0,0]=3 4099 B13R1.33 CCCC(C)O[C@H](C)[C@H]1CCCO1 e871369ba28bd4454e14412d4d3965a2 [0,2,0,0,0,0|1,0,1]=4 4100 B13R1.33 COCC(=O)NC(C)C1CCCC1 a8841f70b01c99b373aa94d4f420e96f [0,2,0,0,0,0|2,0,0]=4 4101 B13R1.33 COCC(=O)NC(C)C1CCCO1 8cc39a499ad67af51c46ad6cd68ba38c [0,2,0,0,0,0|1,0,0]=3 4102 B13R1.33 COCC(=O)N[C@@H](C)[C@@H]1CCCO1 fca4fff828364f3e97594c58b8372987 [0,2,0,0,0,0|1,0,0]=3 4103 B13R1.33 COCC(C)O[C@H](C)[C@H]1CCCO1 76402bf7004609f1cd4dbe9913cdacc2 [0,2,0,0,0,0|1,0,1]=4 4104 B13R1.33 CSCC(=O)NC(C)C1CCCC1 04adbaf09c14d052b68200c0e7b95673 [0,2,0,0,0,0|2,0,0]=4 4105 B13R1.33 C[C@H](NC(=O)CC=O)[C@@H]1CCCO1 365f6cfdf4a5fb439e3d46a00d30f4b0 [0,2,0,0,0,0|1,0,1]=4 4106 B13R1.33 C[C@H](NC(=O)CCF)[C@@H]1CCCO1 f703d3732994278a08765edcdaee31b1 [0,2,0,0,0,0|1,0,0]=3 4107 B13R1.33 C[C@H](NC(=O)CCS)[C@@H]1CCCO1 06606ad6204213869a2fcac6e7602a3b [0,2,0,0,0,0|1,0,0]=3 4108 B13R1.33 C[C@H](NC(=O)CON)[C@@H]1CCCO1 22e137aa725610b916a12250bcc0cc0a [0,2,0,0,0,0|2,0,0]=4 4109 B13R1.65 CCC(C=O)NC(C)C1CCCO1 961b36ad06d5ad151e71cb9504ec137b [0,2,0,0,0,0|1,0,1]=4 4110 B13R1.65 CCC(C=O)N[C@@H](C)[C@@H]1CCCO1 b88c9ddcbe285acc60a37afa1dd523f1 [0,2,0,0,0,0|1,0,1]=4 4111 B13R1.65 CCC(C=O)OC(C)C1CCCC1 7eab10b73ae84b7bfd692601e6ced5ab [0,2,0,0,0,0|1,0,1]=4 4112 B13R1.65 CCC(C=O)O[C@H](C)[C@H]1CCCO1 7f578313b68656efb6f5fdfef61cbcb0 [0,2,0,0,0,0|0,0,1]=3 4113 B13R1.65 CCC(CC)O[C@H](C)[C@H]1CCCO1 007be48d6ca7cfd8d377bd029348c725 [0,2,0,0,0,0|1,0,1]=4 4114 B13R1.339 C=C(C)C(=O)NC(C)C1CCCO1 019050e027ab039e3a4a1a819df1e8c6 [0,2,0,0,0,0|1,0,1]=4 4115 B13R1.339 C=C(C)C(=O)N[C@@H](C)[C@@H]1CCCO1 f35140815c41f8e8931382df5201d01e [0,2,0,0,0,0|1,0,1]=4 4116 B13R1.339 CC(=O)C(=O)NC(C)C1CCCO1 ac2987ad8e9fbdce461e5fb574a8522b [0,2,0,0,0,0|1,0,1]=4 4117 B13R1.339 CC(=O)C(=O)N[C@@H](C)[C@@H]1CCCO1 2aa26e51bf417bb257d8428f3a3512e1 [0,2,0,0,0,0|1,0,1]=4 4118 B13R1.339 CC(C)C(C)O[C@H](C)[C@H]1CCCO1 da67b205241cd58098edccfdaf11bf9c [0,2,0,0,0,0|1,0,1]=4 4119 B13R1.339 CC(F)C(=O)NC(C)C1CCCC1 f43d790ce42bd8f62f1a8b2f8b2f14ba [0,2,0,0,0,0|2,0,0]=4 4120 B13R1.339 CC(NC(=O)C(F)F)C1CCCO1 e92c67561aa85b2b6e58098956ebe5ae [0,2,0,0,0,0|2,0,0]=4 4121 B13R1.339 CC(NC(=O)C(O)O)C1CCCO1 0c2df6a3e4e579ef22818776c5d6dba1 [0,2,0,0,0,0|2,0,0]=4 4122 B13R1.339 CC(NC(=O)[C@@H](C)F)C1CCCC1 9046b3e9b850c7ae1d75e6872324148b [0,2,0,0,0,0|2,0,0]=4 4123 B13R1.339 CC(NC(=O)[C@@H](C)O)C1CCCC1 50af6493d7e9ba32cf2961a90dfc10b3 [0,2,0,0,0,0|2,0,0]=4 4124 B13R1.339 CC(NC(=O)[C@@H](C)O)C1CCCO1 a604cd3059efb21e846cc0ae4a385507 [0,2,0,0,0,0|1,0,0]=3 4125 B13R1.339 CC(NC(=O)[C@H](C)F)C1CCCC1 64162477439a1a164178fb3284f0f694 [0,2,0,0,0,0|2,0,0]=4 4126 B13R1.339 CC(NC(=O)[C@H](C)O)C1CCCC1 54131d00830fb9692a6c336f68ed8623 [0,2,0,0,0,0|2,0,0]=4 4127 B13R1.339 CC(NC(=O)[C@H](C)O)C1CCCO1 1f82dee2d939bf3a186b81b60c896f1b [0,2,0,0,0,0|1,0,0]=3 4128 B13R1.339 CC(O)C(=O)NC(C)C1CCCC1 60bf366cf156491525ba862b027fff90 [0,2,0,0,0,0|2,0,0]=4 4129 B13R1.339 CC(O)C(=O)NC(C)C1CCCO1 ecbb301a6d60d9ec2b9c94ea2d47bf09 [0,2,0,0,0,0|1,0,0]=3 4130 B13R1.339 CC(O)C(=O)N[C@@H](C)[C@@H]1CCCO1 e719a5eaaa09f01b2cb8f850ff3b48c7 [0,2,0,0,0,0|1,0,0]=3 4131 B13R1.339 CC(S)C(=O)NC(C)C1CCCC1 d965fc35e79bf5c1410b724d42cd372e [0,2,0,0,0,0|2,0,0]=4 4132 B13R1.339 CC(S)C(=O)NC(C)C1CCCO1 b29a6aebe6020a05e61cb09fb0809a2d [0,2,0,0,0,0|1,0,0]=3 4133 B13R1.339 CC(S)C(=O)N[C@@H](C)[C@@H]1CCCO1 9c085349acc228fa4c3a95bd5ab78a45 [0,2,0,0,0,0|1,0,0]=3 4134 B13R1.339 C[C@H](NC(=O)C(F)F)[C@@H]1CCCO1 4a58ba991d87403b9f1e3615b84b0741 [0,2,0,0,0,0|2,0,0]=4 4135 B13R1.339 C[C@H](NC(=O)C(O)O)[C@@H]1CCCO1 4d40f22afdc9e0b48dd03da62782cb42 [0,2,0,0,0,0|2,0,0]=4 4136 B13R1.339 C[C@H](NC(=O)[C@@H](C)O)[C@@H]1CCCO1 9fdb71993eac98c9974844ca3657e53d [0,2,0,0,0,0|1,0,0]=3 4137 B13R1.339 C[C@H](O)C(=O)N[C@@H](C)[C@@H]1CCCO1 eabb6ee3d76d2e83e0778c94936e591c [0,2,0,0,0,0|1,0,0]=3 4138 B13R1.2873 CCC(=O)NC(CC)C1CCCC1 b69a028ef7737811895a0d189854b4fe [0,2,0,0,0,0|2,0,0]=4 4139 B13R1.2873 CCC(=O)NC(CO)C1CCCC1 045dac0d058a3a929ddf29486f5387da [0,2,0,0,0,0|2,0,0]=4 4140 B13R1.2873 CCC(=O)N[C@@H](CO)C1CCCC1 692c0d1e5a622e610ba991242a8950c2 [0,2,0,0,0,0|2,0,0]=4 4141 B13R1.2873 CCC(=O)N[C@H](CO)C1CCCC1 7627417a35a8d4dc592adce501b6bc3d [0,2,0,0,0,0|2,0,0]=4 4142 B13R1.41 CCCC(=O)NCC1CCC(C1)O 37f851fb85b853d43febb8c34a3c8bda [0,2,0,0,0,0|2,0,0]=4 4143 B13R1.41 CCCC(=O)OCN1CCC(C1)C 4ad345bfb335c6326a8c09354e6427d7 [0,2,0,0,0,0|2,0,0]=4 4144 B13R1.41 CCCC(=O)OCN1CCC(C1)O 6aed6cfb74a692903610afeb40ad85da [0,2,0,0,0,0|2,0,0]=4 4145 B13R1.41 CCCC(=O)OCN1CC[C@@H](C1)O ec584588942e8b7517525d0b5708d755 [0,2,0,0,0,0|2,0,0]=4 4146 B13R1.41 CCCC(=O)OCN1CC[C@H](C1)O b20513f592b7d27bafabf2c66fe6522f [0,2,0,0,0,0|2,0,0]=4 4147 B13R1.41 CCCC(=S)OCC1CCC(=O)O1 dc0da3bda80260a049033455fe175e8e [0,2,0,0,0,0|0,1,1]=4 4148 B13R1.41 CCCC(C)OCC1CCC(O1)C 5eef478e06e424eea3329f40af83e23f [0,2,0,0,0,0|1,0,1]=4 4149 B13R1.41 CCCC(C)OC[C@@H]1CC[C@@H](O1)C c20dd2c4548fc886a9133d43d16f7943 [0,2,0,0,0,0|1,0,1]=4 4150 B13R1.41 CCOC(=O)OCN1CCC(C1)C bf58426e664a12555a7c85a02e357b92 [0,2,0,0,0,0|2,0,0]=4 4151 B13R1.41 CCOC(=O)OCN1CCC(C1)F 1342fba706f1f747a87edb7c9957bd95 [0,2,0,0,0,0|2,0,0]=4 4152 B13R1.41 CCOC(=O)OCN1CCC(C1)O 787b428f8a032f5739f1c309762b149f [0,2,0,0,0,0|2,0,0]=4 4153 B13R1.41 CCOC(=O)OCN1CC[C@@H](C1)F 4e707dfe9df557ad4fcb6710ca314e02 [0,2,0,0,0,0|2,0,0]=4 4154 B13R1.41 CCOC(=O)OCN1CC[C@@H](C1)O 540d606e19a68411f284c778eb42d4d5 [0,2,0,0,0,0|2,0,0]=4 4155 B13R1.41 CCOC(=O)OCN1CC[C@H](C1)F d13504ed6a32c476a77eedf4124828d0 [0,2,0,0,0,0|2,0,0]=4 4156 B13R1.41 CCOC(=O)OCN1CC[C@H](C1)O 2b663bec045872d86a98ff42a43e876e [0,2,0,0,0,0|2,0,0]=4 4157 B13R1.41 CCSC(=O)OCN1CCC(C1)C 043054eb1f224b343ff82d66c4d26e8b [0,2,0,0,0,0|2,0,0]=4 4158 B13R1.41 CCSC(=O)OCN1CCC(C1)F e7e60d11612202ad40854160c1cbb71b [0,2,0,0,0,0|2,0,0]=4 4159 B13R1.41 CCSC(=O)OCN1CCC(C1)O d454a7043ad97ad2fd0578895e480a0a [0,2,0,0,0,0|2,0,0]=4 4160 B13R1.41 CCSC(=O)OCN1CC[C@@H](C1)F 141488f43bf1cfb594351411cc75f444 [0,2,0,0,0,0|2,0,0]=4 4161 B13R1.41 CCSC(=O)OCN1CC[C@@H](C1)O 9ca858a5d0536682b3bdbe6b1625bd42 [0,2,0,0,0,0|2,0,0]=4 4162 B13R1.41 CCSC(=O)OCN1CC[C@H](C1)F b63fc91cd2a36e0e9f87994acf581d78 [0,2,0,0,0,0|2,0,0]=4 4163 B13R1.41 CCSC(=O)OCN1CC[C@H](C1)O d78afaa07d7a52a3328d619db3f5cbca [0,2,0,0,0,0|2,0,0]=4 4164 B13R1.41 COCC(=O)NCC1CCC(C1)O 2136899d191e75bfeb9ea4894fed285f [0,2,0,0,0,0|2,0,0]=4 4165 B13R1.41 COCC(C)OCC1CCC(O1)C 4cc3ef41452c39317ad2e816dd99d592 [0,2,0,0,0,0|1,0,1]=4 4166 B13R1.41 COCC(C)OC[C@@H]1CC[C@@H](O1)C 173e8435221f2b972fe42d0e40963e9e [0,2,0,0,0,0|1,0,1]=4 4167 B13R1.41 CSCC(=O)NCC1CCC(C1)O 7c8badd31c00c3c624ae64c52cb5bdf5 [0,2,0,0,0,0|2,0,0]=4 4168 B13R1.41 O=C(CCF)NCC1CCC(C1)O 990a4d6bcc6a1963fb48effb57a08c74 [0,2,0,0,0,0|2,0,0]=4 4169 B13R1.41 O=C(CCO)NCC1CCC(C1)O b1132d69b4a691e319b81fdeff2a701d [0,2,0,0,0,0|2,0,0]=4 4170 B13R1.41 O=C(CCS)NCC1CCC(C1)O 40c834cb64581411e8f13f043305a235 [0,2,0,0,0,0|2,0,0]=4 4171 B13R1.61 C#CC1CCN(C1)COC(=O)CC 06b8954799bd6d5fb95ebb0b40fb6bc0 [0,2,0,0,0,0|2,0,0]=4 4172 B13R1.61 C=CC1CCN(C1)COC(=O)CC 2eec3e89eab417da993ae80b9170e282 [0,2,0,0,0,0|2,0,0]=4 4173 B13R1.61 CCC(=O)OCN1CCC(C1)C#N f15743d609cad2c6e6b9f66f37fbba1e [0,2,0,0,0,0|2,0,0]=4 4174 B13R1.61 CCC(=O)OCN1CCC(C1)CC dfdb694c3ee020b20302cb514a84d2c1 [0,2,0,0,0,0|2,0,0]=4 4175 B13R1.61 CCC(=O)OCN1CCC(C1)CO 6512a9913b4576d0df3d93043869f39c [0,2,0,0,0,0|2,0,0]=4 4176 B13R1.61 CCC(=O)OCN1CCC(C1)OC 8b0bc20523b13874bb0e6832bef02ba8 [0,2,0,0,0,0|2,0,0]=4 4177 B13R1.61 CCC(=O)OCN1CC[C@@H](C1)C#N 04e1d02fc9e7afb6680df1cfb6806cff [0,2,0,0,0,0|2,0,0]=4 4178 B13R1.61 CCC(=O)OCN1CC[C@@H](C1)CO 7c51a8e553db9ae2e96cef59a640e409 [0,2,0,0,0,0|2,0,0]=4 4179 B13R1.61 CCC(=O)OCN1CC[C@@H](C1)OC 4e98a564ea58f810a4f6ab06d9dc668f [0,2,0,0,0,0|2,0,0]=4 4180 B13R1.61 CCC(=O)OCN1CC[C@H](C1)C#N 1b0e55e15839016f258f56b338ac248c [0,2,0,0,0,0|2,0,0]=4 4181 B13R1.61 CCC(=O)OCN1CC[C@H](C1)CO c9eac47bbf3073646b454f85d6c09f30 [0,2,0,0,0,0|2,0,0]=4 4182 B13R1.61 CCC(=O)OCN1CC[C@H](C1)OC e91500afae0b88bc4507a6f6c4b22700 [0,2,0,0,0,0|2,0,0]=4 4183 B13R1.416 CCC(C=O)OCC1CCC(=O)O1 d557daca7e64d6617c91a5af6b4414d8 [0,2,0,0,0,0|0,0,2]=4 4184 B13R1.416 CCC(C=O)OCC1CCC(C1)C 7e18c5bdf1ec5291bce68e37633b6f31 [0,2,0,0,0,0|1,0,1]=4 4185 B13R1.416 CCC(C=O)OCC1CCC(C1)F e823124f3fac09cf14e2d6c51a0bc4e8 [0,2,0,0,0,0|1,0,1]=4 4186 B13R1.416 CCC(C=O)OCC1CCC(O1)C ed6a0626dd37454a51b5fdcf67931c60 [0,2,0,0,0,0|0,0,1]=3 4187 B13R1.416 CCC(C=O)OC[C@@H]1CCC(=O)O1 32f6e2c0bef4911bb2d9ef139be60131 [0,2,0,0,0,0|0,0,2]=4 4188 B13R1.416 CCC(C=O)OC[C@@H]1CC[C@@H](O1)C 125c639b7b379e6e30c325b50d92dc44 [0,2,0,0,0,0|0,0,1]=3 4189 B13R1.416 CCC(C=O)OC[C@@H]1CC[C@H](C1)F a8b5ec39e229a8bed4bf7c413c8a9b6d [0,2,0,0,0,0|1,0,1]=4 4190 B13R1.416 CCC(C=O)OC[C@H]1CCC(=O)O1 7c149d8302878d79fb61aff162cd7217 [0,2,0,0,0,0|0,0,2]=4 4191 B13R1.416 CCC(C=O)OC[C@H]1CC[C@H](C1)F 72040f330cf01a5185bd93f71cd77de1 [0,2,0,0,0,0|1,0,1]=4 4192 B13R1.416 CCC(CC)OCC1CCC(O1)C 289ec3d0b4beaeb4fc320510f0cc76b6 [0,2,0,0,0,0|1,0,1]=4 4193 B13R1.416 CCC(CC)OC[C@@H]1CC[C@@H](O1)C 21f7d05900ed8a304b6d482957042e22 [0,2,0,0,0,0|1,0,1]=4 4194 B13R1.596 CCC(=O)OCN1C[C@@H](C[C@@H]1C)F 7cd8f17b58dac49364b910336172dc41 [0,2,0,0,0,0|2,0,0]=4 4195 B13R1.596 CCC(=O)OCN1C[C@@H](C[C@@H]1C)O 7bc99d8807085ce1865757fd162915c1 [0,2,0,0,0,0|2,0,0]=4 4196 B13R1.596 CCC(=O)OCN1C[C@@H](C[C@H]1C)F 19c4407505d5c898bb55da437daacaad [0,2,0,0,0,0|2,0,0]=4 4197 B13R1.596 CCC(=O)OCN1C[C@@H](C[C@H]1C)O b5370318b03b5b7e7318048c1f7f4be6 [0,2,0,0,0,0|2,0,0]=4 4198 B13R1.596 CCC(=O)OCN1C[C@H](C[C@@H]1C)F c94c3ac8a3ddf1c2dd7bb9580a745b6b [0,2,0,0,0,0|2,0,0]=4 4199 B13R1.596 CCC(=O)OCN1C[C@H](C[C@@H]1C)O 377457074ff8f2c0e0712715ecd26d86 [0,2,0,0,0,0|2,0,0]=4 4200 B13R1.596 CCC(=O)OCN1C[C@H](C[C@H]1C)F 23df2dfc4e9b4c74fc55323f9d0a5063 [0,2,0,0,0,0|2,0,0]=4 4201 B13R1.596 CCC(=O)OCN1C[C@H](C[C@H]1C)O c9eac8a95c2e8b8b6cd96d1fa37e84c3 [0,2,0,0,0,0|2,0,0]=4 4202 B13R1.597 CCC(=O)OCN1CC(C(C1)Br)O bd8dec9bc0257e2c81fb9f2a310671bc [0,2,0,0,0,0|2,0,0]=4 4203 B13R1.597 CCC(=O)OCN1CC(C(C1)O)C f5120598c591710930d4199f059c66bf [0,2,0,0,0,0|2,0,0]=4 4204 B13R1.597 CCC(=O)OCN1C[C@@H]([C@H](C1)O)O 7736353eea15082ef08cea588e872196 [0,2,0,0,0,0|2,0,0]=4 4205 B13R1.597 CCC(=O)OCN1C[C@H]([C@@H](C1)F)O 4c9cefe9cb95c1d14f6b83edde6c381f [0,2,0,0,0,0|2,0,0]=4 4206 B13R1.597 CCC(=O)OCN1C[C@H]([C@@H](C1)O)O 8d67d4816fd12c82e6959bf123bd278a [0,2,0,0,0,0|2,0,0]=4 4207 B13R1.597 CCC(=O)OCN1C[C@H]([C@H](C1)O)C 3690b90e897f20ab4834690fef28271f [0,2,0,0,0,0|2,0,0]=4 4208 B13R1.597 CCC(=O)OCN1C[C@H]([C@H](C1)O)O 2511a440f2b155e1b43fa675b145ec84 [0,2,0,0,0,0|2,0,0]=4 4209 B13R1.2038 CCC(=O)OCN1CCC(C1C)O c650b6fc372aa6babf5f17872ceeb3a6 [0,2,0,0,0,0|2,0,0]=4 4210 B13R1.2038 CCC(=O)OCN1CC[C@@H]([C@@H]1C)O 08a69fc6d6d21e64ec31cccb84584e6b [0,2,0,0,0,0|2,0,0]=4 4211 B13R1.2038 CCC(=O)OCN1CC[C@H]([C@H]1C)O 90cb564faa1becb0bec1c961e7a2923a [0,2,0,0,0,0|2,0,0]=4 4212 B13R1.2039 CC1(CCC(O1)CNC(=O)CF)C e8145ced88c88b37b66186d658dceefa [0,2,0,0,0,0|2,0,0]=4 4213 B13R1.2039 CC1(CCC(O1)CNC(=O)CO)C c64e8e275859b1643c043658d7dbe397 [0,2,0,0,0,0|2,0,0]=4 4214 B13R1.2039 CC1(CCC(O1)CNC(=O)CS)C 53b5ce43ce959c5ee5be668735e41db3 [0,2,0,0,0,0|2,0,0]=4 4215 B13R1.2039 CC1(CC[C@@H](O1)CNC(=O)CF)C 34e11241244844db8346598684b0c661 [0,2,0,0,0,0|2,0,0]=4 4216 B13R1.2039 CC1(CC[C@@H](O1)CNC(=O)CO)C e61fa040f0b323f2668ea38147299215 [0,2,0,0,0,0|2,0,0]=4 4217 B13R1.2039 CC1(CC[C@@H](O1)CNC(=O)CS)C 3a50e03c1518eac14458633af5e9dee7 [0,2,0,0,0,0|2,0,0]=4 4218 B13R1.2039 CCC(=O)NCC1CCC(C1)(F)F 40cc11fa8b453f247f7f1f2ab106a1e7 [0,2,0,0,0,0|2,0,0]=4 4219 B13R1.2039 CCC(=O)NCC1CCC(O1)(C)C 99e6bff08c385ff5de67785701c6c112 [0,2,0,0,0,0|1,0,0]=3 4220 B13R1.2039 CCC(=O)NC[C@@H]1CCC(C1)(F)F eb40ee7810f343db5a771dd5fe0fdd52 [0,2,0,0,0,0|2,0,0]=4 4221 B13R1.2039 CCC(=O)NC[C@H]1CCC(C1)(F)F 085265fbcbea7888a4d1e74814050dc6 [0,2,0,0,0,0|2,0,0]=4 4222 B13R1.2039 CCC(=O)NC[C@H]1CCC(O1)(C)C 6dc6f9b160f70b98a03c142d9756e964 [0,2,0,0,0,0|1,0,0]=3 4223 B13R1.2039 CCC(=O)OCN1CCC(C1)(C)C 21aba43c2f451d033335ef05b3c29dab [0,2,0,0,0,0|2,0,0]=4 4224 B13R1.2039 CCC(=O)OCN1CCC(C1)(C)F 6f0189cd1a7e04504c4bc9ed2bcc820b [0,2,0,0,0,0|2,0,0]=4 4225 B13R1.2039 CCC(=O)OCN1CCC(C1)(C)O ad0500478e4f18ad6496f9ec16ad07a6 [0,2,0,0,0,0|2,0,0]=4 4226 B13R1.2039 CCC(=O)OCN1CCC(C1)(F)F d200b1f9f94841db72b994d2b0235c7a [0,2,0,0,0,0|2,0,0]=4 4227 B13R1.2039 CCC(=O)OCN1CC[C@@](C1)(C)O f0d50773fe3176dfc66425f83da78ffe [0,2,0,0,0,0|2,0,0]=4 4228 B13R1.2039 CCC(=O)OCN1CC[C@](C1)(C)O 4c985bf86ed5153229de94c76901fe2d [0,2,0,0,0,0|2,0,0]=4 4229 B13R1.2039 CCC(C)OCC1CC(CO1)(C)C d9c6e6ebdc3f0f646456dad5c769804f [0,2,0,0,0,0|1,0,1]=4 4230 B13R1.2039 CCC(C)OCC1CCC(O1)(C)C dff41befb10de37cbdb4f779d099343e [0,2,0,0,0,0|1,0,1]=4 4231 B13R1.2039 CCC(C)OC[C@@H]1CCC(O1)(C)C 9bb9b808bacda5a3daa08d95e2d4b0e8 [0,2,0,0,0,0|1,0,1]=4 4232 B13R1.2039 CCC(C)OC[C@H]1CCC(O1)(C)C 8e156e91d82c7abba66ac1b90201b5ce [0,2,0,0,0,0|1,0,1]=4 4233 B13R1.3425 CC(C)C(=O)OCN1CCC(C1)F ea4ba758a66d40104736910ac9d21096 [0,2,0,0,0,0|2,0,0]=4 4234 B13R1.3425 CC(C)C(=O)OCN1CCC(C1)O 3e59daa7593f3a52e4d2f280c85dae5e [0,2,0,0,0,0|2,0,0]=4 4235 B13R1.3425 CC(C)C(=O)OCN1CC[C@@H](C1)F ed3bf52c7d0ab69b8a078da7ef4925cc [0,2,0,0,0,0|2,0,0]=4 4236 B13R1.3425 CC(C)C(=O)OCN1CC[C@@H](C1)O 09c9cfbd40cf14738e745ab893a4ce12 [0,2,0,0,0,0|2,0,0]=4 4237 B13R1.3425 CC(C)C(=O)OCN1CC[C@H](C1)F d7fce5acc74752dba63a87390d082496 [0,2,0,0,0,0|2,0,0]=4 4238 B13R1.3425 CC(C)C(=O)OCN1CC[C@H](C1)O 6696d7a067a397e0f24fe9e834c5e64a [0,2,0,0,0,0|2,0,0]=4 4239 B13R1.3425 CC(C)C(C)OC[C@@H]1CC[C@@H](O1)C 8ca7a81efd23c62b8bae3404536caf80 [0,2,0,0,0,0|1,0,1]=4 4240 B13R1.3425 CC(F)C(=O)NCC1CCC(C1)O 9ad576d6631fbf23b796d3109bb49142 [0,2,0,0,0,0|2,0,0]=4 4241 B13R1.3425 CC(O)C(=O)NCC1CCC(C1)O 299875b6266096b1d66ee3de0e5e6ec3 [0,2,0,0,0,0|2,0,0]=4 4242 B13R1.3425 CC(S)C(=O)NCC1CCC(C1)O a765fbdcbd118339e0a4aef22e93f907 [0,2,0,0,0,0|2,0,0]=4 4243 B13R1.3425 CC1CCC(O1)COC(C)C(C)C e656b6e89bf6334d29220ea1f31ef2fd [0,2,0,0,0,0|1,0,1]=4 4244 B13R1.3425 CC1CCN(C1)COC(=O)C(C)C 985a92c6e00626d0aa6afe18e9d35b9e [0,2,0,0,0,0|2,0,0]=4 4245 B13R1.3425 C[C@@H](F)C(=O)NCC1CCC(C1)O cad722b350fdb66d9fd6f69516427610 [0,2,0,0,0,0|2,0,0]=4 4246 B13R1.3425 C[C@@H](O)C(=O)NCC1CCC(C1)O 4b7af54c9ae0ab25a8e3e365d9b7e690 [0,2,0,0,0,0|2,0,0]=4 4247 B13R1.3425 C[C@H](F)C(=O)NCC1CCC(C1)O 178134ef08e2b611ebc28bca8bff70dc [0,2,0,0,0,0|2,0,0]=4 4248 B13R1.3425 C[C@H](O)C(=O)NCC1CCC(C1)O 14c302732d3bd2710b55f3935e3c9a8d [0,2,0,0,0,0|2,0,0]=4 4249 B13R1.66 C#CCC(=O)N(C)CC1CCCO1 ee536321197a6b3345bb49b221865468 [0,2,0,0,0,0|1,0,1]=4 4250 B13R1.66 C/C=C/C(=O)N(C)CC1CCCO1 c8d8aa199cb2bdb34250fd4cb3abf95f [0,2,0,0,0,0|1,0,1]=4 4251 B13R1.66 C=CCC(=O)N(C)CC1CCCO1 8aaf82ad908774b9608483c8a14d9f4f [0,2,0,0,0,0|1,0,1]=4 4252 B13R1.66 CC#CC(=O)N(C)CC1CCCO1 e1446e96004db81b7052ae762e2ef794 [0,2,0,0,0,0|1,0,1]=4 4253 B13R1.66 CCCC(=O)N(C)CC1CCCC1 f33851383d522ad4182f9d9d8adc76cc [0,2,0,0,0,0|2,0,0]=4 4254 B13R1.66 CCCC(=O)N(C)CC1CCCO1 819d6c9e15c7e6ec73a8acfe8fce922f [0,2,0,0,0,0|1,0,0]=3 4255 B13R1.66 CCNC(=O)C(C)OC1CCCO1 8ed666e76c1f5d64e40a8f924a42a5a9 [0,2,0,0,0,0|2,0,0]=4 4256 B13R1.66 CCOC(=O)C(C)OC1CCCO1 28fa5654adb141dc6972d05d6c3f314d [0,2,0,0,0,0|2,0,0]=4 4257 B13R1.66 CCOC(=O)C(F)OC1CCCO1 a9d81a08d751816610b85a2f0abe4294 [0,2,0,0,0,0|2,0,0]=4 4258 B13R1.66 CCOC(=O)[C@@H](C)OC1CCCO1 dff0460a70306a108e532da94a5ceb2e [0,2,0,0,0,0|2,0,0]=4 4259 B13R1.66 CCOC(=O)[C@H](C)OC1CCCO1 03177d75e56bc75e1af73d88eff33229 [0,2,0,0,0,0|2,0,0]=4 4260 B13R1.66 CN(CC1CCCC1)C(=O)CCF 70c46728843431a277f291f1cfd69fe7 [0,2,0,0,0,0|2,0,0]=4 4261 B13R1.66 CN(CC1CCCC1)C(=O)CCO 6e063475d293a94cf5716baf6dffb9da [0,2,0,0,0,0|2,0,0]=4 4262 B13R1.66 CN(CC1CCCC1)C(=O)CCS 61d5c71d7c3cbc4cb14bc4391752971d [0,2,0,0,0,0|2,0,0]=4 4263 B13R1.66 CN(CC1CCCO1)C(=O)CC#N b7c8ecc5724dcdfab2b5847211fbfe94 [0,2,0,0,0,0|1,0,1]=4 4264 B13R1.66 CN(CC1CCCO1)C(=O)CC=O 5eab41d932b3b4443cdb1a9faed6b39e [0,2,0,0,0,0|1,0,1]=4 4265 B13R1.66 CN(CC1CCCO1)C(=O)CCF 02e072317a1a9521fa2e3559e8434b52 [0,2,0,0,0,0|1,0,0]=3 4266 B13R1.66 CN(CC1CCCO1)C(=O)CCO 5918a2183188e08d45f8ba629f8bc7dc [0,2,0,0,0,0|1,0,0]=3 4267 B13R1.66 CN(CC1CCCO1)C(=O)CCS 8e0483467cf9ce1e90ebddf23296c8b1 [0,2,0,0,0,0|1,0,0]=3 4268 B13R1.66 CN(CC1CCCO1)C(=O)CON 99f259f14d9a9bbb5a56d800ad14fc3a [0,2,0,0,0,0|2,0,0]=4 4269 B13R1.66 COCC(=O)N(C)CC1CCCC1 c60ba086ca3000854c21fd028bf64312 [0,2,0,0,0,0|2,0,0]=4 4270 B13R1.66 COCC(=O)N(C)CC1CCCO1 bb438ef4b63fa689947a0ff9ce78b87a [0,2,0,0,0,0|1,0,0]=3 4271 B13R1.66 CSCC(=O)N(C)CC1CCCC1 1cfd8368239579312c28a6f228cbcad2 [0,2,0,0,0,0|2,0,0]=4 4272 B13R1.66 CSCC(=O)N(C)CC1CCCO1 7a059ea56fdb53274ea0752af7781f76 [0,2,0,0,0,0|1,0,0]=3 4273 B13R1.153 C#CCCC(=O)NCC1CCCC1 37c335e915c49c7d56e91beb484d13ad [0,2,0,0,0,0|2,0,0]=4 4274 B13R1.153 C#CCCC(=O)NCC1CCCO1 23ec65d44be5aee3a4c3c2e9288916d5 [0,2,0,0,0,0|1,0,0]=3 4275 B13R1.153 C#CCCC(=O)NC[C@@H]1CCCO1 7bb8042cd536ae99f48653396a0cb6b7 [0,2,0,0,0,0|1,0,0]=3 4276 B13R1.153 C#CCCC(=O)NC[C@H]1CCCO1 6cd1b3e13d14cc28ff24c772681e6dee [0,2,0,0,0,0|1,0,0]=3 4277 B13R1.153 C#CCNC(=O)CCC1CCCO1 6084fa9810482e2360a68dfb7fde78cb [0,2,0,0,0,0|1,0,1]=4 4278 B13R1.153 C#CCNC(=O)NCC1CCCO1 79853699177d6767213638eb25ca3932 [0,2,0,0,0,0|1,0,1]=4 4279 B13R1.153 C#CCNC(=O)NC[C@@H]1CCCO1 7936c00b8639b1e168d35f6fbd0ba937 [0,2,0,0,0,0|1,0,1]=4 4280 B13R1.153 C#CCNC(=O)NC[C@H]1CCCO1 54ac761ddff7d824ed2704ec8b1b7bcd [0,2,0,0,0,0|1,0,1]=4 4281 B13R1.153 C/C=C/CC(=O)NCC1CCCC1 45f8f9fc5c5869e0dfa79a771a18e771 [0,2,0,0,0,0|2,0,0]=4 4282 B13R1.153 C/C=C/CC(=O)NCC1CCCO1 45f7b0d2aca0240bebcebf873acd444f [0,2,0,0,0,0|1,0,0]=3 4283 B13R1.153 C/C=C/CC(=O)NC[C@@H]1CCCO1 9ecac75f32e8a1097c8acdd457376495 [0,2,0,0,0,0|1,0,0]=3 4284 B13R1.153 C/C=C/CC(=O)NC[C@H]1CCCO1 d043ac93a0139a9d28d60f72740d12d0 [0,2,0,0,0,0|1,0,0]=3 4285 B13R1.153 C=CCCC(=O)NCC1CCCC1 40328554ed16b090359354501934e84b [0,2,0,0,0,0|2,0,0]=4 4286 B13R1.153 C=CCCC(=O)NCC1CCCO1 06eb45a7731fc3d210e393f61a98644b [0,2,0,0,0,0|1,0,0]=3 4287 B13R1.153 C=CCCC(=O)NC[C@@H]1CCCO1 9442b16ce908e4d833bda3f6876d51bf [0,2,0,0,0,0|1,0,0]=3 4288 B13R1.153 C=CCCC(=O)NC[C@H]1CCCO1 9a2a8185febf7bb31d5061f246342192 [0,2,0,0,0,0|1,0,0]=3 4289 B13R1.153 C=CCCC(C)OCC1CCCO1 d7f1cffe9f7dc7d305cc8d9f8353e63c [0,2,0,0,0,0|1,0,1]=4 4290 B13R1.153 C=CCCC(C)OC[C@@H]1CCCO1 f0320c7d1a7fc560db82cf81bb93ac7b [0,2,0,0,0,0|1,0,1]=4 4291 B13R1.153 C=CCCC(C)OC[C@H]1CCCO1 2afcf09c513308fd65245f49a89f43f1 [0,2,0,0,0,0|1,0,1]=4 4292 B13R1.153 C=CCC[C@@H](C)OCC1CCCO1 a02d70992e5c7dcb507160f9328f51a8 [0,2,0,0,0,0|1,0,1]=4 4293 B13R1.153 CC#CCC(=O)NCC1CCCC1 b09d47e36afc8cc858ec0d6ab7b4029c [0,2,0,0,0,0|2,0,0]=4 4294 B13R1.153 CC#CCC(=O)NCC1CCCO1 a4f4dc5a4849c14e490370363ab735cc [0,2,0,0,0,0|1,0,0]=3 4295 B13R1.153 CC#CCC(=O)NC[C@@H]1CCCO1 3b322d8047aa3340de3bc911e61fd6b6 [0,2,0,0,0,0|1,0,0]=3 4296 B13R1.153 CC#CCC(=O)NC[C@H]1CCCO1 188aae3fa1ab0217e0f28e2f0cfa9c41 [0,2,0,0,0,0|1,0,0]=3 4297 B13R1.153 CC(CCC#N)OCC1CCCO1 03659b699c8ba7d46a13ec40a6a35a50 [0,2,0,0,0,0|1,0,1]=4 4298 B13R1.153 CC(CCC#N)OC[C@@H]1CCCO1 59d09d778b4ef0fa32d88331b4b12e3d [0,2,0,0,0,0|1,0,1]=4 4299 B13R1.153 CC(CCC#N)OC[C@H]1CCCO1 82cb8eb6430547bcc0afce7c0dfaaf20 [0,2,0,0,0,0|1,0,1]=4 4300 B13R1.153 CC/C=C/C(=O)NCC1CCCC1 01c425351af9e5e9e5543da914535509 [0,2,0,0,0,0|2,0,0]=4 4301 B13R1.153 CC/C=C/C(=O)NCC1CCCO1 7d6c0c999c0bb3f44272280700463813 [0,2,0,0,0,0|1,0,0]=3 4302 B13R1.153 CC/C=C/C(=O)NC[C@@H]1CCCO1 d95b051572b34c54bfe8d14a1edd3786 [0,2,0,0,0,0|1,0,0]=3 4303 B13R1.153 CC/C=C/C(=O)NC[C@H]1CCCO1 91e698398e69dca9784aa9fc0497679c [0,2,0,0,0,0|1,0,0]=3 4304 B13R1.153 CC/C=C\C(=O)NCC1CCCC1 3bc65b31660719bf7c292279d06539dc [0,2,0,0,0,0|2,0,0]=4 4305 B13R1.153 CC/C=C\C(=O)NCC1CCCO1 6342392a5f552755dec1353af28be064 [0,2,0,0,0,0|1,0,0]=3 4306 B13R1.153 CC/C=C\C(=O)NC[C@@H]1CCCO1 b59beb325d5d6a7fc451fefec4c9e6b9 [0,2,0,0,0,0|1,0,0]=3 4307 B13R1.153 CC/C=C\C(=O)NC[C@H]1CCCO1 463738b28d42cb3c013811873e49282d [0,2,0,0,0,0|1,0,0]=3 4308 B13R1.153 CCC#CC(=O)NCC1CCCC1 76b899e1bdfaccbf5e201dbba39128ef [0,2,0,0,0,0|2,0,0]=4 4309 B13R1.153 CCC#CC(=O)NCC1CCCO1 bbd39f82b822ddac8c61122b17d9ff03 [0,2,0,0,0,0|1,0,0]=3 4310 B13R1.153 CCC#CC(=O)NC[C@@H]1CCCO1 5b606bc2c9777ab186fbb9a9627d9a18 [0,2,0,0,0,0|1,0,0]=3 4311 B13R1.153 CCC#CC(=O)NC[C@H]1CCCO1 c7a8ec89deec4f6ec85f099dd9dfe4c0 [0,2,0,0,0,0|1,0,0]=3 4312 B13R1.153 CCC#CC(C)OCC1CCCO1 52c2ca18944c78faf2445e18cf479a97 [0,2,0,0,0,0|1,0,1]=4 4313 B13R1.153 CCC=CC(=O)NCC1CCCC1 2dc3adfe5d9db62237b9bfd7c41a83a9 [0,2,0,0,0,0|2,0,0]=4 4314 B13R1.153 CCC=CC(=O)NCC1CCCO1 26d22dac6b8818318fe4d4ab768ae194 [0,2,0,0,0,0|1,0,0]=3 4315 B13R1.153 CCC=CC(=O)NC[C@@H]1CCCO1 3e3525d13228d6c473e2e067a8235e67 [0,2,0,0,0,0|1,0,0]=3 4316 B13R1.153 CCC=CC(=O)NC[C@H]1CCCO1 9e1ebd4a67f7979a5880be62a1502436 [0,2,0,0,0,0|1,0,0]=3 4317 B13R1.153 CCCCC(=O)NCC1CCCC1 6f5543e1a0e768595d290b41fd10bbe0 [0,2,0,0,0,0|2,0,0]=4 4318 B13R1.153 CCCCC(=O)NCC1CCCO1 b2ab1fb8249ac75bff3623f455562415 [0,2,0,0,0,0|1,0,0]=3 4319 B13R1.153 CCCCC(=O)NC[C@@H]1CCCO1 873f095f8567b60792f44bb11ded4207 [0,2,0,0,0,0|1,0,0]=3 4320 B13R1.153 CCCCC(=O)NC[C@H]1CCCO1 291a3cfdcbdbee98251e31096f5a7b82 [0,2,0,0,0,0|1,0,0]=3 4321 B13R1.153 CCCCC(C)OCC1CCCO1 175121e89a4541bb2aa7d84a13ab4f99 [0,2,0,0,0,0|1,0,1]=4 4322 B13R1.153 CCCCC(C)OC[C@@H]1CCCO1 d5bfde13b514fcd7fbe1b014e7e6eae7 [0,2,0,0,0,0|1,0,1]=4 4323 B13R1.153 CCCCC(C)OC[C@H]1CCCO1 d06ae82f6517c899faeb91d19e48c999 [0,2,0,0,0,0|1,0,1]=4 4324 B13R1.153 CCCC[C@@H](C)OCC1CCCO1 42bc23d83d698a518225352df45b5998 [0,2,0,0,0,0|1,0,1]=4 4325 B13R1.153 CCCC[C@H](C)OCC1CCCO1 9e8445a0d446182124d2b20b67ff7937 [0,2,0,0,0,0|1,0,1]=4 4326 B13R1.153 CCCNC(=O)CCC1CCCC1 c733f3d0d974c82a55544e55a3e22b1e [0,2,0,0,0,0|2,0,0]=4 4327 B13R1.153 CCCNC(=O)CCC1CCCO1 c4d24011c845f3d760febcb0cdea49b6 [0,2,0,0,0,0|1,0,0]=3 4328 B13R1.153 CCCNC(=O)COC1CCCO1 1ce52c0d797853fb5a12b36047cbd4c1 [0,2,0,0,0,0|2,0,0]=4 4329 B13R1.153 CCCNC(=O)NCC1CCCC1 a3b5fbd16e4e9659e48d9ee176c2f822 [0,2,0,0,0,0|2,0,0]=4 4330 B13R1.153 CCCNC(=O)NCC1CCCO1 92dbfd6f2c02e9ec415ad85c078aada9 [0,2,0,0,0,0|1,0,0]=3 4331 B13R1.153 CCCNC(=O)NC[C@@H]1CCCO1 fcf892eee516befe22afc2395b5d35ad [0,2,0,0,0,0|1,0,0]=3 4332 B13R1.153 CCCNC(=O)NC[C@H]1CCCO1 cfdee8061117b4a92534df8764c19d1b [0,2,0,0,0,0|1,0,0]=3 4333 B13R1.153 CCCNC(=S)NCC1CCCO1 c91f31e4964bd3ac6546c61ae32f25f6 [0,2,0,0,0,0|1,1,0]=4 4334 B13R1.153 CCCNC(=S)NC[C@@H]1CCCO1 59a4a6c41f548f04f095e88674e67c22 [0,2,0,0,0,0|1,1,0]=4 4335 B13R1.153 CCCNC(=S)NC[C@H]1CCCO1 dd0ecdc0a15ef43ae4cd291e98278682 [0,2,0,0,0,0|1,1,0]=4 4336 B13R1.153 CCCOC(=O)COC1CCCO1 831a4a41c9f1321ab4374ae5e3ac0436 [0,2,0,0,0,0|2,0,0]=4 4337 B13R1.153 CCOCC(=O)NCC1CCCC1 af5db74faf36e2b14009bb6ff3ada6fa [0,2,0,0,0,0|2,0,0]=4 4338 B13R1.153 CCOCC(=O)NCC1CCCO1 d5e767dca64469b197ab284dd3008e5e [0,2,0,0,0,0|1,0,0]=3 4339 B13R1.153 CCOCC(=O)NC[C@@H]1CCCO1 8ff6b595ab7532c87487af20e705afb6 [0,2,0,0,0,0|1,0,0]=3 4340 B13R1.153 CCOCC(=O)NC[C@H]1CCCO1 222e559c34c946c2cb8a94a934e58be7 [0,2,0,0,0,0|1,0,0]=3 4341 B13R1.153 CCOCC(C)OCC1CCCO1 ce7df7fa472d6a12aa5e18b34697e745 [0,2,0,0,0,0|1,0,1]=4 4342 B13R1.153 CCSCC(=O)NCC1CCCC1 7ab8d70355c405d6859a043987cfb007 [0,2,0,0,0,0|2,0,0]=4 4343 B13R1.153 CCSCC(=O)NCC1CCCO1 877dd67e3acf826e3e0e9963f88bfa00 [0,2,0,0,0,0|1,0,0]=3 4344 B13R1.153 CCSCC(=O)NC[C@@H]1CCCO1 48967a04147a960f94d28702f493d555 [0,2,0,0,0,0|1,0,0]=3 4345 B13R1.153 CCSCC(=O)NC[C@H]1CCCO1 81202c91e2b8e7ca2ba585c129f3be5d [0,2,0,0,0,0|1,0,0]=3 4346 B13R1.153 CO/C=C/C(=O)NCC1CCCO1 8ade16af7d15182b42ccfefd5a404703 [0,2,0,0,0,0|1,0,1]=4 4347 B13R1.153 CO/C=C/C(=O)NC[C@@H]1CCCO1 049df23ed7142c5dc140ba16035a16c9 [0,2,0,0,0,0|1,0,1]=4 4348 B13R1.153 CO/C=C/C(=O)NC[C@H]1CCCO1 73ad3598542216a9e3178eaf87d1c705 [0,2,0,0,0,0|1,0,1]=4 4349 B13R1.153 COC=CC(=O)NCC1CCCO1 c9a9d1985ed566d3d3230848934aa787 [0,2,0,0,0,0|1,0,1]=4 4350 B13R1.153 COC=CC(=O)NC[C@@H]1CCCO1 0ccdaf25cd50ec298717629488924543 [0,2,0,0,0,0|1,0,1]=4 4351 B13R1.153 COC=CC(=O)NC[C@H]1CCCO1 2119b0bd1936d4d8d7e66593a3db3bb5 [0,2,0,0,0,0|1,0,1]=4 4352 B13R1.153 COCCC(=O)NCC1CCCC1 7afb48ca409e36ac858d7e64dd12fc8b [0,2,0,0,0,0|2,0,0]=4 4353 B13R1.153 COCCC(=O)NCC1CCCO1 f46c7cb25212bd5d663582f8feea1f04 [0,2,0,0,0,0|1,0,0]=3 4354 B13R1.153 COCCC(=O)NC[C@@H]1CCCO1 5b7973f46e5fde41a2ac078da2d016b9 [0,2,0,0,0,0|1,0,0]=3 4355 B13R1.153 COCCC(=O)NC[C@H]1CCCO1 d6e9ac5ac9b85bf4770cb6acfc03078f [0,2,0,0,0,0|1,0,0]=3 4356 B13R1.153 COCCC(C)OCC1CCCO1 fee53d9feb65d53bc4bf53b6efedd127 [0,2,0,0,0,0|1,0,1]=4 4357 B13R1.153 CSCCC(=O)COC1CCCO1 ef0e195c19737bc7a7208b4b1858d222 [0,2,0,0,0,0|2,0,0]=4 4358 B13R1.153 CSCCC(=O)NCC1CCCC1 0279bb27bcf61719574be7698e8ae39e [0,2,0,0,0,0|2,0,0]=4 4359 B13R1.153 CSCCC(=O)NCC1CCCO1 412120c038d764c85ba0a5ecf6ef9334 [0,2,0,0,0,0|1,0,0]=3 4360 B13R1.153 CSCCC(=O)NC[C@@H]1CCCO1 d48c1905614ab8f2cd901ed2d71e239c [0,2,0,0,0,0|1,0,0]=3 4361 B13R1.153 CSCCC(=O)NC[C@H]1CCCO1 d80bf6a887fd57f5975a2bb7b4027842 [0,2,0,0,0,0|1,0,0]=3 4362 B13R1.153 CSCCC(C)OCC1CCCO1 281a368d191beb1e257f1447fa163b1d [0,2,0,0,0,0|1,0,1]=4 4363 B13R1.153 CSSCC(=O)NCC1CCCC1 f0cbd777f2d3a9f7dec99c6e13e57951 [0,2,0,0,0,0|2,0,0]=4 4364 B13R1.153 CSSCC(=O)NCC1CCCO1 de970e30157bd6def4809d6606503773 [0,2,0,0,0,0|1,0,0]=3 4365 B13R1.153 CSSCC(=O)NC[C@@H]1CCCO1 040935e9a7425f329ea60c788619cd88 [0,2,0,0,0,0|1,0,0]=3 4366 B13R1.153 CSSCC(=O)NC[C@H]1CCCO1 a0cffea9b71dfde36a3b7856f6e13cbc [0,2,0,0,0,0|1,0,0]=3 4367 B13R1.153 FCCNC(=S)NCC1CCCO1 33781baaf8c2838c663b25b2d7d3b7ed [0,2,0,0,0,0|1,1,0]=4 4368 B13R1.153 FCCNC(=S)NC[C@@H]1CCCO1 ee45a1b513bf165a4a8cfb3198fe27b7 [0,2,0,0,0,0|1,1,0]=4 4369 B13R1.153 FCCNC(=S)NC[C@H]1CCCO1 0c98b189adbf021df2f855c6598f4069 [0,2,0,0,0,0|1,1,0]=4 4370 B13R1.153 N#CCCC(=O)NCC1CCCC1 ba0d69dab95ad892b6b874f64d04873a [0,2,0,0,0,0|2,0,0]=4 4371 B13R1.153 N#CCCC(=O)NCC1CCCO1 d3797c39d86cfd9a021a54a730361caa [0,2,0,0,0,0|1,0,0]=3 4372 B13R1.153 N#CCCC(=O)NC[C@@H]1CCCO1 4e69a288252ebed543a191391e8dfea7 [0,2,0,0,0,0|1,0,0]=3 4373 B13R1.153 N#CCCC(=O)NC[C@H]1CCCO1 44977018de81f1cbbc6550fba0bcbdda [0,2,0,0,0,0|1,0,0]=3 4374 B13R1.153 N#CCNC(=O)CCC1CCCO1 e2e05dface11b22b4d56883c6293693e [0,2,0,0,0,0|1,0,1]=4 4375 B13R1.153 N#CCNC(=O)NCC1CCCO1 1a9988b41eeec4a9021b205df6c0ec73 [0,2,0,0,0,0|1,0,1]=4 4376 B13R1.153 N#CCNC(=O)NC[C@@H]1CCCO1 3f1eea5dcdef77f98cb806c9bfe22a01 [0,2,0,0,0,0|1,0,1]=4 4377 B13R1.153 N#CCNC(=O)NC[C@H]1CCCO1 edc07c8d1350cb77c901af0f31357128 [0,2,0,0,0,0|1,0,1]=4 4378 B13R1.153 N#CNCC(=O)NCC1CCCO1 b0e3eabadedf034da0d3405a41df1299 [0,2,0,0,0,0|1,0,1]=4 4379 B13R1.153 NCCNC(=O)NCC1CCCC1 332e0f72f5ae492bc57de0458b914158 [0,2,0,0,0,0|2,0,0]=4 4380 B13R1.153 NCCNC(=O)NCC1CCCO1 4c47eeeb4e1787a5a6a59aa96d80318f [0,2,0,0,0,0|1,0,0]=3 4381 B13R1.153 NCCNC(=O)NC[C@@H]1CCCO1 d5a6a7fb55c08b0dc6b502b0d1362694 [0,2,0,0,0,0|1,0,0]=3 4382 B13R1.153 NCCNC(=O)NC[C@H]1CCCO1 94b33ada368d1a187b7ad9e51f54713b [0,2,0,0,0,0|1,0,0]=3 4383 B13R1.153 NCCNC(=S)NCC1CCCO1 53aea015da63e4985bac5998ff7faa9f [0,2,0,0,0,0|1,1,0]=4 4384 B13R1.153 NCCNC(=S)NC[C@@H]1CCCO1 a501517d3ed90b126343da707e185e70 [0,2,0,0,0,0|1,1,0]=4 4385 B13R1.153 NCCNC(=S)NC[C@H]1CCCO1 9f56a9dc3b484c60d7a170c506a14ff0 [0,2,0,0,0,0|1,1,0]=4 4386 B13R1.153 O=C(/C=C/CF)NCC1CCCO1 0ee81ada312866bf78c6936609819fd6 [0,2,0,0,0,0|1,0,1]=4 4387 B13R1.153 O=C(/C=C/CF)NC[C@@H]1CCCO1 8adbc50f9acde38f847d3dd335b02d30 [0,2,0,0,0,0|1,0,1]=4 4388 B13R1.153 O=C(/C=C/CF)NC[C@H]1CCCO1 4ededd81bcd013e5f43110df567c9523 [0,2,0,0,0,0|1,0,1]=4 4389 B13R1.153 O=C(/C=C/CO)NCC1CCCO1 d4b3f9ebd9e11dcfa563938e35e19d8d [0,2,0,0,0,0|1,0,1]=4 4390 B13R1.153 O=C(/C=C/CO)NC[C@@H]1CCCO1 95331cc081ba02200e4d9e2c49eba7bf [0,2,0,0,0,0|1,0,1]=4 4391 B13R1.153 O=C(/C=C/CO)NC[C@H]1CCCO1 2b3d78f84d0b5bbc79a6c274cb86cc00 [0,2,0,0,0,0|1,0,1]=4 4392 B13R1.153 O=C(C#CCO)NCC1CCCO1 86c8223ebf990ffde8288c21645937dd [0,2,0,0,0,0|1,0,1]=4 4393 B13R1.153 O=C(C#CCO)NC[C@@H]1CCCO1 68b6c868111233dd1d0b62a2d2dbf899 [0,2,0,0,0,0|1,0,1]=4 4394 B13R1.153 O=C(C#CCO)NC[C@H]1CCCO1 7c53d6e682634b63269514eb2a4bb983 [0,2,0,0,0,0|1,0,1]=4 4395 B13R1.153 O=C(C=CCO)NCC1CCCO1 abbe1f97cf3d9789f0f50b96d083fdaa [0,2,0,0,0,0|1,0,1]=4 4396 B13R1.153 O=C(C=CCO)NC[C@@H]1CCCO1 ee1f30fbd62a18bf769e317ac25b8371 [0,2,0,0,0,0|1,0,1]=4 4397 B13R1.153 O=C(C=CCO)NC[C@H]1CCCO1 da14c28570e7109ccc8519a101c7a37e [0,2,0,0,0,0|1,0,1]=4 4398 B13R1.153 O=C(CCC1CCCC1)NCCBr 68b712d55245adbab48ad3fa6fa77887 [0,2,0,0,0,0|2,0,0]=4 4399 B13R1.153 O=C(CCC1CCCC1)NCCF f9da8ed2eebe72714f54e76ae8823088 [0,2,0,0,0,0|2,0,0]=4 4400 B13R1.153 O=C(CCC1CCCC1)NCCI c92922a82b52c8c3efa8db4c8fa96e65 [0,2,0,0,0,0|2,0,0]=4 4401 B13R1.153 O=C(CCC1CCCC1)NCCO 8ee952a9791432e23cfa9470e9d3aa87 [0,2,0,0,0,0|2,0,0]=4 4402 B13R1.153 O=C(CCC1CCCC1)NCCS 4d8b10118cc7e9fab48daa83055659f5 [0,2,0,0,0,0|2,0,0]=4 4403 B13R1.153 O=C(CCC1CCCO1)NCCBr 101054f79545c290c02b59755dac6623 [0,2,0,0,0,0|1,0,0]=3 4404 B13R1.153 O=C(CCC1CCCO1)NCCF 488b89cce365938f0b5b0e34a15c91bd [0,2,0,0,0,0|1,0,0]=3 4405 B13R1.153 O=C(CCC1CCCO1)NCCI 2a86a218c5ed2b13a44e60f7d326ca3d [0,2,0,0,0,0|1,0,0]=3 4406 B13R1.153 O=C(CCC1CCCO1)NCCO a279558d4c9ff8123a87118fdc1e7ad7 [0,2,0,0,0,0|1,0,0]=3 4407 B13R1.153 O=C(CCC1CCCO1)NCCS b52fd6c7bf8c4044884cea16da5adabe [0,2,0,0,0,0|1,0,0]=3 4408 B13R1.153 O=C(CCCF)NCC1CCCC1 6b27a1af358962b438586bc718f808a2 [0,2,0,0,0,0|2,0,0]=4 4409 B13R1.153 O=C(CCCF)NCC1CCCO1 d9ba9411fb2c6e473769877a7744133f [0,2,0,0,0,0|1,0,0]=3 4410 B13R1.153 O=C(CCCF)NC[C@@H]1CCCO1 bc0fb803fba673f0fd16d6050c126828 [0,2,0,0,0,0|1,0,0]=3 4411 B13R1.153 O=C(CCCF)NC[C@H]1CCCO1 be8614ce4565cc06879a30f683782278 [0,2,0,0,0,0|1,0,0]=3 4412 B13R1.153 O=C(CCCS)NCC1CCCC1 3314c3a7ed84cfa26f2d081447417412 [0,2,0,0,0,0|2,0,0]=4 4413 B13R1.153 O=C(CCCS)NCC1CCCO1 a740aa48f8be91871a0db5560741c578 [0,2,0,0,0,0|1,0,0]=3 4414 B13R1.153 O=C(CCCS)NC[C@@H]1CCCO1 2786f3cc93e35a6a099a1e23e8d1a60c [0,2,0,0,0,0|1,0,0]=3 4415 B13R1.153 O=C(CCCS)NC[C@H]1CCCO1 857e1fd07fdbabc94dea66cc9ce2f636 [0,2,0,0,0,0|1,0,0]=3 4416 B13R1.153 O=C(NCCF)NCC1CCCC1 11dc9b72ca334d2218e2385ac009adb5 [0,2,0,0,0,0|2,0,0]=4 4417 B13R1.153 O=C(NCCF)NCC1CCCO1 91a88a14147886cb636e39cfbe58c034 [0,2,0,0,0,0|1,0,0]=3 4418 B13R1.153 O=C(NCCF)NC[C@@H]1CCCO1 fe8f22f899de78001d53590c1b3f4dd4 [0,2,0,0,0,0|1,0,0]=3 4419 B13R1.153 O=C(NCCF)NC[C@H]1CCCO1 41f10f46ec3a6342152da5fad4bb5bd9 [0,2,0,0,0,0|1,0,0]=3 4420 B13R1.153 O=C(NCCO)NCC1CCCC1 b3b082dfe09aade8f9d0a52dc47d2d76 [0,2,0,0,0,0|2,0,0]=4 4421 B13R1.153 O=C(NCCO)NCC1CCCO1 573e10c6cb262a65c881d6776942d0a2 [0,2,0,0,0,0|1,0,0]=3 4422 B13R1.153 O=C(NCCO)NC[C@@H]1CCCO1 5900612c5fb5d3f38a2712bcdad4bd5f [0,2,0,0,0,0|1,0,0]=3 4423 B13R1.153 O=C(NCCO)NC[C@H]1CCCO1 1f1fe8323e8b5acf5d996aa8c68ec370 [0,2,0,0,0,0|1,0,0]=3 4424 B13R1.153 O=C(NCCS)NCC1CCCC1 2e018e3a2d1f5cb3a41241923210b193 [0,2,0,0,0,0|2,0,0]=4 4425 B13R1.153 O=C(NCCS)NCC1CCCO1 a088eb5fb1165e4745707698ff3940e3 [0,2,0,0,0,0|1,0,0]=3 4426 B13R1.153 O=C(NCCS)NC[C@@H]1CCCO1 ee124b9f55650be1af100b815e4c5a8a [0,2,0,0,0,0|1,0,0]=3 4427 B13R1.153 O=C(NCCS)NC[C@H]1CCCO1 86ca49a4ac87d7fea330cfde6a7ae892 [0,2,0,0,0,0|1,0,0]=3 4428 B13R1.153 O=CCCC(=O)NCC1CCCC1 be4ff0d75687a09ca927c8140da38196 [0,2,0,0,0,0|2,0,0]=4 4429 B13R1.153 O=CCCC(=O)NCC1CCCO1 47cd4f731439065303364b24ba187422 [0,2,0,0,0,0|1,0,0]=3 4430 B13R1.153 O=CCCC(=O)NC[C@@H]1CCCO1 f29c7e7fc947facfe17440773b664b8c [0,2,0,0,0,0|1,0,0]=3 4431 B13R1.153 O=CCCC(=O)NC[C@H]1CCCO1 edf295152ccb147c75f5a2ceb276275c [0,2,0,0,0,0|1,0,0]=3 4432 B13R1.153 O=CNCC(=O)NCC1CCCO1 376bbecb6a105a5f131a266c5dfff424 [0,2,0,0,0,0|1,0,1]=4 4433 B13R1.153 O=CNCC(=O)NC[C@@H]1CCCO1 a3dc0778729e1afc867b64b8900a35cc [0,2,0,0,0,0|1,0,1]=4 4434 B13R1.153 O=CNCC(=O)NC[C@H]1CCCO1 0be0858ed3104cb67334c0f443cf4499 [0,2,0,0,0,0|1,0,1]=4 4435 B13R1.153 OCCNC(=S)NCC1CCCO1 dbe9ac51d6c3aa4fd65d4c76947e6057 [0,2,0,0,0,0|1,1,0]=4 4436 B13R1.153 OCCNC(=S)NC[C@@H]1CCCO1 79bca7fc8f5f081d62f7e0741cab5c3d [0,2,0,0,0,0|1,1,0]=4 4437 B13R1.153 OCCNC(=S)NC[C@H]1CCCO1 896d22d455f171907c01ae834121253c [0,2,0,0,0,0|1,1,0]=4 4438 B13R1.153 S=C(NCCS)NCC1CCCO1 8b57db642636ad7eb7704980335a233b [0,2,0,0,0,0|1,1,0]=4 4439 B13R1.153 S=C(NCCS)NC[C@@H]1CCCO1 42a5ef0515750fd594536fb9f6b59666 [0,2,0,0,0,0|1,1,0]=4 4440 B13R1.153 S=C(NCCS)NC[C@H]1CCCO1 2def2caf62bb131a5d40aa94d7ac693f [0,2,0,0,0,0|1,1,0]=4 4441 B13R1.444 CCCC(=O)NCC1CCCC1O 869cf5fce2a558fdd67d90536c7772ac [0,2,0,0,0,0|2,0,0]=4 4442 B13R1.444 CCCC(=O)NCC1CCCN1C 5862134bbcd1bc3ac100a215c39d4b54 [0,2,0,0,0,0|2,0,0]=4 4443 B13R1.444 CCCC(=O)NC[C@@H]1CCCN1C 7038fdbdca8aabdd06490b358231997f [0,2,0,0,0,0|2,0,0]=4 4444 B13R1.444 CCCC(=O)NC[C@H]1CCCN1C bf11a143dc2c8633580f1a6fc67b9c28 [0,2,0,0,0,0|2,0,0]=4 4445 B13R1.444 CCCC(=O)OCN1CCCC1C 8ec4f73f00bc2401841660bac493dc4f [0,2,0,0,0,0|2,0,0]=4 4446 B13R1.444 CCCC(=O)OCN1CCCC1O f824b7a2e692fbdd90eb6bd9f0dd08eb [0,2,0,0,0,0|2,0,0]=4 4447 B13R1.444 CCCC(=O)OCN1CCC[C@@H]1C a36648f41955d08c03e7c4a2c2634618 [0,2,0,0,0,0|2,0,0]=4 4448 B13R1.444 CCCC(=O)OCN1CCC[C@H]1C 938e07ec6e070895762f4ebea35727df [0,2,0,0,0,0|2,0,0]=4 4449 B13R1.444 CCCC(C)OCC1OCCC1C c0f5afb96ce24e96b99e12b9cd94d5e0 [0,2,0,0,0,0|1,0,1]=4 4450 B13R1.444 CCOC(=O)OCN1CCCC1C 40dbd9e7eaafe440b97b2e55c86da4dc [0,2,0,0,0,0|2,0,0]=4 4451 B13R1.444 CCOC(=O)OCN1CCCC1O de6242bcbdfc05c7f9d795ac47c3f297 [0,2,0,0,0,0|2,0,0]=4 4452 B13R1.444 CCOC(=O)OCN1CCC[C@@H]1C 9e76bcf2b5ceae6e0a9863c9729cfdab [0,2,0,0,0,0|2,0,0]=4 4453 B13R1.444 CCOC(=O)OCN1CCC[C@H]1C a04aaaaa36ff7e5a254252bb9232c32f [0,2,0,0,0,0|2,0,0]=4 4454 B13R1.444 CCSC(=O)OCN1CCCC1C 2d4eab11197a3fcc848ec5c94093977b [0,2,0,0,0,0|2,0,0]=4 4455 B13R1.444 CCSC(=O)OCN1CCCC1O 6c5ffb94ce702d8e7ea520b9d3359da2 [0,2,0,0,0,0|2,0,0]=4 4456 B13R1.444 CCSC(=O)OCN1CCC[C@@H]1C 34b6d676d7ea4fd036450058cddb6633 [0,2,0,0,0,0|2,0,0]=4 4457 B13R1.444 CCSC(=O)OCN1CCC[C@H]1C 5ceadd1be15d91fa8f7a397c6d25fb33 [0,2,0,0,0,0|2,0,0]=4 4458 B13R1.444 CN1CCCC1CNC(=O)CCF c1e87eea05998ea45bbab8b0918d6677 [0,2,0,0,0,0|2,0,0]=4 4459 B13R1.444 CN1CCCC1CNC(=O)CCO c45fbbfc822af760fd1284e9c43f233f [0,2,0,0,0,0|2,0,0]=4 4460 B13R1.444 CN1CCCC1CNC(=O)CCS a1f71ca67dca5f823e25451f495a7d9b [0,2,0,0,0,0|2,0,0]=4 4461 B13R1.444 CN1CCC[C@@H]1CNC(=O)CCF 8a76bb5579773022835b34bedd0afa5a [0,2,0,0,0,0|2,0,0]=4 4462 B13R1.444 CN1CCC[C@@H]1CNC(=O)CCO 34a21eac08ae5dbc65ac2594a105c8c9 [0,2,0,0,0,0|2,0,0]=4 4463 B13R1.444 CN1CCC[C@@H]1CNC(=O)CCS dedde7f7816f6284415b93891155ddcb [0,2,0,0,0,0|2,0,0]=4 4464 B13R1.444 CN1CCC[C@H]1CNC(=O)CCF 2f1b02eceedc4c5cd174d5ee60c39ef9 [0,2,0,0,0,0|2,0,0]=4 4465 B13R1.444 CN1CCC[C@H]1CNC(=O)CCO f5569d8ae1a32c9eed5bf931f83dc8e6 [0,2,0,0,0,0|2,0,0]=4 4466 B13R1.444 CN1CCC[C@H]1CNC(=O)CCS ab3aafe4896ce41abbfe7a5c6cafef07 [0,2,0,0,0,0|2,0,0]=4 4467 B13R1.444 COCC(=O)NCC1CCCC1O ee83a891e93cb97f708d5e0431fd2a1a [0,2,0,0,0,0|2,0,0]=4 4468 B13R1.444 COCC(=O)NCC1CCCN1C 60407925ba798cc84a553da15d7dc8fc [0,2,0,0,0,0|2,0,0]=4 4469 B13R1.444 COCC(=O)NC[C@@H]1CCCN1C 71e03cdbfbd2641b3238ba22874e9a7b [0,2,0,0,0,0|2,0,0]=4 4470 B13R1.444 COCC(=O)NC[C@H]1CCCN1C b992519591645d5ff80bd4a0bde85de1 [0,2,0,0,0,0|2,0,0]=4 4471 B13R1.444 COCC(C)OCC1OCCC1C 02e0ebf6f839aa49bbde5677a5051eb1 [0,2,0,0,0,0|1,0,1]=4 4472 B13R1.444 CSCC(=O)NCC1CCCC1O c6030c3b23ea94bf6a4dcc0828783b20 [0,2,0,0,0,0|2,0,0]=4 4473 B13R1.444 CSCC(=O)NCC1CCCN1C 5283d8e24cbb95c72e48f1adafd5719d [0,2,0,0,0,0|2,0,0]=4 4474 B13R1.444 CSCC(=O)NC[C@@H]1CCCN1C c4f95780e169c4253bba1b402ac9ccb9 [0,2,0,0,0,0|2,0,0]=4 4475 B13R1.444 CSCC(=O)NC[C@H]1CCCN1C d2b4a5449b776077329bb4c2a99f2586 [0,2,0,0,0,0|2,0,0]=4 4476 B13R1.444 O=C(CCF)NCC1CCCC1O a67ea1f7fa390ca12b01be150290bae5 [0,2,0,0,0,0|2,0,0]=4 4477 B13R1.444 O=C(CCO)NCC1CCCC1O 9bc8a79c91da2759a9d6124ff0ab71a9 [0,2,0,0,0,0|2,0,0]=4 4478 B13R1.444 O=C(CCS)NCC1CCCC1O b124ff834ef806489d14a5fc8eaccd87 [0,2,0,0,0,0|2,0,0]=4 4479 B13R1.593 C/C(=C/C(=O)NCC1CCCO1)/Cl 063ac48191222ad643d7279d6b438f18 [0,2,0,0,0,0|1,0,1]=4 4480 B13R1.593 C/C(=C/C(=O)NCC1CCCO1)/I 42819593f649e2e28cd0b736ba41bee2 [0,2,0,0,0,0|1,0,1]=4 4481 B13R1.593 C/C(=C/C(=O)NC[C@@H]1CCCO1)/Cl 892efaadf5b5d155518419944eb27a62 [0,2,0,0,0,0|1,0,1]=4 4482 B13R1.593 C/C(=C/C(=O)NC[C@@H]1CCCO1)/I 697c0226241015d4bdd7aaa4ba588770 [0,2,0,0,0,0|1,0,1]=4 4483 B13R1.593 C/C(=C/C(=O)NC[C@H]1CCCO1)/Cl 3b2b9b74ef385f46d002f464bdeced53 [0,2,0,0,0,0|1,0,1]=4 4484 B13R1.593 C/C(=C/C(=O)NC[C@H]1CCCO1)/I d8c50d289e62255397379992eaca4ba2 [0,2,0,0,0,0|1,0,1]=4 4485 B13R1.593 C/C(=C\C(=O)NCC1CCCO1)/Cl 35508a977ad009654d6155bb7bb3792a [0,2,0,0,0,0|1,0,1]=4 4486 B13R1.593 C/C(=C\C(=O)NC[C@@H]1CCCO1)/Cl 1e226f272cb217d22dc43acc912048d8 [0,2,0,0,0,0|1,0,1]=4 4487 B13R1.593 C/C(=C\C(=O)NC[C@H]1CCCO1)/Cl 486de1269c2de1e8049a5910db7a8071 [0,2,0,0,0,0|1,0,1]=4 4488 B13R1.593 C=C(C)CC(=O)NCC1CCCC1 796b4b5a6bdf1030610e190f08a353bb [0,2,0,0,0,0|2,0,0]=4 4489 B13R1.593 C=C(C)CC(=O)NCC1CCCO1 e41bdbde2bfb535034918dd51b249c64 [0,2,0,0,0,0|1,0,0]=3 4490 B13R1.593 C=C(C)CC(=O)NC[C@@H]1CCCO1 ef6ac2627a4f0755c3533ac7d15e418d [0,2,0,0,0,0|1,0,0]=3 4491 B13R1.593 C=C(C)CC(=O)NC[C@H]1CCCO1 75fefaac844f761a5fc5e3f3243f0116 [0,2,0,0,0,0|1,0,0]=3 4492 B13R1.593 CC(=CC(=O)NCC1CCCO1)C a6c218de047c24212fdb2e88dd8b748f [0,2,0,0,0,0|1,0,1]=4 4493 B13R1.593 CC(=CC(=O)NCC1CCCO1)I 984f5632019c44d1a57728d0dfb1e647 [0,2,0,0,0,0|1,0,1]=4 4494 B13R1.593 CC(=CC(=O)NC[C@@H]1CCCO1)C 3cc08aa9c4fe2c3c94e8dbc087d7f0b4 [0,2,0,0,0,0|1,0,1]=4 4495 B13R1.593 CC(=CC(=O)NC[C@@H]1CCCO1)I 69d8ceb92ab6c0c10ed71f8871d9df86 [0,2,0,0,0,0|1,0,1]=4 4496 B13R1.593 CC(=CC(=O)NC[C@H]1CCCO1)C b4ae02c60860c0533fcc6cb2a88ae0fc [0,2,0,0,0,0|1,0,1]=4 4497 B13R1.593 CC(=CC(=O)NC[C@H]1CCCO1)I fdc76760b4d126f0ce18094f16fe7729 [0,2,0,0,0,0|1,0,1]=4 4498 B13R1.593 CC(=O)CC(=O)NCC1CCCC1 f119ebf378d303edb29d74dd3379b274 [0,2,0,0,0,0|2,0,0]=4 4499 B13R1.593 CC(=O)CC(=O)NCC1CCCO1 134122890a11171fe3bd7d13688d47ae [0,2,0,0,0,0|1,0,0]=3 4500 B13R1.593 CC(=O)CC(=O)NC[C@@H]1CCCO1 56eee6a3a34c41aaa7ed57354e4c54f9 [0,2,0,0,0,0|1,0,0]=3 4501 B13R1.593 CC(=O)CC(=O)NC[C@H]1CCCO1 afc5b91531fc9e61a401b2d1321dfeb8 [0,2,0,0,0,0|1,0,0]=3 4502 B13R1.593 CC(C)CC(=O)COC1CCCO1 5f31c82363588b421b36f863a9c43e95 [0,2,0,0,0,0|2,0,0]=4 4503 B13R1.593 CC(C)CC(=O)NCC1CCCC1 ad07f5c8ba9b4ded9a0d3b590f8600a7 [0,2,0,0,0,0|2,0,0]=4 4504 B13R1.593 CC(C)CC(=O)NCC1CCCO1 fde7131fe1af646009634009d09bb6ed [0,2,0,0,0,0|1,0,0]=3 4505 B13R1.593 CC(C)CC(=O)NC[C@@H]1CCCO1 3a861391940f35a38e8f796f78c1e7de [0,2,0,0,0,0|1,0,0]=3 4506 B13R1.593 CC(C)CC(=O)NC[C@H]1CCCO1 a5a64b5ee088bfc6b8b43b283797c372 [0,2,0,0,0,0|1,0,0]=3 4507 B13R1.593 CC(C)CC(C)OCC1CCCO1 067df67d5f3972304ca0eb00ec26a66b [0,2,0,0,0,0|1,0,1]=4 4508 B13R1.593 CC(C)CC(C)OC[C@@H]1CCCO1 9e80282d5aa2656c1ce37e87a359a33d [0,2,0,0,0,0|1,0,1]=4 4509 B13R1.593 CC(C)CC(C)OC[C@H]1CCCO1 926778e8b414f52adc1f9c957f0a53dc [0,2,0,0,0,0|1,0,1]=4 4510 B13R1.593 CC(C)C[C@@H](C)OCC1CCCO1 1c3979f35e42afd8600ef813db65c8ff [0,2,0,0,0,0|1,0,1]=4 4511 B13R1.593 CC(C)C[C@H](C)OCC1CCCO1 2ecb7039f606048104823692a7704e70 [0,2,0,0,0,0|1,0,1]=4 4512 B13R1.593 CC(C)NC(=O)COC1CCCO1 eec2a778112b8c6ba3c103b7f5656564 [0,2,0,0,0,0|2,0,0]=4 4513 B13R1.593 CC(C)OC(=O)COC1CCCO1 e9d64db84b14e5b30fbeb62a5b91e78c [0,2,0,0,0,0|2,0,0]=4 4514 B13R1.593 CC(CN(C)C)OCC1CCCO1 b65ab1fb79b5b00e138ed42a3bac3789 [0,2,0,0,0,0|1,0,1]=4 4515 B13R1.593 CC(O)CC(=O)NCC1CCCC1 40ed582e889013c425a5173c749b5d82 [0,2,0,0,0,0|2,0,0]=4 4516 B13R1.593 CC(O)CC(=O)NCC1CCCO1 3e478f20f46233bf849ae7055035cdf8 [0,2,0,0,0,0|1,0,0]=3 4517 B13R1.593 CC(O)CC(=O)NC[C@@H]1CCCO1 fd85a1a666683fc22508950cece4cff9 [0,2,0,0,0,0|1,0,0]=3 4518 B13R1.593 CC(O)CC(=O)NC[C@H]1CCCO1 5e161a662978104055ec7a3a33f8e307 [0,2,0,0,0,0|1,0,0]=3 4519 B13R1.593 CN(C)CC(=O)NCC1CCCC1 f5a3b5758e654d82da55618a3974b246 [0,2,0,0,0,0|2,0,0]=4 4520 B13R1.593 CN(C)CC(=O)NCC1CCCO1 da358e0944855484ebd57b14ea14be1a [0,2,0,0,0,0|1,0,0]=3 4521 B13R1.593 CN(C)CC(=O)NC[C@@H]1CCCO1 5fdc117f00b0bffe301edfcaa29565a6 [0,2,0,0,0,0|1,0,0]=3 4522 B13R1.593 CN(C)CC(=O)NC[C@H]1CCCO1 3a20d93f495bb438648dfdf25e05c609 [0,2,0,0,0,0|1,0,0]=3 4523 B13R1.593 C[C@@H](CN(C)C)OCC1CCCO1 97c2d2b2103b0f45ff8bbf13adfa505a [0,2,0,0,0,0|1,0,1]=4 4524 B13R1.593 C[C@@H](O)CC(=O)NCC1CCCC1 7b3d2414706c7c0f991a348e60875c7d [0,2,0,0,0,0|2,0,0]=4 4525 B13R1.593 C[C@@H](O)CC(=O)NCC1CCCO1 93b49bb1e8f2a7c75a1b1f33f19242e0 [0,2,0,0,0,0|1,0,0]=3 4526 B13R1.593 C[C@@H](O)CC(=O)NC[C@@H]1CCCO1 c7c68c50827bb1c07730d335f24aa559 [0,2,0,0,0,0|1,0,0]=3 4527 B13R1.593 C[C@@H](O)CC(=O)NC[C@H]1CCCO1 39ac30487e4400cc21e60bf7740fe7a3 [0,2,0,0,0,0|1,0,0]=3 4528 B13R1.593 C[C@H](CN(C)C)OCC1CCCO1 4ca5ffe5b139cdedf6854b2678025e25 [0,2,0,0,0,0|1,0,1]=4 4529 B13R1.593 C[C@H](O)CC(=O)NCC1CCCC1 15d6d22a425e25d3e0f9e55c5f375621 [0,2,0,0,0,0|2,0,0]=4 4530 B13R1.593 C[C@H](O)CC(=O)NCC1CCCO1 2df9fbc2be3bc331d5197e972d2b802a [0,2,0,0,0,0|1,0,0]=3 4531 B13R1.593 C[C@H](O)CC(=O)NC[C@@H]1CCCO1 f1e5c90c6d9a70ea752793ea9b95f7fc [0,2,0,0,0,0|1,0,0]=3 4532 B13R1.593 C[C@H](O)CC(=O)NC[C@H]1CCCO1 12845facc481976e52eb59ae785f148e [0,2,0,0,0,0|1,0,0]=3 4533 B13R1.593 NC(=O)CC(=O)NCC1CCCO1 eec5b0e8ddbeb552fbdb3ae5c37b23b8 [0,2,0,0,0,0|1,0,1]=4 4534 B13R1.593 NC(=O)CC(=O)NC[C@@H]1CCCO1 1cb398415099dc07c527ead1ba0f112b [0,2,0,0,0,0|1,0,1]=4 4535 B13R1.593 NC(=O)CC(=O)NC[C@H]1CCCO1 b7361c49717981f2f6520def5425ffa5 [0,2,0,0,0,0|1,0,1]=4 4536 B13R1.593 O=C(CC(F)F)NCC1CCCC1 ee328e4be6915fa12872868c904097a2 [0,2,0,0,0,0|2,0,0]=4 4537 B13R1.593 O=C(CC(F)F)NCC1CCCO1 c5995b66202246e6a126dd3e2ae3309d [0,2,0,0,0,0|1,0,0]=3 4538 B13R1.593 O=C(CC(F)F)NC[C@@H]1CCCO1 5e993a066814b4c5b659d520ff99bf5a [0,2,0,0,0,0|1,0,0]=3 4539 B13R1.593 O=C(CC(F)F)NC[C@H]1CCCO1 c3efdadb6ce0f9c141c9de75f04999c3 [0,2,0,0,0,0|1,0,0]=3 4540 B13R1.694 BrCCC(CBr)OCC1CCCO1 baf62612221354961c1086d1a03f1d74 [0,2,0,0,0,0|1,0,1]=4 4541 B13R1.694 C#CC(CCC)OCC1CCCO1 449a3d18209765884f222ce4676ba8f0 [0,2,0,0,0,0|1,0,1]=4 4542 B13R1.694 C#CCC(CC)OCC1CCCO1 5e1f38181ee73ef60220435125febbe9 [0,2,0,0,0,0|1,0,1]=4 4543 B13R1.694 C=CC(CCC)OCC1CCCO1 87553ce8451d66304314ea3ade4e3a9f [0,2,0,0,0,0|1,0,1]=4 4544 B13R1.694 CCC(CC#N)OCC1CCCO1 6cf8b716f1a57217145d81c8391cccd4 [0,2,0,0,0,0|1,0,1]=4 4545 B13R1.694 CCC(COC)OCC1CCCO1 9858a294c90e834b075844bd48b0e162 [0,2,0,0,0,0|0,0,2]=4 4546 B13R1.694 CCC(CSC)OCC1CCCO1 47f4ac2f939efae40ba7274b5c7c0792 [0,2,0,0,0,0|0,1,1]=4 4547 B13R1.694 CCCC(C#N)OCC1CCCO1 81c9aeee757650724e07405e8673d023 [0,2,0,0,0,0|1,0,1]=4 4548 B13R1.694 CCCC(CC)OCC1CCCO1 f4c61fd6461b9db3fcf2897b11a0fe31 [0,2,0,0,0,0|1,0,1]=4 4549 B13R1.694 CCCC(CC)OC[C@@H]1CCCO1 738035a5dabc18ae1822735a1a9de7c0 [0,2,0,0,0,0|1,0,1]=4 4550 B13R1.694 CCCC(CC)OC[C@H]1CCCO1 4413ab28fa5a94abcaca4a95868e2551 [0,2,0,0,0,0|1,0,1]=4 4551 B13R1.694 CCC[C@@H](CC)OCC1CCCO1 65e1f6ba47205c30bcde6fed25e6442b [0,2,0,0,0,0|1,0,1]=4 4552 B13R1.694 CC[C@H](CC#N)OCC1CCCO1 0c52c73dcebaa6184b490ed0cab8defd [0,2,0,0,0,0|1,0,1]=4 4553 B13R1.694 ClCCC(CCl)OCC1CCCO1 4eaa7d2dd9a8a38f46e1d9f402a7818b [0,2,0,0,0,0|1,0,1]=4 4554 B13R1.694 OCC[C@H](CO)OCC1CCCO1 d7d6c99a22834299f006795daf01b106 [0,2,0,0,0,0|0,0,2]=4 4555 B13R1.694 OCC[C@H](CO)OC[C@@H]1CCCO1 8c854f878d77a420f685aeb4fc1c8131 [0,2,0,0,0,0|0,0,2]=4 4556 B13R1.694 OCC[C@H](CO)OC[C@H]1CCCO1 b36a055f123566457126dec9de620043 [0,2,0,0,0,0|0,0,2]=4 4557 B13R1.1483 C#CCC(=O)NCC1(CCCO1)C 2d21f699b73be3f47f95a6f70f781b40 [0,2,0,0,0,0|1,0,1]=4 4558 B13R1.1483 C/C=C/C(=O)NCC1(CCCO1)C a5d09b38339680565c03521a3dd1b148 [0,2,0,0,0,0|1,0,1]=4 4559 B13R1.1483 C=CCC(=O)NCC1(CCCO1)C 3e841c4dbbd2511047d1c3e3d06e11a2 [0,2,0,0,0,0|1,0,1]=4 4560 B13R1.1483 CC#CC(=O)NCC1(CCCO1)C 935a4f2e89224270a7a47af549d2a738 [0,2,0,0,0,0|1,0,1]=4 4561 B13R1.1483 CC1(CCCC1)CNC(=O)CCF f61dac85f5968808cd180436553cf4fa [0,2,0,0,0,0|2,0,0]=4 4562 B13R1.1483 CC1(CCCC1)CNC(=O)CCO 6a3cd4f30e3686dd3c8ba5e32fc5b7ac [0,2,0,0,0,0|2,0,0]=4 4563 B13R1.1483 CC1(CCCC1)CNC(=O)CCS aa4eeac9eb24643893d96b07e4b410ad [0,2,0,0,0,0|2,0,0]=4 4564 B13R1.1483 CC1(CCCO1)CNC(=O)CC#N 1f1ca254cc97fa4da365b950d74ab81f [0,2,0,0,0,0|1,0,1]=4 4565 B13R1.1483 CC1(CCCO1)CNC(=O)CC=O 8fab7877ba12600f18fc9f4000f9476c [0,2,0,0,0,0|1,0,1]=4 4566 B13R1.1483 CC1(CCCO1)CNC(=O)CCF 41c614eca476fb71f9daae0f95fb3330 [0,2,0,0,0,0|1,0,0]=3 4567 B13R1.1483 CC1(CCCO1)CNC(=O)CCO 7e4ac2c977fc28acc925b78e2ad346b6 [0,2,0,0,0,0|1,0,0]=3 4568 B13R1.1483 CC1(CCCO1)CNC(=O)CCS 1922c4dae6639c959972de4c4da66d6e [0,2,0,0,0,0|1,0,0]=3 4569 B13R1.1483 CC1(CCCO1)CNC(=O)CON 40301ea02bd9256f5c7ef2f09592aa2d [0,2,0,0,0,0|2,0,0]=4 4570 B13R1.1483 CCCC(=O)NCC1(CCCC1)C 864de174b8ccabbaf26aa5cc9799af55 [0,2,0,0,0,0|2,0,0]=4 4571 B13R1.1483 CCCC(=O)NCC1(CCCC1)F bb7b0e31425ee349cdedf9799690f474 [0,2,0,0,0,0|2,0,0]=4 4572 B13R1.1483 CCCC(=O)NCC1(CCCC1)O 204c4acb33378f51bfa5d8ce28dc1e77 [0,2,0,0,0,0|2,0,0]=4 4573 B13R1.1483 CCCC(=O)NCC1(CCCO1)C f7b97b0f8c6235ac8d844855a6a3eaa4 [0,2,0,0,0,0|1,0,0]=3 4574 B13R1.1483 CCCC(=S)OCC1(CCCC1)C 42fea10f65a81e7070e2b2de6845277f [0,2,0,0,0,0|1,1,0]=4 4575 B13R1.1483 CCCC(=S)OCC1(CCCC1)F 9ca8558495a8118804566f5dad7339b8 [0,2,0,0,0,0|1,1,0]=4 4576 B13R1.1483 CCCC(C)OCC1(CCCO1)C 014cfc2fe630de835d9ec4f4705c5dfd [0,2,0,0,0,0|1,0,1]=4 4577 B13R1.1483 COCC(=O)NCC1(CCCC1)C 513ca79907c3fbc5e983ae7887b97b48 [0,2,0,0,0,0|2,0,0]=4 4578 B13R1.1483 COCC(=O)NCC1(CCCC1)F 8e4971330a7543ca713b8099311a628c [0,2,0,0,0,0|2,0,0]=4 4579 B13R1.1483 COCC(=O)NCC1(CCCC1)O afc20efc5f03edc91d0ace31d5a54ccb [0,2,0,0,0,0|2,0,0]=4 4580 B13R1.1483 COCC(=O)NCC1(CCCO1)C 3d00e08a4e89da1a7c907b23196f1d76 [0,2,0,0,0,0|1,0,0]=3 4581 B13R1.1483 COCC(C)OCC1(CCCO1)C 58611cab6ca23f66d98462d1f564bba4 [0,2,0,0,0,0|1,0,1]=4 4582 B13R1.1483 CSCC(=O)NCC1(CCCC1)C 50c99798c68f6b85c4e7ab5247ab93dc [0,2,0,0,0,0|2,0,0]=4 4583 B13R1.1483 CSCC(=O)NCC1(CCCC1)F 3d7592c6532726cb5e16b727a66587bb [0,2,0,0,0,0|2,0,0]=4 4584 B13R1.1483 CSCC(=O)NCC1(CCCC1)O fb876017d40b1c496dd79f4eff5fcc29 [0,2,0,0,0,0|2,0,0]=4 4585 B13R1.1483 CSCC(=O)NCC1(CCCO1)C 6e4a530d3ce095d2fa1f7de71d2f833a [0,2,0,0,0,0|1,0,0]=3 4586 B13R1.1483 O=C(CCF)NCC1(CCCC1)F bd2633d2c1f68eb362ad27a895cac9e8 [0,2,0,0,0,0|2,0,0]=4 4587 B13R1.1483 O=C(CCF)NCC1(CCCC1)O 3d424263eeb60581a151c6511b0b6427 [0,2,0,0,0,0|2,0,0]=4 4588 B13R1.1483 O=C(CCO)NCC1(CCCC1)F dae484ea384a76b6a4d0819b61c4fb1b [0,2,0,0,0,0|2,0,0]=4 4589 B13R1.1483 O=C(CCO)NCC1(CCCC1)O 142e30ace74f17bf25b414ccba58ca05 [0,2,0,0,0,0|2,0,0]=4 4590 B13R1.1483 O=C(CCS)NCC1(CCCC1)F afb142e0d47155fa51f82bcca6525ebe [0,2,0,0,0,0|2,0,0]=4 4591 B13R1.1483 O=C(CCS)NCC1(CCCC1)O 3211cee21baafeff0f7009f6495d4640 [0,2,0,0,0,0|2,0,0]=4 4592 B13R1.346 C=C(C)C(=O)N(C)CC1CCCO1 c635584a29c4549f8fa5299129db9ab9 [0,2,0,0,0,0|1,0,1]=4 4593 B13R1.346 CC(=O)C(=O)N(C)CC1CCCO1 20d76a6166dfd01683a4b89ce6a77d07 [0,2,0,0,0,0|1,0,1]=4 4594 B13R1.346 CC(C)C(=O)C(C)OC1CCCO1 2aa98d8b9009457e288c70207ba2e0f2 [0,2,0,0,0,0|2,0,0]=4 4595 B13R1.346 CC(F)C(=O)N(C)CC1CCCC1 9089693dc1a02b890a129cc9cd9f5773 [0,2,0,0,0,0|2,0,0]=4 4596 B13R1.346 CC(F)C(=O)N(C)CC1CCCO1 b1f1b4663564084ad77bc7f7f2ecb5d8 [0,2,0,0,0,0|1,0,0]=3 4597 B13R1.346 CC(O)C(=O)N(C)CC1CCCC1 a74578d2953c9264228bd39309115d0a [0,2,0,0,0,0|2,0,0]=4 4598 B13R1.346 CC(O)C(=O)N(C)CC1CCCO1 3826d984329b8e0f2f592f28b953088d [0,2,0,0,0,0|1,0,0]=3 4599 B13R1.346 CC(S)C(=O)N(C)CC1CCCC1 5adea3938ccef502dc02ccd8f20b3388 [0,2,0,0,0,0|2,0,0]=4 4600 B13R1.346 CC(S)C(=O)N(C)CC1CCCO1 3a439a61fb3087775a949771412c42d3 [0,2,0,0,0,0|1,0,0]=3 4601 B13R1.346 CN(CC1CCCO1)C(=O)C(F)F f53b30b62bd47186474a8237317ac549 [0,2,0,0,0,0|2,0,0]=4 4602 B13R1.346 CN(CC1CCCO1)C(=O)C(O)O ce3ca8dc79e4f376e91ce1576d145ab6 [0,2,0,0,0,0|2,0,0]=4 4603 B13R1.346 C[C@@H](F)C(=O)N(C)CC1CCCC1 ca4898c3bbfbd4e894c755c4e83a3eb6 [0,2,0,0,0,0|2,0,0]=4 4604 B13R1.346 C[C@@H](F)C(=O)N(C)CC1CCCO1 0c12b973c3f42d33b1d21c0b74842938 [0,2,0,0,0,0|1,0,0]=3 4605 B13R1.346 C[C@@H](O)C(=O)N(C)CC1CCCC1 5b90abf7fe23372e353a5845ffd9a328 [0,2,0,0,0,0|2,0,0]=4 4606 B13R1.346 C[C@@H](O)C(=O)N(C)CC1CCCO1 9655e5f1eda4621035403534c3df9bc7 [0,2,0,0,0,0|1,0,0]=3 4607 B13R1.346 C[C@H](F)C(=O)N(C)CC1CCCC1 26309282b3c0999ab553632da6d0ba1e [0,2,0,0,0,0|2,0,0]=4 4608 B13R1.346 C[C@H](F)C(=O)N(C)CC1CCCO1 45af5a6678b0f58e57ef1ea34d95bd20 [0,2,0,0,0,0|1,0,0]=3 4609 B13R1.346 C[C@H](O)C(=O)N(C)CC1CCCC1 f777afe6fe05bc5caa3a2d549df7c3e9 [0,2,0,0,0,0|2,0,0]=4 4610 B13R1.346 C[C@H](O)C(=O)N(C)CC1CCCO1 4e5340d3d0f7bc5b2749f8755b130818 [0,2,0,0,0,0|1,0,0]=3 4611 B13R1.409 CCC(C=O)N(C)CC1CCCO1 3484cce3c438222b36140dc4e0b3b519 [0,2,0,0,0,0|1,0,1]=4 4612 B13R1.704 CCC(=O)N(C)CC1CCCN1C 329deeca5ddddc1e182a68c777699fa8 [0,2,0,0,0,0|2,0,0]=4 4613 B13R1.704 CCC(=O)N(C)C[C@@H]1CCCN1C 296b400e651b185fa8c6496c8df2f523 [0,2,0,0,0,0|2,0,0]=4 4614 B13R1.704 CCC(=O)N(C)C[C@H]1CCCN1C 1bf40c0b618d4e271eeb59213731e5e6 [0,2,0,0,0,0|2,0,0]=4 4615 B13R1.721 CCC(=O)N(CC)CC1CCCO1 8dbc8331fd097e0bc94c3844e76a95f3 [0,2,0,0,0,0|1,0,0]=3 4616 B13R1.721 CCN(CC1CCCO1)C(=O)CF 4bb4d18f6103c41213a58c104cae2832 [0,2,0,0,0,0|2,0,0]=4 4617 B13R1.721 CCN(CC1CCCO1)C(=O)CO 64b3546de1a547ce4dcdbdb48262d868 [0,2,0,0,0,0|2,0,0]=4 4618 B13R1.721 CCN(CC1CCCO1)C(=O)CS c4114a2e73390b23a90e46ffd769bcd7 [0,2,0,0,0,0|2,0,0]=4 4619 B13R1.2667 CCC(=O)N(C)CC1(CCCO1)C bf751b4ecb03b4b452670814b07ec31e [0,2,0,0,0,0|1,0,0]=3 4620 B13R1.2667 CN(CC1(CCCO1)C)C(=O)CF 9344818e53601c81d8d6137892e741c8 [0,2,0,0,0,0|2,0,0]=4 4621 B13R1.2667 CN(CC1(CCCO1)C)C(=O)CO cd0630d847f5f936acf07b377ed0585e [0,2,0,0,0,0|2,0,0]=4 4622 B13R1.2667 CN(CC1(CCCO1)C)C(=O)CS f103ff95a167fb4c47fab4b6bbe71c3c [0,2,0,0,0,0|2,0,0]=4 4623 B13R1.169 CC(C)C(=O)OCN1CCCC1C 581fb1e92b834714ca1be5b77055b723 [0,2,0,0,0,0|2,0,0]=4 4624 B13R1.169 CC(C)C(=O)OCN1CCCC1O c701f8ac2126fc2740beb76c29f8f275 [0,2,0,0,0,0|2,0,0]=4 4625 B13R1.169 CC(C)C(=O)OCN1CCC[C@@H]1C 9997cc49076d691ac5d5cad3ff3605bc [0,2,0,0,0,0|2,0,0]=4 4626 B13R1.169 CC(C)C(=O)OCN1CCC[C@H]1C 8952b7663dd7e9473fff1c3d06c170d8 [0,2,0,0,0,0|2,0,0]=4 4627 B13R1.169 CC(C)C(C)OCC1OCCC1C ab8eb5aae05e298810872cc9b0b76117 [0,2,0,0,0,0|1,0,1]=4 4628 B13R1.169 CC(F)C(=O)NCC1CCCC1O a27759cdcbdb31eae85aa3b70db858e1 [0,2,0,0,0,0|2,0,0]=4 4629 B13R1.169 CC(F)C(=O)NCC1CCCN1C c7125bbade7c95b2d7fbb38c83ea52b5 [0,2,0,0,0,0|2,0,0]=4 4630 B13R1.169 CC(F)C(=O)NC[C@@H]1CCCN1C d8b5d7ce6c377d8c76e88fa7342bfbdb [0,2,0,0,0,0|2,0,0]=4 4631 B13R1.169 CC(F)C(=O)NC[C@H]1CCCN1C 149d26006210843e217a6e3466d9e2ff [0,2,0,0,0,0|2,0,0]=4 4632 B13R1.169 CC(O)C(=O)NCC1CCCC1O 5992b54901e1984580daaff473dda7f1 [0,2,0,0,0,0|2,0,0]=4 4633 B13R1.169 CC(O)C(=O)NCC1CCCN1C 51320ff569542ebb6590cb006f42a6c2 [0,2,0,0,0,0|2,0,0]=4 4634 B13R1.169 CC(O)C(=O)NC[C@@H]1CCCN1C 61746be08d6369af1e11688351528f91 [0,2,0,0,0,0|2,0,0]=4 4635 B13R1.169 CC(O)C(=O)NC[C@H]1CCCN1C 632b9896c2d637be91ed3d4c53d56b01 [0,2,0,0,0,0|2,0,0]=4 4636 B13R1.169 CC(S)C(=O)NCC1CCCC1O 7700df3c778cc6ae8e470f09936ccf97 [0,2,0,0,0,0|2,0,0]=4 4637 B13R1.169 CC(S)C(=O)NCC1CCCN1C 88cb3afdedcab41f5d33fb72837c5f5d [0,2,0,0,0,0|2,0,0]=4 4638 B13R1.169 CC(S)C(=O)NC[C@@H]1CCCN1C 9d0281ae4c24dfa095f84bac00d67e7b [0,2,0,0,0,0|2,0,0]=4 4639 B13R1.169 CC(S)C(=O)NC[C@H]1CCCN1C ce7776d0a7bf880d84decc623d2c72bd [0,2,0,0,0,0|2,0,0]=4 4640 B13R1.169 C[C@@H](F)C(=O)NCC1CCCC1O ac910f24121321b7c5a6aadd19b5f1e5 [0,2,0,0,0,0|2,0,0]=4 4641 B13R1.169 C[C@@H](F)C(=O)NCC1CCCN1C 46186ea08f6bb471572f8789651d5696 [0,2,0,0,0,0|2,0,0]=4 4642 B13R1.169 C[C@@H](F)C(=O)NC[C@@H]1CCCN1C 3c2afe6f5eee3cf2e18f7a2bce27e4a5 [0,2,0,0,0,0|2,0,0]=4 4643 B13R1.169 C[C@@H](F)C(=O)NC[C@H]1CCCN1C 0e4f9eba51cea1fd5f3c15db4aa0028f [0,2,0,0,0,0|2,0,0]=4 4644 B13R1.169 C[C@@H](O)C(=O)NCC1CCCC1O 17bf2ff39bc1eb4eb9777087afb584b5 [0,2,0,0,0,0|2,0,0]=4 4645 B13R1.169 C[C@@H](O)C(=O)NCC1CCCN1C b4b4a0968bcfab51883ef04fc0aebe62 [0,2,0,0,0,0|2,0,0]=4 4646 B13R1.169 C[C@@H](O)C(=O)NC[C@@H]1CCCN1C e51db718187abb9847c9e44233cc0d3c [0,2,0,0,0,0|2,0,0]=4 4647 B13R1.169 C[C@@H](O)C(=O)NC[C@H]1CCCN1C 7d6377a455337654a70bff2fc4b87b64 [0,2,0,0,0,0|2,0,0]=4 4648 B13R1.169 C[C@H](F)C(=O)NCC1CCCC1O f57e44185d3d73331a63fb22a4d0cd84 [0,2,0,0,0,0|2,0,0]=4 4649 B13R1.169 C[C@H](F)C(=O)NCC1CCCN1C a015868084197692519c1aedfff8a548 [0,2,0,0,0,0|2,0,0]=4 4650 B13R1.169 C[C@H](F)C(=O)NC[C@@H]1CCCN1C e7ef8ffed66735aa98c8e6ec5d2ee22f [0,2,0,0,0,0|2,0,0]=4 4651 B13R1.169 C[C@H](F)C(=O)NC[C@H]1CCCN1C 36fd3a4cfa6d0065773a44ce25d9a48c [0,2,0,0,0,0|2,0,0]=4 4652 B13R1.169 C[C@H](O)C(=O)NCC1CCCC1O 3b480fb93a38c000761b3488a2a105f2 [0,2,0,0,0,0|2,0,0]=4 4653 B13R1.169 C[C@H](O)C(=O)NCC1CCCN1C 4795f8e911738dcb8e071bffd7a9cf6e [0,2,0,0,0,0|2,0,0]=4 4654 B13R1.169 C[C@H](O)C(=O)NC[C@@H]1CCCN1C 94e24a857893afaec81fa1a3838a17ef [0,2,0,0,0,0|2,0,0]=4 4655 B13R1.169 C[C@H](O)C(=O)NC[C@H]1CCCN1C 0b3b1a8cfbc3ba9b75ca56f291159283 [0,2,0,0,0,0|2,0,0]=4 4656 B13R1.2781 CC(C)(C)C(=O)COC1CCCO1 50cd27ed4df5c8348f4d51f0cf69951d [0,2,0,0,0,0|2,0,0]=4 4657 B13R1.2781 CC(C)(O)C(=O)COC1CCCO1 0bd4b666a12f786aa12ec7ddddafd932 [0,2,0,0,0,0|2,0,0]=4 4658 B13R1.2781 CC(F)(F)C(=O)NCC1CCCC1 2ef1a1b9f623d5fe25aac6155432c62a [0,2,0,0,0,0|2,0,0]=4 4659 B13R1.2781 CC(F)(F)C(=O)NCC1CCCO1 c4ac0759ec789a64c9c4449964fa3772 [0,2,0,0,0,0|1,0,0]=3 4660 B13R1.2781 CC(F)(F)C(=O)NC[C@@H]1CCCO1 43983dcf498d412e6968e68e7a3c5a25 [0,2,0,0,0,0|1,0,0]=3 4661 B13R1.2781 CC(F)(F)C(=O)NC[C@H]1CCCO1 0536ebad918bd47ae50fb32119ae4699 [0,2,0,0,0,0|1,0,0]=3 4662 B13R1.2781 CC(OCC1CCCO1)C(C)(C)O d3ef462fcedde27b6ac6929bbef0f5e2 [0,2,0,0,0,0|1,0,1]=4 4663 B13R1.2781 CC(OC[C@@H]1CCCO1)C(C)(C)O 623c98248e4b0afff7100c3275c6aecd [0,2,0,0,0,0|1,0,1]=4 4664 B13R1.2781 CC(OC[C@H]1CCCO1)C(C)(C)O ceda1fbf5c1ea8d71bd0b9a5afb87ee5 [0,2,0,0,0,0|1,0,1]=4 4665 B13R1.2781 O=C(NCC1CCCO1)C(F)(F)Br c4589aa833c7ede70388ed1f6afc484f [0,2,0,0,0,0|2,0,0]=4 4666 B13R1.2781 O=C(NCC1CCCO1)C(F)(F)Cl 9634398464c515fc13d0f93d8a4e8d10 [0,2,0,0,0,0|2,0,0]=4 4667 B13R1.2781 O=C(NCC1CCCO1)C(F)(F)F d7b4c065bf2255f27f8a4006e2ee3644 [0,2,0,0,0,0|2,0,0]=4 4668 B13R1.2781 O=C(NCC1CCCO1)C(F)(F)I d94982d31e932feb7dd854a0e46962a8 [0,2,0,0,0,0|2,0,0]=4 4669 B13R1.2781 O=C(NC[C@@H]1CCCO1)C(F)(F)Br e13fe93add4ccafb61f761e3bafcb286 [0,2,0,0,0,0|2,0,0]=4 4670 B13R1.2781 O=C(NC[C@@H]1CCCO1)C(F)(F)Cl 8a811fb2d1161c398a2539c3afe6492b [0,2,0,0,0,0|2,0,0]=4 4671 B13R1.2781 O=C(NC[C@@H]1CCCO1)C(F)(F)F 2269fd408bf4a6aed9c480886126cd82 [0,2,0,0,0,0|2,0,0]=4 4672 B13R1.2781 O=C(NC[C@@H]1CCCO1)C(F)(F)I c8db3f79ea3c894ffff78d3fa0a0dd2b [0,2,0,0,0,0|2,0,0]=4 4673 B13R1.2781 O=C(NC[C@H]1CCCO1)C(F)(F)Br 32090d642360aea8f909c2274bc319b4 [0,2,0,0,0,0|2,0,0]=4 4674 B13R1.2781 O=C(NC[C@H]1CCCO1)C(F)(F)Cl 86aa3bc4ecc2ab2988d4891b88a28335 [0,2,0,0,0,0|2,0,0]=4 4675 B13R1.2781 O=C(NC[C@H]1CCCO1)C(F)(F)F 4f94c08f2fcf49ec9973be281ae1f513 [0,2,0,0,0,0|2,0,0]=4 4676 B13R1.2781 O=C(NC[C@H]1CCCO1)C(F)(F)I 192c2c109107a5de0577854528c0751c [0,2,0,0,0,0|2,0,0]=4 4677 B13R1.3383 C#CC(OCC1CCCO1)C(C)C 308177e48b495c6e42db9cd991ef4935 [0,2,0,0,0,0|1,0,1]=4 4678 B13R1.3383 C/C=C(\OCC1CCCC1)/C(=O)O 44790c41b67a23d824278c851c5ef316 [0,2,0,0,0,0|1,0,1]=4 4679 B13R1.3383 C/C=C(\OCC1CCCO1)/C(=O)O 31b68226aadeae5bfdd8bd00e5cd3635 [0,2,0,0,0,0|0,0,1]=3 4680 B13R1.3383 C=CC(OCC1CCCO1)C(C)C 02ce3766bfb39c5c956890105bee64cc [0,2,0,0,0,0|1,0,1]=4 4681 B13R1.3383 CC(C)C(C#N)OCC1CCCO1 75a120c6b0b96eb2814dd3c845d6d0b1 [0,2,0,0,0,0|1,0,1]=4 4682 B13R1.3383 CC(C)C(C=O)NCC1CCCO1 3498706d47949a00b5f5d0c0b1798064 [0,2,0,0,0,0|1,0,1]=4 4683 B13R1.3383 CC(C)C(C=O)NC[C@@H]1CCCO1 8a0945b008f59e54458dfdd268ee3982 [0,2,0,0,0,0|1,0,1]=4 4684 B13R1.3383 CC(C)C(C=O)NC[C@H]1CCCO1 6d21291f866b5996835abe1079fb9cc4 [0,2,0,0,0,0|1,0,1]=4 4685 B13R1.3383 CC(C)C(C=O)OCC1CCCC1 025514d7d51453da2f25881b8dc55744 [0,2,0,0,0,0|1,0,1]=4 4686 B13R1.3383 CC(C)C(C=O)OCC1CCCO1 28ce09336030a41c50ff5f00ee694ec0 [0,2,0,0,0,0|0,0,1]=3 4687 B13R1.3383 CC(C)C(C=O)OCC1CCCS1 608168d43327e4a4883c7717ccfbbdd3 [0,2,0,0,0,0|0,1,1]=4 4688 B13R1.3383 CC(C)C(C=O)OC[C@@H]1CCCO1 4010101b80e00e9d0d356830c0f9cfa5 [0,2,0,0,0,0|0,0,1]=3 4689 B13R1.3383 CC(C)C(C=O)OC[C@H]1CCCO1 f45ff6a9af9a463e4f191bfe2c4043a0 [0,2,0,0,0,0|0,0,1]=3 4690 B13R1.3383 CCC(NCC1CCCO1)C(=O)N 04b4520702e6b60e0f937473db243e3c [0,2,0,0,0,0|1,0,1]=4 4691 B13R1.3383 CCC(NCC1CCCO1)C(=O)O 8b8d5f259b47e9954223824f3d790e89 [0,2,0,0,0,0|1,0,1]=4 4692 B13R1.3383 CCC(NC[C@@H]1CCCO1)C(=O)N aa03bbda88cc958bf8c880b29e2f6361 [0,2,0,0,0,0|1,0,1]=4 4693 B13R1.3383 CCC(NC[C@@H]1CCCO1)C(=O)O 15d54f91f0b4b4c680eea1672ac166f8 [0,2,0,0,0,0|1,0,1]=4 4694 B13R1.3383 CCC(NC[C@H]1CCCO1)C(=O)N 85fa3424b7a1dbbd7f8b25932b1bb9d7 [0,2,0,0,0,0|1,0,1]=4 4695 B13R1.3383 CCC(NC[C@H]1CCCO1)C(=O)O 66eee7af206b74d7dfd221ea0bfad2c4 [0,2,0,0,0,0|1,0,1]=4 4696 B13R1.3383 CCC(OCC1CCCC1)C(=O)N e5e14b7e0d51818d8c13f3366919132a [0,2,0,0,0,0|1,0,1]=4 4697 B13R1.3383 CCC(OCC1CCCC1)C(=O)O 6c181ba4067d30042f143425c2ba1dd7 [0,2,0,0,0,0|1,0,1]=4 4698 B13R1.3383 CCC(OCC1CCCO1)C(=O)N c16914951d34e2143a4ffa6d6f9ac797 [0,2,0,0,0,0|0,0,1]=3 4699 B13R1.3383 CCC(OCC1CCCO1)C(=O)O 6d3b93cd19af913bfdd9e613c116da0c [0,2,0,0,0,0|0,0,1]=3 4700 B13R1.3383 CCC(OCC1CCCO1)C(C)C ccff779fd1c4efb396e084185a3798d6 [0,2,0,0,0,0|1,0,1]=4 4701 B13R1.3383 CCC(OCC1CCCS1)C(=O)N b950285097ac5547cd517ba219f46bab [0,2,0,0,0,0|0,1,1]=4 4702 B13R1.3383 CCC(OC[C@@H]1CCCO1)C(=O)N 308c7d5eee9ecd1c4469a69259ebf0e9 [0,2,0,0,0,0|0,0,1]=3 4703 B13R1.3383 CCC(OC[C@H]1CCCO1)C(=O)N 6db9417c2f5c6cdac2cb14077a11b64e [0,2,0,0,0,0|0,0,1]=3 4704 B13R1.3383 CC[C@@H](NCC1CCCO1)C(=O)O b67fc1fdad7589f4da20563793d2b224 [0,2,0,0,0,0|1,0,1]=4 4705 B13R1.3383 CC[C@@H](NC[C@@H]1CCCO1)C(=O)O 97729c6805d7afc65f915aa1db81dfd3 [0,2,0,0,0,0|1,0,1]=4 4706 B13R1.3383 CC[C@@H](NC[C@H]1CCCO1)C(=O)O 5be7ff208c9cec5c08cdad343558fdc9 [0,2,0,0,0,0|1,0,1]=4 4707 B13R1.3383 CC[C@@H](OCC1CCCC1)C(=O)O 78a8c5159aefeb6cd2b90061e0113737 [0,2,0,0,0,0|1,0,1]=4 4708 B13R1.3383 CC[C@@H](OCC1CCCO1)C(=O)O b07dc22943dda04187e901c107ed696d [0,2,0,0,0,0|0,0,1]=3 4709 B13R1.3383 CC[C@H](NCC1CCCO1)C(=O)N b737e06cb6ee1e5e5572068f39ef090e [0,2,0,0,0,0|1,0,1]=4 4710 B13R1.3383 CC[C@H](NCC1CCCO1)C(=O)O 72f3b0403c367befd66debd84c01e7ea [0,2,0,0,0,0|1,0,1]=4 4711 B13R1.3383 CC[C@H](NC[C@@H]1CCCO1)C(=O)O 35fa678408ebea562b8da5f0022dee0e [0,2,0,0,0,0|1,0,1]=4 4712 B13R1.3383 CC[C@H](NC[C@H]1CCCO1)C(=O)O c16442fe43338686592008055805db27 [0,2,0,0,0,0|1,0,1]=4 4713 B13R1.3383 CC[C@H](OCC1CCCC1)C(=O)O 2140f2118a609a13a7377bac48d5f910 [0,2,0,0,0,0|1,0,1]=4 4714 B13R1.3383 CC[C@H](OCC1CCCO1)C(=O)O 794ad0bd2b640d3291dc26734dcf7e8a [0,2,0,0,0,0|0,0,1]=3 4715 B13R1.3383 O=C(O)[C@@H](CF)OCC1CCCO1 d4c59ff3588bc33d2bcf9d8f326fe78a [0,2,0,0,0,0|1,0,1]=4 4716 B13R1.6166 C=C(C)C(=O)NCC1(CCCO1)C e8603781e47d381ff01f0d0579319a24 [0,2,0,0,0,0|1,0,1]=4 4717 B13R1.6166 CC(=O)C(=O)NCC1(CCCO1)C f1f3958716e67e063e4ce72b23163621 [0,2,0,0,0,0|1,0,1]=4 4718 B13R1.6166 CC(C)C(C)OCC1(CCCO1)C 2eb6bc6c063e61f5570c57789e733ad2 [0,2,0,0,0,0|1,0,1]=4 4719 B13R1.6166 CC(F)C(=O)NCC1(CCCC1)C eb2494372e5f74a3e434e827416168b8 [0,2,0,0,0,0|2,0,0]=4 4720 B13R1.6166 CC(F)C(=O)NCC1(CCCC1)O 488ca37ee5b565ead71c2ba68e474848 [0,2,0,0,0,0|2,0,0]=4 4721 B13R1.6166 CC(F)C(=O)NCC1(CCCO1)C 7875f88af879810234db00816a521fe1 [0,2,0,0,0,0|1,0,0]=3 4722 B13R1.6166 CC(O)C(=O)NCC1(CCCC1)C 11dbd230215b5fa961d539c0e59c9ee8 [0,2,0,0,0,0|2,0,0]=4 4723 B13R1.6166 CC(O)C(=O)NCC1(CCCC1)F 9f93e27d73e3017a444e6236a0944530 [0,2,0,0,0,0|2,0,0]=4 4724 B13R1.6166 CC(O)C(=O)NCC1(CCCC1)O 6747c7d93f6f566f39648f6a486ddc61 [0,2,0,0,0,0|2,0,0]=4 4725 B13R1.6166 CC(O)C(=O)NCC1(CCCO1)C 2619cbf4810a0aeed275ea414642fb75 [0,2,0,0,0,0|1,0,0]=3 4726 B13R1.6166 CC(S)C(=O)NCC1(CCCC1)C 2a7fc7abdc234b1a8b1d7c307f2568b2 [0,2,0,0,0,0|2,0,0]=4 4727 B13R1.6166 CC(S)C(=O)NCC1(CCCC1)F c7ecc129da93b0aede7543c6e115ae96 [0,2,0,0,0,0|2,0,0]=4 4728 B13R1.6166 CC(S)C(=O)NCC1(CCCC1)O 2c77aa135ad8d0b52cd3d02e6bb9ae99 [0,2,0,0,0,0|2,0,0]=4 4729 B13R1.6166 CC(S)C(=O)NCC1(CCCO1)C a0a03ec8760d3bbb27f891e47fe9112c [0,2,0,0,0,0|1,0,0]=3 4730 B13R1.6166 CC1(CCCO1)CNC(=O)C(F)F ec7dbb65169fd0966e72a4d66f107f63 [0,2,0,0,0,0|2,0,0]=4 4731 B13R1.6166 CC1(CCCO1)CNC(=O)C(O)O fe798b4270a2d622f51be19cbd43a6b4 [0,2,0,0,0,0|2,0,0]=4 4732 B13R1.6166 C[C@@H](F)C(=O)NCC1(CCCC1)C 4049a203be83d62da8ead3b49def510b [0,2,0,0,0,0|2,0,0]=4 4733 B13R1.6166 C[C@@H](F)C(=O)NCC1(CCCC1)O 7ac85801054461b3eb89891ee6592d92 [0,2,0,0,0,0|2,0,0]=4 4734 B13R1.6166 C[C@@H](F)C(=O)NCC1(CCCO1)C 9c733146ec668aa2c5a3f9e885541310 [0,2,0,0,0,0|1,0,0]=3 4735 B13R1.6166 C[C@@H](O)C(=O)NCC1(CCCC1)C 7566330192ef1c8d5130aa3f1942b21d [0,2,0,0,0,0|2,0,0]=4 4736 B13R1.6166 C[C@@H](O)C(=O)NCC1(CCCC1)F cf8022d1a652b0a44c665aefef35d512 [0,2,0,0,0,0|2,0,0]=4 4737 B13R1.6166 C[C@@H](O)C(=O)NCC1(CCCC1)O ec0d07441d09f0d7c9965acc4087e580 [0,2,0,0,0,0|2,0,0]=4 4738 B13R1.6166 C[C@@H](O)C(=O)NCC1(CCCO1)C b871ecb506088dd867d0b6a7462d758d [0,2,0,0,0,0|1,0,0]=3 4739 B13R1.6166 C[C@H](F)C(=O)NCC1(CCCC1)C eb6d0d3d601d5d11a4dad8b3dccc5f7f [0,2,0,0,0,0|2,0,0]=4 4740 B13R1.6166 C[C@H](F)C(=O)NCC1(CCCC1)O 4940953719a9dd29cd7dc2e968badf1b [0,2,0,0,0,0|2,0,0]=4 4741 B13R1.6166 C[C@H](F)C(=O)NCC1(CCCO1)C d8484b1bc5c8f6e803ef07352888265f [0,2,0,0,0,0|1,0,0]=3 4742 B13R1.6166 C[C@H](O)C(=O)NCC1(CCCC1)C 957870e96fe0039aed22f1ce22d787ef [0,2,0,0,0,0|2,0,0]=4 4743 B13R1.6166 C[C@H](O)C(=O)NCC1(CCCC1)F c2761d4f42b38e80987521afd96fa38f [0,2,0,0,0,0|2,0,0]=4 4744 B13R1.6166 C[C@H](O)C(=O)NCC1(CCCC1)O bca1e43ca8f1d141df9523a7627e1b96 [0,2,0,0,0,0|2,0,0]=4 4745 B13R1.6166 C[C@H](O)C(=O)NCC1(CCCO1)C ea5e254a95cbc9000e6bea0f68add214 [0,2,0,0,0,0|1,0,0]=3 4746 B13R1.316 CCC(C=O)OCC1CCCC1=O 4c3b809354f77cda89d67ceb228a88a9 [0,2,0,0,0,0|1,0,1]=4 4747 B13R1.316 CCC(C=O)OCC1CCCC1C dd9678cde44fad12231190dd642095c1 [0,2,0,0,0,0|1,0,1]=4 4748 B13R1.316 CCC(C=O)OCC1CCCN1C cf0caec40b7a578d30d4ba8fc5017d7c [0,2,0,0,0,0|1,0,1]=4 4749 B13R1.316 CCC(C=O)OCC1OCCC1C 7b093497c9a5c2e40a85fbb1236f71c7 [0,2,0,0,0,0|0,0,1]=3 4750 B13R1.316 CCC(C=O)OC[C@@H]1CCCN1C ae20560dea6489331e300b1dfe83d28a [0,2,0,0,0,0|1,0,1]=4 4751 B13R1.316 CCC(C=O)OC[C@@H]1CCC[C@H]1F 1db37408d676675b6f157f24ba71de37 [0,2,0,0,0,0|1,0,1]=4 4752 B13R1.316 CCC(C=O)OC[C@H]1CCCN1C c68e5028b45041252fed54bd875a0442 [0,2,0,0,0,0|1,0,1]=4 4753 B13R1.316 CCC(CC)OCC1OCCC1C bc54aeaaf135ae6372fc91c11bb4053a [0,2,0,0,0,0|1,0,1]=4 4754 B13R1.935 CCC(C=O)NCC1(CCCO1)C 636dee059c2fdf1fbb98fee78796ed8b [0,2,0,0,0,0|1,0,1]=4 4755 B13R1.935 CCC(C=O)OCC1(CCCC1)C a2790f2607ec1e34add89b2125fa1273 [0,2,0,0,0,0|1,0,1]=4 4756 B13R1.935 CCC(C=O)OCC1(CCCC1)F bc075ee2eb7996237159fc7fd84bc814 [0,2,0,0,0,0|1,0,1]=4 4757 B13R1.935 CCC(C=O)OCC1(CCCO1)C a67912412b33ea4246c5e587f37016f1 [0,2,0,0,0,0|0,0,1]=3 4758 B13R1.935 CCC(CC)OCC1(CCCO1)C 64f5a88df28ed63b8b7cc2784f6a87a1 [0,2,0,0,0,0|1,0,1]=4 4759 B13R1.598 CCC(=O)OCN1CCCC1(C)C 9dc7f70a192d7d5635dfe4b77b10df55 [0,2,0,0,0,0|2,0,0]=4 4760 B13R1.613 C#CC1CCCN1COC(=O)CC c83b2d6ccb332704425d0d7757aa2908 [0,2,0,0,0,0|2,0,0]=4 4761 B13R1.613 CCC(=O)NCC1CCCN1CC 6182dfacf12e29324f7cbe518bcd31cd [0,2,0,0,0,0|2,0,0]=4 4762 B13R1.613 CCC(=O)NC[C@@H]1CCCN1CC b071f92c6eff088ccb628784a71f84da [0,2,0,0,0,0|2,0,0]=4 4763 B13R1.613 CCC(=O)NC[C@H]1CCCN1CC 708b0346cb2fa08e3401ff2a595959e3 [0,2,0,0,0,0|2,0,0]=4 4764 B13R1.613 CCC(=O)OCN1CCCC1C#N 4a7addb9deacc9100a58e4aa83a22185 [0,2,0,0,0,0|2,0,0]=4 4765 B13R1.613 CCC(=O)OCN1CCCC1CC 9f00493ef55a1b256a15911599d0cf43 [0,2,0,0,0,0|2,0,0]=4 4766 B13R1.613 CCC(=O)OCN1CCCC1CO a79248fd31be2488d9b6a2b1a35eb5fd [0,2,0,0,0,0|2,0,0]=4 4767 B13R1.613 CCC(=O)OCN1CCCC1OC d4c667712f8086f9566ec46174cc833b [0,2,0,0,0,0|2,0,0]=4 4768 B13R1.613 CCC(=O)OCN1CCC[C@@H]1CF acc99c709dccb69debd704c3bee257f2 [0,2,0,0,0,0|2,0,0]=4 4769 B13R1.613 CCC(=O)OCN1CCC[C@@H]1CO cd777af57402a8f564151fd6e5642fe0 [0,2,0,0,0,0|2,0,0]=4 4770 B13R1.613 CCC(=O)OCN1CCC[C@H]1C#N 5d325612d1340b65100a158e297d4055 [0,2,0,0,0,0|2,0,0]=4 4771 B13R1.613 CCC(=O)OCN1CCC[C@H]1CC ea55b020021674041e71558ed8e79c39 [0,2,0,0,0,0|2,0,0]=4 4772 B13R1.613 CCC(=O)OCN1CCC[C@H]1CF 4b5c399e6ba32da614ba161110f5b2cf [0,2,0,0,0,0|2,0,0]=4 4773 B13R1.613 CCC(=O)OCN1CCC[C@H]1CO e4dc33d2ea5b2f6e429ec516fb7733e0 [0,2,0,0,0,0|2,0,0]=4 4774 B13R1.2042 CCC(=O)OCN1C(CCC1C)C abb73f3c4214f6ff484c46af7a090c3b [0,2,0,0,0,0|2,0,0]=4 4775 B13R1.2042 CCC(=O)OCN1[C@@H](CC[C@@H]1C)C ba09ba1ec6220e6eb9a6684f7acefda3 [0,2,0,0,0,0|2,0,0]=4 4776 B13R1.2042 CCC(=O)OCN1[C@@H](CC[C@H]1C)C 4f8b2efe600c9514f6566b952db804a6 [0,2,0,0,0,0|2,0,0]=4 4777 B13R1.2042 CCC(=O)OCN1[C@H](CC[C@@H]1C)C 7bd97d0053295d6e6bb921d31268bedd [0,2,0,0,0,0|2,0,0]=4 4778 B13R1.4713 CCC(=O)NCC1(CCCC1)CO 8094e1555de31bf40067452e034f5827 [0,2,0,0,0,0|2,0,0]=4 4779 B11R1.44 CCC(=O)N1CCC(C1)CC 9c942fe148046ddf3325c6b967f2244f [0,0,1,1,0,0|2,0,0]=4 4780 B11R1.44 CCC(=O)N1CCC(C1)OC 2f17bb79caa74cf87be6008ac6d034ae [0,0,1,1,0,0|1,0,0]=3 4781 B11R1.44 CCC(=O)N1CC[C@@H](C1)OC ec580c6d1933e6006530bac61136e134 [0,0,1,1,0,0|1,0,0]=3 4782 B11R1.44 CCC(=O)N1CC[C@H](C1)OC 5bfeec9ebab9fbb88580ab3bd1bdae72 [0,0,1,1,0,0|1,0,0]=3 4783 B11R1.44 COC1CCN(C1)C(=O)CF a9379b60bfa0a70a077f1e165dbc371e [0,0,1,1,0,0|2,0,0]=4 4784 B11R1.44 COC1CCN(C1)C(=O)CO 972fd081c7736390f607aa362ac08d82 [0,0,1,1,0,0|2,0,0]=4 4785 B11R1.44 COC1CCN(C1)C(=O)CS d6d721e82eb9cdd57e69185afe7d3a05 [0,0,1,1,0,0|2,0,0]=4 4786 B11R1.44 CO[C@@H]1CCN(C1)C(=O)CF 4447843eb796357db01d25102569ca4d [0,0,1,1,0,0|2,0,0]=4 4787 B11R1.44 CO[C@@H]1CCN(C1)C(=O)CO 898f6246da47ebfb717af6739b483e53 [0,0,1,1,0,0|2,0,0]=4 4788 B11R1.44 CO[C@@H]1CCN(C1)C(=O)CS aba3f11130ecccd1a8d2accf036a7eae [0,0,1,1,0,0|2,0,0]=4 4789 B11R1.44 CO[C@H]1CCN(C1)C(=O)CF 7451f21091a1aea5cfe5b5b1f4ed9365 [0,0,1,1,0,0|2,0,0]=4 4790 B11R1.44 CO[C@H]1CCN(C1)C(=O)CO e0e7a6a3ecb3d732dc7befbd7274b4c2 [0,0,1,1,0,0|2,0,0]=4 4791 B11R1.44 CO[C@H]1CCN(C1)C(=O)CS 45b614b4eb7bc603f25eb4a58a3b0d5c [0,0,1,1,0,0|2,0,0]=4 4792 B11R1.272 CCC(=O)NC1CCC1OC e7285f16d1d5dbd47997b628016d1378 [0,0,1,1,0,0|1,0,0]=3 4793 B11R1.272 CCC(=O)N[C@@H]1CC[C@@H]1OC d9f4964db7ec69354b764cc67fe5d6e6 [0,0,1,1,0,0|1,0,0]=3 4794 B11R1.272 CCC(=O)N[C@@H]1CC[C@H]1OC 406ec9297b0387d64c35765792c90ee7 [0,0,1,1,0,0|1,0,0]=3 4795 B11R1.272 CCC(=O)N[C@H]1CC[C@@H]1OC 590e3059730ce6ee85e93dfc686f563e [0,0,1,1,0,0|1,0,0]=3 4796 B11R1.272 CCC(=O)N[C@H]1CC[C@H]1OC 150c5a1082953ed5314588ea5763b42d [0,0,1,1,0,0|1,0,0]=3 4797 B11R1.272 COC1CCC1NC(=O)CF aa8085ddcec47c2bfbcb7f60e560123d [0,0,1,1,0,0|2,0,0]=4 4798 B11R1.272 COC1CCC1NC(=O)CO 1b17aed343688187b223e591cc0354d6 [0,0,1,1,0,0|2,0,0]=4 4799 B11R1.272 COC1CCC1NC(=O)CS 7aeacc7bcef07b954e877848b80c70ba [0,0,1,1,0,0|2,0,0]=4 4800 B11R1.272 CO[C@@H]1CC[C@@H]1NC(=O)CF 07603586c3d1c9661869f1aeba662ed6 [0,0,1,1,0,0|2,0,0]=4 4801 B11R1.272 CO[C@@H]1CC[C@@H]1NC(=O)CO 82bc1c2e95ec1f133b3ca922d795780e [0,0,1,1,0,0|2,0,0]=4 4802 B11R1.272 CO[C@@H]1CC[C@@H]1NC(=O)CS b0a9e1e7ef1426fd4f3fa25385e652d0 [0,0,1,1,0,0|2,0,0]=4 4803 B11R1.272 CO[C@@H]1CC[C@H]1NC(=O)CF 5f6beea41f357a2d10ef1af80d1c1ef2 [0,0,1,1,0,0|2,0,0]=4 4804 B11R1.272 CO[C@@H]1CC[C@H]1NC(=O)CO d46e37f29e5e4172ca6bfe7cb6cbad70 [0,0,1,1,0,0|2,0,0]=4 4805 B11R1.272 CO[C@@H]1CC[C@H]1NC(=O)CS bb0d7435df3998d3594152f9c12e41fd [0,0,1,1,0,0|2,0,0]=4 4806 B11R1.272 CO[C@H]1CC[C@@H]1NC(=O)CF 7b4130950c500c6337057367391329ef [0,0,1,1,0,0|2,0,0]=4 4807 B11R1.272 CO[C@H]1CC[C@@H]1NC(=O)CO 23b8c1774ee2861a3cc420c460812089 [0,0,1,1,0,0|2,0,0]=4 4808 B11R1.272 CO[C@H]1CC[C@@H]1NC(=O)CS 6c798be73ffdb81c76442c1cdcc7a442 [0,0,1,1,0,0|2,0,0]=4 4809 B11R1.272 CO[C@H]1CC[C@H]1NC(=O)CF 5fc47be6942516e7c06340432a7c3902 [0,0,1,1,0,0|2,0,0]=4 4810 B11R1.272 CO[C@H]1CC[C@H]1NC(=O)CO e589e896780362d990b6f64f7b60b1aa [0,0,1,1,0,0|2,0,0]=4 4811 B11R1.272 CO[C@H]1CC[C@H]1NC(=O)CS e7d57d86a4c595583ff50292b480c074 [0,0,1,1,0,0|2,0,0]=4 4812 B11R1.938 CCC(C)OCC1(CC1)OC dc665607b95f0f408e25bcb6527c50fe [0,0,1,1,0,0|1,0,1]=4 4813 B11R1.1 C#CCOC1CCC(=O)OC1 b43cc436f98b53b5c0b5fef0b13833c9 [0,0,1,1,0,0|0,0,2]=4 4814 B11R1.1 C=CCOC1CCC(=O)OC1 540d874e016052e8606b11acde6de179 [0,0,1,1,0,0|0,0,2]=4 4815 B11R1.1 CCCNC1CCC(=O)NC1 01bca8b88e0ca1be03a17004b6a757eb [0,0,1,1,0,0|2,0,0]=4 4816 B11R1.1 CCCN[C@@H]1CCC(=O)NC1 f6da54c348c4f94d3f0c0f59910a83e9 [0,0,1,1,0,0|2,0,0]=4 4817 B11R1.1 CCCN[C@H]1CCC(=O)NC1 102971ed7a08e614b31cecd45e20f679 [0,0,1,1,0,0|2,0,0]=4 4818 B11R1.1 CCCOC1CC=C(CC1)Br 24e3a1efb1cb09f20e9f7cb49f5c0622 [0,0,1,1,0,0|2,0,0]=4 4819 B11R1.1 CCCOC1CCC(=O)CC1 bd2b467d79e74784675ac0fed3b52410 [0,0,1,1,0,0|1,0,0]=3 4820 B11R1.1 CCCOC1CCC(=O)NC1 2c5714f2e0f298f2039432cc852f7bea [0,0,1,1,0,0|1,0,0]=3 4821 B11R1.1 CCCOC1CCC(=O)OC1 14f68677ebd93dd79e6aff031f73ae29 [0,0,1,1,0,0|0,0,0]=2 4822 B11R1.1 CCCOC1CNC(=O)NC1 1f9252325261c65cd6cb040142d3a805 [0,0,1,1,0,0|2,0,0]=4 4823 B11R1.1 CCCO[C@@H]1CCC(=O)NC1 a1b5fbd9589b341d2f02f45d48cf9b8b [0,0,1,1,0,0|1,0,0]=3 4824 B11R1.1 CCCO[C@H]1CCC(=O)NC1 d60f46dfa0faf1fef277b47dbe8465b4 [0,0,1,1,0,0|1,0,0]=3 4825 B11R1.1 COCOC1CCC(=O)CC1 fea8160e4410982ee670f1bff435143f [0,0,1,1,0,0|2,0,0]=4 4826 B11R1.1 COCOC1CCC(=O)NC1 e620a3f19a066effd108174e2aab5f08 [0,0,1,1,0,0|2,0,0]=4 4827 B11R1.1 COCOC1CCC(=O)OC1 7bbb527ea6b8b0aa3dea9ab4b8ad3e42 [0,0,1,1,0,0|1,0,0]=3 4828 B11R1.1 COCO[C@@H]1CCC(=O)NC1 566ac7f8468ea299cc9c8d5cf850f41d [0,0,1,1,0,0|2,0,0]=4 4829 B11R1.1 COCO[C@H]1CCC(=O)NC1 d9334ae89d7b993027e1754cd1f9c595 [0,0,1,1,0,0|2,0,0]=4 4830 B11R1.1 CSCOC1CCC(=O)CC1 7e63585c350d6c74d6865a68487a4cfb [0,0,1,1,0,0|2,0,0]=4 4831 B11R1.1 CSCOC1CCC(=O)NC1 dc54ed725f13709124794a7b3cddd1f1 [0,0,1,1,0,0|2,0,0]=4 4832 B11R1.1 CSCOC1CCC(=O)OC1 2a56f8b9adee39ece1780f4b86a249e9 [0,0,1,1,0,0|1,0,0]=3 4833 B11R1.1 CSCO[C@@H]1CCC(=O)NC1 089ea19b3027c689354619445d2d9ddd [0,0,1,1,0,0|2,0,0]=4 4834 B11R1.1 CSCO[C@H]1CCC(=O)NC1 ce29c4f0482fd232d2e8fd9e61508aaf [0,0,1,1,0,0|2,0,0]=4 4835 B11R1.1 N#CCOC1CCC(=O)OC1 2e8c4e8adb9e98d631a4b39f62b8705b [0,0,1,1,0,0|1,0,1]=4 4836 B11R1.1 O=C1CCC(CC1)NCCO 09b1daa64cc1523074ce66ce577e58f7 [0,0,1,1,0,0|2,0,0]=4 4837 B11R1.1 O=C1CCC(CC1)OCCF e50737a0ff4d6fe15d99594f5f7e9dfb [0,0,1,1,0,0|2,0,0]=4 4838 B11R1.1 O=C1CCC(CC1)OCCS 4a84df1baa5611a6684da63acd5a0f89 [0,0,1,1,0,0|2,0,0]=4 4839 B11R1.1 O=C1CCC(CN1)CNCO 3df6172398829c8381b9dcc070296268 [0,0,1,1,0,0|2,0,0]=4 4840 B11R1.1 O=C1CCC(CN1)NCCO 61cee4b6bf8e70f48c6a5b9a6ec567f5 [0,0,1,1,0,0|2,0,0]=4 4841 B11R1.1 O=C1CCC(CN1)OCCF 62ec5c43737dd0f108edab62eb6afebf [0,0,1,1,0,0|2,0,0]=4 4842 B11R1.1 O=C1CCC(CN1)OCCS 6c884fe800eef59f4ba64b4695923383 [0,0,1,1,0,0|2,0,0]=4 4843 B11R1.1 O=C1CCC(CO1)OCCF 2fe856fd4572c2d2c163269a480451cf [0,0,1,1,0,0|1,0,0]=3 4844 B11R1.1 O=C1CCC(CO1)OCCS 52ab2dec8247620d8be01eb74f832e4e [0,0,1,1,0,0|1,0,0]=3 4845 B11R1.1 O=C1CC[C@@H](CN1)NCCO 1e8614144ec4641c0457520096eb168d [0,0,1,1,0,0|2,0,0]=4 4846 B11R1.1 O=C1CC[C@@H](CN1)OCCF 242e5cafd20fb0b9444b6bbabed0b900 [0,0,1,1,0,0|2,0,0]=4 4847 B11R1.1 O=C1CC[C@@H](CN1)OCCS 0244ec49e2c90e4c98fda6255965c07c [0,0,1,1,0,0|2,0,0]=4 4848 B11R1.1 O=C1CC[C@H](CN1)NCCO e255ede5447a24caf37b5e061626632f [0,0,1,1,0,0|2,0,0]=4 4849 B11R1.1 O=C1CC[C@H](CN1)OCCF 35e8fc43de89f382fca3afc968c45e63 [0,0,1,1,0,0|2,0,0]=4 4850 B11R1.1 O=C1CC[C@H](CN1)OCCS 8bcbcfc9e4f13f1240083b7bcb766dbe [0,0,1,1,0,0|2,0,0]=4 4851 B11R1.1 O=CCOC1CCC(=O)OC1 9f2163389721640fc416d26b80ed80b1 [0,0,1,1,0,0|1,0,1]=4 4852 B11R1.13 CC1C(=O)NCCN1CCO 33e418a6d987c1a5c3995f157055f32b [0,0,1,1,0,0|2,0,0]=4 4853 B11R1.13 CCCN1CCNC(=O)C1C e2000285665816158bad39a600919fdf [0,0,1,1,0,0|2,0,0]=4 4854 B11R1.13 CCCN1CCNC(=O)[C@@H]1C 5f00d6742afd6e2977c386756da7cab8 [0,0,1,1,0,0|2,0,0]=4 4855 B11R1.13 CCCN1CCNC(=O)[C@H]1C 5612e150fb5409c8a4be11e1d3c4784d [0,0,1,1,0,0|2,0,0]=4 4856 B11R1.13 C[C@@H]1C(=O)NCCN1CCO eae193c5a50e47d49968a87d2a7c9d0d [0,0,1,1,0,0|2,0,0]=4 4857 B11R1.13 C[C@H]1C(=O)NCCN1CCO cd13ea57769fd2f09a601f10e985e0d6 [0,0,1,1,0,0|2,0,0]=4 4858 B11R1.40 CCC(=O)CN1CCCOC1 7046902aefff4b3e599b27f052d2ad82 [0,0,1,1,0,0|2,0,0]=4 4859 B11R1.40 CCC(=O)NC1CCCOC1 6a44e5ed4a68ff40ee26387827becf9a [0,0,1,1,0,0|1,0,0]=3 4860 B11R1.40 CCC(=O)N[C@@H]1CCCOC1 07ed65afefafaafb25ccddc8b9d18cc2 [0,0,1,1,0,0|1,0,0]=3 4861 B11R1.40 CCC(=O)N[C@H]1CCCOC1 87319a9c3ec35612f157bccaab09fdd1 [0,0,1,1,0,0|1,0,0]=3 4862 B11R1.40 CCC(C)OC1CCCCO1 866400394c66efa3e01b8163a60ae9ed [0,0,1,1,0,0|1,0,1]=4 4863 B11R1.40 CCC(C)OC1CCCOC1 a2625f8a1e0bc12a01dd630844e12512 [0,0,1,1,0,0|1,0,1]=4 4864 B11R1.40 CCC(C)O[C@@H]1CCCOC1 aa904e469a395a41aa272c38fcc1d6d5 [0,0,1,1,0,0|1,0,1]=4 4865 B11R1.40 CCC(C)O[C@H]1CCCOC1 3fdecd21fd85b255e75afd742daeafb1 [0,0,1,1,0,0|1,0,1]=4 4866 B11R1.40 CC[C@@H](C)OC1CCCCO1 f47118099e5a490bf071faff600b4871 [0,0,1,1,0,0|1,0,1]=4 4867 B11R1.40 CC[C@@H](C)OC1CCCOC1 26819f30e2a7a47e39a339a133015cb2 [0,0,1,1,0,0|1,0,1]=4 4868 B11R1.40 CC[C@H](C)OC1CCCCO1 8a6ec1d622767f749f7d91ce92b4a5bc [0,0,1,1,0,0|1,0,1]=4 4869 B11R1.40 CC[C@H](C)OC1CCCOC1 6649f6146f685c4892b3bddc1d3097bb [0,0,1,1,0,0|1,0,1]=4 4870 B11R1.40 O=C(CF)NC1CCCOC1 374e78ec6ebec43e094f69eddb35aed8 [0,0,1,1,0,0|2,0,0]=4 4871 B11R1.40 O=C(CF)N[C@@H]1CCCOC1 fa51cd16e98b0ab770f31f46f1f33cc0 [0,0,1,1,0,0|2,0,0]=4 4872 B11R1.40 O=C(CF)N[C@H]1CCCOC1 4bf00f909078d5c8b394a67173bf6d69 [0,0,1,1,0,0|2,0,0]=4 4873 B11R1.40 O=C(CO)NC1CCCOC1 e68fca1be22977985af541802f524cec [0,0,1,1,0,0|2,0,0]=4 4874 B11R1.40 O=C(CO)N[C@@H]1CCCOC1 53c5ab99580ab667aa55ce860987381b [0,0,1,1,0,0|2,0,0]=4 4875 B11R1.40 O=C(CO)N[C@H]1CCCOC1 982073ebf29b28f3868e25b25930c9a3 [0,0,1,1,0,0|2,0,0]=4 4876 B11R1.47 CCCOCCOC1CCC1 bbceec19bb20ee49155cb185e848c1f0 [0,0,1,1,0,0|1,0,1]=4 4877 B11R1.59 CCC(=O)N1CCCC1CC 2ce87378127394d65266906acf474f6e [0,0,1,1,0,0|2,0,0]=4 4878 B11R1.59 CCC(=O)N1CCCC1CO a30543a2e0b85ced04a885e63f2a90f6 [0,0,1,1,0,0|1,0,0]=3 4879 B11R1.59 CCC(=O)N1CCC[C@@H]1CF d9a66285aa8275f1d9f57e277d52b988 [0,0,1,1,0,0|2,0,0]=4 4880 B11R1.59 CCC(=O)N1CCC[C@@H]1CO 110fbd1b0721564ee8bd4aa2e3e499a4 [0,0,1,1,0,0|1,0,0]=3 4881 B11R1.59 CCC(=O)N1CCC[C@H]1CC 6dd4884ad62ec61fc10830857b5556fa [0,0,1,1,0,0|2,0,0]=4 4882 B11R1.59 CCC(=O)N1CCC[C@H]1CF 5efa260936e5159046b7210fd61cb6a2 [0,0,1,1,0,0|2,0,0]=4 4883 B11R1.59 CCC(=O)N1CCC[C@H]1CO 926090e2a7c586e2ae33596e021708e1 [0,0,1,1,0,0|1,0,0]=3 4884 B11R1.59 O=C(CF)N1CCCC1CO 128dacde4f938d9732fa08c8a13b1591 [0,0,1,1,0,0|2,0,0]=4 4885 B11R1.59 O=C(CF)N1CCC[C@@H]1CO e00f11288a4578cac1b70657f76ca1e2 [0,0,1,1,0,0|2,0,0]=4 4886 B11R1.59 O=C(CF)N1CCC[C@H]1CO 1f27fdd59800f9b82bbb881f06171eab [0,0,1,1,0,0|2,0,0]=4 4887 B11R1.59 O=C(CO)N1CCCC1CO a40fc2fdc917cc097d2ab870f928554e [0,0,1,1,0,0|2,0,0]=4 4888 B11R1.59 O=C(CO)N1CCC[C@@H]1CO 3acaa3f7e1f93f8d605791407683f932 [0,0,1,1,0,0|2,0,0]=4 4889 B11R1.59 O=C(CO)N1CCC[C@H]1CO 20d8ebe9d8e3712f5febc1fb49a41763 [0,0,1,1,0,0|2,0,0]=4 4890 B11R1.59 O=C(CS)N1CCCC1CO f5be8c2db95df672523b1326c9e4c038 [0,0,1,1,0,0|2,0,0]=4 4891 B11R1.59 O=C(CS)N1CCC[C@@H]1CO 274eb0f56cfe5fde68c3ef0c9ace31bb [0,0,1,1,0,0|2,0,0]=4 4892 B11R1.59 O=C(CS)N1CCC[C@H]1CO 061a83753a0ca39701ca99504c6b0cbd [0,0,1,1,0,0|2,0,0]=4 4893 B11R1.115 CCC(=O)N1CCC1CCO eddb6c4f0d5bb86f1b69a9d0a98c855f [0,0,1,1,0,0|1,0,0]=3 4894 B11R1.115 O=C(CF)N1CCC1CCO 3fe3a4a4d3cd71140be18df25ba2af5a [0,0,1,1,0,0|2,0,0]=4 4895 B11R1.115 O=C(CO)N1CCC1CCO 0b3e4e1066ab23b0bf3d9547da9449f2 [0,0,1,1,0,0|2,0,0]=4 4896 B11R1.115 O=C(CS)N1CCC1CCO 7676b739bfd07a1c915762629788cac7 [0,0,1,1,0,0|2,0,0]=4 4897 B11R1.135 CCCN1CCCC(=O)CC1 5d78a27b1115d294c02accd204f79118 [0,0,1,1,0,0|2,0,0]=4 4898 B11R1.135 CCCN1CCNC(=O)CC1 48ce520870f98876c5e1e95b092620e1 [0,0,1,1,0,0|2,0,0]=4 4899 B11R1.135 O=C1CCCN(CC1)CCO b4a404177f191c32df318444d301e880 [0,0,1,1,0,0|2,0,0]=4 4900 B11R1.135 O=C1CCN(CCN1)CCO 2b0735eaf2ccee639c49fa9b9bcf96b1 [0,0,1,1,0,0|2,0,0]=4 4901 B11R1.190 CCCNCCC1CCC1=O 0df107ac77dd6110f0f6944cef3eb9cb [0,0,1,1,0,0|2,0,0]=4 4902 B11R1.190 CCCOCCC1CCC1=O 3983d0cb93d7fc373cd10be3938cd7ef [0,0,1,1,0,0|1,0,0]=3 4903 B11R1.190 COCOCCC1CCC1=O 1b902c3135b01ed7c14160c6514c9e7d [0,0,1,1,0,0|2,0,0]=4 4904 B11R1.190 CSCOCCC1CCC1=O cd1ac41154f135523f059991ea45fe2f [0,0,1,1,0,0|2,0,0]=4 4905 B11R1.190 O=C1CCC1CCNCCO 701f1a99110aea4553209584f7ebc192 [0,0,1,1,0,0|2,0,0]=4 4906 B11R1.190 O=C1CCC1CCOCCF d784d851219d3287289c76aa3e37ac18 [0,0,1,1,0,0|2,0,0]=4 4907 B11R1.190 O=C1CCC1CCOCCS ad78671cf8811410842220d360daa455 [0,0,1,1,0,0|2,0,0]=4 4908 B11R1.190 O=C1CCC1NCCCCO 3d21debe0f6f5c5df86c29558df3d840 [0,0,1,1,0,0|2,0,0]=4 4909 B11R1.212 CCCOC1=C(C(=O)OC1)C c83b5d4e05f48d3072e5cdd73e3449db [0,0,1,1,0,0|0,0,2]=4 4910 B11R1.212 CCCOC1CCC(=O)N1C aa96e294f9e3d82238916255ee71dd01 [0,0,1,1,0,0|2,0,0]=4 4911 B11R1.218 CCCOC1CC1C(=O)OC 59b5d33cee1671ee5db2fc6a97a054ed [0,0,1,1,0,0|2,0,0]=4 4912 B11R1.222 CC1COCCN1C(=O)CF 568528c1149cd714b2c77c7c68cb5b28 [0,0,1,1,0,0|2,0,0]=4 4913 B11R1.222 CC1COCCN1C(=O)CO f6f90be4619efd504f44d2beed5d8c3c [0,0,1,1,0,0|2,0,0]=4 4914 B11R1.222 CCC(=O)N1CCCCC1C 9f8997a43a0135743998f58647508ffc [0,0,1,1,0,0|2,0,0]=4 4915 B11R1.222 CCC(=O)N1CCCC[C@@H]1C b83df98c72b4c39c4638f2400442f81a [0,0,1,1,0,0|2,0,0]=4 4916 B11R1.222 CCC(=O)N1CCCC[C@H]1C ea345c17f894328087f191f4cea87dc5 [0,0,1,1,0,0|2,0,0]=4 4917 B11R1.222 CCC(=O)N1CCOCC1C c62b05094ec92ad8bfadc072896fcd99 [0,0,1,1,0,0|1,0,0]=3 4918 B11R1.222 CCC(=O)N1CCOC[C@@H]1C fa6d883d02ea18be62391aed8ef72573 [0,0,1,1,0,0|1,0,0]=3 4919 B11R1.222 CCC(=O)N1CCOC[C@H]1C 2ec268205e61d451ea1e7cf81e8e23f4 [0,0,1,1,0,0|1,0,0]=3 4920 B11R1.222 C[C@@H]1COCCN1C(=O)CF 286db0d5d1a5875a42f05dd2f0631adc [0,0,1,1,0,0|2,0,0]=4 4921 B11R1.222 C[C@@H]1COCCN1C(=O)CO da72d4e9470d7f5ff9992b7a93f6c077 [0,0,1,1,0,0|2,0,0]=4 4922 B11R1.222 C[C@H]1COCCN1C(=O)CF 547da22985160246e7b5a16675eeaca6 [0,0,1,1,0,0|2,0,0]=4 4923 B11R1.222 C[C@H]1COCCN1C(=O)CO e95e5d58e2046dd4c45d2926c985dce7 [0,0,1,1,0,0|2,0,0]=4 4924 B11R1.235 CCC(=O)OCNC1CC1C 644da267049d5b708bb3cedeecd660b4 [0,0,1,1,0,0|2,0,0]=4 4925 B11R1.235 CCC(=O)OCN[C@@H]1C[C@H]1F 27d5ae84d4fbfa9da8f2328f11f93f77 [0,0,1,1,0,0|2,0,0]=4 4926 B11R1.235 CCC(=O)OCN[C@H]1C[C@@H]1F 731f4a2b7be5e854f0eed746dd43db0e [0,0,1,1,0,0|2,0,0]=4 4927 B11R1.235 CCC(=O)OCN[C@H]1C[C@H]1F 2d6158952590e680ff56b53e43b13a40 [0,0,1,1,0,0|2,0,0]=4 4928 B11R1.236 CCC(=O)CNCC1CCO1 327b0fbc9b4ec7d2a000723699f2c6f0 [0,0,1,1,0,0|2,0,0]=4 4929 B11R1.236 CCC(=O)CNC[C@@H]1CCO1 300fae03261bb63365a6cfa5a5a03d1f [0,0,1,1,0,0|2,0,0]=4 4930 B11R1.236 CCC(=O)CNC[C@H]1CCO1 9a4aed2aaaf00d94726b5182dfcc78b3 [0,0,1,1,0,0|2,0,0]=4 4931 B11R1.236 CCC(=O)COCC1CCO1 e85e05b7225d20da8d3ab64e6f2a9ce0 [0,0,1,1,0,0|2,0,0]=4 4932 B11R1.236 CCC(=O)COC[C@@H]1CCO1 da590a1749b8a21039d2578e78c9e356 [0,0,1,1,0,0|2,0,0]=4 4933 B11R1.236 CCC(=O)COC[C@H]1CCO1 56659b3a479e47931004d2abe6b48014 [0,0,1,1,0,0|2,0,0]=4 4934 B11R1.236 CCC(=O)NCCC1CCC1 424ecc43df8cb195dcf80d34a2290143 [0,0,1,1,0,0|2,0,0]=4 4935 B11R1.236 CCC(=O)NCCC1CCO1 1c5c180df930aff8d65a8590b771e4f7 [0,0,1,1,0,0|1,0,0]=3 4936 B11R1.236 CCC(=O)NCCN1CCC1 d684be5be3fc7d63c571e250661eb9a7 [0,0,1,1,0,0|2,0,0]=4 4937 B11R1.236 CCC(=O)NCC[C@@H]1CCO1 3f7d2d87abb674b6849ac47bf6e904c7 [0,0,1,1,0,0|1,0,0]=3 4938 B11R1.236 CCC(=O)OCNC1CCC1 6178da29b3ca0f634ea9ab677e1cdc3b [0,0,1,1,0,0|2,0,0]=4 4939 B11R1.236 CCC(=O)OCOC1CCC1 b0693e1f9834616d9c4fe44a72dc7190 [0,0,1,1,0,0|2,0,0]=4 4940 B11R1.236 CCC(C)OCCC1CCO1 f808bfaecdb75a96e3743c3fe63e10fc [0,0,1,1,0,0|1,0,1]=4 4941 B11R1.236 CCC(C)OCC[C@@H]1CCO1 a754afc29f82d48472ad4e6eaf0c740e [0,0,1,1,0,0|1,0,1]=4 4942 B11R1.236 CCC(C)OCC[C@H]1CCO1 c6b60aa1f967f257aa8db4991463bb85 [0,0,1,1,0,0|1,0,1]=4 4943 B11R1.236 CC[C@@H](C)OCCC1CCO1 9a5f696e57bcf120a8431f39615f31fb [0,0,1,1,0,0|1,0,1]=4 4944 B11R1.236 CC[C@H](C)OCCC1CCO1 e40e8089c604e846deaa8e6cfd9ee903 [0,0,1,1,0,0|1,0,1]=4 4945 B11R1.236 O=C(CF)NCCC1CCO1 6494e66a20265f3a80ea9ce5ad82b8b6 [0,0,1,1,0,0|2,0,0]=4 4946 B11R1.236 O=C(CF)NCC[C@@H]1CCO1 3edaa03a0be776c5e677af6fec479653 [0,0,1,1,0,0|2,0,0]=4 4947 B11R1.236 O=C(CO)NCCC1CCO1 71f43463764f666b9cdb64c6ca973e14 [0,0,1,1,0,0|2,0,0]=4 4948 B11R1.236 O=C(CO)NCC[C@@H]1CCO1 07ba8230dd152157da0083f2a8415f5b [0,0,1,1,0,0|2,0,0]=4 4949 B11R1.236 O=C(CS)NCCC1CCO1 39887ed2f2e1799c3bb3963c5aea52b8 [0,0,1,1,0,0|2,0,0]=4 4950 B11R1.236 O=C(CS)NCC[C@@H]1CCO1 79ad2f93233f11f85236909d59ab0147 [0,0,1,1,0,0|2,0,0]=4 4951 B11R1.237 C=CC(=O)OCCOC1CC1 513484518de9df4d850900ca472706ef [0,0,1,1,0,0|0,0,2]=4 4952 B11R1.237 CCC(=O)NCCNC1CC1 c11d43882c7255aab965fb9b0283789e [0,0,1,1,0,0|2,0,0]=4 4953 B11R1.237 CCC(=O)NCCOC1CC1 222abf03812b552b303d49d6f6d7b290 [0,0,1,1,0,0|1,0,0]=3 4954 B11R1.237 CCC(=O)OCCOC1CC1 0edf8fa417b2cc16897743808c4a9552 [0,0,1,1,0,0|0,0,0]=2 4955 B11R1.237 CCC(=O)OCNCC1CC1 a92e7e772187ba05103d48a4209f5629 [0,0,1,1,0,0|2,0,0]=4 4956 B11R1.237 CCC(=O)OCOCC1CC1 b37ea5bb71dbf18ba2597a44792ddd61 [0,0,1,1,0,0|2,0,0]=4 4957 B11R1.237 CCC(C)OCCOC1CC1 050b004324dbf7bb256b7758c0e59085 [0,0,1,1,0,0|1,0,1]=4 4958 B11R1.237 CC[C@@H](C)OCCOC1CC1 a79aa269d5ed8063f5cba8151f37ef73 [0,0,1,1,0,0|1,0,1]=4 4959 B11R1.237 CC[C@H](C)OCCOC1CC1 1ebc9d8d2ac5a4999b2949ccfa56dc02 [0,0,1,1,0,0|1,0,1]=4 4960 B11R1.237 CNC(=O)CCCOC1CC1 1f685bae77813cf8dbf291a6b8ae6b37 [0,0,1,1,0,0|2,0,0]=4 4961 B11R1.237 COC(=O)CCCOC1CC1 ce0aa01a0a22e22e273fc191e24962c2 [0,0,1,1,0,0|2,0,0]=4 4962 B11R1.237 COC(=O)OCCOC1CC1 dcfcb2cf70b06d0935ce2516c06ad540 [0,0,1,1,0,0|1,0,0]=3 4963 B11R1.237 O=C(CF)NCCOC1CC1 fa334ce1cda5d298961c76f186054265 [0,0,1,1,0,0|2,0,0]=4 4964 B11R1.237 O=C(CO)NCCOC1CC1 f88743acbd62749f0cf2b710be051bfe [0,0,1,1,0,0|2,0,0]=4 4965 B11R1.237 O=C(CS)NCCOC1CC1 cf2d61a3e87d7cafeef41e780424bf0f [0,0,1,1,0,0|2,0,0]=4 4966 B11R1.255 CCC(=O)CN[C@@H]1C[C@H]1CO a728d43e27edd53ea8752203eb5b1d2c [0,0,1,1,0,0|2,0,0]=4 4967 B11R1.255 CCC(=O)CN[C@H]1C[C@@H]1CO a80c630f3283a546a3889b7c1e14d681 [0,0,1,1,0,0|2,0,0]=4 4968 B11R1.255 CCC(=O)CN[C@H]1C[C@H]1CO f8b6b52a2147865b6abb164f723b25ea [0,0,1,1,0,0|2,0,0]=4 4969 B11R1.255 CCC(=O)NCC1CC1CO 0aae466cb1dd24e9fad227372103c5a7 [0,0,1,1,0,0|1,0,0]=3 4970 B11R1.255 O=C(CF)NCC1CC1CO 0e4848c291920c6d3a116d05145ad2c7 [0,0,1,1,0,0|2,0,0]=4 4971 B11R1.255 O=C(CO)NCC1CC1CO 9fb3ca5c3ceeaf220cee1fad3741f5c5 [0,0,1,1,0,0|2,0,0]=4 4972 B11R1.255 O=C(CS)NCC1CC1CO 77f6a4794d4db18dfadaf84f92eb1fb0 [0,0,1,1,0,0|2,0,0]=4 4973 B11R1.381 C[C@@H]1C(=O)NCCCN1CO b9e18d98cc3c8ffaba3743c45a0be20c [0,0,1,1,0,0|2,0,0]=4 4974 B11R1.381 C[C@H]1C(=O)NCCCN1CO 083eaa22ae9182ebf891db020acc76bd [0,0,1,1,0,0|2,0,0]=4 4975 B11R1.852 CCC(=O)N1CCCCCC1 ad10cabe38a2ba06b9fbc202cc4d0017 [0,0,1,1,0,0|2,0,0]=4 4976 B11R1.852 CCC(=O)N1CCCOCC1 73461dfd41208a3bd9e9ede4249daf39 [0,0,1,1,0,0|1,0,0]=3 4977 B11R1.852 O=C(CF)N1CCCOCC1 e4ccc01313f15fb8860a055d7e287742 [0,0,1,1,0,0|2,0,0]=4 4978 B11R1.852 O=C(CO)N1CCCOCC1 f66135ce179e65849e76fd2d8d4970c8 [0,0,1,1,0,0|2,0,0]=4 4979 B11R1.852 O=C(CS)N1CCCOCC1 a1354320b49148caf41b85965101a770 [0,0,1,1,0,0|2,0,0]=4 4980 B11R1.23 CC1CN(CCO1)C(=O)CF 793697971f08062c71a877ae9266dfe2 [0,0,1,1,0,0|2,0,0]=4 4981 B11R1.23 CC1CN(CCO1)C(=O)CO b53e05d3d84d6a9c102cba59825c8456 [0,0,1,1,0,0|2,0,0]=4 4982 B11R1.23 CC1CN(CCO1)C(=O)CS 394df4e75ea34e53a4753013c84793d4 [0,0,1,1,0,0|2,0,0]=4 4983 B11R1.23 CCC(=O)N1CCCC(C1)C 4e57e3dfb9866093b5cffcdef1d774b8 [0,0,1,1,0,0|2,0,0]=4 4984 B11R1.23 CCC(=O)N1CCCC(C1)F 3711759df20044644960f7e16f4cd065 [0,0,1,1,0,0|2,0,0]=4 4985 B11R1.23 CCC(=O)N1CCCC(C1)O 08a3476cdfae9801bfc398769d1a3ff4 [0,0,1,1,0,0|1,0,0]=3 4986 B11R1.23 CCC(=O)N1CCC[C@@H](C1)C 155d25339585a6337863069b50c07a39 [0,0,1,1,0,0|2,0,0]=4 4987 B11R1.23 CCC(=O)N1CCC[C@@H](C1)F 9b8c26c4e607e329f0ddf2df0d8b103b [0,0,1,1,0,0|2,0,0]=4 4988 B11R1.23 CCC(=O)N1CCC[C@@H](C1)O d00fcb83beebeb2187f59f7e4d361f05 [0,0,1,1,0,0|1,0,0]=3 4989 B11R1.23 CCC(=O)N1CCC[C@H](C1)C 4efaf12040bbd4cc1a5e5a5062f987b9 [0,0,1,1,0,0|2,0,0]=4 4990 B11R1.23 CCC(=O)N1CCC[C@H](C1)F cbfc5eb3c21bf5f1ab38fef883d5a82f [0,0,1,1,0,0|2,0,0]=4 4991 B11R1.23 CCC(=O)N1CCC[C@H](C1)O d8bdca72b8556378c8efbd87f49adc9b [0,0,1,1,0,0|1,0,0]=3 4992 B11R1.23 CCC(=O)N1CCOC(C1)C cdd9ef0289dcce77c0d5905f9a7499d4 [0,0,1,1,0,0|1,0,0]=3 4993 B11R1.23 CCC(=O)N1CCO[C@@H](C1)C a95a1cb43b31068b80cc2d0f9614b161 [0,0,1,1,0,0|1,0,0]=3 4994 B11R1.23 CCC(=O)N1CCO[C@H](C1)C d9eeb04a26761ccce85e7f5d9ae637de [0,0,1,1,0,0|1,0,0]=3 4995 B11R1.23 C[C@@H]1CN(CCO1)C(=O)CF 9e72ecb208751be7e9acabf4c31a24de [0,0,1,1,0,0|2,0,0]=4 4996 B11R1.23 C[C@@H]1CN(CCO1)C(=O)CO f80df496f08c0a9f9f0e1c5e340c8bf7 [0,0,1,1,0,0|2,0,0]=4 4997 B11R1.23 C[C@@H]1CN(CCO1)C(=O)CS 7a361befec25c5ddd2dff19ebf8d8315 [0,0,1,1,0,0|2,0,0]=4 4998 B11R1.23 C[C@H]1CN(CCO1)C(=O)CF 357ff355702f7cff61e46bfcd24b3302 [0,0,1,1,0,0|2,0,0]=4 4999 B11R1.23 C[C@H]1CN(CCO1)C(=O)CO 32a9f04fcb3806f6f8cf59eeb58776d0 [0,0,1,1,0,0|2,0,0]=4 5000 B11R1.23 C[C@H]1CN(CCO1)C(=O)CS 7c906b1fb137ff7870572a27870c4ffd [0,0,1,1,0,0|2,0,0]=4 5001 B11R1.23 O=C(CF)N1CCCC(C1)O ccee3ac9ddb0eac35b98fac1f50fd264 [0,0,1,1,0,0|2,0,0]=4 5002 B11R1.23 O=C(CF)N1CCC[C@@H](C1)O a63084090f971fe0c28960b09302c8e6 [0,0,1,1,0,0|2,0,0]=4 5003 B11R1.23 O=C(CF)N1CCC[C@H](C1)O 6f4815cf9f9e9e348430a42fab25f81b [0,0,1,1,0,0|2,0,0]=4 5004 B11R1.23 O=C(CO)N1CCCC(C1)O 53a11ced452d3f968c076c6ae31253b7 [0,0,1,1,0,0|2,0,0]=4 5005 B11R1.23 O=C(CO)N1CCC[C@@H](C1)O dc55870d5eb9500a412b83203631bb62 [0,0,1,1,0,0|2,0,0]=4 5006 B11R1.23 O=C(CO)N1CCC[C@H](C1)O 368cdb7c0947334a1aeb848b99d4f50a [0,0,1,1,0,0|2,0,0]=4 5007 B11R1.23 O=C(CS)N1CCCC(C1)O ba2f0cac693b598e1b26a3185af97bb9 [0,0,1,1,0,0|2,0,0]=4 5008 B11R1.23 O=C(CS)N1CCC[C@@H](C1)O e707f05a5854fd1ec2d9762976bd3e97 [0,0,1,1,0,0|2,0,0]=4 5009 B11R1.23 O=C(CS)N1CCC[C@H](C1)O 610c5da76f3fdc149bc9505293c3e328 [0,0,1,1,0,0|2,0,0]=4 5010 B11R1.72 CCN1[C@@H](CNC(=O)[C@H]1C)C 2cbd558adab922f22954292b768190aa [0,0,1,1,0,0|2,0,0]=4 5011 B11R1.72 CCN1[C@H](CNC(=O)[C@@H]1C)C 1d596ad619d1111224617db1bdf18015 [0,0,1,1,0,0|2,0,0]=4 5012 B11R1.121 CCCC1CN(C1)C(=O)CC 3a78c9f3b105c37349f4f8f49b090a6c [0,0,1,1,0,0|2,0,0]=4 5013 B11R1.121 CCOC1CC(C1)C(=O)NC 5d435a93f77ec515d719a24004efceba [0,0,1,1,0,0|2,0,0]=4 5014 B11R1.121 CCOC1CC(C1)C(=O)OC fe473cdf32d2091a125e438ab93cec29 [0,0,1,1,0,0|2,0,0]=4 5015 B11R1.121 CCOC1CN(C1)C(=O)CC acb544abfd540e92110164db450e3a39 [0,0,1,1,0,0|1,0,0]=3 5016 B11R1.121 CCOC1CN(C1)C(=O)CF e56b66d842aca41fc20f8f242497fef9 [0,0,1,1,0,0|2,0,0]=4 5017 B11R1.121 CCOC1CN(C1)C(=O)CO 122eb25f7d4f65f7c94caadfa5e66d62 [0,0,1,1,0,0|2,0,0]=4 5018 B11R1.121 CCOC1CN(C1)C(=O)CS eebb59f674a09f873dc8ac51a4cad485 [0,0,1,1,0,0|2,0,0]=4 5019 B11R1.121 CCO[C@H]1C[C@@H](C1)C(=O)OC a46578e3bb4fa8ac8e98edc4d9054bad [0,0,1,1,0,0|2,0,0]=4 5020 B11R1.121 CCO[C@H]1C[C@H](C1)C(=O)OC 69cd26ea8d3ae0e9d8cf77c496483a53 [0,0,1,1,0,0|2,0,0]=4 5021 B11R1.192 CC1CC(CCC1=O)OCF 300147b7d3658a36049487c7fc2326d7 [0,0,1,1,0,0|2,0,0]=4 5022 B11R1.192 CC1CC(CNC1=O)OCF 310a919f147db34dcabb2c6fa4b01604 [0,0,1,1,0,0|2,0,0]=4 5023 B11R1.192 CCOC1CCC(=O)C(C1)C 4cc402ef6e7467a722bd3753328c3b3b [0,0,1,1,0,0|1,0,0]=3 5024 B11R1.192 CCOC1CCC(=O)N(C1)C f2d76e830091a66b170486874902a29e [0,0,1,1,0,0|2,0,0]=4 5025 B11R1.192 CCOC1CNC(=O)C(C1)C 3ec48322b562f948a58a3008aa916b09 [0,0,1,1,0,0|1,0,0]=3 5026 B11R1.225 CCC(=O)N1C[C@@H](C[C@@H]1C)F 00e8a4a11c33639a40709a50291162af [0,0,1,1,0,0|2,0,0]=4 5027 B11R1.225 CCC(=O)N1C[C@@H](C[C@@H]1C)O 5948412c57f199f52e8241e80559e6e7 [0,0,1,1,0,0|1,0,0]=3 5028 B11R1.225 CCC(=O)N1C[C@@H](C[C@H]1C)F c2ccf50a6b0e7bf7f68e2e2e4f0476b5 [0,0,1,1,0,0|2,0,0]=4 5029 B11R1.225 CCC(=O)N1C[C@@H](C[C@H]1C)O d814f136a4505decc97f9d29b1872836 [0,0,1,1,0,0|1,0,0]=3 5030 B11R1.225 CCC(=O)N1C[C@H](C[C@@H]1C)F 51d6611aece71eb9b6c29fb2ba9f00d8 [0,0,1,1,0,0|2,0,0]=4 5031 B11R1.225 CCC(=O)N1C[C@H](C[C@@H]1C)O 670d8dfc1509018e1f270d224dbdd7dd [0,0,1,1,0,0|1,0,0]=3 5032 B11R1.225 CCC(=O)N1C[C@H](C[C@H]1C)F 7b039be4936cff5c2734de53b67cc9c6 [0,0,1,1,0,0|2,0,0]=4 5033 B11R1.225 CCC(=O)N1C[C@H](C[C@H]1C)O 89354f70c63189dbd5166fa3e69a96ba [0,0,1,1,0,0|1,0,0]=3 5034 B11R1.225 C[C@@H]1C[C@@H](CN1C(=O)CF)O 7cad623d9a3189668b2ab18361672190 [0,0,1,1,0,0|2,0,0]=4 5035 B11R1.225 C[C@@H]1C[C@@H](CN1C(=O)CO)O 49baa8cd9400a0d7cef407877a7c1cd0 [0,0,1,1,0,0|2,0,0]=4 5036 B11R1.225 C[C@@H]1C[C@@H](CN1C(=O)CS)O bea7cab6da7c8affc4c30160b8b31ab0 [0,0,1,1,0,0|2,0,0]=4 5037 B11R1.225 C[C@@H]1C[C@H](CN1C(=O)CF)O 42d4d58959b096c1187fef99a1f66b96 [0,0,1,1,0,0|2,0,0]=4 5038 B11R1.225 C[C@@H]1C[C@H](CN1C(=O)CO)O e413a6876c0546e24b53d20d5ed6aa10 [0,0,1,1,0,0|2,0,0]=4 5039 B11R1.225 C[C@@H]1C[C@H](CN1C(=O)CS)O 94d7fb507decc9ce1c1fd96217f69ef9 [0,0,1,1,0,0|2,0,0]=4 5040 B11R1.225 C[C@H]1C[C@@H](CN1C(=O)CF)O c61c0bbca4cbce6e3328b5f0699eb926 [0,0,1,1,0,0|2,0,0]=4 5041 B11R1.225 C[C@H]1C[C@@H](CN1C(=O)CO)O bdd02667c901d9520e0a46c9d17af475 [0,0,1,1,0,0|2,0,0]=4 5042 B11R1.225 C[C@H]1C[C@@H](CN1C(=O)CS)O c7ff93a3563833c16b3e75707e6b603d [0,0,1,1,0,0|2,0,0]=4 5043 B11R1.225 C[C@H]1C[C@H](CN1C(=O)CF)O 9e460972d9384d6a574ec73397490bc4 [0,0,1,1,0,0|2,0,0]=4 5044 B11R1.225 C[C@H]1C[C@H](CN1C(=O)CO)O d58cde7818689c2f06bfac0b6aad8500 [0,0,1,1,0,0|2,0,0]=4 5045 B11R1.225 C[C@H]1C[C@H](CN1C(=O)CS)O b86aad21d670f7fb92a6c432b331001f [0,0,1,1,0,0|2,0,0]=4 5046 B11R1.524 CCC(=O)NCC(O)C1CC1 c29b2f57ba1988cb4f5060d9991fa769 [0,0,1,1,0,0|1,0,0]=3 5047 B11R1.524 CCC(=O)OCN(C)C1CC1 b0273b866814ec0e3db6da4fb1f27446 [0,0,1,1,0,0|2,0,0]=4 5048 B11R1.524 O=C(CF)NCC(O)C1CC1 cf1160aeb291da27e8f659d5439222aa [0,0,1,1,0,0|2,0,0]=4 5049 B11R1.524 O=C(CO)NCC(O)C1CC1 03cb8f1b654e1aeebefd95932222b001 [0,0,1,1,0,0|2,0,0]=4 5050 B11R1.524 O=C(CS)NCC(O)C1CC1 445dbd383944d9dc7b0dd9eabf26d330 [0,0,1,1,0,0|2,0,0]=4 5051 B11R2.237 C1COC(C1)CN2CCC2 f6ca315db8e5a31764dfa600fce9f0ad [1,0,0,1,0,0|1,0,1]=4 5052 B11R2.248 CCCN1CC2CC1CO2 70e68c24d6ab173b21704f8c9ad8bbcb [1,0,0,1,0,0|1,0,1]=4 5053 B11R2.248 CCCN1C[C@@H]2C[C@H]1CO2 c20ea206162848cfe80696565519d680 [1,0,0,1,0,0|1,0,1]=4 5054 B11R2.248 CCCN1C[C@H]2C[C@@H]1CO2 ced179c5788e69ab801d1f2235d304af [1,0,0,1,0,0|1,0,1]=4 5055 B11R2.258 CCOCC1C2C1OCC2 b601f71e492085d1a6fea869414ad259 [1,0,0,1,0,0|2,0,0]=4 5056 B11R2.385 C1CCC(C1)COC2CC2 187a867e1d7884834e6281b63c966aa2 [1,0,0,1,0,0|1,0,1]=4 5057 B11R2.385 C1COC(C1)CNC2CC2 fffd041f2ad759070159cff0fc7ea9ad [1,0,0,1,0,0|1,0,1]=4 5058 B11R2.385 C1COC(C1)COC2CC2 0099d5c82fdf5da57b7fb5bd241a766f [1,0,0,1,0,0|0,0,1]=3 5059 B11R2.385 C1CO[C@@H](C1)CNC2CC2 8287f0925e169b7d8591c3cefb2e5c79 [1,0,0,1,0,0|1,0,1]=4 5060 B11R2.385 C1CO[C@@H](C1)COC2CC2 9617ec7fbaf57e43343ca238e91c559b [1,0,0,1,0,0|0,0,1]=3 5061 B11R2.385 C1CO[C@H](C1)CNC2CC2 6eef7079fcc9939c561a94aa923a8a1f [1,0,0,1,0,0|1,0,1]=4 5062 B11R2.385 C1CO[C@H](C1)COC2CC2 1660739e97643c61e900f8679a46eeff [1,0,0,1,0,0|0,0,1]=3 5063 B11R2.385 C1CSC(C1)COC2CC2 3fc11852e18decbd8d694d945d6ec8d2 [1,0,0,1,0,0|0,1,1]=4 5064 B11R2.867 CCCOCC12CCC1C2 6003a1ab255d99c19cbd0f0dbf21073b [1,0,0,1,0,0|1,0,1]=4 5065 B11R2.814 CC(=O)N1CC2C1CCC2 b66cf4cc41f614540ee6f24fdee08dfd [1,0,0,1,0,0|2,0,0]=4 5066 B11R2.814 CC(=O)N1C[C@H]2[C@@H]1CCC2 f5a3d79dc235cd39c2fa6c2c93ea603f [1,0,0,1,0,0|2,0,0]=4 5067 B11R2.845 CC(=O)N1CC2CC1CO2 cdba30b368015f0c4f00115ed54a22e2 [1,0,0,1,0,0|1,0,0]=3 5068 B11R2.845 CC(=O)N1CC2CCC1C2 385da044f803c3658eaf6205f7c45b18 [1,0,0,1,0,0|2,0,0]=4 5069 B11R2.845 CC(=O)N1C[C@@H]2CC[C@H]1C2 091d1dc4f2ba9af11a5947aacab8edb2 [1,0,0,1,0,0|2,0,0]=4 5070 B11R2.845 CC(=O)N1C[C@@H]2C[C@H]1CO2 e03494fcfe7db4a2ef1e49d433ee9cf6 [1,0,0,1,0,0|1,0,0]=3 5071 B11R2.845 CC(=O)N1C[C@H]2CC[C@@H]1C2 049c179e37bf694487eaee700ba6c76d [1,0,0,1,0,0|2,0,0]=4 5072 B11R2.845 CC(=O)N1C[C@H]2C[C@@H]1CO2 981081ade67df19f1269c9bdb0b26dff [1,0,0,1,0,0|1,0,0]=3 5073 B11R2.15 CCN1CC2CCOC2C1 15e9485264acf5e1c26e0fa818d0e8e7 [0,0,0,1,1,0|2,0,0]=4 5074 B11R2.16 CCN1CC2CCC(C1)O2 910782ec5099f31cf06fc4c4c8008860 [0,0,0,1,1,0|2,0,0]=4 5075 B11R2.16 CCN1C[C@H]2CC[C@@H](C1)O2 f16b114128608e1e0d94762b4a7d1bcd [0,0,0,1,1,0|2,0,0]=4 5076 B11R2.905 CCC(=O)N1C2C1CCC2 b946ca4f6a3bb3c12c28935ab23d1ad7 [0,0,0,1,1,0|2,0,0]=4 5077 B11R2.985 CCN1CC2(C1)CCCO2 4ec5f8dcb0d6b44dad517295b063e072 [0,0,0,1,1,0|2,0,0]=4 5078 B11R2.384 C1CC(C1)COC2CCC2 c5fcde8f64c59598f8bc7725563dc9f4 [0,0,0,1,1,0|1,0,1]=4 5079 B11R2.384 C1CC(C1)OCC2CCO2 2185eca824b05cab6811d9e3a6edba8c [0,0,0,1,1,0|1,0,1]=4 5080 B11R2.384 C1CC(C1)OC[C@@H]2CCO2 d33e64faae7a50078de22dedce7f28e8 [0,0,0,1,1,0|1,0,1]=4 5081 B11R2.384 C1CC(C1)OC[C@H]2CCO2 12c7ac8d8b91da19e411fd59627b40c6 [0,0,0,1,1,0|1,0,1]=4 5082 B11R2.898 CCC(=O)N1CC2CC1C2 84617ac9e7673ff97bb34948b796f6bb [0,0,0,1,1,0|1,0,0]=3 5083 B11R2.898 O=C(CF)N1CC2CC1C2 03cc351692e839bff1f4710e9d8020f8 [0,0,0,1,1,0|2,0,0]=4 5084 B11R2.898 O=C(CO)N1CC2CC1C2 ce8b14e4c4074a7eec900252b2adde55 [0,0,0,1,1,0|2,0,0]=4 5085 B11R2.898 O=C(CS)N1CC2CC1C2 f02dff58c133a9f858897c6780c7202d [0,0,0,1,1,0|2,0,0]=4 5086 B13R2.27 O=C1CCC1OC2CCCCO2 41083e998632d73a75dcd1d8ddf0296e [0,0,0,1,0,1|2,0,0]=4 5087 B13R2.1105 CCC(=O)CN1C2COCC1C2 eabc917ee7eae9ce85966e33d2e971a2 [0,0,0,1,0,1|2,0,0]=4 5088 B13R2.1115 CCC(C)OCC12COCC1C2 4a5c48a65986369e7edc572a989c6b70 [0,0,0,1,0,1|1,0,1]=4 5089 B13R2.1115 CCC(C)OC[C@@]12COC[C@@H]1C2 f90589fc0a2e84e258e6b85ce42d0769 [0,0,0,1,0,1|1,0,1]=4 5090 B13R2.1115 CCC(C)OC[C@]12COC[C@H]1C2 314418a650a2144197abee32b9b13b19 [0,0,0,1,0,1|1,0,1]=4 5091 B13R2.1125 CCC(=O)OCN1C2C1CCC2 ab83ca38d61392573f712fc4be088852 [0,0,0,1,0,1|2,0,0]=4 5092 B13R2.1125 CCC(C)OCC1C2C1OCC2 bb7eda8409e52a1256fcd3a2f39595a6 [0,0,0,1,0,1|1,0,1]=4 5093 B13R2.1132 CCC(=O)OCN1CC2CC2C1 9b8698783baacf94b510e12c948be29e [0,0,0,1,0,1|2,0,0]=4 5094 B13R2.1152 CCC(=O)N1CC2CCCC1C2 3997b31eab671c3b96a9b6e8a2deb1c3 [0,0,0,1,0,1|2,0,0]=4 5095 B13R2.1153 CCC(=O)N1CC2CCC1CC2 f39ab61d935e9a8c302a4038467dc790 [0,0,0,1,0,1|2,0,0]=4 5096 B13R2.1153 CCC(=O)N1C[C@H]2CC[C@@H]1CC2 63b7c8e33d93a3b1e9dcc96d9879b358 [0,0,0,1,0,1|2,0,0]=4 5097 B13R2.1304 CCC(=O)OCN1CCC2C1C2 a0a780328b637acc6bee3afe9420a078 [0,0,0,1,0,1|2,0,0]=4 5098 B13R2.2383 C1CC(C1)OCC2COCCO2 a64c999161ef23ff4ec11cf2ac10de87 [0,0,0,1,0,1|1,0,1]=4 5099 B13R2.2383 C1CC(C1)OC[C@@H]2CCCOC2 c3e3b89e85dc0ac4380c6f7aec48fd6f [0,0,0,1,0,1|1,0,1]=4 5100 B13R2.2383 C1CC(C1)OC[C@@H]2COCCO2 bc01978675571c654049f4073663f516 [0,0,0,1,0,1|1,0,1]=4 5101 B13R2.2383 C1CC(C1)OC[C@H]2CCCOC2 c19db783f46bc953a1a2b8efb9266202 [0,0,0,1,0,1|1,0,1]=4 5102 B13R2.2383 C1CC(C1)OC[C@H]2COCCO2 9779ca873707475db2f9f3b6fa8d6263 [0,0,0,1,0,1|1,0,1]=4 5103 B13R2.2383 C1CCC(OC1)COC2CCC2 90f65bae1d8f7e1f2dab1f66ce896b9b [0,0,0,1,0,1|1,0,1]=4 5104 B13R2.2383 C1CC[C@@H](OC1)COC2CCC2 46758c27dc4857a2849e3878bb94b81a [0,0,0,1,0,1|1,0,1]=4 5105 B13R2.2383 C1CC[C@H](OC1)COC2CCC2 75d00212e79fc0453f4f8236c444fa84 [0,0,0,1,0,1|1,0,1]=4 5106 B13R2.2383 C1COCC(C1)COC2CCC2 df1fcb91dc85f37da38c94febe85322f [0,0,0,1,0,1|1,0,1]=4 5107 B13R2.15272 CCC(=O)N1CC2C1CCCC2 78e7e5cb2b41b3be99209c161d27d674 [0,0,0,1,0,1|2,0,0]=4 5108 B13R2.15272 CCC(=O)N1C[C@@H]2[C@H]1CCCC2 6b17b337fda6b5892ac13b0b2bd8744b [0,0,0,1,0,1|2,0,0]=4 5109 B13R2.142 O=C1CN(CN1)CC2CCCO2 36a0af9445f8eec5e22ab70cc442fe76 [0,0,0,1,0,1|2,0,0]=4 5110 B13R2.158 O=C1CCC1COC2CCCC2 780e1f4cdf08cf9785876c675c975709 [0,0,0,1,0,1|2,0,0]=4 5111 B13R2.158 O=C1CCC1NCC2CCCC2 084cb6dbeaf7de9fe8c016bde9f9835e [0,0,0,1,0,1|2,0,0]=4 5112 B13R2.158 O=C1CCC1NCC2CCCO2 6483d4a7eb16ddcb465888b53c1a580d [0,0,0,1,0,1|1,0,0]=3 5113 B13R2.158 O=C1CCC1NC[C@@H]2CCCO2 434bcbe5b57af7a134d3424f814ca3e2 [0,0,0,1,0,1|1,0,0]=3 5114 B13R2.158 O=C1CCC1NC[C@H]2CCCO2 09af270104e30492662650785e86d820 [0,0,0,1,0,1|1,0,0]=3 5115 B13R2.158 O=C1CCC1OCC2CCCC2 9723795aaed146cd7ac95a148c01263e [0,0,0,1,0,1|1,0,0]=3 5116 B13R2.158 O=C1CCC1OCC2CCCO2 cb2b0b9909e9c9f0da5750924199e69f [0,0,0,1,0,1|0,0,0]=2 5117 B13R2.158 O=C1CCC1OCC2CCOC2 3e4ef857bf3540d95f540d18edb9ca8e [0,0,0,1,0,1|2,0,0]=4 5118 B13R2.158 O=C1NC[C@@H]1NCC2CCCO2 c12b6bfcec2a371c29784f00297f4651 [0,0,0,1,0,1|2,0,0]=4 5119 B13R2.158 O=C1OCC1COC2CCCO2 efa26ebdd5c27c4028f1d83f2f4d2303 [0,0,0,1,0,1|2,0,0]=4 5120 B13R2.196 CC1CC1COCC2CCCO2 e675b9a1f0b14293dad56f4b1268d054 [0,0,0,1,0,1|1,0,1]=4 5121 B13R2.196 C[C@@H]1C[C@H]1COCC2CCCO2 a631eec17d58a9c5d7994a3d315ea038 [0,0,0,1,0,1|1,0,1]=4 5122 B13R2.196 C[C@H]1C[C@@H]1COCC2CCCO2 f442dda74a0e96c87fc93035562ce7f0 [0,0,0,1,0,1|1,0,1]=4 5123 B13R2.196 C[C@H]1C[C@H]1COCC2CCCO2 259b440da05a30455e072a694d5dc81f [0,0,0,1,0,1|1,0,1]=4 5124 B13R2.533 CCC(=O)N1CCC12CCCC2 67b222050516d22ccb648147cc2398fb [0,0,0,1,0,1|2,0,0]=4 5125 B13R2.537 CCC(=O)NC1CC12CCCC2 976e0f8b15f3ee209c4929912a24e23e [0,0,0,1,0,1|2,0,0]=4 5126 B13R2.1145 CCC(=O)N1CCC2CCC1C2 143e429821a3bf43003417e09b202e20 [0,0,0,1,0,1|2,0,0]=4 5127 B13R2.1145 CCC(=O)N1CC[C@@H]2CC[C@H]1C2 01f08a72c3e76140ae54ced07ced41b0 [0,0,0,1,0,1|2,0,0]=4 5128 B13R2.1197 CCC(=O)CN1CC2C1CCC2 be769816b8afe2fa5ee76c979059d405 [0,0,0,1,0,1|2,0,0]=4 5129 B13R2.1197 CCC(=O)CN1C[C@H]2[C@@H]1CCC2 50f1ef122ea32d65feac4f8c15820234 [0,0,0,1,0,1|2,0,0]=4 5130 B13R2.1312 C=C(CC)COCC12CCC1C2 6d82c83832ad96e475ed02f73687fa86 [0,0,0,1,0,1|2,0,0]=4 5131 B13R2.1312 CCC(=O)COCC12CCC1C2 5b6c1dcf060b6bfa371384b3d2d573a9 [0,0,0,1,0,1|1,0,0]=3 5132 B13R2.1312 CNC(=O)COCC12CCC1C2 d12577b8ac07af1a51eb845c917ed2b5 [0,0,0,1,0,1|2,0,0]=4 5133 B13R2.1312 COC(=O)COCC12CCC1C2 e48e60361ecf56f164851937f06d130e [0,0,0,1,0,1|2,0,0]=4 5134 B13R2.2381 C1CC(C1)COCC2CCCO2 cba77bb7c1db3c15c1118058abea7c35 [0,0,0,1,0,1|1,0,1]=4 5135 B13R2.2381 C1CC(C1)COC[C@@H]2CCCO2 ef9d5ce4f6d132e8aeadd9f5e0955eb7 [0,0,0,1,0,1|1,0,1]=4 5136 B13R2.2381 C1CC(C1)COC[C@H]2CCCO2 923321dd55bee8b5468c0b7b36e8d27f [0,0,0,1,0,1|1,0,1]=4 5137 B13R2.2381 C1CC(C1)OCCC2CCCO2 a5d55353d74405801270b3ed80bcc8df [0,0,0,1,0,1|1,0,1]=4 5138 B13R2.2381 C1COC(C1)COCC2CCO2 b209cd35f776e10c1710b32faad943ec [0,0,0,1,0,1|0,0,2]=4 5139 B13R2.2381 C1COC(C1)COC[C@@H]2CCO2 c27e397d84d9c8d3ed787d3bfd56be4a [0,0,0,1,0,1|0,0,2]=4 5140 B13R2.2381 C1COC(C1)COC[C@H]2CCO2 71ea78f0d906ec2459f90d0396d2946a [0,0,0,1,0,1|0,0,2]=4 5141 B13R2.2381 C1CO[C@@H](C1)COCC2CCO2 8bca832379e9b14beed63aa86a94150c [0,0,0,1,0,1|0,0,2]=4 5142 B13R2.2381 C1CO[C@@H](C1)COC[C@@H]2CCO2 44cb34e17ef924d52dc121dc3058b113 [0,0,0,1,0,1|0,0,2]=4 5143 B13R2.2381 C1CO[C@@H](C1)COC[C@H]2CCO2 1d88e227bd5f6a8814a120ca42a0012a [0,0,0,1,0,1|0,0,2]=4 5144 B13R2.2381 C1CO[C@H](C1)COCC2CCO2 a4f7f97c232674c95d86ac13495c5610 [0,0,0,1,0,1|0,0,2]=4 5145 B13R2.2381 C1CO[C@H](C1)COC[C@@H]2CCO2 2f4d07dcc51c5ef93d44a9de8f648e2b [0,0,0,1,0,1|0,0,2]=4 5146 B13R2.2381 C1CO[C@H](C1)COC[C@H]2CCO2 eb46cbec31152dc4e10eac6a3ca26384 [0,0,0,1,0,1|0,0,2]=4 5147 B13R2.3205 BrC1(CC1)COCC2CCCO2 d4d39cb2fd55417c8bdce5f4b98246e8 [0,0,0,1,0,1|1,0,1]=4 5148 B13R2.3205 CC1(CC1)COCC2CCCO2 efaee62df4f48a8969706e3540ea48c3 [0,0,0,1,0,1|1,0,1]=4 5149 B13R2.3205 CC1(CC1)COC[C@@H]2CCCO2 6052f6594d29a035514c57b36ba21fba [0,0,0,1,0,1|1,0,1]=4 5150 B13R2.3205 CC1(CC1)COC[C@H]2CCCO2 c602891b143082db6378efd6ac9b9569 [0,0,0,1,0,1|1,0,1]=4 5151 B13R2.3205 ClC1(CC1)COCC2CCCO2 963a6c5f3e5261a057d3d7364493bec2 [0,0,0,1,0,1|1,0,1]=4 5152 B13R2.3205 FC1(CC1)COCC2CCCO2 12bdfcee38a2c7fd49b74931553d232e [0,0,0,1,0,1|1,0,1]=4 5153 B13R2.3205 FC1(CC1)COC[C@@H]2CCCO2 6c63263608f3ad2e9960cb98dcf884ca [0,0,0,1,0,1|1,0,1]=4 5154 B13R2.3205 FC1(CC1)COC[C@H]2CCCO2 57ce2896a98fdedd879d3972bdf3c9b4 [0,0,0,1,0,1|1,0,1]=4 5155 B13R2.6859 C=C(CC)CN1CC2CC1CO2 dc6941523426932bf9c1485adae68f43 [0,0,0,1,0,1|2,0,0]=4 5156 B13R2.6859 C=C(CC)CN1C[C@@H]2C[C@H]1CO2 41f3a96b3d8bcbe49bf44925a8bcce3e [0,0,0,1,0,1|2,0,0]=4 5157 B13R2.6859 C=C(CC)CN1C[C@H]2C[C@@H]1CO2 acc7dadde2ef63e687f13f12040b9095 [0,0,0,1,0,1|2,0,0]=4 5158 B13R2.6859 CCC(=O)CN1CC2CC1CO2 2284d5f7686a293faf25e61b3b113344 [0,0,0,1,0,1|1,0,0]=3 5159 B13R2.6859 CCC(=O)CN1CC2CCC1C2 c2710dff1de73aad9d89eaa09186d4c8 [0,0,0,1,0,1|2,0,0]=4 5160 B13R2.6859 CCC(=O)CN1C[C@@H]2CC[C@H]1C2 19b9325ed60796c9ad10e3c9e9e96f90 [0,0,0,1,0,1|2,0,0]=4 5161 B13R2.6859 CCC(=O)CN1C[C@@H]2C[C@H]1CO2 69012aca0317f9e94547b74397c12fe4 [0,0,0,1,0,1|1,0,0]=3 5162 B13R2.6859 CCC(=O)CN1C[C@H]2CC[C@@H]1C2 82c544c0d1be8da51faf15e60e6deeb7 [0,0,0,1,0,1|2,0,0]=4 5163 B13R2.6859 CCC(=O)CN1C[C@H]2C[C@@H]1CO2 170f8bc9e850a7dd114f9df40ebf1a03 [0,0,0,1,0,1|1,0,0]=3 5164 B13R2.6859 CCC(=O)NC1CC2CCC1C2 98eaf547eeb0d53d686af6bc6e8257e3 [0,0,0,1,0,1|2,0,0]=4 5165 B13R2.6859 CCC(=O)NC1C[C@@H]2CC[C@H]1C2 34d09e1c32641bf399adcdf93e6ff97c [0,0,0,1,0,1|2,0,0]=4 5166 B13R2.6859 CCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1C2 0a53f01893047b239606f940c803d3ce [0,0,0,1,0,1|2,0,0]=4 5167 B13R2.6859 CCC(=O)N[C@H]1C[C@H]2CC[C@@H]1C2 18cb252edfe661a73c20a31c96087791 [0,0,0,1,0,1|2,0,0]=4 5168 B13R2.6859 CNC(=O)CN1CC2CC1CO2 fb6ad6171f465c2281c9b4d406176658 [0,0,0,1,0,1|2,0,0]=4 5169 B13R2.6859 CNC(=O)CN1C[C@@H]2C[C@H]1CO2 859e3a9da9919f14ea5756257d5c8a66 [0,0,0,1,0,1|2,0,0]=4 5170 B13R2.6859 CNC(=O)CN1C[C@H]2C[C@@H]1CO2 84aee18c7196b811b9db0fac41677444 [0,0,0,1,0,1|2,0,0]=4 5171 B13R2.6859 COC(=O)CN1CC2CC1CO2 5cae7424bbcba5def20c18c1fe88a494 [0,0,0,1,0,1|2,0,0]=4 5172 B13R2.6859 COC(=O)CN1C[C@@H]2C[C@H]1CO2 4466cdcc4a153a0d2fbf4cd988161922 [0,0,0,1,0,1|2,0,0]=4 5173 B13R2.6859 COC(=O)CN1C[C@H]2C[C@@H]1CO2 3c1070e9f7bd755f0befb9591d0fba86 [0,0,0,1,0,1|2,0,0]=4 5174 B13R2.6859 O=C(CO)CN1CC2CC1CO2 04763d22d13ee6ef9ff75b229a30f66c [0,0,0,1,0,1|2,0,0]=4 5175 B13R2.6859 O=C(CO)CN1C[C@@H]2C[C@H]1CO2 d50b8c3bc3f59bc0bedff1fc50f4022e [0,0,0,1,0,1|2,0,0]=4 5176 B13R2.6859 O=C(CO)CN1C[C@H]2C[C@@H]1CO2 2b24388295fb51875e1a86ab5d436c1a [0,0,0,1,0,1|2,0,0]=4 5177 B13R2.445 C[C@@H](OC1CCC1)[C@H]2CCCO2 5fcf0926b89e8e0dc44d5692467b8a34 [0,1,0,1,0,0|1,0,1]=4 5178 B13R2.532 CCC(=O)N1CC2CCC(C1)O2 f139a37704b9531e1279a6e1514664fe [0,1,0,1,0,0|1,0,0]=3 5179 B13R2.532 CCC(=O)N1CC2CCC(C1)S2 7dc6d804bc6a6821808e5d5807533c67 [0,1,0,1,0,0|1,1,0]=4 5180 B13R2.532 CCC(=O)N1CC2CCC(C2)C1 783ce3d362f5f03942a492c96a27f05b [0,1,0,1,0,0|2,0,0]=4 5181 B13R2.532 CCC(=O)N1C[C@H]2CC[C@@H](C1)O2 9b785cd506d52731cb15e0094a45e433 [0,1,0,1,0,0|1,0,0]=3 5182 B13R2.532 O=C(CF)N1CC2CCC(C1)O2 6fc862ca7920056814fa389a1b5c4518 [0,1,0,1,0,0|2,0,0]=4 5183 B13R2.532 O=C(CF)N1C[C@H]2CC[C@@H](C1)O2 aef1ffbd4f31364a48212c2f5dbb58b6 [0,1,0,1,0,0|2,0,0]=4 5184 B13R2.532 O=C(CO)N1CC2CCC(C1)O2 b4511ee788aa4b7a8f4ae7a2e0aba66f [0,1,0,1,0,0|2,0,0]=4 5185 B13R2.532 O=C(CO)N1C[C@H]2CC[C@@H](C1)O2 dfb7ccb3f779d871b8f5059fd82f6a30 [0,1,0,1,0,0|2,0,0]=4 5186 B13R2.532 O=C(CS)N1CC2CCC(C1)O2 9a254961e71ef8a19e14e839745b1c6b [0,1,0,1,0,0|2,0,0]=4 5187 B13R2.532 O=C(CS)N1C[C@H]2CC[C@@H](C1)O2 4bcf31ee590b4f245f59817438e94e3b [0,1,0,1,0,0|2,0,0]=4 5188 B13R2.1118 CCC(=O)OCN1CC2CC1C2 9b88401e17fd5ba43238b5a6eefc81f9 [0,1,0,1,0,0|2,0,0]=4 5189 B13R2.1121 CCC(=O)NCC12CC(C1)CO2 ce608d4e95ab5272ca145df5543d24de [0,1,0,1,0,0|1,0,0]=3 5190 B13R2.1121 CCC(C)OCC12CC(C1)CO2 a2ca3958046de6e3bcbd3345dd95aa74 [0,1,0,1,0,0|1,0,1]=4 5191 B13R2.1121 CC[C@@H](C)OCC12CC(C1)CO2 831f5135e8aac1e8e85f1e4651d78e54 [0,1,0,1,0,0|1,0,1]=4 5192 B13R2.1121 CC[C@H](C)OCC12CC(C1)CO2 d81ec6eb401dabce71411e9dc9145e9d [0,1,0,1,0,0|1,0,1]=4 5193 B13R2.1121 O=C(CF)NCC12CC(C1)CO2 6fc47e49bf78c041507f428ecb775d47 [0,1,0,1,0,0|2,0,0]=4 5194 B13R2.1121 O=C(CO)NCC12CC(C1)CO2 9990abad65a545f03efe741f9ffd03f0 [0,1,0,1,0,0|2,0,0]=4 5195 B13R2.1121 O=C(CS)NCC12CC(C1)CO2 b9dc849ea1292fa3839cf4218290033f [0,1,0,1,0,0|2,0,0]=4 5196 B13R2.2974 CC1CCC(O1)COC2CCC2 3ec348d36d92406268c33f0f0dbda4c7 [0,1,0,1,0,0|1,0,1]=4 5197 B13R2.2974 C[C@H]1CC[C@H](O1)COC2CCC2 78f67382eca21b5fb5f6eaa79baf3d81 [0,1,0,1,0,0|1,0,1]=4 5198 B13R2.29 O=C1NCCC1OC2CCCO2 a2a435ad4fe86075a7a1f9902cef90cb [0,1,0,1,0,0|2,0,0]=4 5199 B13R2.183 C1=CC(CC1)OCC2CCCO2 c167275d1d559f2d5d4be8d53d3ab6b3 [0,1,0,1,0,0|1,0,1]=4 5200 B13R2.183 C1CCC(C1)OCC2CCCO2 68ab4afeec07b66e4f96174323b45755 [0,1,0,1,0,0|1,0,1]=4 5201 B13R2.183 C1CCC(C1)OC[C@@H]2CCCO2 c13defab0386d1e6c163d3761b444660 [0,1,0,1,0,0|1,0,1]=4 5202 B13R2.183 C1CCC(C1)OC[C@H]2CCCO2 556c2b652bfac1023b443fcdaefa2966 [0,1,0,1,0,0|1,0,1]=4 5203 B13R2.183 C1COC(C1)COC2CCCO2 98bd4c3ed7791a2eb08913d68345e0ce [0,1,0,1,0,0|0,0,2]=4 5204 B13R2.183 C1COC(C1)COC2CCOC2 c044ad81b9a1dc5b0914f8728147020c [0,1,0,1,0,0|0,0,2]=4 5205 B13R2.183 C1COC(C1)COC2CCSC2 9bfae64c835a85efe22c369acb456509 [0,1,0,1,0,0|0,1,1]=4 5206 B13R2.183 C1COC(C1)CO[C@@H]2CCOC2 5abb72e97593b130c572ca55428a9d4a [0,1,0,1,0,0|0,0,2]=4 5207 B13R2.183 C1COC(C1)CO[C@@H]2CCSC2 fd0d9d9a195f81620e92978f812e102f [0,1,0,1,0,0|0,1,1]=4 5208 B13R2.183 C1COC(C1)CO[C@H]2CCOC2 76d3877359e783efdd17f632c7c0e5b6 [0,1,0,1,0,0|0,0,2]=4 5209 B13R2.183 C1COC(C1)CO[C@H]2CCSC2 d95284658792db37214eb8a0b10c0468 [0,1,0,1,0,0|0,1,1]=4 5210 B13R2.183 C1CO[C@@H](C1)COC2CCOC2 439766b9b0b4a4ff1fc84a5467a9aaa3 [0,1,0,1,0,0|0,0,2]=4 5211 B13R2.183 C1CO[C@@H](C1)CO[C@@H]2CCOC2 1fe4b3f1ea60db96da9ff127d5dc5691 [0,1,0,1,0,0|0,0,2]=4 5212 B13R2.183 C1CO[C@@H](C1)CO[C@H]2CCOC2 b528d121928cce938c7595f55f7f3453 [0,1,0,1,0,0|0,0,2]=4 5213 B13R2.183 C1CO[C@H](C1)COC2CCOC2 aa10362a9560c1ede7f033d47ff0aaf8 [0,1,0,1,0,0|0,0,2]=4 5214 B13R2.183 C1CO[C@H](C1)CO[C@@H]2CCOC2 03262aa12b142acd67e3801b2989da3f [0,1,0,1,0,0|0,0,2]=4 5215 B13R2.183 C1CO[C@H](C1)CO[C@H]2CCOC2 914f4a99f0b8152c9a675bee52695335 [0,1,0,1,0,0|0,0,2]=4 5216 B13R2.241 CC1CC(C1)OCC2CCCO2 db62309d6ae842b7f1dc14f332761d30 [0,1,0,1,0,0|1,0,1]=4 5217 B13R2.241 CN1CC(C1)OCC2CCCO2 4de710d66baa60d3f73bfbcee9eea261 [0,1,0,1,0,0|1,0,1]=4 5218 B13R2.241 FC1CC(C1)OCC2CCCO2 9d6324f13127987030d44262d2db03db [0,1,0,1,0,0|1,0,1]=4 5219 B13R2.241 F[C@H]1C[C@@H](C1)OCC2CCCO2 3b3ae34898b7ac9aa77f3c023e0d0913 [0,1,0,1,0,0|1,0,1]=4 5220 B13R2.241 F[C@H]1C[C@H](C1)OCC2CCCO2 3abd3ef2563a931b162599373193e639 [0,1,0,1,0,0|1,0,1]=4 5221 B13R2.797 CCCC(=O)N1CC2C1CCC2 d9a3dd65f47a47bbb8874a3a467de8b2 [0,1,0,1,0,0|2,0,0]=4 5222 B13R2.797 CCCC(=O)N1C[C@H]2[C@@H]1CCC2 855d942a40eba2183faab891a710a421 [0,1,0,1,0,0|2,0,0]=4 5223 B13R2.797 COCC(=O)N1CC2C1CCC2 aba17e73a829aee4c9c3f318b9976a80 [0,1,0,1,0,0|2,0,0]=4 5224 B13R2.797 COCC(=O)N1C[C@H]2[C@@H]1CCC2 3dfcae80a451ed5942d42dfd7232e57c [0,1,0,1,0,0|2,0,0]=4 5225 B13R2.797 CSCC(=O)N1CC2C1CCC2 3816c2087e0aca81c20ac1e05a8ce4e0 [0,1,0,1,0,0|2,0,0]=4 5226 B13R2.797 CSCC(=O)N1C[C@H]2[C@@H]1CCC2 0150cbb33bff9b8cd281ab2d1ea74642 [0,1,0,1,0,0|2,0,0]=4 5227 B13R2.797 O=C(CCF)N1CC2C1CCC2 1c180d55bfacd2cae402c63120922894 [0,1,0,1,0,0|2,0,0]=4 5228 B13R2.797 O=C(CCF)N1C[C@H]2[C@@H]1CCC2 933cb41effa0d3784fb91d6d95ddda98 [0,1,0,1,0,0|2,0,0]=4 5229 B13R2.797 O=C(CCO)N1CC2C1CCC2 1210064cda9ceea7d907e84aa8940ad0 [0,1,0,1,0,0|2,0,0]=4 5230 B13R2.797 O=C(CCO)N1C[C@H]2[C@@H]1CCC2 ee3f5d568001b5e0544d8635f6b0c39e [0,1,0,1,0,0|2,0,0]=4 5231 B13R2.797 O=C(CCS)N1CC2C1CCC2 4a76939e412e4de895619f3d523ead7d [0,1,0,1,0,0|2,0,0]=4 5232 B13R2.797 O=C(CCS)N1C[C@H]2[C@@H]1CCC2 7cd3a62284f17bf93a132a211e7f22e4 [0,1,0,1,0,0|2,0,0]=4 5233 B13R2.856 C#CCC(=O)N1CC2CC1CO2 545dbe15bbec6aeb76c098016a3098f6 [0,1,0,1,0,0|1,0,1]=4 5234 B13R2.856 C#CCC(=O)N1C[C@@H]2C[C@H]1CO2 7a8965d01964cf3a845593a0389a6c69 [0,1,0,1,0,0|1,0,1]=4 5235 B13R2.856 C#CCC(=O)N1C[C@H]2C[C@@H]1CO2 adf4b5b4a321effde4175284f4238094 [0,1,0,1,0,0|1,0,1]=4 5236 B13R2.856 C/C=C/C(=O)N1CC2CC1CO2 d606c6a8b4e2edf5debb1c6039c13a13 [0,1,0,1,0,0|1,0,1]=4 5237 B13R2.856 C/C=C/C(=O)N1C[C@@H]2C[C@H]1CO2 5e9b1a749979007d96b77e7318af4336 [0,1,0,1,0,0|1,0,1]=4 5238 B13R2.856 C/C=C/C(=O)N1C[C@H]2C[C@@H]1CO2 0fa528e3adf75dbaa521b1f8440778e4 [0,1,0,1,0,0|1,0,1]=4 5239 B13R2.856 C=CCC(=O)N1CC2CC1CO2 42c2bfe41efeae8f628d300be8b0d9e9 [0,1,0,1,0,0|1,0,1]=4 5240 B13R2.856 C=CCC(=O)N1C[C@@H]2C[C@H]1CO2 2cc89d1484250ce9544ccfa0121381a0 [0,1,0,1,0,0|1,0,1]=4 5241 B13R2.856 C=CCC(=O)N1C[C@H]2C[C@@H]1CO2 42d0f9e120b752127173032d085b794f [0,1,0,1,0,0|1,0,1]=4 5242 B13R2.856 CC#CC(=O)N1CC2CC1CO2 73af5615c2ec130713f18146c7678863 [0,1,0,1,0,0|1,0,1]=4 5243 B13R2.856 CC#CC(=O)N1C[C@@H]2C[C@H]1CO2 e0ae42f9852343ba7583835db3e5ae8e [0,1,0,1,0,0|1,0,1]=4 5244 B13R2.856 CC#CC(=O)N1C[C@H]2C[C@@H]1CO2 a710c590bb80c46c95c704a455beab9b [0,1,0,1,0,0|1,0,1]=4 5245 B13R2.856 CCCC(=O)N1CC2CC1CO2 307c2ae062760b1d113b4e9342086a46 [0,1,0,1,0,0|1,0,0]=3 5246 B13R2.856 CCCC(=O)N1CC2CCC1C2 c6983d50442d0565590b76cf094a075c [0,1,0,1,0,0|2,0,0]=4 5247 B13R2.856 CCCC(=O)N1C[C@@H]2CC[C@H]1C2 b25016f30e6e2c521d02d2a4e4768cde [0,1,0,1,0,0|2,0,0]=4 5248 B13R2.856 CCCC(=O)N1C[C@@H]2C[C@H]1CO2 6f6fd493c41250b58a014db6356a4a5b [0,1,0,1,0,0|1,0,0]=3 5249 B13R2.856 CCCC(=O)N1C[C@H]2CC[C@@H]1C2 57a65563c0663b58c3d3e9f128211804 [0,1,0,1,0,0|2,0,0]=4 5250 B13R2.856 CCCC(=O)N1C[C@H]2C[C@@H]1CO2 8acf936f0768f95c976e2ac13d1d1f9b [0,1,0,1,0,0|1,0,0]=3 5251 B13R2.856 COCC(=O)N1CC2CC1CO2 b686789a8de92624bc31fa59868cc929 [0,1,0,1,0,0|1,0,0]=3 5252 B13R2.856 COCC(=O)N1CC2CCC1C2 9b16cd99ea103b68b547f8413bb62f0b [0,1,0,1,0,0|2,0,0]=4 5253 B13R2.856 COCC(=O)N1C[C@@H]2CC[C@H]1C2 53a3a47552b21843cd8aa8975b2ef338 [0,1,0,1,0,0|2,0,0]=4 5254 B13R2.856 COCC(=O)N1C[C@@H]2C[C@H]1CO2 5cfff210846b0d764009b2c83f86570a [0,1,0,1,0,0|1,0,0]=3 5255 B13R2.856 COCC(=O)N1C[C@H]2CC[C@@H]1C2 32b1e160cb2aadaabc0e58b763708ba2 [0,1,0,1,0,0|2,0,0]=4 5256 B13R2.856 COCC(=O)N1C[C@H]2C[C@@H]1CO2 b758cab8ccf6997ed5ce3e5cad8ccdbb [0,1,0,1,0,0|1,0,0]=3 5257 B13R2.856 CSCC(=O)N1CC2CC1CO2 3a9c475c5d00e8e02b8f8d760c144953 [0,1,0,1,0,0|1,0,0]=3 5258 B13R2.856 CSCC(=O)N1CC2CCC1C2 00671ec5bee645234de95b9fe628c0b7 [0,1,0,1,0,0|2,0,0]=4 5259 B13R2.856 CSCC(=O)N1C[C@@H]2CC[C@H]1C2 49f17c570b095e1630f41689e232d8d9 [0,1,0,1,0,0|2,0,0]=4 5260 B13R2.856 CSCC(=O)N1C[C@@H]2C[C@H]1CO2 d4e94e11e02866ce0a308b582ac76781 [0,1,0,1,0,0|1,0,0]=3 5261 B13R2.856 CSCC(=O)N1C[C@H]2CC[C@@H]1C2 6daee6b97f6e0e13a3677fb6b57f9d12 [0,1,0,1,0,0|2,0,0]=4 5262 B13R2.856 CSCC(=O)N1C[C@H]2C[C@@H]1CO2 2f61ee770aceb3036fbf608f72f5d402 [0,1,0,1,0,0|1,0,0]=3 5263 B13R2.856 N#CCC(=O)N1CC2CC1CO2 bf9209685707b153faecee2f0efcf729 [0,1,0,1,0,0|1,0,1]=4 5264 B13R2.856 N#CCC(=O)N1C[C@@H]2C[C@H]1CO2 5ba150170e02782a50344f2d6f1bb85a [0,1,0,1,0,0|1,0,1]=4 5265 B13R2.856 N#CCC(=O)N1C[C@H]2C[C@@H]1CO2 2e2f40c6d281c92a487dfdf7a0c26250 [0,1,0,1,0,0|1,0,1]=4 5266 B13R2.856 NOCC(=O)N1CC2CC1CO2 6a1a8766c1216084f8f9407b47457351 [0,1,0,1,0,0|2,0,0]=4 5267 B13R2.856 NOCC(=O)N1C[C@@H]2C[C@H]1CO2 9902d225e6a1b46dabf6e44829d1fb0e [0,1,0,1,0,0|2,0,0]=4 5268 B13R2.856 NOCC(=O)N1C[C@H]2C[C@@H]1CO2 627047b92dcc1483830dfabc98b912d6 [0,1,0,1,0,0|2,0,0]=4 5269 B13R2.856 O=C(CCF)N1CC2CC1CO2 abdd2f9ef02e8d70cc4a6defb084d53c [0,1,0,1,0,0|1,0,0]=3 5270 B13R2.856 O=C(CCF)N1CC2CCC1C2 6199857735e9a61b3f0172ef8ea059c6 [0,1,0,1,0,0|2,0,0]=4 5271 B13R2.856 O=C(CCF)N1C[C@@H]2CC[C@H]1C2 62437484829064b95f7868b470444226 [0,1,0,1,0,0|2,0,0]=4 5272 B13R2.856 O=C(CCF)N1C[C@@H]2C[C@H]1CO2 d1f9f1fb6c6eaebd631166fdfa8344f4 [0,1,0,1,0,0|1,0,0]=3 5273 B13R2.856 O=C(CCF)N1C[C@H]2CC[C@@H]1C2 77079110398275014918204f8beeb3e8 [0,1,0,1,0,0|2,0,0]=4 5274 B13R2.856 O=C(CCF)N1C[C@H]2C[C@@H]1CO2 f2af48328d09dcc25008d7d6216c12cc [0,1,0,1,0,0|1,0,0]=3 5275 B13R2.856 O=C(CCO)N1CC2CC1CO2 727a4794875fee0e4888f694f275d38c [0,1,0,1,0,0|1,0,0]=3 5276 B13R2.856 O=C(CCO)N1CC2CCC1C2 7ea9009cafa12dc8d6c802aac64f1a74 [0,1,0,1,0,0|2,0,0]=4 5277 B13R2.856 O=C(CCO)N1C[C@@H]2CC[C@H]1C2 c7739cbad75b4d9f90f9c330dea60a7c [0,1,0,1,0,0|2,0,0]=4 5278 B13R2.856 O=C(CCO)N1C[C@@H]2C[C@H]1CO2 7c06645130d046df3c8a008be6dc80f2 [0,1,0,1,0,0|1,0,0]=3 5279 B13R2.856 O=C(CCO)N1C[C@H]2CC[C@@H]1C2 235058bbbfa26a3dd867249f9441dc4e [0,1,0,1,0,0|2,0,0]=4 5280 B13R2.856 O=C(CCO)N1C[C@H]2C[C@@H]1CO2 81c3c3354f7350a194ef09c67db8d84a [0,1,0,1,0,0|1,0,0]=3 5281 B13R2.856 O=C(CCS)N1CC2CC1CO2 c96a7e73d00d0267012fdb479a68b25b [0,1,0,1,0,0|1,0,0]=3 5282 B13R2.856 O=C(CCS)N1CC2CCC1C2 16c935dc172c14b348ab84eeaa0cd31b [0,1,0,1,0,0|2,0,0]=4 5283 B13R2.856 O=C(CCS)N1C[C@@H]2CC[C@H]1C2 87a481f89de8aef43e4940e1999e5917 [0,1,0,1,0,0|2,0,0]=4 5284 B13R2.856 O=C(CCS)N1C[C@@H]2C[C@H]1CO2 4e06fa0da8f79be365cd4962968d461e [0,1,0,1,0,0|1,0,0]=3 5285 B13R2.856 O=C(CCS)N1C[C@H]2CC[C@@H]1C2 60b6d188e68cf79405d03fa56a3da227 [0,1,0,1,0,0|2,0,0]=4 5286 B13R2.856 O=C(CCS)N1C[C@H]2C[C@@H]1CO2 d388b703894ebdce7282eb1a390bfe1b [0,1,0,1,0,0|1,0,0]=3 5287 B13R2.856 O=CCC(=O)N1CC2CC1CO2 9346c72160d9b41fa335ead525c32fc9 [0,1,0,1,0,0|1,0,1]=4 5288 B13R2.856 O=CCC(=O)N1C[C@@H]2C[C@H]1CO2 7bf6b81f31c6b940cfc57972fae4390a [0,1,0,1,0,0|1,0,1]=4 5289 B13R2.856 O=CCC(=O)N1C[C@H]2C[C@@H]1CO2 933957a0e766da75f7fd97169e885fa8 [0,1,0,1,0,0|1,0,1]=4 5290 B13R2.6970 CC(OCC1CCCO1)C2CC2 698eae5c51ff7540d09b56d11a3e864a [0,1,0,1,0,0|1,0,1]=4 5291 B13R2.6970 CC(OC[C@@H]1CCCO1)C2CC2 c2f0fab57854deaf3bcfbf6e49f1a9d1 [0,1,0,1,0,0|1,0,1]=4 5292 B13R2.6970 CC(OC[C@H]1CCCO1)C2CC2 987db23f3ab0f6d2732dda3fe669c56b [0,1,0,1,0,0|1,0,1]=4 5293 B13R2.6970 C[C@@H](OCC1CCCO1)C2CC2 e03fc27f67b12bdd2062f6f0633017a6 [0,1,0,1,0,0|1,0,1]=4 5294 B13R2.6970 C[C@H](OCC1CCCO1)C2CC2 6a65d81cda762464a18451ffd171718f [0,1,0,1,0,0|1,0,1]=4 5295 B13R2.6970 O=C(COC1CCCO1)C2CC2 8c75fc182ee1affa9daa82da17d01813 [0,1,0,1,0,0|2,0,0]=4 5296 B13R2.531 CCC(=O)N1CC2CCCC2C1 8ad445d74f49dbf98f5a48e03805d360 [0,1,0,1,0,0|2,0,0]=4 5297 B13R2.531 CCC(=O)N1CC2CCOC2C1 d51eebd500e72c4f6be39a3334fc1898 [0,1,0,1,0,0|1,0,0]=3 5298 B13R2.531 CCC(=O)N1C[C@H]2CCC[C@H]2C1 ca936f0d284a588d1a1371bbb6ecef20 [0,1,0,1,0,0|2,0,0]=4 5299 B13R2.531 O=C(CF)N1CC2CCOC2C1 30db76bd40fa8026c3694a389524b96c [0,1,0,1,0,0|2,0,0]=4 5300 B13R2.531 O=C(CO)N1CC2CCOC2C1 3d385ede7ddd7fdca4907a99e8a9df28 [0,1,0,1,0,0|2,0,0]=4 5301 B13R2.531 O=C(CS)N1CC2CCOC2C1 2557efbf41c20ac477d5cb450ea98d16 [0,1,0,1,0,0|2,0,0]=4 5302 B13R2.15269 CCC(=O)N1CC2(C1)CCCC2 3eac0ae2808acc72a19ff88f83e3fca0 [0,1,0,1,0,0|2,0,0]=4 5303 B13R2.15269 CCC(=O)N1CC2(C1)CCCO2 3d4221aa7156357e44d5f3365bb0805f [0,1,0,1,0,0|1,0,0]=3 5304 B13R2.15269 O=C(CF)N1CC2(C1)CCCO2 55845d585297ab385c13f89c6853f932 [0,1,0,1,0,0|2,0,0]=4 5305 B13R2.15269 O=C(CO)N1CC2(C1)CCCO2 321b7daf4a6666bebed650ddb01e0793 [0,1,0,1,0,0|2,0,0]=4 5306 B13R2.15269 O=C(CS)N1CC2(C1)CCCO2 525e436cce0bd7af9147dcb9d49c2aeb [0,1,0,1,0,0|2,0,0]=4 5307 B13R2.3598 CC1(CC1OCC2CCCO2)C 7d852935872d7bfb1fb7a4edd25e569e [0,1,0,1,0,0|1,0,1]=4 5308 B13R2.3598 CC1(CC1OC[C@@H]2CCCO2)C 1d08ca8d945b1c422ac55c5e49b00e39 [0,1,0,1,0,0|1,0,1]=4 5309 B13R2.3598 CC1(CC1OC[C@H]2CCCO2)C 03675fe6e8d2515ebd6433c15e466799 [0,1,0,1,0,0|1,0,1]=4 5310 B13R2.7926 CC(F)C(=O)N1CC2C1CCC2 5cef58b7f8a806e33b4e71bdae96b1c7 [0,1,0,1,0,0|2,0,0]=4 5311 B13R2.7926 CC(F)C(=O)N1C[C@H]2[C@@H]1CCC2 d5e4b393dd35ba809c6e76ed7fa770ff [0,1,0,1,0,0|2,0,0]=4 5312 B13R2.7926 CC(O)C(=O)N1CC2C1CCC2 780fa6669ae7e91d5d5224e7970c0fb5 [0,1,0,1,0,0|2,0,0]=4 5313 B13R2.7926 CC(O)C(=O)N1C[C@H]2[C@@H]1CCC2 060b3210027d05c90c1e7723fb900974 [0,1,0,1,0,0|2,0,0]=4 5314 B13R2.7926 CC(S)C(=O)N1CC2C1CCC2 588122c4aeff0933cee6802c9ff54acf [0,1,0,1,0,0|2,0,0]=4 5315 B13R2.7926 CC(S)C(=O)N1C[C@H]2[C@@H]1CCC2 de3d79af923ce3e14061c82a0bc578ee [0,1,0,1,0,0|2,0,0]=4 5316 B13R2.7926 C[C@@H](F)C(=O)N1CC2C1CCC2 34d6c6e5e067e557c2997c34d606c332 [0,1,0,1,0,0|2,0,0]=4 5317 B13R2.7926 C[C@@H](F)C(=O)N1C[C@H]2[C@@H]1CCC2 2b3d17f5f8c8ab836a4f36774e6e58db [0,1,0,1,0,0|2,0,0]=4 5318 B13R2.7926 C[C@@H](O)C(=O)N1CC2C1CCC2 ed0e9afd17b70f216504e628526f0312 [0,1,0,1,0,0|2,0,0]=4 5319 B13R2.7926 C[C@@H](O)C(=O)N1C[C@H]2[C@@H]1CCC2 a62411527b0895fb52796bb17039c6aa [0,1,0,1,0,0|2,0,0]=4 5320 B13R2.7926 C[C@H](F)C(=O)N1CC2C1CCC2 8c0f90c29b343b8fec589989e38c6117 [0,1,0,1,0,0|2,0,0]=4 5321 B13R2.7926 C[C@H](F)C(=O)N1C[C@H]2[C@@H]1CCC2 d48e1c8db26cfab7e56090abf0c134a4 [0,1,0,1,0,0|2,0,0]=4 5322 B13R2.7926 C[C@H](O)C(=O)N1CC2C1CCC2 77f6adde654e8ccbcc7ec32dce9ee037 [0,1,0,1,0,0|2,0,0]=4 5323 B13R2.7926 C[C@H](O)C(=O)N1C[C@H]2[C@@H]1CCC2 ac667e52eb21d0b869d22a9f07d54a90 [0,1,0,1,0,0|2,0,0]=4 5324 B13R2.7957 C=C(C)C(=O)N1CC2CC1CO2 10b4d28f263c8d4d40dc89be7c3c0b11 [0,1,0,1,0,0|1,0,1]=4 5325 B13R2.7957 C=C(C)C(=O)N1C[C@@H]2C[C@H]1CO2 79c31a56be4af58a827670b5433b2f63 [0,1,0,1,0,0|1,0,1]=4 5326 B13R2.7957 C=C(C)C(=O)N1C[C@H]2C[C@@H]1CO2 e4af5c4cd31d39638f405a475fe5bc83 [0,1,0,1,0,0|1,0,1]=4 5327 B13R2.7957 CC(=O)C(=O)N1CC2CC1CO2 3c52d3364f2284b86e2254512efd95bc [0,1,0,1,0,0|1,0,1]=4 5328 B13R2.7957 CC(=O)C(=O)N1C[C@@H]2C[C@H]1CO2 20e05adcc76f26ecc3627b23fe7abe85 [0,1,0,1,0,0|1,0,1]=4 5329 B13R2.7957 CC(=O)C(=O)N1C[C@H]2C[C@@H]1CO2 4ada4a764cee110e5f2fe5e9a4d38523 [0,1,0,1,0,0|1,0,1]=4 5330 B13R2.7957 CC(O)C(=O)N1CC2CC1CO2 aa4d9ee7a0ae1a4071bd9701aafefe92 [0,1,0,1,0,0|1,0,0]=3 5331 B13R2.7957 CC(O)C(=O)N1CC2CCC1C2 a4e637b291d4804da7635a117f130762 [0,1,0,1,0,0|2,0,0]=4 5332 B13R2.7957 CC(O)C(=O)N1C[C@@H]2CC[C@H]1C2 5fa42c8890f3b9ed17b19fe585467b9a [0,1,0,1,0,0|2,0,0]=4 5333 B13R2.7957 CC(O)C(=O)N1C[C@@H]2C[C@H]1CO2 306496036bb3e9b20b1014729c7792b5 [0,1,0,1,0,0|1,0,0]=3 5334 B13R2.7957 CC(O)C(=O)N1C[C@H]2CC[C@@H]1C2 9ce64394ffc2addb73a5d1c51e8887ca [0,1,0,1,0,0|2,0,0]=4 5335 B13R2.7957 CC(O)C(=O)N1C[C@H]2C[C@@H]1CO2 0209e3b2a23fd81f2c25ca61cb377b98 [0,1,0,1,0,0|1,0,0]=3 5336 B13R2.7957 CC(S)C(=O)N1CC2CC1CO2 009b6d57ced9ef6b97f89d924f072d1a [0,1,0,1,0,0|1,0,0]=3 5337 B13R2.7957 CC(S)C(=O)N1CC2CCC1C2 8c8cb429562787b5162e2f2194c47f5e [0,1,0,1,0,0|2,0,0]=4 5338 B13R2.7957 CC(S)C(=O)N1C[C@@H]2CC[C@H]1C2 74a9e4479e315a956e54283cea63ba1d [0,1,0,1,0,0|2,0,0]=4 5339 B13R2.7957 CC(S)C(=O)N1C[C@@H]2C[C@H]1CO2 84af3a00dc054cfeffad2b87af410851 [0,1,0,1,0,0|1,0,0]=3 5340 B13R2.7957 CC(S)C(=O)N1C[C@H]2CC[C@@H]1C2 829eb3815c25b87c892cee0f6817b3a5 [0,1,0,1,0,0|2,0,0]=4 5341 B13R2.7957 CC(S)C(=O)N1C[C@H]2C[C@@H]1CO2 3b752c02c19a868327b5f51278c1bee2 [0,1,0,1,0,0|1,0,0]=3 5342 B13R2.7957 C[C@@H](O)C(=O)N1CC2CC1CO2 94ced1df68ba8f45e78a0192f7485966 [0,1,0,1,0,0|1,0,0]=3 5343 B13R2.7957 C[C@@H](O)C(=O)N1CC2CCC1C2 0f452f9e731f5558b46606966fb0a3b3 [0,1,0,1,0,0|2,0,0]=4 5344 B13R2.7957 C[C@@H](O)C(=O)N1C[C@@H]2CC[C@H]1C2 a9e842d83ebc6d78062f027cc36941a1 [0,1,0,1,0,0|2,0,0]=4 5345 B13R2.7957 C[C@@H](O)C(=O)N1C[C@@H]2C[C@H]1CO2 6f7ecec05c3c899426c277b6c436cf08 [0,1,0,1,0,0|1,0,0]=3 5346 B13R2.7957 C[C@@H](O)C(=O)N1C[C@H]2CC[C@@H]1C2 491299ddf1f9bb347006a150ccb01f42 [0,1,0,1,0,0|2,0,0]=4 5347 B13R2.7957 C[C@@H](O)C(=O)N1C[C@H]2C[C@@H]1CO2 9cf421fd419b5de19963eedfca431d27 [0,1,0,1,0,0|1,0,0]=3 5348 B13R2.7957 C[C@H](O)C(=O)N1CC2CC1CO2 d445322c8391d14207889a987e764d86 [0,1,0,1,0,0|1,0,0]=3 5349 B13R2.7957 C[C@H](O)C(=O)N1CC2CCC1C2 afbf7a37a376e42915f6289b9d188b3d [0,1,0,1,0,0|2,0,0]=4 5350 B13R2.7957 C[C@H](O)C(=O)N1C[C@@H]2CC[C@H]1C2 7237799be27bc6a7a251a6bfbc44be20 [0,1,0,1,0,0|2,0,0]=4 5351 B13R2.7957 C[C@H](O)C(=O)N1C[C@@H]2C[C@H]1CO2 0751b7b5bf1fbb1b4dff64be74a474e5 [0,1,0,1,0,0|1,0,0]=3 5352 B13R2.7957 C[C@H](O)C(=O)N1C[C@H]2CC[C@@H]1C2 cda2fdb611d7beee37dd39abaa904b8b [0,1,0,1,0,0|2,0,0]=4 5353 B13R2.7957 C[C@H](O)C(=O)N1C[C@H]2C[C@@H]1CO2 3f23ad33fe06298f63d6a1f9dca851cb [0,1,0,1,0,0|1,0,0]=3 5354 B13R2.7957 O=C(C(F)F)N1CC2CC1CO2 052fd222aba7b265b903558d78abe6aa [0,1,0,1,0,0|2,0,0]=4 5355 B13R2.7957 O=C(C(F)F)N1C[C@@H]2C[C@H]1CO2 c48c7f82a04ca5e0966a2054f10d863c [0,1,0,1,0,0|2,0,0]=4 5356 B13R2.7957 O=C(C(F)F)N1C[C@H]2C[C@@H]1CO2 67ea48aed37385b2c7c90100e1bd6088 [0,1,0,1,0,0|2,0,0]=4 5357 B13R2.7957 O=C(C(O)O)N1CC2CC1CO2 2ac942d5a5bd634873ab14d99a166748 [0,1,0,1,0,0|2,0,0]=4 5358 B13R2.7957 O=C(C(O)O)N1C[C@@H]2C[C@H]1CO2 bb7e0acb0cc71f7479a5432c3a634132 [0,1,0,1,0,0|2,0,0]=4 5359 B13R2.7957 O=C(C(O)O)N1C[C@H]2C[C@@H]1CO2 587f26dd21e2a1859aedf019bd36fc1d [0,1,0,1,0,0|2,0,0]=4 5360 B13R2.1791 O=CN1CCC2(CCCO2)CC1 496a2eefed612129caade32cbf51214c [0,1,0,1,0,0|2,0,0]=4 5361 B13R2.5456 CCC(C=O)OCC12CCC1C2 859d2b055e8c11a54e6f8a0336f557db [0,1,0,1,0,0|1,0,1]=4 5362 B13R2.5477 CCC(C=O)N1CC2CC1CO2 62ac50d22a8e7a221f9409b897b2a3fc [0,1,0,1,0,0|1,0,1]=4 5363 B13R2.5477 CCC(C=O)N1C[C@@H]2C[C@H]1CO2 df4fe6ad916842a17579ff380c21b91a [0,1,0,1,0,0|1,0,1]=4 5364 B13R2.5477 CCC(C=O)N1C[C@H]2C[C@@H]1CO2 c26b26cecc6122fa9905975a4df131fe [0,1,0,1,0,0|1,0,1]=4 5365 B13R2.1151 CCC(=O)N1CC2CC1CC2O 3fe182c0ee0439d1e79f73357b640a9c [0,1,0,1,0,0|2,0,0]=4 5366 B13R2.1151 CCC(=O)N1CC2C[C@@H]1C[C@@H]2O 805ddf3b3b12c87a29ebe60e449a4568 [0,1,0,1,0,0|2,0,0]=4 5367 B13R2.1151 CCC(=O)N1C[C@H]2C[C@@H]1CN2C e6ff3eb79f5780782a71c8a510c15f81 [0,1,0,1,0,0|2,0,0]=4 5368 B13R2.3152 CC1CCOC1COC2CCC2 f26d1982b5e713dfbc0ca0a985a17cf8 [0,1,0,1,0,0|1,0,1]=4 5369 B13R2.11531 CC1(CCCO1)COC2CCC2 a5fb4c0eef457f3a8ff7197a8289842f [0,1,0,1,0,0|1,0,1]=4 5370 B9R0.26 CCC(=O)NC(CC)CC 48af0a339dbe677364c040662b1ffef5 [0,0,1,0,1,0|2,0,0]=4 5371 B9R0.34 CCCC(C)NC(=O)CC 1c5e7d013b6d8314fad6ff12635fab4a [0,0,1,0,1,0|2,0,0]=4 5372 B9R0.34 CCCN(C)CC(=O)CC c80c7d6de1d5253ede7d75a7d9fc6b4c [0,0,1,0,1,0|2,0,0]=4 5373 B9R0.34 CCC[C@H](C)NC(=O)CC ad5f66cc617489af6f8b7c428b7d7795 [0,0,1,0,1,0|2,0,0]=4 5374 B9R0.34 CCNC(C)CC(=O)OC 8f5a36e5208499c391d24b252a12bf38 [0,0,1,0,1,0|2,0,0]=4 5375 B9R0.34 CCN[C@@H](C)CC(=O)OC 9e23f1bf52061ebf026cb501e421df05 [0,0,1,0,1,0|2,0,0]=4 5376 B9R0.34 CCN[C@H](C)CC(=O)OC 996cd301be79ec168f4649523ee618f0 [0,0,1,0,1,0|2,0,0]=4 5377 B9R0.34 CCO/C(=C/C(=O)CC)/C c820e01072ca31bdd89ad2eb64e446a9 [0,0,1,0,1,0|0,0,2]=4 5378 B9R0.34 CCOC(C)CC(=O)OC bb8935a6b3f2527590add1883d9af4ba [0,0,1,0,1,0|1,0,0]=3 5379 B9R0.34 CCOC(C)CN(C)CC 183803ac9c8d7cf06ded93f15f118dc8 [0,0,1,0,1,0|2,0,0]=4 5380 B9R0.34 CCO[C@@H](C)CC(=O)OC aac0a176fbc44f8c523dab5a743853de [0,0,1,0,1,0|1,0,0]=3 5381 B9R0.34 CCO[C@H](C)CC(=O)OC 3c6c55836fc2ed2696b0ec29d17e7dcf [0,0,1,0,1,0|1,0,0]=3 5382 B9R0.34 COC(=O)CC(C)OCF 68dbeec4b12b0259cc1cb07aaaa75105 [0,0,1,0,1,0|2,0,0]=4 5383 B9R0.34 COC(=O)C[C@@H](C)OCF 7f7d1856387b433cec9b5e54411bfa81 [0,0,1,0,1,0|2,0,0]=4 5384 B9R0.34 COC(=O)C[C@H](C)OCF 5de665b9654f96b29e1d14acbc21116f [0,0,1,0,1,0|2,0,0]=4 5385 B9R1.17 CC/C=C/CN1CCC1 00bce6f94f88e4fad015011e92441d45 [1,0,0,0,1,0|2,0,0]=4 5386 B9R1.17 CCCNCC1CCC1 c55f078a4591dc6bcef7e0f4bb7d93c0 [1,0,0,0,1,0|1,0,1]=4 5387 B9R1.17 CCCNCC1CCO1 787b259f563a64412a05f6375c510307 [1,0,0,0,1,0|1,0,1]=4 5388 B9R1.17 CCCNC[C@@H]1CCO1 09e702ada7d1001485e8ef84f376d413 [1,0,0,0,1,0|1,0,1]=4 5389 B9R1.17 CCCNC[C@H]1CCO1 cff33eb3b6a9e99c0c6a161e680951b7 [1,0,0,0,1,0|1,0,1]=4 5390 B9R1.17 CCCOCC1CCC1 6bc97c6b8b74b4afb6348dbcd6370478 [1,0,0,0,1,0|0,0,1]=3 5391 B9R1.17 CCCOCC1CCO1 dce9304902398e33f033a8ebfca20c53 [1,0,0,0,1,0|0,0,1]=3 5392 B9R1.17 CCCOCC1COC1 51179db10ee449120577f8bb7f6d1912 [1,0,0,0,1,0|1,0,1]=4 5393 B9R1.17 CCCOCC1CSC1 64a1c8278d20c100c180e7544e8bcc71 [1,0,0,0,1,0|1,0,1]=4 5394 B9R1.17 CCCOC[C@@H]1CCO1 c245ae24508202032a63f9f16acb84cf [1,0,0,0,1,0|0,0,1]=3 5395 B9R1.17 CCCOC[C@H]1CCO1 41d8fefb0693f7efdbac57d0fec29667 [1,0,0,0,1,0|0,0,1]=3 5396 B9R1.17 CCNCCC1CCC1 2a6d507a82730c6232a4872c109a0b5c [1,0,0,0,1,0|2,0,0]=4 5397 B9R1.17 CCNCCC1CCO1 4ae5fe85c000a9c5bb25d4ff5bb61f46 [1,0,0,0,1,0|2,0,0]=4 5398 B9R1.17 CCNCC[C@@H]1CCO1 87fce7fd72273e8060816918b85a2637 [1,0,0,0,1,0|2,0,0]=4 5399 B9R1.17 CCOCCC1CCC1 b8fb156ada576d4ff345af9850e688ed [1,0,0,0,1,0|2,0,0]=4 5400 B9R1.17 CCOCCC1CCO1 cd6091d78b963fcc0d69fc11334e4cc1 [1,0,0,0,1,0|2,0,0]=4 5401 B9R1.17 CCOCC[C@@H]1CCO1 5a8cf1d590ea701c17ab71cbcce8b435 [1,0,0,0,1,0|2,0,0]=4 5402 B9R1.17 CCOCC[C@H]1CCO1 585e9080fae90924dbee753be634e6b9 [1,0,0,0,1,0|2,0,0]=4 5403 B9R1.17 COCOCC1CCC1 8b689d4795025d681e5fff3550f78a35 [1,0,0,0,1,0|1,0,1]=4 5404 B9R1.17 COCOCC1CCO1 09fd28a73ccbc8c638d6f31aa99da7ff [1,0,0,0,1,0|1,0,1]=4 5405 B9R1.17 COCOC[C@@H]1CCO1 d7f0f17ed91ade35d0560c1aa17c9591 [1,0,0,0,1,0|1,0,1]=4 5406 B9R1.17 COCOC[C@H]1CCO1 52148cb36fe79b54cd4adae0bdb4ff0c [1,0,0,0,1,0|1,0,1]=4 5407 B9R1.17 CSCOCC1CCC1 bedefa5460dd9daf8d601ebd120c7465 [1,0,0,0,1,0|1,0,1]=4 5408 B9R1.17 CSCOCC1CCO1 6c8e2111a3f94134e80bf8dc4d57f591 [1,0,0,0,1,0|1,0,1]=4 5409 B9R1.17 CSCOC[C@@H]1CCO1 8deef529a0cde32bbd303d6f89fa57ab [1,0,0,0,1,0|1,0,1]=4 5410 B9R1.17 CSCOC[C@H]1CCO1 63e1bb878dc9711500979a8b17c3ea2f [1,0,0,0,1,0|1,0,1]=4 5411 B9R1.17 FCCOCC1CCC1 82bcce98f73dbc2c6d505f58542894f6 [1,0,0,0,1,0|1,0,1]=4 5412 B9R1.17 FCCOCC1CCO1 7806ad5e6ae70d13ff50ed87dc11629e [1,0,0,0,1,0|1,0,1]=4 5413 B9R1.17 FCCOC[C@@H]1CCO1 2671611904c76bc05b4fea8a35610b04 [1,0,0,0,1,0|1,0,1]=4 5414 B9R1.17 FCCOC[C@H]1CCO1 fc45e6858c3c260890fd8931dc56a63e [1,0,0,0,1,0|1,0,1]=4 5415 B9R1.17 SCCOCC1CCC1 bf6bded4786a47dd707579e4d889696b [1,0,0,0,1,0|1,0,1]=4 5416 B9R1.17 SCCOCC1CCO1 3153da5b485d0784119997884e35ce3a [1,0,0,0,1,0|1,0,1]=4 5417 B9R1.17 SCCOC[C@@H]1CCO1 d979bc04000d38eadddb72ca67633645 [1,0,0,0,1,0|1,0,1]=4 5418 B9R1.17 SCCOC[C@H]1CCO1 97197136988d3a4e8b7a67043ce7b1ac [1,0,0,0,1,0|1,0,1]=4 5419 B9R1.13 CC(=O)NC1CCCC1 a2d6bc9cfdeb39e26a278a42ee1d6324 [1,0,0,0,1,0|2,0,0]=4 5420 B9R1.13 CC(C)OC1CCCO1 af2408e49f3115bccbf657c1fe05b160 [1,0,0,0,1,0|1,0,1]=4 5421 B9R1.84 CC(=O)CCN1CCC1 c956718020bd2b18bed19cbea6541b6f [1,0,0,0,1,0|2,0,0]=4 5422 B9R1.84 CC(=O)CNC1CCC1 bd7acdba40fc474c96d220c49c50bbfc [1,0,0,0,1,0|2,0,0]=4 5423 B9R1.84 CC(=O)COC1CCC1 d88d952edae987109b22eaffa67aceef [1,0,0,0,1,0|2,0,0]=4 5424 B9R1.84 CC(=O)NCC1CCC1 49ba76efa54494cc240e1d7dd1323f42 [1,0,0,0,1,0|1,0,0]=3 5425 B9R1.84 CC(=O)NCC1CCO1 74e9962ae59f4502bd57c52161ee5de6 [1,0,0,0,1,0|1,0,0]=3 5426 B9R1.84 CC(=O)NCC1COC1 06f36132d2ba2aaa4f8f4e9acac72ed3 [1,0,0,0,1,0|2,0,0]=4 5427 B9R1.84 CC(=O)NC[C@@H]1CCO1 baaf61a8c2cd88fd09af18fef905e8f1 [1,0,0,0,1,0|1,0,0]=3 5428 B9R1.84 CC(=O)NC[C@H]1CCO1 089f4a24e0b07350837a3d7a33ecfc52 [1,0,0,0,1,0|1,0,0]=3 5429 B9R1.84 CC(=O)OCN1CCC1 638bb9b9bb086da0d3d66884a5e5b05c [1,0,0,0,1,0|1,0,0]=3 5430 B9R1.84 CC(C)OCC1CCC1 faecac9acd91267a6f1e378c8fcaf469 [1,0,0,0,1,0|1,0,1]=4 5431 B9R1.84 CC(C)OCC1CCO1 6dd03ea9fa93d5620934acc500209c85 [1,0,0,0,1,0|1,0,1]=4 5432 B9R1.84 CC(C)OC[C@@H]1CCO1 6e34a7c8eb080aca60084dc91f237acc [1,0,0,0,1,0|1,0,1]=4 5433 B9R1.84 CC(C)OC[C@H]1CCO1 de355a6e1b3df4104ae7d01b7eee8729 [1,0,0,0,1,0|1,0,1]=4 5434 B9R1.79 C=C(CC)CN1CCC1 a4a5f2c82181704fa3ffa7cf579c1790 [0,0,0,0,2,0|2,0,0]=4 5435 B9R1.79 CCC(=O)CN1CCC1 9b8a54515dd7b03c067360cc9113002b [0,0,0,0,2,0|1,0,0]=3 5436 B9R1.79 CCC(=O)NC1CCC1 269364fc2d30f4a38dda69b505509556 [0,0,0,0,2,0|1,0,0]=3 5437 B9R1.79 CCC(=O)NC1COC1 6739d08e29bd2fa57d1040e7a261b158 [0,0,0,0,2,0|2,0,0]=4 5438 B9R1.79 CCC(C)OC1CCC1 0180d2caa13c9dd8070620c42711187f [0,0,0,0,2,0|1,0,1]=4 5439 B9R1.79 CCN(C)CC1CCC1 596526aeae520c22a1108f5e92c3f472 [0,0,0,0,2,0|2,0,0]=4 5440 B9R1.79 CCN(C)CC1CCO1 9f7b1892a55aecae5157efc33f2b177f [0,0,0,0,2,0|2,0,0]=4 5441 B9R1.79 CCN(C)C[C@@H]1CCO1 3b21f82b1f442cac988fe84c9700a0c2 [0,0,0,0,2,0|2,0,0]=4 5442 B9R1.79 CCN(C)C[C@H]1CCO1 ae459f031ee03d57081f50f10a4aeac1 [0,0,0,0,2,0|2,0,0]=4 5443 B9R1.79 CC[C@@H](C)OC1CCC1 9a0987cfaf5d278e5eb1876f8a7aa72a [0,0,0,0,2,0|1,0,1]=4 5444 B9R1.79 CC[C@H](C)OC1CCC1 1d7b74c52414befa8e301dae5eea3aac [0,0,0,0,2,0|1,0,1]=4 5445 B9R1.79 CNC(=O)CN1CCC1 34c940b2505425ba8a151c0b3e8838b6 [0,0,0,0,2,0|2,0,0]=4 5446 B9R1.79 COC(=O)CN1CCC1 a8f3fa2cf91e8163638e85cafd81936a [0,0,0,0,2,0|2,0,0]=4 5447 B9R1.79 O=C(CF)NC1CCC1 a9d2c830d70e4baef8d8ccbad12e86b4 [0,0,0,0,2,0|2,0,0]=4 5448 B9R1.79 O=C(CO)CN1CCC1 1812f82997ebe060276760730379ad88 [0,0,0,0,2,0|2,0,0]=4 5449 B9R1.79 O=C(CO)NC1CCC1 0966cf85b1996540e8450078e870cb20 [0,0,0,0,2,0|2,0,0]=4 5450 B9R1.80 CCC(=O)CNC1CC1 37826a98e92108ea7fc6fac87e9bc89f [0,0,0,0,2,0|2,0,0]=4 5451 B9R1.80 CCC(=O)COC1CC1 91b908d3bdda21bf408da4d85b40356e [0,0,0,0,2,0|2,0,0]=4 5452 B9R1.80 CCC(=O)NCC1CC1 0fd8034b5195a5a694e4806b7766cc71 [0,0,0,0,2,0|1,0,0]=3 5453 B9R1.80 CCC(C)OCC1CC1 3cee3b67aa9344af3ffffd26076f0925 [0,0,0,0,2,0|1,0,1]=4 5454 B9R1.80 CC[C@@H](C)OCC1CC1 fffa99e08d63840e92c952887fb614e2 [0,0,0,0,2,0|1,0,1]=4 5455 B9R1.80 CC[C@H](C)OCC1CC1 ac9d849fab3ff96df981f8d72e68155e [0,0,0,0,2,0|1,0,1]=4 5456 B9R1.80 O=C(CF)NCC1CC1 bd65a3abd206f713d85d03567008090d [0,0,0,0,2,0|2,0,0]=4 5457 B9R1.80 O=C(CO)NCC1CC1 1aa11e15f6d97fd26e12f2bf021722dd [0,0,0,0,2,0|2,0,0]=4 5458 B9R1.80 O=C(CS)NCC1CC1 4799434c4261038cc690dddbd1100a1e [0,0,0,0,2,0|2,0,0]=4 5459 B11R0.200 C#CC(CC)OCOC(=O)CC 2d053f05a0375d47e3c87e3cbc1158df [0,0,1,0,0,1|1,0,1]=4 5460 B11R0.200 C=C(CC)COCC(CC)CC 7f28389a65d0429e6eb2b8c3dd8019f9 [0,0,1,0,0,1|2,0,0]=4 5461 B11R0.200 C=C(CC)COCC(CC)OC 00da145f729a98bf8d645327be7ab7d2 [0,0,1,0,0,1|1,0,0]=3 5462 B11R0.200 C=C(CC)COCC(OC)OC d34638ca8c0627b85e74f97b6bd20ee7 [0,0,1,0,0,1|2,0,0]=4 5463 B11R0.200 C=C(COCC(CC)OC)OC 3c8e4ea9f7bba0634c5d3d89b2104d30 [0,0,1,0,0,1|2,0,0]=4 5464 B11R0.200 C=CC(CC)OCOC(=O)CC fe99e7afb242f881ab71b5684ce75ce4 [0,0,1,0,0,1|1,0,1]=4 5465 B11R0.200 CCC(=O)CNCC(CC)CC f3e97de0e002ce4c572e4796029bd51f [0,0,1,0,0,1|2,0,0]=4 5466 B11R0.200 CCC(=O)CNCC(OC)OC ec3036ea018dcf2053b35e4fc2339d1f [0,0,1,0,0,1|2,0,0]=4 5467 B11R0.200 CCC(=O)CNC[C@H](CO)OC 46e9ae8704b9a28f20ed7e2ef5d601bf [0,0,1,0,0,1|2,0,0]=4 5468 B11R0.200 CCC(=O)COCC(CC)CC a2208217b972eb9b429f087e7c6f2b7a [0,0,1,0,0,1|1,0,0]=3 5469 B11R0.200 CCC(=O)COCC(CC)OC 4e4c9079f38bf7d09039ca9bf5f77615 [0,0,1,0,0,1|0,0,0]=2 5470 B11R0.200 CCC(=O)COCC(OC)OC 786de2ec961bca236299323cab081127 [0,0,1,0,0,1|1,0,0]=3 5471 B11R0.200 CCC(=O)COCN(CC)CC e5b74465f16e0f81d9d9f64973d4afbe [0,0,1,0,0,1|2,0,0]=4 5472 B11R0.200 CCC(=O)NCCC(CC)CC fabd9b3f3f2b4a84a2f6bf9b804c64cb [0,0,1,0,0,1|2,0,0]=4 5473 B11R0.200 CCC(=O)NCCC(OC)OC 74ac1659b1bcfdc23767e8af406dcf15 [0,0,1,0,0,1|2,0,0]=4 5474 B11R0.200 CCC(=O)OCNC(CC)CC 5508f940219b57f00c288d28fb719c42 [0,0,1,0,0,1|1,0,0]=3 5475 B11R0.200 CCC(=O)OCNC(CC)CO 0f5bda43768da42d884809efa94d0f8c [0,0,1,0,0,1|2,0,0]=4 5476 B11R0.200 CCC(=O)OCN[C@@H](CC)CO be5c6f70705a09b56c597e2f4c3f1faf [0,0,1,0,0,1|2,0,0]=4 5477 B11R0.200 CCC(=O)OCN[C@H](CC)CO 551b7fd8ab1ca2d1588a12b977a89c0c [0,0,1,0,0,1|2,0,0]=4 5478 B11R0.200 CCC(=O)OCOC(C#N)CC 9f238755999159630e1a950379555d2b [0,0,1,0,0,1|2,0,0]=4 5479 B11R0.200 CCC(=O)OCOC(CC)CC edb93253abc6579e4fa516a923d34c88 [0,0,1,0,0,1|1,0,0]=3 5480 B11R0.200 CCC(C)COCC(CC)OC 225e55d3d5c681378404a5ea8aaed399 [0,0,1,0,0,1|1,0,1]=4 5481 B11R0.200 CCC(CC)COCC(=O)NC 5031fcc42654e230c18b19a636fc1026 [0,0,1,0,0,1|2,0,0]=4 5482 B11R0.200 CCC(CC)COCC(=O)OC 6c8dd451fa4f59a27905366afe5b2100 [0,0,1,0,0,1|2,0,0]=4 5483 B11R0.200 CCC(CC)NCOC(=O)OC 06e370766d94c516ef99a22f1afd8053 [0,0,1,0,0,1|2,0,0]=4 5484 B11R0.200 CCC(CC)OCOC(=O)OC 412371fed4634c97b8b6fcff085a00c4 [0,0,1,0,0,1|2,0,0]=4 5485 B11R0.200 CCC(COCC(=O)NC)OC aa8c08777e2397574e56f3b77f98ebdb [0,0,1,0,0,1|1,0,0]=3 5486 B11R0.200 CCC(COCC(=O)OC)OC a45dc93ccd097f96d85589d3f801e6c5 [0,0,1,0,0,1|1,0,0]=3 5487 B11R0.200 CCC(COC[C@@H](C)CC)OC fc644b0122c9c4e342f7fb6508708648 [0,0,1,0,0,1|1,0,1]=4 5488 B11R0.200 CCC(COC[C@H](C)CC)OC 2281a707c997f831a7f3617c2aab9bbe [0,0,1,0,0,1|1,0,1]=4 5489 B11R0.200 CNC(=O)COCC(OC)OC 116302ec9c0d7086bee5ad3e8c45840d [0,0,1,0,0,1|2,0,0]=4 5490 B11R0.200 COC(=O)COCC(OC)OC b2969f57f0f3f9e4911585f53feee980 [0,0,1,0,0,1|2,0,0]=4 5491 B11R1.28 CC/C=C/CN1CCCOC1 815487305c5d01a00d35c00ab40e98b9 [1,0,0,0,0,1|2,0,0]=4 5492 B11R1.28 CCCNCC1CCCCO1 fe32d4ffbdc5749c38e47cf869213fa5 [1,0,0,0,0,1|1,0,1]=4 5493 B11R1.28 CCCNCC1CCCOC1 67d90b054c31d898f4946882df762eb2 [1,0,0,0,0,1|1,0,1]=4 5494 B11R1.28 CCCNCC1COCCO1 ed3557b82f8e084d504cdedb116e42d8 [1,0,0,0,0,1|1,0,1]=4 5495 B11R1.28 CCCNC[C@@H]1CCCOC1 d9e4e27e5401c0756a055952e9b2275d [1,0,0,0,0,1|1,0,1]=4 5496 B11R1.28 CCCNC[C@H]1CCCOC1 96507b1af994998589d4527a37dcf9f0 [1,0,0,0,0,1|1,0,1]=4 5497 B11R1.28 CCCNC[C@H]1COCCO1 76f9b05e4c1d6229a6a7e19c907faf38 [1,0,0,0,0,1|1,0,1]=4 5498 B11R1.28 CCCOCC1=CCCCO1 fd0a4208366709896cb1e56da0f533fc [1,0,0,0,0,1|0,0,2]=4 5499 B11R1.28 CCCOCC1CCC=CO1 e89dcca9344c6e6ffe5fd85c14cfe540 [1,0,0,0,0,1|0,0,2]=4 5500 B11R1.28 CCCOCC1CCCCC1 a40e97204a11eb00ef961e0329142e58 [1,0,0,0,0,1|1,0,1]=4 5501 B11R1.28 CCCOCC1CCCCO1 90f98ba9e9eadc1d9df337afb14e5eef [1,0,0,0,0,1|0,0,1]=3 5502 B11R1.28 CCCOCC1CCCOC1 bc76e5d72680f980fe3e82eb083b157e [1,0,0,0,0,1|0,0,1]=3 5503 B11R1.28 CCCOCC1CCOCC1 3229f1aa26cacbd34eaf1ba6443a14eb [1,0,0,0,0,1|1,0,1]=4 5504 B11R1.28 CCCOCC1CCSCC1 d6dbd4199228a9dc0915dbaecf7046d9 [1,0,0,0,0,1|1,0,1]=4 5505 B11R1.28 CCCOCC1COCCO1 d373cb86d24bc03b4f5de11ba9c8dd0b [1,0,0,0,0,1|0,0,1]=3 5506 B11R1.28 CCCOC[C@@H]1CCCCO1 20a5d3e0feb8c992886908978ec6f96d [1,0,0,0,0,1|0,0,1]=3 5507 B11R1.28 CCCOC[C@@H]1CCCOC1 24a0567a60a59f6a00220b24c33e7478 [1,0,0,0,0,1|0,0,1]=3 5508 B11R1.28 CCCOC[C@@H]1COCCO1 399dd8b05ea70e6a33ab405f8465f1ec [1,0,0,0,0,1|0,0,1]=3 5509 B11R1.28 CCCOC[C@H]1CCCCO1 6cb49fd295b71bf392a373607d504cfc [1,0,0,0,0,1|0,0,1]=3 5510 B11R1.28 CCCOC[C@H]1CCCOC1 85e9a301351c961de50f44cf9c85bb85 [1,0,0,0,0,1|0,0,1]=3 5511 B11R1.28 CCCOC[C@H]1COCCO1 61da58f2af21a43cf6549adc8199e648 [1,0,0,0,0,1|0,0,1]=3 5512 B11R1.28 CCNCCC1CCCCO1 0514cc2009abea27205eb2d4527ea2a3 [1,0,0,0,0,1|2,0,0]=4 5513 B11R1.28 CCNCCC1CCCOC1 97eeccda4adb42457b18a5a9b4a8e19b [1,0,0,0,0,1|2,0,0]=4 5514 B11R1.28 CCNCCC1COCCO1 43d21b9749475a28ebf4e260baab8d3d [1,0,0,0,0,1|2,0,0]=4 5515 B11R1.28 CCOCCC1CCCCO1 0eb2e7b6ffe2601ad6e04d63bcdae13d [1,0,0,0,0,1|2,0,0]=4 5516 B11R1.28 CCOCCC1COCCO1 a0f15d9fb996534b4cdb5208ddc95c47 [1,0,0,0,0,1|2,0,0]=4 5517 B11R1.28 CCOCC[C@@H]1COCCO1 af7c6d7fe58ce08ff7c192e8f2109968 [1,0,0,0,0,1|2,0,0]=4 5518 B11R1.28 CCOCC[C@H]1COCCO1 2c3e5d7679458cacfefb08b815331ec5 [1,0,0,0,0,1|2,0,0]=4 5519 B11R1.28 COCOCC1CCCCO1 abdc3aff433495bd3417250fa96b3f5e [1,0,0,0,0,1|1,0,1]=4 5520 B11R1.28 COCOCC1CCCOC1 5d6fcb460ac34ec47e3d1e920582a10e [1,0,0,0,0,1|1,0,1]=4 5521 B11R1.28 COCOCC1COCCO1 4b1b0860955c402ecdf8874e26a47fbd [1,0,0,0,0,1|1,0,1]=4 5522 B11R1.28 COCOC[C@@H]1CCCCO1 4c389b580c190708168cdbed880fb514 [1,0,0,0,0,1|1,0,1]=4 5523 B11R1.28 COCOC[C@@H]1CCCOC1 31459db82cefa20d89e57db3a6fd08f3 [1,0,0,0,0,1|1,0,1]=4 5524 B11R1.28 COCOC[C@@H]1COCCO1 59561e3184869eb15b5a430499896192 [1,0,0,0,0,1|1,0,1]=4 5525 B11R1.28 COCOC[C@H]1CCCCO1 29174a6964b3c17a5ab2af6015adccec [1,0,0,0,0,1|1,0,1]=4 5526 B11R1.28 COCOC[C@H]1CCCOC1 1b04a41fe977b4b3236be70ea9516e65 [1,0,0,0,0,1|1,0,1]=4 5527 B11R1.28 COCOC[C@H]1COCCO1 e959419c8ed91aa99ee3e1b4a69d4e59 [1,0,0,0,0,1|1,0,1]=4 5528 B11R1.28 CSCOCC1CCCCO1 8e01f9bfd7b853754075c877cc79b9e4 [1,0,0,0,0,1|1,0,1]=4 5529 B11R1.28 CSCOCC1CCCOC1 8f09bead1ffab3297aca7a553ba30fcc [1,0,0,0,0,1|1,0,1]=4 5530 B11R1.28 CSCOCC1COCCO1 cafa795fe6ad1cb30c128d6a1833bd7c [1,0,0,0,0,1|1,0,1]=4 5531 B11R1.28 CSCOC[C@@H]1CCCCO1 30effe68ec12a71101c3df4d991df6ae [1,0,0,0,0,1|1,0,1]=4 5532 B11R1.28 CSCOC[C@@H]1CCCOC1 7e44d903e69c8787803c0992bb6f8c24 [1,0,0,0,0,1|1,0,1]=4 5533 B11R1.28 CSCOC[C@@H]1COCCO1 4812e0c4a32d08d2f1a713ad395e2817 [1,0,0,0,0,1|1,0,1]=4 5534 B11R1.28 CSCOC[C@H]1CCCCO1 a3c6230f487104272597aca9b9b68532 [1,0,0,0,0,1|1,0,1]=4 5535 B11R1.28 CSCOC[C@H]1CCCOC1 ee8cb991d11dfe2007ac1e03556e566b [1,0,0,0,0,1|1,0,1]=4 5536 B11R1.28 CSCOC[C@H]1COCCO1 870a50c9320bebbebef0fdafefc309a2 [1,0,0,0,0,1|1,0,1]=4 5537 B11R1.28 FCCOCC1CCCCO1 12c3d7e4501cabab4113070366eb5398 [1,0,0,0,0,1|1,0,1]=4 5538 B11R1.28 FCCOCC1CCCOC1 7f054f15c1c2916be26ec38eee37b8c2 [1,0,0,0,0,1|1,0,1]=4 5539 B11R1.28 FCCOCC1COCCO1 c4419c04f82341f9807e47d9faffc168 [1,0,0,0,0,1|1,0,1]=4 5540 B11R1.28 FCCOC[C@@H]1CCCCO1 9b448c6463fff37a51b6fc8419c662ab [1,0,0,0,0,1|1,0,1]=4 5541 B11R1.28 FCCOC[C@@H]1CCCOC1 0513b2faf444a45e9e16fad3e43d74af [1,0,0,0,0,1|1,0,1]=4 5542 B11R1.28 FCCOC[C@@H]1COCCO1 0ffde1c0d03cf5779d99262a14f2d6e9 [1,0,0,0,0,1|1,0,1]=4 5543 B11R1.28 FCCOC[C@H]1CCCCO1 3472adcec135aff3b4a29d5aa3cf27bc [1,0,0,0,0,1|1,0,1]=4 5544 B11R1.28 FCCOC[C@H]1CCCOC1 c00948fd594cdfac9cdad4b28c7556b2 [1,0,0,0,0,1|1,0,1]=4 5545 B11R1.28 FCCOC[C@H]1COCCO1 556bfeacf037185eef1347e9c3747e29 [1,0,0,0,0,1|1,0,1]=4 5546 B11R1.28 SCCOCC1CCCCO1 86aa807ab484b9f23e5f277d7f7abbcb [1,0,0,0,0,1|1,0,1]=4 5547 B11R1.28 SCCOCC1CCCOC1 18c39f9ece56db6dc0987044d5ca3cc1 [1,0,0,0,0,1|1,0,1]=4 5548 B11R1.28 SCCOCC1COCCO1 1c6b2760a14c6e6f1d88e04a50857911 [1,0,0,0,0,1|1,0,1]=4 5549 B11R1.28 SCCOC[C@@H]1CCCCO1 3663e7beeaf311a325d64bf56f1e650f [1,0,0,0,0,1|1,0,1]=4 5550 B11R1.28 SCCOC[C@@H]1CCCOC1 75d4c627508ef03c9b052c35a7c318c0 [1,0,0,0,0,1|1,0,1]=4 5551 B11R1.28 SCCOC[C@@H]1COCCO1 7654e0ae79978211e0f252c5f82d3b75 [1,0,0,0,0,1|1,0,1]=4 5552 B11R1.28 SCCOC[C@H]1CCCCO1 d6b15e9d088711ec46e2651cdf37fc89 [1,0,0,0,0,1|1,0,1]=4 5553 B11R1.28 SCCOC[C@H]1CCCOC1 1c215f4234ca2d3fb809a014feb6e6e1 [1,0,0,0,0,1|1,0,1]=4 5554 B11R1.28 SCCOC[C@H]1COCCO1 7e99db26eb9547732bd6d0d4ea4b45b7 [1,0,0,0,0,1|1,0,1]=4 5555 B11R1.91 CC(=O)CCN1CCCOC1 8ee6fb3dcc39cce30e50adee130f6e9a [1,0,0,0,0,1|2,0,0]=4 5556 B11R1.91 CC(=O)CNC1CCCCO1 640e2d5dd77a8849aa1935cd7a9aaaec [1,0,0,0,0,1|2,0,0]=4 5557 B11R1.91 CC(=O)COC1CCCCO1 3d4068b55a8ce6af68b0e3cc3b7d2997 [1,0,0,0,0,1|2,0,0]=4 5558 B11R1.91 CC(=O)NCC1CCCCC1 13ef8179cc48c409da15977c5ecf76d3 [1,0,0,0,0,1|2,0,0]=4 5559 B11R1.91 CC(=O)NCC1CCCCO1 d41d6bb17f3dbf038f44a0f16313e24b [1,0,0,0,0,1|1,0,0]=3 5560 B11R1.91 CC(=O)NCC1CCCOC1 c162092dc9bd16e0593256fa1f9ecc04 [1,0,0,0,0,1|1,0,0]=3 5561 B11R1.91 CC(=O)NCC1CCOCC1 a250d52d0d92eb3951169ce5ef31c600 [1,0,0,0,0,1|2,0,0]=4 5562 B11R1.91 CC(=O)NCC1CCSCC1 1a220d480c47a704f778fa097ef9e650 [1,0,0,0,0,1|2,0,0]=4 5563 B11R1.91 CC(=O)NCC1COCCO1 d2892358b1317027cf7ff86baffb9721 [1,0,0,0,0,1|1,0,0]=3 5564 B11R1.91 CC(=O)NC[C@@H]1CCCOC1 7aa7e3d46556da04f95282ed5cd2d18d [1,0,0,0,0,1|1,0,0]=3 5565 B11R1.91 CC(=O)NC[C@H]1CCCOC1 084cc7a58a2d167832e33c785a7b8e6f [1,0,0,0,0,1|1,0,0]=3 5566 B11R1.91 CC(=O)NC[C@H]1COCCO1 ff4b8978f4c203daf6959cb790835636 [1,0,0,0,0,1|1,0,0]=3 5567 B11R1.91 CC(=O)OCN1CCCOC1 a435707ece880897c2100e8bac5dc365 [1,0,0,0,0,1|1,0,0]=3 5568 B11R1.91 CC(=O)OCN1CCCSC1 3cb1b90740ede26e7b067364b9666030 [1,0,0,0,0,1|1,1,0]=4 5569 B11R1.91 CC(=O)OCN1CCOCC1 d9ae0f642945963ffb89753dee635384 [1,0,0,0,0,1|2,0,0]=4 5570 B11R1.91 CC(=O)OCN1CCSCC1 e8cd7b236b32cf305e5aa75427d0e458 [1,0,0,0,0,1|2,0,0]=4 5571 B11R1.91 CC(C)OCC1CCCCO1 20acd8f7ac6aa86a8b31738edacf0c05 [1,0,0,0,0,1|1,0,1]=4 5572 B11R1.91 CC(C)OCC1CCCOC1 f245700c5266f387684eb85f872bf271 [1,0,0,0,0,1|1,0,1]=4 5573 B11R1.91 CC(C)OCC1COCCO1 5e9bd5637fab2cbbb31e92008e57e9d2 [1,0,0,0,0,1|1,0,1]=4 5574 B11R1.91 CC(C)OC[C@@H]1CCCCO1 0766e11af823d141a1d14141a013c84f [1,0,0,0,0,1|1,0,1]=4 5575 B11R1.91 CC(C)OC[C@@H]1CCCOC1 7c8192793fbb2f47f8dec37a376f1bd8 [1,0,0,0,0,1|1,0,1]=4 5576 B11R1.91 CC(C)OC[C@@H]1COCCO1 5de7db5c9756cc9ede4a507f8d8db9c9 [1,0,0,0,0,1|1,0,1]=4 5577 B11R1.91 CC(C)OC[C@H]1CCCCO1 2ecca1fe337e2edf1e5a0c64b75c4580 [1,0,0,0,0,1|1,0,1]=4 5578 B11R1.91 CC(C)OC[C@H]1CCCOC1 206e62d1b44858cb2d557ade713d4d60 [1,0,0,0,0,1|1,0,1]=4 5579 B11R1.91 CC(C)OC[C@H]1COCCO1 68c955eb7712dbc17d99655a34893d7b [1,0,0,0,0,1|1,0,1]=4 5580 B13R1.718 C=C(CC)CNCC1CCCCO1 d4a7d4bfe7458fb032c90430dd48aff3 [0,0,0,0,0,2|2,0,0]=4 5581 B13R1.718 C=C(CC)CNCC1CCCOC1 a99d24bc8efc2a7f221666afc3df688f [0,0,0,0,0,2|2,0,0]=4 5582 B13R1.718 C=C(CC)CNCC1COCCO1 8b4779cdf249b1ba857a6adc0dc04630 [0,0,0,0,0,2|2,0,0]=4 5583 B13R1.718 C=C(CC)CNC[C@@H]1CCCOC1 3809e77abb37bce59f1a0d39b47b9325 [0,0,0,0,0,2|2,0,0]=4 5584 B13R1.718 C=C(CC)CNC[C@H]1CCCOC1 be8c2181c224ff5fe3859e4cf8b45ef9 [0,0,0,0,0,2|2,0,0]=4 5585 B13R1.718 C=C(CC)CNC[C@H]1COCCO1 407097cae424559a258c47e08b24408d [0,0,0,0,0,2|2,0,0]=4 5586 B13R1.718 C=C(CC)COCC1=CCCCO1 09de6dd387c26bcdc3aa179432908371 [0,0,0,0,0,2|1,0,1]=4 5587 B13R1.718 C=C(CC)COCC1CCC=CO1 795d1bb878ae05c996ac4ed0cf1f9f07 [0,0,0,0,0,2|1,0,1]=4 5588 B13R1.718 C=C(CC)COCC1CCCCC1 26eb58b399c8a02978b4346502105f71 [0,0,0,0,0,2|2,0,0]=4 5589 B13R1.718 C=C(CC)COCC1CCCCO1 fd2cae9e48e3fd54e7ffc691ea59059f [0,0,0,0,0,2|1,0,0]=3 5590 B13R1.718 C=C(CC)COCC1CCCOC1 2e001a32dc30ccafc49367664e4548a8 [0,0,0,0,0,2|1,0,0]=3 5591 B13R1.718 C=C(CC)COCC1CCOCC1 8358d893dd3e6c12edb4233a64c1ad7d [0,0,0,0,0,2|2,0,0]=4 5592 B13R1.718 C=C(CC)COCC1CCSCC1 5c83ddb5e07ad0f34ea7887287eb840a [0,0,0,0,0,2|2,0,0]=4 5593 B13R1.718 C=C(CC)COCC1COCCO1 5d7bd5a191f5a1102d057a95fd449ef5 [0,0,0,0,0,2|1,0,0]=3 5594 B13R1.718 C=C(CC)COC[C@@H]1CCCCO1 80db5a706d42a8ffd11b698d6e8e2eff [0,0,0,0,0,2|1,0,0]=3 5595 B13R1.718 C=C(CC)COC[C@@H]1CCCOC1 7f7e13320e811cd96e130003410fec43 [0,0,0,0,0,2|1,0,0]=3 5596 B13R1.718 C=C(CC)COC[C@@H]1COCCO1 2386e0d090669ddf453516dc9486884e [0,0,0,0,0,2|1,0,0]=3 5597 B13R1.718 C=C(CC)COC[C@H]1CCCCO1 cf6119d09312a3846297efdd4a40fbe3 [0,0,0,0,0,2|1,0,0]=3 5598 B13R1.718 C=C(CC)COC[C@H]1CCCOC1 014a2a94d0b7d5722eefeec31a9c5864 [0,0,0,0,0,2|1,0,0]=3 5599 B13R1.718 C=C(CC)COC[C@H]1COCCO1 5a97ddaa5d45e1a3bff6eb3dc39ec28b [0,0,0,0,0,2|1,0,0]=3 5600 B13R1.718 C=C(COCC1CCCCO1)OC cf447fe2f6a7620c92f4590dc5deb441 [0,0,0,0,0,2|2,0,0]=4 5601 B13R1.718 C=C(COCC1CCCOC1)OC 6ba759dc727ffa5cb3ac662addc68ea9 [0,0,0,0,0,2|2,0,0]=4 5602 B13R1.718 C=C(COCC1COCCO1)OC bf3e46665dc46957a5c3bb3cc0e717cb [0,0,0,0,0,2|2,0,0]=4 5603 B13R1.718 C=C(COC[C@@H]1CCCCO1)OC 2f2c4290381b411721291c55e17fe20d [0,0,0,0,0,2|2,0,0]=4 5604 B13R1.718 C=C(COC[C@@H]1CCCOC1)OC b92ae9be1b89e807182f842bbf0db303 [0,0,0,0,0,2|2,0,0]=4 5605 B13R1.718 C=C(COC[C@@H]1COCCO1)OC f5e30cdcf5daac7614d8f0275598947c [0,0,0,0,0,2|2,0,0]=4 5606 B13R1.718 C=C(COC[C@H]1CCCCO1)OC 95c9e1e909f7dfdc118c6007e9168050 [0,0,0,0,0,2|2,0,0]=4 5607 B13R1.718 C=C(COC[C@H]1CCCOC1)OC 61f752b27024c07ced05526019e8a099 [0,0,0,0,0,2|2,0,0]=4 5608 B13R1.718 C=C(COC[C@H]1COCCO1)OC d1e2fe7da274bc5724d544693f4a4b10 [0,0,0,0,0,2|2,0,0]=4 5609 B13R1.718 CCC(=O)CNCC1CCCCC1 8052233a27f2a13ff44b59e85ae724dd [0,0,0,0,0,2|2,0,0]=4 5610 B13R1.718 CCC(=O)CNCC1CCCCO1 5a41900e40d4138daf4c2e9a3acab3a5 [0,0,0,0,0,2|1,0,0]=3 5611 B13R1.718 CCC(=O)CNCC1CCCOC1 98976af478d3582c184f0e345202bc8c [0,0,0,0,0,2|1,0,0]=3 5612 B13R1.718 CCC(=O)CNCC1CCOCC1 19b33d975c9c7ef2bc27ac307ed0a05b [0,0,0,0,0,2|2,0,0]=4 5613 B13R1.718 CCC(=O)CNCC1CCSCC1 f819970168d5a94ce71a0bf744899e7c [0,0,0,0,0,2|2,0,0]=4 5614 B13R1.718 CCC(=O)CNCC1COCCO1 72463a8d1c689c04afc65bc11b06d448 [0,0,0,0,0,2|1,0,0]=3 5615 B13R1.718 CCC(=O)CNC[C@@H]1CCCOC1 126612785a87cf80b5a82bc3e2c99ef2 [0,0,0,0,0,2|1,0,0]=3 5616 B13R1.718 CCC(=O)CNC[C@H]1CCCOC1 14713d3a3d30718da68ebc583d094d61 [0,0,0,0,0,2|1,0,0]=3 5617 B13R1.718 CCC(=O)CNC[C@H]1COCCO1 855232528bf43daa06ee0530046876b6 [0,0,0,0,0,2|1,0,0]=3 5618 B13R1.718 CCC(=O)COCC1=CCCCO1 30705a1e8c260bd2a7193e6428aad941 [0,0,0,0,0,2|0,0,1]=3 5619 B13R1.718 CCC(=O)COCC1=CCOCC1 d6e6aeef226f9d8ca1ed711d25c11549 [0,0,0,0,0,2|1,0,1]=4 5620 B13R1.718 CCC(=O)COCC1CC=CCC1 cc1bc6373a5a20f5ccc750202eaeee4a [0,0,0,0,0,2|1,0,1]=4 5621 B13R1.718 CCC(=O)COCC1CCC=CO1 6da1ec415bf1d5bc618dbd434e6017f6 [0,0,0,0,0,2|0,0,1]=3 5622 B13R1.718 CCC(=O)COCC1CCCCC1 454a59f2eb22066d9e61d655e18e8553 [0,0,0,0,0,2|1,0,0]=3 5623 B13R1.718 CCC(=O)COCC1CCCCO1 b3b5f3e2bb7da8261275c7166b34866c [0,0,0,0,0,2|0,0,0]=2 5624 B13R1.718 CCC(=O)COCC1CCCOC1 f1320d383f6fd74d5136514849e1c5f4 [0,0,0,0,0,2|0,0,0]=2 5625 B13R1.718 CCC(=O)COCC1CCOCC1 7bfe499aa194173dbfb4b48299dc7e7e [0,0,0,0,0,2|1,0,0]=3 5626 B13R1.718 CCC(=O)COCC1CCSCC1 57b9859195d90e84719510b1d1bbb8ea [0,0,0,0,0,2|1,0,0]=3 5627 B13R1.718 CCC(=O)COCC1COCCO1 c1a96c5d97992199a9c99389b0842a9e [0,0,0,0,0,2|0,0,0]=2 5628 B13R1.718 CCC(=O)COC[C@@H]1CC=CCC1 313aa3df3c93ddcb09de476885e638ff [0,0,0,0,0,2|1,0,1]=4 5629 B13R1.718 CCC(=O)COC[C@@H]1CCCCO1 befdd08f0dbfa7080b0378dc3aa56fbd [0,0,0,0,0,2|0,0,0]=2 5630 B13R1.718 CCC(=O)COC[C@@H]1CCCOC1 1838844e105208d997069adf8c53d3e2 [0,0,0,0,0,2|0,0,0]=2 5631 B13R1.718 CCC(=O)COC[C@@H]1COCCO1 566c7fdb4f79b295f51b4ea37e27636b [0,0,0,0,0,2|0,0,0]=2 5632 B13R1.718 CCC(=O)COC[C@H]1CC=CCC1 a782fd5b436951fe5673f79d656874ca [0,0,0,0,0,2|1,0,1]=4 5633 B13R1.718 CCC(=O)COC[C@H]1CCCCO1 19ab97f901c68c80b7ce8f8c045d524b [0,0,0,0,0,2|0,0,0]=2 5634 B13R1.718 CCC(=O)COC[C@H]1CCCOC1 4ff26d0d757396bb127ebfc8170188b4 [0,0,0,0,0,2|0,0,0]=2 5635 B13R1.718 CCC(=O)COC[C@H]1COCCO1 61609a56478817d3ce9c45cecf5adb2d [0,0,0,0,0,2|0,0,0]=2 5636 B13R1.718 CCC(=O)NCCC1CCCCC1 db2a24049601c08006277d56d6513d9c [0,0,0,0,0,2|2,0,0]=4 5637 B13R1.718 CCC(=O)NCCC1CCCCO1 083ecfb1513ac5bebc7d07a5b3459507 [0,0,0,0,0,2|1,0,0]=3 5638 B13R1.718 CCC(=O)NCCC1CCCOC1 3c1eadd83a2189c026f93f3757cad627 [0,0,0,0,0,2|1,0,0]=3 5639 B13R1.718 CCC(=O)NCCC1CCOCC1 c4f259ffce4c174012fece4c996cf553 [0,0,0,0,0,2|2,0,0]=4 5640 B13R1.718 CCC(=O)NCCC1CCSCC1 74cecc38541cbf362c1e77430109f64b [0,0,0,0,0,2|2,0,0]=4 5641 B13R1.718 CCC(=O)NCCC1COCCO1 e3fba2158d14805bcafa42bdefc94e59 [0,0,0,0,0,2|1,0,0]=3 5642 B13R1.718 CCC(=O)OCNC1C=CCCC1 28ff06cc64cd2878151657fa175de93e [0,0,0,0,0,2|1,0,0]=3 5643 B13R1.718 CCC(=O)OCNC1CCCOC1 6cd558a929f01f4e1fccf974d330ec85 [0,0,0,0,0,2|0,0,0]=2 5644 B13R1.718 CCC(=O)OCNC1CCOCC1 6a1f0cf1fec8ac5d5cfc26faa95927a4 [0,0,0,0,0,2|1,0,0]=3 5645 B13R1.718 CCC(=O)OCNC1CCSCC1 9f456342e7bace8bbdd8177a1e410ec0 [0,0,0,0,0,2|1,0,0]=3 5646 B13R1.718 CCC(=O)OCNC1CSCSC1 7e76e2e34c10be88d8d5c36cd78c26c6 [0,0,0,0,0,2|1,1,0]=4 5647 B13R1.718 CCC(=O)OCN[C@@H]1CCCOC1 0d7c18f335815d58e3acd3f4dab05e03 [0,0,0,0,0,2|0,0,0]=2 5648 B13R1.718 CCC(=O)OCN[C@H]1CCCOC1 7c39e01a046f198d5e43b4aa4a0e54f3 [0,0,0,0,0,2|0,0,0]=2 5649 B13R1.718 CCC(=O)OCOC1C=CCCC1 a04bf23a4df2975a8297582ef56f54af [0,0,0,0,0,2|1,0,0]=3 5650 B13R1.718 CCC(=O)OCOC1CC=CCC1 065000748d567a1c332647e5bd918e27 [0,0,0,0,0,2|1,0,1]=4 5651 B13R1.718 CCC(=O)OCOC1CCCCC1 a9d78aa7d91bd1b106e26bece6b58b6e [0,0,0,0,0,2|1,0,0]=3 5652 B13R1.718 CCC(=O)OCOC1CCCCO1 0442db7d48c8ee7f2a6559bac1e1f473 [0,0,0,0,0,2|0,0,0]=2 5653 B13R1.718 CCC(=O)OCOC1CCCOC1 f9495b69c58eda49735d85f38a3ee9dd [0,0,0,0,0,2|0,0,0]=2 5654 B13R1.718 CCC(=O)OCOC1CCCSC1 e6b9487c4a5598cc96bf6220af48e718 [0,0,0,0,0,2|0,1,0]=3 5655 B13R1.718 CCC(=O)OCOC1CCOCC1 4e4ac5c0558518a8e8de4a1fdc946112 [0,0,0,0,0,2|1,0,0]=3 5656 B13R1.718 CCC(=O)OCOC1CCSCC1 27eb5b57ec381ebd067e6a60237fcad0 [0,0,0,0,0,2|1,0,0]=3 5657 B13R1.718 CCC(=O)OCO[C@@H]1CCCOC1 8ba6a56cb82c36728fa59e01a1e49a12 [0,0,0,0,0,2|0,0,0]=2 5658 B13R1.718 CCC(=O)OCO[C@H]1CCCOC1 bb39b4e03fd9921c7a11a7d4bfe73c3b [0,0,0,0,0,2|0,0,0]=2 5659 B13R1.718 CCC(C)COCC1CCCCO1 02d331bcd38324b8a1a5dff85110df7b [0,0,0,0,0,2|1,0,1]=4 5660 B13R1.718 CCC(C)COCC1CCCOC1 2f0977ebf6ccf8d79d45fb86a377722d [0,0,0,0,0,2|1,0,1]=4 5661 B13R1.718 CCC(C)COCC1COCCO1 76eb486557a233075a0c3e7a8b423559 [0,0,0,0,0,2|1,0,1]=4 5662 B13R1.718 CCC(C)COC[C@@H]1CCCCO1 11ddf2b894bf12ace07de70392e47f54 [0,0,0,0,0,2|1,0,1]=4 5663 B13R1.718 CCC(C)COC[C@@H]1CCCOC1 c533f3f9363a8924309beb6d595718ac [0,0,0,0,0,2|1,0,1]=4 5664 B13R1.718 CCC(C)COC[C@@H]1COCCO1 dcd4376943adb6fcb5347e2da99f27fc [0,0,0,0,0,2|1,0,1]=4 5665 B13R1.718 CCC(C)COC[C@H]1CCCCO1 ea14e68dccd2f167a122c8c5221e1533 [0,0,0,0,0,2|1,0,1]=4 5666 B13R1.718 CCC(C)COC[C@H]1CCCOC1 4b2d386d9918565da27c806df539cc63 [0,0,0,0,0,2|1,0,1]=4 5667 B13R1.718 CCC(C)COC[C@H]1COCCO1 212cebc335f02cd5c1855b8f0ca878f0 [0,0,0,0,0,2|1,0,1]=4 5668 B13R1.718 CCC(C)OCCC1CCCCO1 3f9d6ae349dba10624e9165ca97b0164 [0,0,0,0,0,2|1,0,1]=4 5669 B13R1.718 CCC(C)OCCC1CCCOC1 0ed9c2b8648372becc68484c5cb661d0 [0,0,0,0,0,2|1,0,1]=4 5670 B13R1.718 CCC(C)OCCC1COCCO1 127349cb74b873020a5c3821424212a1 [0,0,0,0,0,2|1,0,1]=4 5671 B13R1.718 CCC(C)OCC[C@@H]1COCCO1 536a89857e2681faf02ca6b7fdd4b010 [0,0,0,0,0,2|1,0,1]=4 5672 B13R1.718 CCC(C)OCC[C@H]1COCCO1 c2006912c8e203830f5728ccbce47aaa [0,0,0,0,0,2|1,0,1]=4 5673 B13R1.718 CCS(=O)CCNC1CCCOC1 db1994ed5264be848563e15c8790c6af [0,0,0,0,0,2|2,0,0]=4 5674 B13R1.718 CCS(=O)CCN[C@@H]1CCCOC1 81d512281c00e47382edbd384529e912 [0,0,0,0,0,2|2,0,0]=4 5675 B13R1.718 CCS(=O)CCN[C@H]1CCCOC1 e6b52669865b480af7782a87d81d7d62 [0,0,0,0,0,2|2,0,0]=4 5676 B13R1.718 CCS(=O)CCOC1CCCCO1 9ff36c75ef60ab9a0f22ee4bb441f8ec [0,0,0,0,0,2|2,0,0]=4 5677 B13R1.718 CCS(=O)CCOC1CCCOC1 544958760b860b8f523c739873e43c02 [0,0,0,0,0,2|2,0,0]=4 5678 B13R1.718 CCS(=O)CCO[C@@H]1CCCOC1 c3c4680a0420edaa5428f5c6206da6ed [0,0,0,0,0,2|2,0,0]=4 5679 B13R1.718 CCS(=O)CCO[C@H]1CCCOC1 85ff9a7eec186e183ff9a43ede51c502 [0,0,0,0,0,2|2,0,0]=4 5680 B13R1.718 CC[C@@H](C)COCC1CCCCO1 fb00d6c04d06b4e2cd3a0a043d0d6ad8 [0,0,0,0,0,2|1,0,1]=4 5681 B13R1.718 CC[C@@H](C)COCC1CCCOC1 1226df2dc3b695ddde59a0c2c8867876 [0,0,0,0,0,2|1,0,1]=4 5682 B13R1.718 CC[C@@H](C)COCC1COCCO1 e41c42f915a84d5c740219a4cf33ad07 [0,0,0,0,0,2|1,0,1]=4 5683 B13R1.718 CC[C@@H](C)COC[C@@H]1CCCCO1 429e8b302ee3d4185f932ac044df5452 [0,0,0,0,0,2|1,0,1]=4 5684 B13R1.718 CC[C@@H](C)COC[C@@H]1CCCOC1 73773e8de12ce4393d9bde56177d4beb [0,0,0,0,0,2|1,0,1]=4 5685 B13R1.718 CC[C@@H](C)COC[C@@H]1COCCO1 7cee8f52ee81fbca4b61d350f05fa57e [0,0,0,0,0,2|1,0,1]=4 5686 B13R1.718 CC[C@@H](C)COC[C@H]1CCCCO1 c4c61e99016c19627ca31897da99c365 [0,0,0,0,0,2|1,0,1]=4 5687 B13R1.718 CC[C@@H](C)COC[C@H]1CCCOC1 c5d01a3dc74cbd556063e7176529219c [0,0,0,0,0,2|1,0,1]=4 5688 B13R1.718 CC[C@@H](C)COC[C@H]1COCCO1 93bdd9e5df3147f8092e0f7c62ce0aa4 [0,0,0,0,0,2|1,0,1]=4 5689 B13R1.718 CC[C@@H](C)OCCC1CCCOC1 57ea780b412e2417198bbc3ac54b1c47 [0,0,0,0,0,2|1,0,1]=4 5690 B13R1.718 CC[C@@H](C)OCCC1COCCO1 ed979b5f2a4bf92c32103055e20bd0f6 [0,0,0,0,0,2|1,0,1]=4 5691 B13R1.718 CC[C@H](C)COCC1CCCCO1 742b68573e94ed485d2bebe9af90704d [0,0,0,0,0,2|1,0,1]=4 5692 B13R1.718 CC[C@H](C)COCC1CCCOC1 a7fb5142a7e13fb2d0a3008c65b28c34 [0,0,0,0,0,2|1,0,1]=4 5693 B13R1.718 CC[C@H](C)COCC1COCCO1 b309da8dd2a6257c2928588e84c77166 [0,0,0,0,0,2|1,0,1]=4 5694 B13R1.718 CC[C@H](C)COC[C@@H]1CCCCO1 4e42f884a83994fe55df125787a9d265 [0,0,0,0,0,2|1,0,1]=4 5695 B13R1.718 CC[C@H](C)COC[C@@H]1CCCOC1 e776f0540144987d96ebe8c73c5e5f92 [0,0,0,0,0,2|1,0,1]=4 5696 B13R1.718 CC[C@H](C)COC[C@@H]1COCCO1 223d50cb311e1e09a67b5ab77cfdf540 [0,0,0,0,0,2|1,0,1]=4 5697 B13R1.718 CC[C@H](C)COC[C@H]1CCCCO1 791cdc7b3ca7e7121f8ae611f23808e9 [0,0,0,0,0,2|1,0,1]=4 5698 B13R1.718 CC[C@H](C)COC[C@H]1CCCOC1 52c6561f279f6b33ff2ec57abdbd078a [0,0,0,0,0,2|1,0,1]=4 5699 B13R1.718 CC[C@H](C)COC[C@H]1COCCO1 91306fa18665615eeb5472c2c2e6f42c [0,0,0,0,0,2|1,0,1]=4 5700 B13R1.718 CC[C@H](C)OCCC1CCCOC1 5fcebbaaa4885e3c66fdbc3edb2667cb [0,0,0,0,0,2|1,0,1]=4 5701 B13R1.718 CC[C@H](C)OCCC1COCCO1 c212b3e81892cced36d0c4f947c761a5 [0,0,0,0,0,2|1,0,1]=4 5702 B13R1.718 CNC(=O)CCNC1CCCCO1 b9d3e61aec825e787e49ec562c3570e4 [0,0,0,0,0,2|2,0,0]=4 5703 B13R1.718 CNC(=O)CCNC1CCCOC1 79fd5bb77ffea3c730a80f7731395dd7 [0,0,0,0,0,2|2,0,0]=4 5704 B13R1.718 CNC(=O)CCN[C@@H]1CCCOC1 0b80b82f6afbc1cfcdd5aecfa9195821 [0,0,0,0,0,2|2,0,0]=4 5705 B13R1.718 CNC(=O)CCN[C@H]1CCCOC1 5c43e709df3ba5948ffeab005f4a12f2 [0,0,0,0,0,2|2,0,0]=4 5706 B13R1.718 CNC(=O)CCOC1CCCCO1 39ca8da7fadbfd7a3ee85393593f9404 [0,0,0,0,0,2|2,0,0]=4 5707 B13R1.718 CNC(=O)CCOC1CCCOC1 b546ae6914a7913c7a5cdd52421436a5 [0,0,0,0,0,2|2,0,0]=4 5708 B13R1.718 CNC(=O)CCO[C@@H]1CCCOC1 ad794638de62f030f3a4b2bb3254746a [0,0,0,0,0,2|2,0,0]=4 5709 B13R1.718 CNC(=O)CCO[C@H]1CCCOC1 70eb7b93d85eed64772b31771eda228f [0,0,0,0,0,2|2,0,0]=4 5710 B13R1.718 CNC(=O)CNCC1CCCCO1 619b5510a88b0259815c10269a2ef98e [0,0,0,0,0,2|2,0,0]=4 5711 B13R1.718 CNC(=O)CNCC1CCCOC1 2abd9798d853f8f09218eed314cf1bd1 [0,0,0,0,0,2|2,0,0]=4 5712 B13R1.718 CNC(=O)CNCC1COCCO1 02c86b35d42a6bb3642a24be616d7b78 [0,0,0,0,0,2|2,0,0]=4 5713 B13R1.718 CNC(=O)CNC[C@@H]1CCCOC1 93c9a69c696b76ebd693fc03e5ea1179 [0,0,0,0,0,2|2,0,0]=4 5714 B13R1.718 CNC(=O)CNC[C@H]1CCCOC1 d8e98ec09fca4a72bbcbd6bbd7f4d579 [0,0,0,0,0,2|2,0,0]=4 5715 B13R1.718 CNC(=O)CNC[C@H]1COCCO1 6533b6119773d3c3a867d6c005caa65b [0,0,0,0,0,2|2,0,0]=4 5716 B13R1.718 CNC(=O)COCC1=CCCCO1 1df977056f35d0767610d5873875e8a9 [0,0,0,0,0,2|1,0,1]=4 5717 B13R1.718 CNC(=O)COCC1CCC=CO1 2c42436688ed9f35ec81b06f246503a2 [0,0,0,0,0,2|1,0,1]=4 5718 B13R1.718 CNC(=O)COCC1CCCCC1 2e1627d217f8a3eacc5db652c72cc308 [0,0,0,0,0,2|2,0,0]=4 5719 B13R1.718 CNC(=O)COCC1CCCCO1 5c59ec293099e9e1957d23563836dfe3 [0,0,0,0,0,2|1,0,0]=3 5720 B13R1.718 CNC(=O)COCC1CCCOC1 3865693516d5a0bdbee8d112c61b74de [0,0,0,0,0,2|1,0,0]=3 5721 B13R1.718 CNC(=O)COCC1CCOCC1 afe53f78b10534892091612fb5a84af6 [0,0,0,0,0,2|2,0,0]=4 5722 B13R1.718 CNC(=O)COCC1CCSCC1 39ffd9ff44d746cb8e3da8357dd32dba [0,0,0,0,0,2|2,0,0]=4 5723 B13R1.718 CNC(=O)COCC1COCCO1 d40fd254a841143bd64b3591bb45ecd9 [0,0,0,0,0,2|1,0,0]=3 5724 B13R1.718 CNC(=O)COC[C@@H]1CCCCO1 4af78fc581583d10f0b70ef143280ca3 [0,0,0,0,0,2|1,0,0]=3 5725 B13R1.718 CNC(=O)COC[C@@H]1CCCOC1 0d8cbb7255bbe5980a751b81664c6f10 [0,0,0,0,0,2|1,0,0]=3 5726 B13R1.718 CNC(=O)COC[C@@H]1COCCO1 1796bcc1ebbea2ec3bb52df9338a2996 [0,0,0,0,0,2|1,0,0]=3 5727 B13R1.718 CNC(=O)COC[C@H]1CCCCO1 11e057cee97e20e4731fc85d883e44f4 [0,0,0,0,0,2|1,0,0]=3 5728 B13R1.718 CNC(=O)COC[C@H]1CCCOC1 300f4b6b0238d6c7dbb7439cc4abc5dd [0,0,0,0,0,2|1,0,0]=3 5729 B13R1.718 CNC(=O)COC[C@H]1COCCO1 4ce2aef65b77808a2466d3aa6dd8d7cb [0,0,0,0,0,2|1,0,0]=3 5730 B13R1.718 COC(=O)CCNC1CCCOC1 99dd18b7c49e6e14338d4f4ee10559d9 [0,0,0,0,0,2|2,0,0]=4 5731 B13R1.718 COC(=O)CCN[C@@H]1CCCOC1 aa55534ef6f37f2230497e984265936b [0,0,0,0,0,2|2,0,0]=4 5732 B13R1.718 COC(=O)CCN[C@H]1CCCOC1 1eb0b329e5b1cd2562b219eb63dc7e15 [0,0,0,0,0,2|2,0,0]=4 5733 B13R1.718 COC(=O)CCOC1CCCCO1 8a62431700bb89fe4b8cb444b887a2b2 [0,0,0,0,0,2|2,0,0]=4 5734 B13R1.718 COC(=O)CCOC1CCCOC1 ba8811e0e965e2bfa72b6baeb520cda4 [0,0,0,0,0,2|2,0,0]=4 5735 B13R1.718 COC(=O)CCO[C@@H]1CCCOC1 c7aa9b8cf3a18e3c7504ca792afe5485 [0,0,0,0,0,2|2,0,0]=4 5736 B13R1.718 COC(=O)CCO[C@H]1CCCOC1 7df634e20678648a907abb5e85e5ade4 [0,0,0,0,0,2|2,0,0]=4 5737 B13R1.718 COC(=O)CNCC1CCCCO1 0836cc05df886c59e04195bc8a7ec2bb [0,0,0,0,0,2|2,0,0]=4 5738 B13R1.718 COC(=O)CNCC1CCCOC1 a25859a130f9312b264f6595bd8d4bb4 [0,0,0,0,0,2|2,0,0]=4 5739 B13R1.718 COC(=O)CNCC1COCCO1 95de74cc3fac7686a4fdf0a3b81f916e [0,0,0,0,0,2|2,0,0]=4 5740 B13R1.718 COC(=O)CNC[C@@H]1CCCOC1 86a88fc1607bc5d09ee5ea6ca41363f8 [0,0,0,0,0,2|2,0,0]=4 5741 B13R1.718 COC(=O)CNC[C@H]1CCCOC1 62e8604daacdf187d2974b3f7b81f4ce [0,0,0,0,0,2|2,0,0]=4 5742 B13R1.718 COC(=O)CNC[C@H]1COCCO1 45ad79aa11cbc68a3c20e1d4080c39a4 [0,0,0,0,0,2|2,0,0]=4 5743 B13R1.718 COC(=O)COCC1=CCCCO1 1b5aef0d42a4e56d5a5d306f1d11860e [0,0,0,0,0,2|1,0,1]=4 5744 B13R1.718 COC(=O)COCC1CCC=CO1 73ec360e682df86693c8e1bcc26338be [0,0,0,0,0,2|1,0,1]=4 5745 B13R1.718 COC(=O)COCC1CCCCC1 0312531890271d63d212b0994c889dd8 [0,0,0,0,0,2|2,0,0]=4 5746 B13R1.718 COC(=O)COCC1CCCCO1 e83c2357ac433291042ec4565e5d75c9 [0,0,0,0,0,2|1,0,0]=3 5747 B13R1.718 COC(=O)COCC1CCCOC1 683e88a39be75da3ec7c93c84e1d5537 [0,0,0,0,0,2|1,0,0]=3 5748 B13R1.718 COC(=O)COCC1CCOCC1 fd375afb204be8e7c542e11b1af9eb87 [0,0,0,0,0,2|2,0,0]=4 5749 B13R1.718 COC(=O)COCC1CCSCC1 0a35e1e447c0eef8a22f86cbda42bb51 [0,0,0,0,0,2|2,0,0]=4 5750 B13R1.718 COC(=O)COCC1COCCO1 2d249bb7ae7df65e2c3e1cecca424a01 [0,0,0,0,0,2|1,0,0]=3 5751 B13R1.718 COC(=O)COC[C@@H]1CCCCO1 757b2c0e4ea1f7d04b9991c41cbf4847 [0,0,0,0,0,2|1,0,0]=3 5752 B13R1.718 COC(=O)COC[C@@H]1CCCOC1 e890919af9885169d4cc08441f9283e0 [0,0,0,0,0,2|1,0,0]=3 5753 B13R1.718 COC(=O)COC[C@@H]1COCCO1 3f82d99573d9aba99f855d14ff30b456 [0,0,0,0,0,2|1,0,0]=3 5754 B13R1.718 COC(=O)COC[C@H]1CCCCO1 a1e6ffaf53e14b9dc387ddff04ebbb15 [0,0,0,0,0,2|1,0,0]=3 5755 B13R1.718 COC(=O)COC[C@H]1CCCOC1 07b4ff3881bbe3cd1ae49c73e0c58a48 [0,0,0,0,0,2|1,0,0]=3 5756 B13R1.718 COC(=O)COC[C@H]1COCCO1 ae94ec00ea65e5470a8dba5fc83cfc71 [0,0,0,0,0,2|1,0,0]=3 5757 B13R1.718 COC(=O)OCNC1C=CCCC1 29c6d9180fc9c74b65ddade5dc18774d [0,0,0,0,0,2|2,0,0]=4 5758 B13R1.718 COC(=O)OCNC1CCCOC1 8cbb7d2475882c654206f7fc4653f95b [0,0,0,0,0,2|1,0,0]=3 5759 B13R1.718 COC(=O)OCNC1CCOCC1 0efd317e7e1d8bc8bacd3b27ed777f46 [0,0,0,0,0,2|2,0,0]=4 5760 B13R1.718 COC(=O)OCNC1CCSCC1 e2827b13748136a7552a5717a5804c40 [0,0,0,0,0,2|2,0,0]=4 5761 B13R1.718 COC(=O)OCN[C@@H]1CCCOC1 c413c3eabc9e30ff6cd739958ac80427 [0,0,0,0,0,2|1,0,0]=3 5762 B13R1.718 COC(=O)OCN[C@H]1CCCOC1 f4b98d301112ecdd22e4369e3acfeb96 [0,0,0,0,0,2|1,0,0]=3 5763 B13R1.718 COC(=O)OCOC1C=CCCC1 d8cd0ba4f6635e409fcb98366fcddfaa [0,0,0,0,0,2|2,0,0]=4 5764 B13R1.718 COC(=O)OCOC1CCCCC1 1a602a54bb58177feaba28ae34d27642 [0,0,0,0,0,2|2,0,0]=4 5765 B13R1.718 COC(=O)OCOC1CCCCO1 c79a13547f9d169d1efc4fa325082bb6 [0,0,0,0,0,2|1,0,0]=3 5766 B13R1.718 COC(=O)OCOC1CCCOC1 aef1ddc1ecf15d19317e407b220f0ba2 [0,0,0,0,0,2|1,0,0]=3 5767 B13R1.718 COC(=O)OCOC1CCCSC1 f899724c19b3418f3af2db69e806a9e1 [0,0,0,0,0,2|1,1,0]=4 5768 B13R1.718 COC(=O)OCOC1CCOCC1 da2debfb11e20f942386dd1516dbc155 [0,0,0,0,0,2|2,0,0]=4 5769 B13R1.718 COC(=O)OCOC1CCSCC1 df2406ba7633a40c760d710bd66f153c [0,0,0,0,0,2|2,0,0]=4 5770 B13R1.718 COC(=O)OCO[C@@H]1CCCOC1 9bf2c7fef5255477932420b7d6021f97 [0,0,0,0,0,2|1,0,0]=3 5771 B13R1.718 COC(=O)OCO[C@H]1CCCOC1 a520d94f40ce0a3bc16a4231296140fd [0,0,0,0,0,2|1,0,0]=3 5772 B13R1.718 O=C(CF)NCCC1CCCCO1 e1a187278480ab74bec61852658f6fce [0,0,0,0,0,2|2,0,0]=4 5773 B13R1.718 O=C(CF)NCCC1CCCOC1 f9c84f8e7cbca1b17b7bfa71d2783cd4 [0,0,0,0,0,2|2,0,0]=4 5774 B13R1.718 O=C(CF)NCCC1COCCO1 b34c651071a79146d34cefaded2e2358 [0,0,0,0,0,2|2,0,0]=4 5775 B13R1.718 O=C(CO)CNCC1CCCCO1 ad8cd3cb03fdb9650a5e3a3320207660 [0,0,0,0,0,2|2,0,0]=4 5776 B13R1.718 O=C(CO)CNCC1CCCOC1 ffec800a9394baad92892f2c6e25f5dc [0,0,0,0,0,2|2,0,0]=4 5777 B13R1.718 O=C(CO)CNCC1COCCO1 00e4fa732b14bea2e000de5f0a382b86 [0,0,0,0,0,2|2,0,0]=4 5778 B13R1.718 O=C(CO)CNC[C@@H]1CCCOC1 54c46ed7bd5b048fb55ecfb9f70d6f94 [0,0,0,0,0,2|2,0,0]=4 5779 B13R1.718 O=C(CO)CNC[C@H]1CCCOC1 a16e7ee1202624357e7d857c70baa15f [0,0,0,0,0,2|2,0,0]=4 5780 B13R1.718 O=C(CO)CNC[C@H]1COCCO1 da1d5725841e8b452a5a10d2f8a8276f [0,0,0,0,0,2|2,0,0]=4 5781 B13R1.718 O=C(CO)NCCC1CCCCO1 8c5193bb9f0d21ebc8fd73a02220ea14 [0,0,0,0,0,2|2,0,0]=4 5782 B13R1.718 O=C(CO)NCCC1CCCOC1 82e32fb6fd792b6380ce6eb10ff0cbb1 [0,0,0,0,0,2|2,0,0]=4 5783 B13R1.718 O=C(CO)NCCC1COCCO1 465a8eb9ad30ff4e983cd524e796318f [0,0,0,0,0,2|2,0,0]=4 5784 B13R1.718 O=C(CS)NCCC1CCCCO1 20e0b3eee8c0d47b78d05e489d53a85d [0,0,0,0,0,2|2,0,0]=4 5785 B13R1.718 O=C(CS)NCCC1CCCOC1 de4342f12cb186e3254018d6704c5fb2 [0,0,0,0,0,2|2,0,0]=4 5786 B13R1.718 O=C(CS)NCCC1COCCO1 c698f9249bb2233820ac07c6e250bda5 [0,0,0,0,0,2|2,0,0]=4 5787 B13R1.1711 CCC(=O)CNC1CCCOCC1 5286c7cae5001bc694dfc9cbf66e4e59 [0,0,0,0,0,2|2,0,0]=4 5788 B13R1.1711 CCC(=O)COC1CCCOCC1 4dbdecb0656fa8a81f7e78f006646ce5 [0,0,0,0,0,2|2,0,0]=4 5789 B13R1.1711 CCC(=O)COC1COCCOC1 60c55c3a9a58e9ab43c3a5ce058decb7 [0,0,0,0,0,2|2,0,0]=4 5790 B13R1.1711 CCC(=O)NCC1CCCCCC1 859e07a71e58618209b39a2dae6ff918 [0,0,0,0,0,2|2,0,0]=4 5791 B13R1.1711 CCC(=O)OCN1CCCCCC1 40da3ec726d5dcae979461b499f4bfc7 [0,0,0,0,0,2|2,0,0]=4 5792 B13R1.1711 CCC(=O)OCN1CCCOCC1 b9d16cad6b353910f84f158928791615 [0,0,0,0,0,2|1,0,0]=3 5793 B13R1.1711 CCC(C)OCC1COCCOC1 0c2710ff7400dfee55c19123dd4645c0 [0,0,0,0,0,2|1,0,1]=4 5794 B13R1.1711 CC[C@@H](C)OCC1COCCOC1 c64cbce1d97e8ae195ad4e167076202c [0,0,0,0,0,2|1,0,1]=4 5795 B13R1.1711 CC[C@H](C)OCC1COCCOC1 3635115ec90adb9bbd287de5d54bf0f6 [0,0,0,0,0,2|1,0,1]=4 5796 B13R1.1711 COC(=O)OCN1CCCOCC1 64fbba80cc0ca507189e093e06e54694 [0,0,0,0,0,2|2,0,0]=4 5797 B13R1.536 C=C(CC)CNCCC1CCCO1 0ccf5b8d90e49325df08d35000791391 [0,0,0,0,0,2|2,0,0]=4 5798 B13R1.536 C=C(CC)COCCC1CCCC1 0b6b68c702997b0c545610c4b31d7f3c [0,0,0,0,0,2|2,0,0]=4 5799 B13R1.536 C=C(CC)COCCC1CCCO1 934229f7d7b9426fbb21874118ebc537 [0,0,0,0,0,2|1,0,0]=3 5800 B13R1.536 C=C(COCCC1CCCO1)OC 6cd3f9c5b042aca390110f4e6d9ff159 [0,0,0,0,0,2|2,0,0]=4 5801 B13R1.536 C=CC(=O)NCOCC1CCCO1 4af0f0ce435691af5568782fe33633ec [0,0,0,0,0,2|0,0,2]=4 5802 B13R1.536 C=CC(=O)OCCOC1CCCO1 203a98c1760033aa8af89a4517dec62e [0,0,0,0,0,2|0,0,2]=4 5803 B13R1.536 CCC(=O)CNCCC1CCCC1 10bd3f23e78c409f2830920821f616a9 [0,0,0,0,0,2|2,0,0]=4 5804 B13R1.536 CCC(=O)CNCCC1CCCO1 1a38691aedbbc7392b16263e6d98703a [0,0,0,0,0,2|1,0,0]=3 5805 B13R1.536 CCC(=O)COCC=C1CCCC1 5750057ac4f7a74aa6eb7ffc8ac49cb1 [0,0,0,0,0,2|1,0,1]=4 5806 B13R1.536 CCC(=O)COCCC1CCCC1 22b9519c3f202e7018092280eb6134f5 [0,0,0,0,0,2|1,0,0]=3 5807 B13R1.536 CCC(=O)COCCC1CCCO1 1b38a8ef787db33709df418a6c0958d3 [0,0,0,0,0,2|0,0,0]=2 5808 B13R1.536 CCC(=O)COCCC1CCOC1 5435990103b2f569308fdd99dbf2b70f [0,0,0,0,0,2|2,0,0]=4 5809 B13R1.536 CCC(=O)COCCN1CCCC1 078dcec989294493091c1b875e41c94b [0,0,0,0,0,2|2,0,0]=4 5810 B13R1.536 CCC(=O)NCCCC1CCCC1 78401252e8e9003b046e46509e85fda0 [0,0,0,0,0,2|2,0,0]=4 5811 B13R1.536 CCC(=O)NCCNC1CCCC1 91f24aa21b23f2e0d86a5f1a23957461 [0,0,0,0,0,2|2,0,0]=4 5812 B13R1.536 CCC(=O)NCCOC1CCCC1 654f37cd8ea7ec76a708924de62d7f1d [0,0,0,0,0,2|2,0,0]=4 5813 B13R1.536 CCC(=O)NCCSC1CCCC1 8e8c720ca6853249c74ce3841cd1f66b [0,0,0,0,0,2|2,0,0]=4 5814 B13R1.536 CCC(=O)OCCOC1CCCC1 c02f90d726ad92eea083c4e3a3f83094 [0,0,0,0,0,2|1,0,0]=3 5815 B13R1.536 CCC(=O)OCNCC1CCCC1 25e2f4c2cda7b9d81ecf095cec72e957 [0,0,0,0,0,2|1,0,0]=3 5816 B13R1.536 CCC(=O)OCNCC1CCCO1 38337eab7e7f25178ba044b0a6d7713c [0,0,0,0,0,2|0,0,0]=2 5817 B13R1.536 CCC(=O)OCNCC1CCOC1 d918fe0fc88c3f9b03bc4af6c93868d0 [0,0,0,0,0,2|2,0,0]=4 5818 B13R1.536 CCC(=O)OCNC[C@@H]1CCCO1 93477c290fd87c859e709f915c86c161 [0,0,0,0,0,2|0,0,0]=2 5819 B13R1.536 CCC(=O)OCNC[C@@H]1CCOC1 6110c229e3c28b1e6f2c519d8466efe2 [0,0,0,0,0,2|2,0,0]=4 5820 B13R1.536 CCC(=O)OCNC[C@H]1CCCO1 67ed3d4bc224a36e92f995aa9a03fa6b [0,0,0,0,0,2|0,0,0]=2 5821 B13R1.536 CCC(=O)OCNC[C@H]1CCOC1 15e8ba7310ecacd5ccaf8f85c2aa2338 [0,0,0,0,0,2|2,0,0]=4 5822 B13R1.536 CCC(=O)OCOCC1C=CCC1 bd6e72bbb9e487c633845588380a2d8c [0,0,0,0,0,2|1,0,1]=4 5823 B13R1.536 CCC(=O)OCOCC1CCCC1 71c41fd31e5c53b9fc2ac0951512a0d2 [0,0,0,0,0,2|1,0,0]=3 5824 B13R1.536 CCC(=O)OCOCC1CCCO1 f52704470abaf0120154e19f95aecc3e [0,0,0,0,0,2|0,0,0]=2 5825 B13R1.536 CCC(=O)OCOCC1CCCS1 11ae46b8e559fbad756e1b4d711e03c8 [0,0,0,0,0,2|0,1,0]=3 5826 B13R1.536 CCC(=O)OCOCC1CCOC1 1150f644c5e0f204cc2154ed43adf3f0 [0,0,0,0,0,2|2,0,0]=4 5827 B13R1.536 CCC(=O)OCOCN1CCCC1 6ad891e48fee7afd767e8136dc321464 [0,0,0,0,0,2|2,0,0]=4 5828 B13R1.536 CCC(=O)OCOC[C@@H]1CCCO1 8927848464d44d575e9bf04f800b86b4 [0,0,0,0,0,2|0,0,0]=2 5829 B13R1.536 CCC(=O)OCOC[C@@H]1CCOC1 53dcef4014bea33e0f6ef2166065d107 [0,0,0,0,0,2|2,0,0]=4 5830 B13R1.536 CCC(=O)OCOC[C@H]1CCCO1 274d686f009bc5312e63b323a230ddcb [0,0,0,0,0,2|0,0,0]=2 5831 B13R1.536 CCC(=O)OCOC[C@H]1CCOC1 49d15d542cab6dd0ed65af9f6463155d [0,0,0,0,0,2|2,0,0]=4 5832 B13R1.536 CCC(C)CCOCC1CCCO1 5f08e101e7668262e3034e8a5c4c0c8c [0,0,0,0,0,2|1,0,1]=4 5833 B13R1.536 CCC(C)CCOC[C@@H]1CCCO1 a079a8d300a277402d26979058a253f9 [0,0,0,0,0,2|1,0,1]=4 5834 B13R1.536 CCC(C)CCOC[C@H]1CCCO1 e3039b5d7320c58c250651a1b2cff242 [0,0,0,0,0,2|1,0,1]=4 5835 B13R1.536 CCC(C)COCCC1CCCO1 f571b462e1709716e2f88215b5aada8d [0,0,0,0,0,2|1,0,1]=4 5836 B13R1.536 CCC(S)CCOCC1CCCO1 fa4c6aa7d819877c9fbc2c285419840a [0,0,0,0,0,2|0,1,1]=4 5837 B13R1.536 CCS(=O)CCNCC1CCCO1 24941f178bf88641c78459d59f08a18e [0,0,0,0,0,2|2,0,0]=4 5838 B13R1.536 CCS(=O)CCNC[C@@H]1CCCO1 7dbb00ba3ece48d1f0bd91e3aa3bc2e5 [0,0,0,0,0,2|2,0,0]=4 5839 B13R1.536 CCS(=O)CCNC[C@H]1CCCO1 52b6e44cc1bdc82ef66111103d4f3f7a [0,0,0,0,0,2|2,0,0]=4 5840 B13R1.536 CCS(=O)CCOCC1CCCC1 68eae9e84e3f92e0df697af20c5ff2e0 [0,0,0,0,0,2|2,0,0]=4 5841 B13R1.536 CCS(=O)CCOCC1CCCO1 f3f25b59402b4b31cb72426c70c61b59 [0,0,0,0,0,2|1,0,0]=3 5842 B13R1.536 CCS(=O)CCOCC1CCCS1 82f0174fdf178d0ac522099c01cfbf7d [0,0,0,0,0,2|1,1,0]=4 5843 B13R1.536 CCS(=O)CCOC[C@@H]1CCCO1 d404cd4ed59a4e9c210473c2216cf42d [0,0,0,0,0,2|1,0,0]=3 5844 B13R1.536 CCS(=O)CCOC[C@H]1CCCO1 50abb266edd0b8e785652f9c42ce42d5 [0,0,0,0,0,2|1,0,0]=3 5845 B13R1.536 CC[C@@H](C)COCCC1CCCO1 df7bf0ca21dfcf6130848a9ffa40bd2a [0,0,0,0,0,2|1,0,1]=4 5846 B13R1.536 CC[C@H](C)CCOCC1CCCO1 f09d69ed31a55a56b14ee5689bb6d66c [0,0,0,0,0,2|1,0,1]=4 5847 B13R1.536 CC[C@H](C)COCCC1CCCO1 68c8b7e366fa9583dd9dbf3bb923f159 [0,0,0,0,0,2|1,0,1]=4 5848 B13R1.536 CNC(=O)CCCOC1CCCO1 31f701cddd727a289b16c838a19f6cef [0,0,0,0,0,2|2,0,0]=4 5849 B13R1.536 CNC(=O)CCNCC1CCCO1 15ae313cf6ef0d138ce5db2bf3adf2eb [0,0,0,0,0,2|2,0,0]=4 5850 B13R1.536 CNC(=O)CCNC[C@@H]1CCCO1 527d5c347d184bf790a2125fe5190aae [0,0,0,0,0,2|2,0,0]=4 5851 B13R1.536 CNC(=O)CCNC[C@H]1CCCO1 d70b6584fc160a0eb52e160a3d539f0d [0,0,0,0,0,2|2,0,0]=4 5852 B13R1.536 CNC(=O)CCOCC1CCCC1 b8d7a05301068dd25e2855f665885933 [0,0,0,0,0,2|2,0,0]=4 5853 B13R1.536 CNC(=O)CCOCC1CCCO1 632d9bd2a544a171e27f7b25fff105ca [0,0,0,0,0,2|1,0,0]=3 5854 B13R1.536 CNC(=O)CCOCC1CCCS1 d5b55e2e9733b77d5a1e71f116aaa666 [0,0,0,0,0,2|1,1,0]=4 5855 B13R1.536 CNC(=O)CCOC[C@@H]1CCCO1 df4cd195601ddb21b94353e15ff7e9a5 [0,0,0,0,0,2|1,0,0]=3 5856 B13R1.536 CNC(=O)CCOC[C@H]1CCCO1 7f43b9421bcb2b33d30c2e29d79e59f9 [0,0,0,0,0,2|1,0,0]=3 5857 B13R1.536 CNC(=O)CNCCC1CCCO1 43be7f0f5c836043027790db43c93e90 [0,0,0,0,0,2|2,0,0]=4 5858 B13R1.536 CNC(=O)COCCC1CCCC1 38f16741f6abeca1f32bd50b37195dda [0,0,0,0,0,2|2,0,0]=4 5859 B13R1.536 CNC(=O)COCCC1CCCO1 2a6e37db98686f14cf7c04cb850b07a9 [0,0,0,0,0,2|1,0,0]=3 5860 B13R1.536 COC(=O)/C=C/COC1CCCO1 08b33fd8dbcb0e4869f5822f3b65dc59 [0,0,0,0,0,2|2,0,0]=4 5861 B13R1.536 COC(=O)/C=C\COC1CCCO1 64819bcc090cd21fc08f6c2a1959bca4 [0,0,0,0,0,2|2,0,0]=4 5862 B13R1.536 COC(=O)C#CCOC1CCCO1 b4b57b90ddab43d49602db692b990097 [0,0,0,0,0,2|2,0,0]=4 5863 B13R1.536 COC(=O)C=CCOC1CCCO1 c9a7b42bc547083099018bb3867c5ed9 [0,0,0,0,0,2|2,0,0]=4 5864 B13R1.536 COC(=O)CCCOC1CCCO1 8edfb276da38ed9677ec238845090294 [0,0,0,0,0,2|2,0,0]=4 5865 B13R1.536 COC(=O)CCNCC1CCCO1 b3731e64a703520ea8be26fa6353279a [0,0,0,0,0,2|2,0,0]=4 5866 B13R1.536 COC(=O)CCNC[C@@H]1CCCO1 8029bbd90a230a13789b1246f6454418 [0,0,0,0,0,2|2,0,0]=4 5867 B13R1.536 COC(=O)CCNC[C@H]1CCCO1 b1ae8fc053bf28586746aba29001ef9d [0,0,0,0,0,2|2,0,0]=4 5868 B13R1.536 COC(=O)CCOCC1CCCC1 678ac4ada82616416b992d05fa3309a0 [0,0,0,0,0,2|2,0,0]=4 5869 B13R1.536 COC(=O)CCOCC1CCCO1 b5fc66bc8120f12da3df044fdab4d62e [0,0,0,0,0,2|1,0,0]=3 5870 B13R1.536 COC(=O)CCOCC1CCCS1 28aaf7fb8583b4884524f1338144a848 [0,0,0,0,0,2|1,1,0]=4 5871 B13R1.536 COC(=O)CCOC[C@@H]1CCCO1 e02dee49ef963df2c38e0d8c4382b4f6 [0,0,0,0,0,2|1,0,0]=3 5872 B13R1.536 COC(=O)CCOC[C@H]1CCCO1 ec65943fb63d332a6702c29e6efbcf67 [0,0,0,0,0,2|1,0,0]=3 5873 B13R1.536 COC(=O)CNCCC1CCCO1 daf775f62d5a9ce47c354d786303b617 [0,0,0,0,0,2|2,0,0]=4 5874 B13R1.536 COC(=O)COCCC1CCCC1 3d0325bdfaa6d6afbc7c793e9373cc4b [0,0,0,0,0,2|2,0,0]=4 5875 B13R1.536 COC(=O)COCCC1CCCO1 b47136842ef36247c1a34ebb89226889 [0,0,0,0,0,2|1,0,0]=3 5876 B13R1.536 COC(=O)OCCOC1CCCC1 8245b0eebfed04bf29305a216a53b9a5 [0,0,0,0,0,2|2,0,0]=4 5877 B13R1.536 COC(=O)OCNCC1CCCC1 d81bd9cc4820327f55216c82a8525d0f [0,0,0,0,0,2|2,0,0]=4 5878 B13R1.536 COC(=O)OCNCC1CCCO1 6a33e8c444a4a20958a8538557376067 [0,0,0,0,0,2|1,0,0]=3 5879 B13R1.536 COC(=O)OCNC[C@@H]1CCCO1 274e92d95a78c96de46a6fc67811a0c9 [0,0,0,0,0,2|1,0,0]=3 5880 B13R1.536 COC(=O)OCNC[C@H]1CCCO1 94b90f0097c74f90b4e2d6bce6fc26e6 [0,0,0,0,0,2|1,0,0]=3 5881 B13R1.536 COC(=O)OCOCC1CCCC1 73e8bba55c9ac7ef8688d75d4f23f999 [0,0,0,0,0,2|2,0,0]=4 5882 B13R1.536 COC(=O)OCOCC1CCCO1 d822fd7c589756f8d43a56d893b88966 [0,0,0,0,0,2|1,0,0]=3 5883 B13R1.536 COC(=O)OCOCC1CCCS1 87f3c182c3fbbcca817c858c8932ecbc [0,0,0,0,0,2|1,1,0]=4 5884 B13R1.536 COC(=O)OCOC[C@@H]1CCCO1 f6911ec58a817aad044864f3f5e7f6c2 [0,0,0,0,0,2|1,0,0]=3 5885 B13R1.536 COC(=O)OCOC[C@H]1CCCO1 68dfc282dca84c1d32a733e84d52ae85 [0,0,0,0,0,2|1,0,0]=3 5886 B13R1.536 O=C(CO)CNCCC1CCCO1 8106e4ebe7273f1c169f8f83594f7750 [0,0,0,0,0,2|2,0,0]=4