0 B11R0.191 C#CC(OCCC)C(=O)OCC 2ca6e982d1707266ac914aa481e04dbc [0,0,0,0,0,0|1,0,2]=3 1 B11R0.191 C#CC(OCCF)C(=O)OCC e8b82eb628adf683aaa3d34dcc58762b [0,0,0,0,0,0|2,0,2]=4 2 B11R0.191 C#CC(OCCS)C(=O)OCC f6984fc91ccfeffe521bc3deddafadbb [0,0,0,0,0,0|2,0,2]=4 3 B11R0.191 C#CC(OCOC)C(=O)OCC 89e7bc91255205667c4cfc1d642533e5 [0,0,0,0,0,0|2,0,2]=4 4 B11R0.191 C#CC(OCSC)C(=O)OCC 202b41cbbd69989c70cbcfb3827dcae0 [0,0,0,0,0,0|2,0,2]=4 5 B11R0.191 C#CCC(=O)N(CC)CCCC bbade8b054a079ab35a85d9dec6c1012 [0,0,0,0,0,0|2,0,2]=4 6 B11R0.191 C#CCNC(CC)C(=O)CCC 85e7833aace6b6f0273ddd061d90673a [0,0,0,0,0,0|2,0,2]=4 7 B11R0.191 C#CCNC(CC)C(=O)NCC fd0e5f6b22c95534ee4a16d61b59ee1d [0,0,0,0,0,0|2,0,2]=4 8 B11R0.191 C#CCNC(CC)C(=O)OCC 23f2e2cb1047890b5707ac651e7ae626 [0,0,0,0,0,0|1,0,2]=3 9 B11R0.191 C#CCNC(CO)C(=O)OCC 5fe9daf7945e88792ed4cac4e085abc3 [0,0,0,0,0,0|2,0,2]=4 10 B11R0.191 C#CCN[C@@H](CC)C(=O)OCC 2570adf2d05bf1def3b7f20c2214550a [0,0,0,0,0,0|1,0,2]=3 11 B11R0.191 C#CCN[C@H](CC)C(=O)OCC 09940f41ea74e17e1f5580c2b1b4153e [0,0,0,0,0,0|1,0,2]=3 12 B11R0.191 C#CCOC(CC)C(=O)OCC 2d0d5a0f2aeeb0e9dd909ef7fa8831ab [0,0,0,0,0,0|1,0,2]=3 13 B11R0.191 C#CCOC(SC)C(=O)OCC 7724336f12f51597f26c4b5d2d62b940 [0,0,0,0,0,0|2,0,2]=4 14 B11R0.191 C#CCO[C@@H](CC)C(=O)OCC dbe25961a03fb5202ccfa71cadb5397a [0,0,0,0,0,0|1,0,2]=3 15 B11R0.191 C#CCO[C@H](CC)C(=O)OCC c35f0dad5802e782b6c8ef8f8c379078 [0,0,0,0,0,0|1,0,2]=3 16 B11R0.191 C/C=C/C(=O)N(CC)CCCC 4eff54439832b5e8424b637e5db699f4 [0,0,0,0,0,0|2,0,1]=3 17 B11R0.191 C/C=C/C(=O)N(CC)CCCO 22d6b7115463ba3cdab1c81aee4ee141 [0,0,0,0,0,0|3,0,1]=4 18 B11R0.191 C/C=C/C(=O)N(CC)CCOC c6ec85cfba04d3f8c00c3cc4b7410bf2 [0,0,0,0,0,0|3,0,1]=4 19 B11R0.191 C=CCC(=O)N(CC)CCCC b2c06c204f23d32ee96beb491a44daee [0,0,0,0,0,0|2,0,2]=4 20 B11R0.191 C=CCNC(CC)C(=O)NCC 3d4b35064804bf96dc293a45a02bc97a [0,0,0,0,0,0|2,0,2]=4 21 B11R0.191 C=CCNC(CC)C(=O)OCC 34a97432a0005d7f88488a3102653aaa [0,0,0,0,0,0|1,0,2]=3 22 B11R0.191 C=CCN[C@@H](CC)C(=O)OCC efc85e29e2ef2f297dc60cfb6bd9a707 [0,0,0,0,0,0|1,0,2]=3 23 B11R0.191 C=CCN[C@H](CC)C(=O)OCC 3b4e0a4d8379c474ac963565d7de94c1 [0,0,0,0,0,0|1,0,2]=3 24 B11R0.191 C=CCOC(CC)C(=O)OCC d9f444f2066ea707a5fec0002f084a03 [0,0,0,0,0,0|1,0,2]=3 25 B11R0.191 C=CCO[C@@H](CC)C(=O)OCC bd72ade6873ff728eac3e82d57b9a86a [0,0,0,0,0,0|1,0,2]=3 26 B11R0.191 C=CCO[C@H](CC)C(=O)OCC c75f2b2404366e83280d76bd38d3a75f [0,0,0,0,0,0|1,0,2]=3 27 B11R0.191 CC#CC(=O)N(CC)CCCC 72aef7010ccb2ba828198e2364d9a347 [0,0,0,0,0,0|2,0,1]=3 28 B11R0.191 CC#CC(=O)N(CC)CCCO f08051db026a3ed7fefbebb0f0315ca1 [0,0,0,0,0,0|3,0,1]=4 29 B11R0.191 CC#CC(=O)N(CC)CCOC 400879c2fed067e46d1d1a388c6ba5d4 [0,0,0,0,0,0|3,0,1]=4 30 B11R0.191 CCCC(=O)C(CC)NCC#N 7cc57a8943489d6844349ab4c20bfa31 [0,0,0,0,0,0|3,0,1]=4 31 B11R0.191 CCCC(=O)C(CC)NCCBr c729b772a4a97191a85a41e15cce9f5e [0,0,0,0,0,0|3,0,0]=3 32 B11R0.191 CCCC(=O)C(CC)NCCF cf9d1220f364ef622d5ebe4a48f7615c [0,0,0,0,0,0|3,0,0]=3 33 B11R0.191 CCCC(=O)C(CC)NCCI b99abab4a0f90cc3b2f3c2c0fe148baf [0,0,0,0,0,0|3,0,0]=3 34 B11R0.191 CCCC(=O)C(CC)NCCO a4d5c5bb56324216fd188d5ad52db8d0 [0,0,0,0,0,0|3,0,0]=3 35 B11R0.191 CCCC(=O)C(CC)NCCS c88d7281c7453d449ed5189dea052476 [0,0,0,0,0,0|3,0,0]=3 36 B11R0.191 CCCC(=O)C(CC)OCCS fcee9eebded5ff955ee602c89d3fcb1d [0,0,0,0,0,0|3,0,0]=3 37 B11R0.191 CCCC(=O)C(CC)OCOC 119f58c3c50f399214dfde43cdc161d6 [0,0,0,0,0,0|3,0,0]=3 38 B11R0.191 CCCC(=O)N(CC)CCC#N e1c2114cd81531bfbd71479023cb8e64 [0,0,0,0,0,0|3,0,1]=4 39 B11R0.191 CCCC(=O)N(CC)CCCO 806aa4c7ac6c39441b9aae60a6ca898f [0,0,0,0,0,0|3,0,0]=3 40 B11R0.191 CCCC(=O)N(CC)CCOC efeb22e7ea5eba42f03e3820819ffe5a [0,0,0,0,0,0|3,0,0]=3 41 B11R0.191 CCCCC(CC)N(C)CCC 062084a09d51d140f699752035674a63 [0,0,0,0,0,0|3,0,0]=3 42 B11R0.191 CCCCC(CC)N(C)CCF 6df0bc345ddf0f9aad4c32ca318c83b0 [0,0,0,0,0,0|4,0,0]=4 43 B11R0.191 CCCCC(CC)N(C)CCO 4039009e0ca3b90240dd66b07422b570 [0,0,0,0,0,0|4,0,0]=4 44 B11R0.191 CCCCC(CO)N(C)CCC bacfe1ef99ef547a282b621609496d68 [0,0,0,0,0,0|4,0,0]=4 45 B11R0.191 CCCCN(CC)C(=O)/C=C/Br ce06ed0acbb362416d0311573f0462be [0,0,0,0,0,0|3,0,1]=4 46 B11R0.191 CCCCN(CC)C(=O)/C=C/Cl cafc96a618881c27f1b0422b98ee7161 [0,0,0,0,0,0|3,0,1]=4 47 B11R0.191 CCCCN(CC)C(=O)/C=C/I aa39a17afcfdb28db52773476ea86fe6 [0,0,0,0,0,0|3,0,1]=4 48 B11R0.191 CCCCN(CC)C(=O)/C=C\Br d32956ab518176818002b25c1ba09633 [0,0,0,0,0,0|3,0,1]=4 49 B11R0.191 CCCCN(CC)C(=O)/C=C\Cl ca3a2716beb76b78ba564f277518b75d [0,0,0,0,0,0|3,0,1]=4 50 B11R0.191 CCCCN(CC)C(=O)/C=C\I 7ffbbbc14dd249ea98d8491386d4f475 [0,0,0,0,0,0|3,0,1]=4 51 B11R0.191 CCCCN(CC)C(=O)C#CBr e5b987e2bc20bbdd90e490b7d8b4a306 [0,0,0,0,0,0|3,0,1]=4 52 B11R0.191 CCCCN(CC)C(=O)C=CBr b5922bacb29620cf3203075042840039 [0,0,0,0,0,0|3,0,1]=4 53 B11R0.191 CCCCN(CC)C(=O)C=CI 1dc743b259158093cbcdb19942d3e80c [0,0,0,0,0,0|3,0,1]=4 54 B11R0.191 CCCCN(CC)C(=O)CC#N 6092a309a178ab3cd9f1e71da8739957 [0,0,0,0,0,0|3,0,1]=4 55 B11R0.191 CCCCN(CC)C(=O)CC=O c88f840238b90c66e1a1df6d95af7152 [0,0,0,0,0,0|3,0,1]=4 56 B11R0.191 CCCCN(CC)C(=O)CCC 2ff9174d653a3c3383ad7577e6631009 [0,0,0,0,0,0|2,0,0]=2 57 B11R0.191 CCCCN(CC)C(=O)CCF 10ce6a9cd11134b77eb2e717a08c02f7 [0,0,0,0,0,0|3,0,0]=3 58 B11R0.191 CCCCN(CC)C(=O)CCO 89d2f4512be08252fb89a63fabc8b29d [0,0,0,0,0,0|3,0,0]=3 59 B11R0.191 CCCCN(CC)C(=O)CCS 3a6141c3dc5c76cb0365154fa2ce9628 [0,0,0,0,0,0|3,0,0]=3 60 B11R0.191 CCCCN(CC)C(=O)COC bed220e8742b82696fc19e15cdd2ce69 [0,0,0,0,0,0|3,0,0]=3 61 B11R0.191 CCCCN(CC)C(=O)CON 313f82cc9875d0f962e4c25dc2548538 [0,0,0,0,0,0|4,0,0]=4 62 B11R0.191 CCCCN(CC)C(=O)CSC a73ec36217772ae3593afff695717fed [0,0,0,0,0,0|3,0,0]=3 63 B11R0.191 CCCCN(CC)C(=O)NC#N 328f9f051f1c64baf7348c7d8ea0ff27 [0,0,0,0,0,0|3,0,1]=4 64 B11R0.191 CCCCN(CC)C(C)CCC 06c992cf8b1e501274cac6e6a6c1ebb6 [0,0,0,0,0,0|3,0,1]=4 65 B11R0.191 CCCNC(C#N)C(=O)OCC 875fbe14c5c2090a9504c5345896be67 [0,0,0,0,0,0|2,0,1]=3 66 B11R0.191 CCCNC(C=O)C(=O)OCC ba755caedec60f81fa23cb8b45669d82 [0,0,0,0,0,0|2,0,1]=3 67 B11R0.191 CCCNC(CC)C(=O)CCC 5c10031b6dcbf0afefd0de61586e5e0f [0,0,0,0,0,0|2,0,0]=2 68 B11R0.191 CCCNC(CC)C(=O)NCC a3d1288d5e4777b17f0eaa627eeb2f3b [0,0,0,0,0,0|2,0,0]=2 69 B11R0.191 CCCNC(CC)C(=O)OCC 4dd081b468a189eda6d48e8e7d914a12 [0,0,0,0,0,0|1,0,0]=1 70 B11R0.191 CCCNC(CO)C(=O)OCC 53c8aa57fe07e57ddf7b2066988edbaa [0,0,0,0,0,0|2,0,0]=2 71 B11R0.191 CCCN[C@@H](CC)C(=O)OCC fab7cb8c76c00383a8d6bfb8e9dd7d6a [0,0,0,0,0,0|1,0,0]=1 72 B11R0.191 CCCN[C@H](CC)C(=O)OCC 482e7ec8dc94e07220ce6dca04b185eb [0,0,0,0,0,0|1,0,0]=1 73 B11R0.191 CCCOC(C=O)C(=O)OCC ab12fed12727522f20947947a7fed23a [0,0,0,0,0,0|2,0,1]=3 74 B11R0.191 CCCOC(CC)C(=O)CCC 464c224f30ee877fc879ffbcca4a0dee [0,0,0,0,0,0|2,0,0]=2 75 B11R0.191 CCCOC(CC)C(=O)OCC ea9f299900de506cdd19d95e0ed9e469 [0,0,0,0,0,0|1,0,0]=1 76 B11R0.191 CCCOC(CC)C(C)CCC 984e8809a0d29e32851b34f909d092ea [0,0,0,0,0,0|3,0,1]=4 77 B11R0.191 CCCO[C@@H](CC)C(=O)OCC 58f3533b49347381e57d0bbc526b7a96 [0,0,0,0,0,0|1,0,0]=1 78 B11R0.191 CCCO[C@H](CC)C(=O)OCC 292dd8ef1b78875e9fa2ead936c6c30c [0,0,0,0,0,0|1,0,0]=1 79 B11R0.191 CCN(CCCO)C(=O)CCF 68fa25168e4bd7a7eece14b3ff275ff6 [0,0,0,0,0,0|4,0,0]=4 80 B11R0.191 CCN(CCCO)C(=O)CCO 36bcb78d9c85032a1cff83adc99def75 [0,0,0,0,0,0|4,0,0]=4 81 B11R0.191 CCN(CCCO)C(=O)CCS dcf830dc2d0084fb7ba32db8913046ad [0,0,0,0,0,0|4,0,0]=4 82 B11R0.191 CCN(CCCO)C(=O)COC bd792fbb21337765900f9f5bf7c00750 [0,0,0,0,0,0|4,0,0]=4 83 B11R0.191 CCN(CCCO)C(=O)CSC e4f13f6b9bc075a6d406e3dbbdff9c23 [0,0,0,0,0,0|4,0,0]=4 84 B11R0.191 CCN(CCOC)C(=O)CCF 8850247d9e7ba36c39485a8e85b7adcb [0,0,0,0,0,0|4,0,0]=4 85 B11R0.191 CCN(CCOC)C(=O)CCO f36e3b3c7b96577ababef266f8cd6f35 [0,0,0,0,0,0|4,0,0]=4 86 B11R0.191 CCN(CCOC)C(=O)CCS c9904d14177a5172ecf385fa206e57f3 [0,0,0,0,0,0|4,0,0]=4 87 B11R0.191 CCN(CCOC)C(=O)COC d27bfe1dd83f9b67816a7fb1d045a654 [0,0,0,0,0,0|4,0,0]=4 88 B11R0.191 CCN(CCOC)C(=O)CSC edf3369291e482f0b16afb664d7a12b3 [0,0,0,0,0,0|4,0,0]=4 89 B11R0.191 CCNC(=O)C(CC)NCC#N ba6a29b144342f25be8581722850ae2a [0,0,0,0,0,0|3,0,1]=4 90 B11R0.191 CCNC(=O)C(CC)NCC=O f4330d21cd5968ec7a1fb198b3ada8f1 [0,0,0,0,0,0|3,0,1]=4 91 B11R0.191 CCNC(=O)C(CC)NCCF ee6b2ea248dda625cbde5fe934c03a6f [0,0,0,0,0,0|3,0,0]=3 92 B11R0.191 CCNC(=O)C(CC)NCCO 927fdedd71370e1f1a664f385c35844a [0,0,0,0,0,0|3,0,0]=3 93 B11R0.191 CCNC(=O)C(CC)NCCS f795e8456395b6e67cfa7a68bcb285d1 [0,0,0,0,0,0|3,0,0]=3 94 B11R0.191 CCNC(=O)C(CC)NCOC 9b9d20642be6b3cec9573c687eeb99b8 [0,0,0,0,0,0|3,0,0]=3 95 B11R0.191 CCNC(=O)C(CC)NCSC cd7d37b7a04e6d1a624d598d17e0381b [0,0,0,0,0,0|3,0,0]=3 96 B11R0.191 CCOC(=O)C(C#N)NCCF fb261c3b1d8308432111c56b87a273c3 [0,0,0,0,0,0|3,0,1]=4 97 B11R0.191 CCOC(=O)C(C#N)NCCO d5d7e9d4aa9f8f115bee89203e850e81 [0,0,0,0,0,0|3,0,1]=4 98 B11R0.191 CCOC(=O)C(C#N)NCCS f042a586918b19128826809471960d0b [0,0,0,0,0,0|3,0,1]=4 99 B11R0.191 CCOC(=O)C(C#N)NCOC d85a0fa9cfdb5da05e0a109e17cba7a5 [0,0,0,0,0,0|3,0,1]=4 100 B11R0.191 CCOC(=O)C(C#N)NCSC 03b8edcbcefcd3de6d7fbb5f7649c346 [0,0,0,0,0,0|3,0,1]=4 101 B11R0.191 CCOC(=O)C(C=O)NCCBr a411175c9f97b456180e0f0495c15d7b [0,0,0,0,0,0|3,0,1]=4 102 B11R0.191 CCOC(=O)C(C=O)NCCF 76bf14239b20882b0032e63283b5288f [0,0,0,0,0,0|3,0,1]=4 103 B11R0.191 CCOC(=O)C(C=O)NCCI dd92cd1005bcb73ab5843551d46592c6 [0,0,0,0,0,0|3,0,1]=4 104 B11R0.191 CCOC(=O)C(C=O)NCCO eae3793c89c2dfb7f3c9be5c5feaab08 [0,0,0,0,0,0|3,0,1]=4 105 B11R0.191 CCOC(=O)C(C=O)NCCS b2ee9a478e528b835e2309049b058693 [0,0,0,0,0,0|3,0,1]=4 106 B11R0.191 CCOC(=O)C(C=O)OCCF ac58e73011aa3aeecbbdd8277df09326 [0,0,0,0,0,0|3,0,1]=4 107 B11R0.191 CCOC(=O)C(C=O)OCCS 72eb80adca00018584c0c68d2674f948 [0,0,0,0,0,0|3,0,1]=4 108 B11R0.191 CCOC(=O)C(C=O)OCOC 95a9112e04c654e9fb4a3b692403753a [0,0,0,0,0,0|3,0,1]=4 109 B11R0.191 CCOC(=O)C(CC)NCC#N 753f239a52d2034135f320e7790eb29e [0,0,0,0,0,0|2,0,1]=3 110 B11R0.191 CCOC(=O)C(CC)NCC=O 9b9b894e1b71a9097d71bc4b3c8c58b6 [0,0,0,0,0,0|2,0,1]=3 111 B11R0.191 CCOC(=O)C(CC)NCCBr ae374b9908d3f5b7b784586040faec44 [0,0,0,0,0,0|2,0,0]=2 112 B11R0.191 CCOC(=O)C(CC)NCCF 8e968b56c6846d173cadfa80bc893e38 [0,0,0,0,0,0|2,0,0]=2 113 B11R0.191 CCOC(=O)C(CC)NCCI c52ea35fe1ed58953bf6ff5b4584e437 [0,0,0,0,0,0|2,0,0]=2 114 B11R0.191 CCOC(=O)C(CC)NCCO 28904e8af8cd11ead68368b2c15bbef6 [0,0,0,0,0,0|2,0,0]=2 115 B11R0.191 CCOC(=O)C(CC)NCCS 408ef9203d460e5354f130121f40e13f [0,0,0,0,0,0|2,0,0]=2 116 B11R0.191 CCOC(=O)C(CC)NCOC bded515acb63c4d84b9e4eb4a4653591 [0,0,0,0,0,0|2,0,0]=2 117 B11R0.191 CCOC(=O)C(CC)NCSC e0a8118fcf23375317a4277967837dd4 [0,0,0,0,0,0|2,0,0]=2 118 B11R0.191 CCOC(=O)C(CC)OCC#N c098377e85732876b8f85519750dfc93 [0,0,0,0,0,0|2,0,1]=3 119 B11R0.191 CCOC(=O)C(CC)OCC=O 13c2b02e9d20ba98fec76fc9b95db7d0 [0,0,0,0,0,0|2,0,1]=3 120 B11R0.191 CCOC(=O)C(CC)OCCF 2124a1909efd0bf7c2fb66ed72d67714 [0,0,0,0,0,0|2,0,0]=2 121 B11R0.191 CCOC(=O)C(CC)OCCS 5eb83164ef68e9fd21ce423e525ba817 [0,0,0,0,0,0|2,0,0]=2 122 B11R0.191 CCOC(=O)C(CC)OCOC b0ee734096583c92dfdd51725d7fec41 [0,0,0,0,0,0|2,0,0]=2 123 B11R0.191 CCOC(=O)C(CC)OCSC 214df89af478ca10acc9c793423f6d97 [0,0,0,0,0,0|2,0,0]=2 124 B11R0.191 CCOC(=O)C(CO)NCC#N 8eecad2bb86b6d91760ed6217054c8c5 [0,0,0,0,0,0|3,0,1]=4 125 B11R0.191 CCOC(=O)C(CO)NCCBr faa978026ce018c9bf22cb0b3f6435f4 [0,0,0,0,0,0|3,0,0]=3 126 B11R0.191 CCOC(=O)C(CO)NCCF d85b92c3f09a1ab444c7d8079d809fd1 [0,0,0,0,0,0|3,0,0]=3 127 B11R0.191 CCOC(=O)C(CO)NCCI 731bd330d31199083cc01cdc96bf2d66 [0,0,0,0,0,0|3,0,0]=3 128 B11R0.191 CCOC(=O)C(CO)NCCO ccdd6dac08f40b8b24b2b1a707491b89 [0,0,0,0,0,0|3,0,0]=3 129 B11R0.191 CCOC(=O)C(CO)NCCS a693dd45c94fe19e938d455a9f1927a8 [0,0,0,0,0,0|3,0,0]=3 130 B11R0.191 CCOC(=O)C(NCCI)SC df0646ef9cf4617a169cd02b58972431 [0,0,0,0,0,0|3,0,0]=3 131 B11R0.191 CCOC(=O)C(NCCS)SC 5b92492919238bc363ae9b4dd2a9b278 [0,0,0,0,0,0|3,0,0]=3 132 B11R0.191 CCOC(=O)C(OCC#N)SC cc78e7d9faba505026cfae3797d6e4ae [0,0,0,0,0,0|3,0,1]=4 133 B11R0.191 CCOC(=O)[C@@H](CC)NCC#N 3f19f056409696eed25d29157ac7fed1 [0,0,0,0,0,0|2,0,1]=3 134 B11R0.191 CCOC(=O)[C@@H](CC)NCC=O 3586d26221ce39d5f1b781b63581ea53 [0,0,0,0,0,0|2,0,1]=3 135 B11R0.191 CCOC(=O)[C@@H](CC)NCCF d70090edba97b9fe459076883e721411 [0,0,0,0,0,0|2,0,0]=2 136 B11R0.191 CCOC(=O)[C@@H](CC)NCCO 184f5e4d2b6ac5b8ec00ac8405e4f2e2 [0,0,0,0,0,0|2,0,0]=2 137 B11R0.191 CCOC(=O)[C@@H](CC)NCCS 55c46f128a5abdd2c036e07218a0b8c5 [0,0,0,0,0,0|2,0,0]=2 138 B11R0.191 CCOC(=O)[C@@H](CC)NCOC 3ac14d056bcd4ddfaf31567ff54b481f [0,0,0,0,0,0|2,0,0]=2 139 B11R0.191 CCOC(=O)[C@@H](CC)NCSC 81516c6f4640158e8ff27c3674069a36 [0,0,0,0,0,0|2,0,0]=2 140 B11R0.191 CCOC(=O)[C@@H](CC)OCC#N a4954fa7a193c92c6fecd73387f6c84b [0,0,0,0,0,0|2,0,1]=3 141 B11R0.191 CCOC(=O)[C@@H](CC)OCC=O 8c9df41b32268fcdcad8a5320cef8c7e [0,0,0,0,0,0|2,0,1]=3 142 B11R0.191 CCOC(=O)[C@@H](CC)OCCF 52099c21d57f387772f05551560ab545 [0,0,0,0,0,0|2,0,0]=2 143 B11R0.191 CCOC(=O)[C@@H](CC)OCCS 14065d712593a90a3120cf07c0164880 [0,0,0,0,0,0|2,0,0]=2 144 B11R0.191 CCOC(=O)[C@@H](CC)OCOC 70935379ba4c57de12ec8d5cbd2ff30d [0,0,0,0,0,0|2,0,0]=2 145 B11R0.191 CCOC(=O)[C@@H](CC)OCSC 4b8328e1aa3cde9cfd25599cd72f15e5 [0,0,0,0,0,0|2,0,0]=2 146 B11R0.191 CCOC(=O)[C@H](CC)NCC#N 7874146a90b7bfc68c0ea11d71586333 [0,0,0,0,0,0|2,0,1]=3 147 B11R0.191 CCOC(=O)[C@H](CC)NCC=O 23c36d04387615e5cdd9ee64f847981c [0,0,0,0,0,0|2,0,1]=3 148 B11R0.191 CCOC(=O)[C@H](CC)NCCF c977f36b94cc7431a4f35a451436edeb [0,0,0,0,0,0|2,0,0]=2 149 B11R0.191 CCOC(=O)[C@H](CC)NCCO e508080bb58327654e91222d316391ba [0,0,0,0,0,0|2,0,0]=2 150 B11R0.191 CCOC(=O)[C@H](CC)NCCS 8d31e3411b6a95f9dfe4b2a9f75784e6 [0,0,0,0,0,0|2,0,0]=2 151 B11R0.191 CCOC(=O)[C@H](CC)NCOC 49447f2685524021f6624bf1555a163f [0,0,0,0,0,0|2,0,0]=2 152 B11R0.191 CCOC(=O)[C@H](CC)NCSC 23995657db80fc71a38bb6efd91c84b2 [0,0,0,0,0,0|2,0,0]=2 153 B11R0.191 CCOC(=O)[C@H](CC)OCC#N d8ce05e6fd023cb1a324bb242250eb64 [0,0,0,0,0,0|2,0,1]=3 154 B11R0.191 CCOC(=O)[C@H](CC)OCC=O c8c57198d9941618b4c6ce0345c7d178 [0,0,0,0,0,0|2,0,1]=3 155 B11R0.191 CCOC(=O)[C@H](CC)OCCF 992056a8f0b8e494675a903dae25ddcf [0,0,0,0,0,0|2,0,0]=2 156 B11R0.191 CCOC(=O)[C@H](CC)OCCS 9f7be0a3af862bb5f16c338bce230671 [0,0,0,0,0,0|2,0,0]=2 157 B11R0.191 CCOC(=O)[C@H](CC)OCOC 201492aec20d1f130df0cfaaf8da10ca [0,0,0,0,0,0|2,0,0]=2 158 B11R0.191 CCOC(=O)[C@H](CC)OCSC 480b674ba06b0a45755394cb045db10b [0,0,0,0,0,0|2,0,0]=2 159 B10R0.16 CCC/C=C(\CC)/COCC a13df6dc40ecf590499376b9b6903afa [1,0,0,0,0,0|0,0,3]=4 160 B10R0.16 CCCCC(CC)CNCC 9b83e25af41fab978c961cf7313c68d0 [1,0,0,0,0,0|1,0,1]=3 161 B10R0.16 CCCCC(CC)CNCF 1d0773ac96601437e7ce06fa1b10e49b [1,0,0,0,0,0|2,0,1]=4 162 B10R0.16 CCCCC(CC)CNCO 2aae82c6a95e2be8588e5a4d076421f6 [1,0,0,0,0,0|2,0,1]=4 163 B10R0.16 CCCCC(CC)COCC 96439b8b6850b3b4c3007d1875ff17ae [1,0,0,0,0,0|0,0,1]=2 164 B10R0.16 CCCCC(CC)COCF a3a2e2eeebf067bdb554fce7e1ee4b54 [1,0,0,0,0,0|1,0,1]=3 165 B10R0.16 CCCCC(CC)NCCBr 460e0dfd2744df6410cfe268a45a9de4 [1,0,0,0,0,0|3,0,0]=4 166 B10R0.16 CCCCC(CC)NCCC 6df0184b58d8ff0cf7c23e048f6e6c5b [1,0,0,0,0,0|2,0,0]=3 167 B10R0.16 CCCCC(CC)NCCF 1400e8567e659dbb11c66c3a290b6a43 [1,0,0,0,0,0|3,0,0]=4 168 B10R0.16 CCCCC(CC)NCCI 49e28482cf022c135c6e59b1f9f9d66e [1,0,0,0,0,0|3,0,0]=4 169 B10R0.16 CCCCC(CC)NCCO 99872fcd3e2bb3321886f36cfc93acc5 [1,0,0,0,0,0|3,0,0]=4 170 B10R0.16 CCCCC(CC)NCCS 0bfcfdc74ef029cf7b8709409898a9e6 [1,0,0,0,0,0|3,0,0]=4 171 B10R0.16 CCCCC(CC)OCCC b3bc95738f3642c32c67c66055eecfb0 [1,0,0,0,0,0|2,0,0]=3 172 B10R0.16 CCCCC(CC)OCCF d20511100fdf46342d0fc99a9f0b5e29 [1,0,0,0,0,0|3,0,0]=4 173 B10R0.16 CCCCC(CC)OCCS 9e5175a52c15e041db3d646905eb2614 [1,0,0,0,0,0|3,0,0]=4 174 B10R0.16 CCCCC(CC)OCOC 9d2490084f1dfe004f13f67729e00da3 [1,0,0,0,0,0|3,0,0]=4 175 B10R0.16 CCCCC(CC)OCSC 884cdb0c6e7c841e592ec031c49d486f [1,0,0,0,0,0|3,0,0]=4 176 B10R0.16 CCCCC(CO)NCCC 59482fecbc3b570bdc20386e2c0094be [1,0,0,0,0,0|3,0,0]=4 177 B10R0.16 CCCCN(CC)CCCC a3217b82a22da247a2ef1470c6c04f0f [1,0,0,0,0,0|2,0,1]=4 178 B10R0.16 CCCCN(CC)COCC 0899e205cb57606abea58fc0aabb3f54 [1,0,0,0,0,0|1,0,1]=3 179 B10R0.16 CCCC[C@@H](CO)NCCC 88b3aa2fda5f7bf9cc1d583d0aa28008 [1,0,0,0,0,0|3,0,0]=4 180 B10R0.16 CCCC[C@H](CO)NCCC ad79992f471eac3c7cd581c59ab587ca [1,0,0,0,0,0|3,0,0]=4 181 B10R0.16 CCOCN(CC)CCCO d803cefa6b9fe231cad3dc308c75c59e [1,0,0,0,0,0|2,0,1]=4 182 B10R0.16 CCOCN(CC)CCOC 00ea24eeeebc40c9892ba626084ce641 [1,0,0,0,0,0|2,0,1]=4 183 B10R0.19 C#CCNC(C)C(=O)OCC 322d7c402c6044a6c37074f36ea88aef [1,0,0,0,0,0|1,0,2]=4 184 B10R0.19 C#CCN[C@@H](C)C(=O)OCC c01750f25da494708f95baa67be27a4a [1,0,0,0,0,0|1,0,2]=4 185 B10R0.19 C#CCN[C@H](C)C(=O)OCC 4ffc4f5bf0372aff5d5c74f14ecee621 [1,0,0,0,0,0|1,0,2]=4 186 B10R0.19 C#CCOC(C)C(=O)OCC 3b6f728efbeef788f9bd15854fae5528 [1,0,0,0,0,0|1,0,2]=4 187 B10R0.19 C#CCO[C@@H](C)C(=O)OCC 4ce557918f5fead9dd83fd618b31b3c7 [1,0,0,0,0,0|1,0,2]=4 188 B10R0.19 C#CCO[C@H](C)C(=O)OCC 78ce25ce7ab9775f257f7eea412675d0 [1,0,0,0,0,0|1,0,2]=4 189 B10R0.19 C/C=C/C(=O)N(C)CCCC ccd333c0bed68afe374d5dbe797c5355 [1,0,0,0,0,0|2,0,1]=4 190 B10R0.19 C=C(COCC)C(=O)OCC 6f10787a53e9e179e98980ece827ebe3 [1,0,0,0,0,0|1,0,2]=4 191 B10R0.19 C=CCN[C@H](C)C(=O)OCC c3145892d655f1de286cfda93ef70f3c [1,0,0,0,0,0|1,0,2]=4 192 B10R0.19 C=CCOC(C)C(=O)OCC d3309bd84208dc7a3de1b49a2f3dfab4 [1,0,0,0,0,0|1,0,2]=4 193 B10R0.19 C=CCO[C@@H](C)C(=O)OCC 9768f7f1feddcab988d38d38c364b59e [1,0,0,0,0,0|1,0,2]=4 194 B10R0.19 C=CCO[C@H](C)C(=O)OCC 0db01816629daaa0570330a3dd8e22d8 [1,0,0,0,0,0|1,0,2]=4 195 B10R0.19 CC#CC(=O)N(C)CCCC 6efeb6b2550165fdee17d9a1749ae6ea [1,0,0,0,0,0|2,0,1]=4 196 B10R0.19 CCCC(=O)N(C)CCCO aa526b2cb34561ea37f14fc606f15b54 [1,0,0,0,0,0|3,0,0]=4 197 B10R0.19 CCCC(=O)N(C)CCOC 5fee7231bfc5953066c981c54b1ddc91 [1,0,0,0,0,0|3,0,0]=4 198 B10R0.19 CCCC(=O)N(C)CCSC 61727274333cc9fb15271abbb1d84beb [1,0,0,0,0,0|3,0,0]=4 199 B10R0.19 CCCCC(C)N(C)CCC 3dd555de828073303328b989478847b5 [1,0,0,0,0,0|3,0,0]=4 200 B10R0.19 CCCCN(C)C(=O)CCC 2b7b784470b8b7ff831c528c223e6a34 [1,0,0,0,0,0|2,0,0]=3 201 B10R0.19 CCCCN(C)C(=O)CCF 391e477ab1fb6a69251f8957ca28e495 [1,0,0,0,0,0|3,0,0]=4 202 B10R0.19 CCCCN(C)C(=O)CCO 38d92cdad79d05905c316479ef7e8763 [1,0,0,0,0,0|3,0,0]=4 203 B10R0.19 CCCCN(C)C(=O)CCS afb13be8e05a3692f482a3be73f1fe23 [1,0,0,0,0,0|3,0,0]=4 204 B10R0.19 CCCCN(C)C(=O)COC 2577def73493edeac0c4ed538d627414 [1,0,0,0,0,0|3,0,0]=4 205 B10R0.19 CCCCN(C)C(=O)CSC 68573d7f429ecb339090cdbe2bbbc786 [1,0,0,0,0,0|3,0,0]=4 206 B10R0.19 CCCNC(=O)C(=O)OCC 126270ea1ba4e767f191773567423bc3 [1,0,0,0,0,0|2,0,1]=4 207 B10R0.19 CCCNC(C)C(=O)NCC 4d8a751697c0aafd9a4a6523aa2d78a0 [1,0,0,0,0,0|2,0,0]=3 208 B10R0.19 CCCNC(C)C(=O)OCC a5bc76108a07c2d666e42f51eaeeddad [1,0,0,0,0,0|1,0,0]=2 209 B10R0.19 CCCNC(F)C(=O)OCC 5b25cec6bdd3ca76df5dbdfb7f6f2cee [1,0,0,0,0,0|2,0,0]=3 210 B10R0.19 CCCN[C@@H](C)C(=O)NCC a00c96ce6051441db2313a4ef1a99527 [1,0,0,0,0,0|2,0,0]=3 211 B10R0.19 CCCN[C@@H](C)C(=O)OCC 8307fc251a428f5e5cd7764df108d7f4 [1,0,0,0,0,0|1,0,0]=2 212 B10R0.19 CCCN[C@H](C)C(=O)OCC e3baecfd69e367b3a0331595e9b279fc [1,0,0,0,0,0|1,0,0]=2 213 B10R0.19 CCCOC(C)C(=O)NCC 663a3ae454ef80b37fef1892bf90e0da [1,0,0,0,0,0|2,0,0]=3 214 B10R0.19 CCCOC(C)C(=O)OCC ab8ff289244dec834ca22da0f5d8b6d4 [1,0,0,0,0,0|1,0,0]=2 215 B10R0.19 CCCOC(F)C(=O)OCC a0370e8810575cf9bdcdb7d5afcd7c6f [1,0,0,0,0,0|2,0,0]=3 216 B10R0.19 CCCO[C@@H](C)C(=O)OCC d090f23ed408baa128a37269f58d1c53 [1,0,0,0,0,0|1,0,0]=2 217 B10R0.19 CCCO[C@H](C)C(=O)OCC dcab65047931043055d0bc5167530869 [1,0,0,0,0,0|1,0,0]=2 218 B10R0.19 CCNC(=O)C(C)NCCBr b1697a732ba4145998ed19e01b569f7a [1,0,0,0,0,0|3,0,0]=4 219 B10R0.19 CCNC(=O)C(C)NCCF b3da6efcfaad3ebb1fd14c3ff50c2a22 [1,0,0,0,0,0|3,0,0]=4 220 B10R0.19 CCNC(=O)C(C)NCCI d8bb32041f1bfb4efc14f4394129ea74 [1,0,0,0,0,0|3,0,0]=4 221 B10R0.19 CCNC(=O)C(C)NCCO 5db6ec71272c69b798d6506ac5f10a10 [1,0,0,0,0,0|3,0,0]=4 222 B10R0.19 CCNC(=O)C(C)NCCS 54a90f2949c1114eb95aac372663a043 [1,0,0,0,0,0|3,0,0]=4 223 B10R0.19 CCNC(=O)C(C)OCCF 1ae2480e25992c330124a9785da3e9ad [1,0,0,0,0,0|3,0,0]=4 224 B10R0.19 CCNC(=O)C(C)OCCS bed8f45fbd0ecbf0d0d67fa92b81b18d [1,0,0,0,0,0|3,0,0]=4 225 B10R0.19 CCNC(=O)C(C)OCOC 17aff2bf08c198cb4ff8d8c2aede6997 [1,0,0,0,0,0|3,0,0]=4 226 B10R0.19 CCNC(=O)[C@H](C)NCCF 54ade2c7f3e006d8deb9cccf3be62589 [1,0,0,0,0,0|3,0,0]=4 227 B10R0.19 CCNC(=O)[C@H](C)NCCO f8485129771c5a355f1ad0560da47d5b [1,0,0,0,0,0|3,0,0]=4 228 B10R0.19 CCNC(=O)[C@H](C)NCCS 5a0161fe5368a431c1e5717e181a6bd3 [1,0,0,0,0,0|3,0,0]=4 229 B10R0.19 CCNC(=O)[C@H](C)NCOC 4de34bccfba3445b243e17972b4d8161 [1,0,0,0,0,0|3,0,0]=4 230 B10R0.19 CCNC(=O)[C@H](C)NCSC 6bc53ef00ae8061db9ad69bef44b8bfb [1,0,0,0,0,0|3,0,0]=4 231 B10R0.19 CCNCC(C)C(=O)OCC bed894143b65f72480fec39bc03493cb [1,0,0,0,0,0|1,0,0]=2 232 B10R0.19 CCOC(=O)C(C)CNC=O bed2fd71dc9bb7980ae2f217b27b0fdb [1,0,0,0,0,0|2,0,1]=4 233 B10R0.19 CCOC(=O)C(C)CNCF 65b75c44499b15f5420832089f2adf0e [1,0,0,0,0,0|2,0,0]=3 234 B10R0.19 CCOC(=O)C(C)CNCO 1f1750a2c4f819bc91715968f9192e85 [1,0,0,0,0,0|2,0,0]=3 235 B10R0.19 CCOC(=O)C(C)COCF c5820983f330cf6b193a3557b26a6ebb [1,0,0,0,0,0|2,0,0]=3 236 B10R0.19 CCOC(=O)C(C)NCC#N 625b4eff48b7e171da2a9a45b77394a5 [1,0,0,0,0,0|2,0,1]=4 237 B10R0.19 CCOC(=O)C(C)NCCBr 0cb64ee6d40c775f652c0f1ed4d70014 [1,0,0,0,0,0|2,0,0]=3 238 B10R0.19 CCOC(=O)C(C)NCCF 3e674721f9ca0de01d6018656ac1e53f [1,0,0,0,0,0|2,0,0]=3 239 B10R0.19 CCOC(=O)C(C)NCCI 55e62beeb294e545a76ab3053ddfb073 [1,0,0,0,0,0|2,0,0]=3 240 B10R0.19 CCOC(=O)C(C)NCCO 98c9648ddf7fb40bfeef5c796786de98 [1,0,0,0,0,0|2,0,0]=3 241 B10R0.19 CCOC(=O)C(C)NCCS 65da2a38f995f40d39f707e54203408c [1,0,0,0,0,0|2,0,0]=3 242 B10R0.19 CCOC(=O)C(C)OCC#N 28979f855b1255ab0292b6d12d1cff0d [1,0,0,0,0,0|2,0,1]=4 243 B10R0.19 CCOC(=O)C(C)OCC=O cf6cab0c3795d7f7ec6eed23be2e7e3d [1,0,0,0,0,0|2,0,1]=4 244 B10R0.19 CCOC(=O)C(C)OCCF 8d33ec125dcfde79d3c39b701ed510aa [1,0,0,0,0,0|2,0,0]=3 245 B10R0.19 CCOC(=O)C(C)OCCS 678639ffc4291db2dbdeb8e121892a25 [1,0,0,0,0,0|2,0,0]=3 246 B10R0.19 CCOC(=O)C(C)OCOC 45b535ba590e906f0e2f4a938e1f9641 [1,0,0,0,0,0|2,0,0]=3 247 B10R0.19 CCOC(=O)C(C)OCSC cd91fd18a612d8c5c10fbf2ba48318b3 [1,0,0,0,0,0|2,0,0]=3 248 B10R0.19 CCOC(=O)C(F)NCCBr c502d56bb21a329e75a4cf87fe854b1b [1,0,0,0,0,0|3,0,0]=4 249 B10R0.19 CCOC(=O)C(F)NCCF 0ef17089aa08c9f3a130311a7db0ac82 [1,0,0,0,0,0|3,0,0]=4 250 B10R0.19 CCOC(=O)C(F)NCCI 3d310d605a07f3fa002a80d4a6c3e3a2 [1,0,0,0,0,0|3,0,0]=4 251 B10R0.19 CCOC(=O)C(F)NCCO 12d98e39721837c854962eaf22066fee [1,0,0,0,0,0|3,0,0]=4 252 B10R0.19 CCOC(=O)C(F)NCCS 3e6a3c7139ac9811230674e453a045de [1,0,0,0,0,0|3,0,0]=4 253 B10R0.19 CCOC(=O)C(F)OCCF cdfc8b1ed6e9271c3833a5df53b2d241 [1,0,0,0,0,0|3,0,0]=4 254 B10R0.19 CCOC(=O)C(F)OCCS dd9db70d453889e0010adfa217c779c9 [1,0,0,0,0,0|3,0,0]=4 255 B10R0.19 CCOC(=O)C(F)OCOC 661b3a15b4790ac19fe7144a75f3c85b [1,0,0,0,0,0|3,0,0]=4 256 B10R0.19 CCOC(=O)[C@@H](C)NCC#N 53e73c0b33544674919ff2fdb17314c0 [1,0,0,0,0,0|2,0,1]=4 257 B10R0.19 CCOC(=O)[C@@H](C)NCC=O 547b522acc4f4cdc45373508f073a278 [1,0,0,0,0,0|2,0,1]=4 258 B10R0.19 CCOC(=O)[C@@H](C)NCCBr a4736d092bcbb74d11f55219d2897228 [1,0,0,0,0,0|2,0,0]=3 259 B10R0.19 CCOC(=O)[C@@H](C)NCCF 74cfd0f122c169ccf9b6b621f20b549a [1,0,0,0,0,0|2,0,0]=3 260 B10R0.19 CCOC(=O)[C@@H](C)NCCI 18aa06b3a7d7be0ac9906415cc40b82b [1,0,0,0,0,0|2,0,0]=3 261 B10R0.19 CCOC(=O)[C@@H](C)NCCO 08be691523ceeab57d04dc6f7a075a2d [1,0,0,0,0,0|2,0,0]=3 262 B10R0.19 CCOC(=O)[C@@H](C)NCCS ae4d5e48f6e61befa3bb39020df1cd80 [1,0,0,0,0,0|2,0,0]=3 263 B10R0.19 CCOC(=O)[C@@H](C)NCOC eafdb504bf06787408e52bffc60497c2 [1,0,0,0,0,0|2,0,0]=3 264 B10R0.19 CCOC(=O)[C@@H](C)NCSC dbc28556b9a8bc59336f0af509aa4836 [1,0,0,0,0,0|2,0,0]=3 265 B10R0.19 CCOC(=O)[C@@H](C)OCC#N 873455e77439e2c622c41a11a66a36ad [1,0,0,0,0,0|2,0,1]=4 266 B10R0.19 CCOC(=O)[C@@H](C)OCC=O 13ac69e6277e243c82e2b43a48383520 [1,0,0,0,0,0|2,0,1]=4 267 B10R0.19 CCOC(=O)[C@@H](C)OCCF 2b98e3a0780235a1ab49d0fbd769cbb9 [1,0,0,0,0,0|2,0,0]=3 268 B10R0.19 CCOC(=O)[C@@H](C)OCCS 54ec4dd0d44697b6d0f71910611b4787 [1,0,0,0,0,0|2,0,0]=3 269 B10R0.19 CCOC(=O)[C@@H](C)OCOC 6d10ddf4d83787d87e4c56e629f34599 [1,0,0,0,0,0|2,0,0]=3 270 B10R0.19 CCOC(=O)[C@@H](C)OCSC b356af9367a0d09fe45fe2ecf2a2739c [1,0,0,0,0,0|2,0,0]=3 271 B10R0.19 CCOC(=O)[C@H](C)NCC#N a9dc4a0e03d3a54af69bdb9af69ea84f [1,0,0,0,0,0|2,0,1]=4 272 B10R0.19 CCOC(=O)[C@H](C)NCCBr 9f347487137125f70c0bb9513dfc54a5 [1,0,0,0,0,0|2,0,0]=3 273 B10R0.19 CCOC(=O)[C@H](C)NCCF 3d30530e1f846694e4b0c842723df9a7 [1,0,0,0,0,0|2,0,0]=3 274 B10R0.19 CCOC(=O)[C@H](C)NCCI 776bdf0f095d7a7840333d374bd2156b [1,0,0,0,0,0|2,0,0]=3 275 B10R0.19 CCOC(=O)[C@H](C)NCCO f7b2e715928240e2797f31972a8afb06 [1,0,0,0,0,0|2,0,0]=3 276 B10R0.19 CCOC(=O)[C@H](C)NCCS 71303de23b18ac2977d5420a4e8bc5d2 [1,0,0,0,0,0|2,0,0]=3 277 B10R0.19 CCOC(=O)[C@H](C)OCC#N 0bee0d2833822b1bacba437e3c5ed99b [1,0,0,0,0,0|2,0,1]=4 278 B10R0.19 CCOC(=O)[C@H](C)OCC=O ef3bf9b52e9524b1d7e12e7dcb4dfc50 [1,0,0,0,0,0|2,0,1]=4 279 B10R0.19 CCOC(=O)[C@H](C)OCCF 8b3dd1eaac08d97cfee9ac1b8cad2069 [1,0,0,0,0,0|2,0,0]=3 280 B10R0.19 CCOC(=O)[C@H](C)OCCS a2fb7a9524546fdcaa3c8036beec55ee [1,0,0,0,0,0|2,0,0]=3 281 B10R0.19 CCOC(=O)[C@H](C)OCOC fa68e3132ada730f1da09bc5267e2344 [1,0,0,0,0,0|2,0,0]=3 282 B10R0.19 CCOC(=O)[C@H](C)OCSC 83fc4e59b76985b825fcf4c9a31c6b4b [1,0,0,0,0,0|2,0,0]=3 283 B10R0.19 CCOCC(C)C(=O)OCC 0f2424f972bf92769c6abc269b3fc887 [1,0,0,0,0,0|1,0,0]=2 284 B10R0.33 C#CC(OCC)C(=O)OCC bec8a880b6ab065c2100bd73c5184b84 [1,0,0,0,0,0|1,0,2]=4 285 B10R0.33 C/C=C/C(=O)N(CC)CCC b5e5872235c84cb4539324c449ae9c1d [1,0,0,0,0,0|2,0,1]=4 286 B10R0.33 CC#CC(=O)N(CC)CCC 5b8c060a82ce5634c0b2a13ae956c6cb [1,0,0,0,0,0|2,0,1]=4 287 B10R0.33 CCCC(=O)N(CC)CCC ea7521b80eb3bd14abb9ad7f2965575d [1,0,0,0,0,0|2,0,0]=3 288 B10R0.33 CCCC(=O)N(CC)CCCl 83804b601d5f3e64948f9212ca3c8eac [1,0,0,0,0,0|3,0,0]=4 289 B10R0.33 CCCC(=O)N(CC)CCO fe6605a97d013d25745341ad1fa2dabc [1,0,0,0,0,0|3,0,0]=4 290 B10R0.33 CCCC(CC)N(C)CCC d62c5d29ba2f1efed4917004f5599428 [1,0,0,0,0,0|3,0,0]=4 291 B10R0.33 CCCN(CC)C(=O)CCF ced02ee12df1f0901dda230f8fa7f324 [1,0,0,0,0,0|3,0,0]=4 292 B10R0.33 CCCN(CC)C(=O)CCO 5de95b18b52afc7d2ad4df6f0d8b4af3 [1,0,0,0,0,0|3,0,0]=4 293 B10R0.33 CCCN(CC)C(=O)CCS 78695ff9eb44072d356bad5d73a40cf2 [1,0,0,0,0,0|3,0,0]=4 294 B10R0.33 CCCN(CC)C(=O)COC 4dff7cf21d988388cfbabd86b12f5823 [1,0,0,0,0,0|3,0,0]=4 295 B10R0.33 CCCN(CC)C(=O)CSC 8cbc26ef8054ceb2a2b4fd548cccf095 [1,0,0,0,0,0|3,0,0]=4 296 B10R0.33 CCNC(=O)C(CC)NCC fce887c87af909596eb23d74e74a91dd [1,0,0,0,0,0|2,0,0]=3 297 B10R0.33 CCNC(=O)C(CC)NCF bca81ffa850286f378fc3d725af31d05 [1,0,0,0,0,0|3,0,0]=4 298 B10R0.33 CCNC(=O)C(CC)NCO 61658cad68823714e8066d9a8e7b34a2 [1,0,0,0,0,0|3,0,0]=4 299 B10R0.33 CCNC(C#N)C(=O)OCC cf0d7cc240273b038b2ad9ab8395f52e [1,0,0,0,0,0|2,0,1]=4 300 B10R0.33 CCNC(CC)C(=O)OCC 912b0a3b7f7085814fcbf07ecbe82bcb [1,0,0,0,0,0|1,0,0]=2 301 B10R0.33 CCN[C@@H](CC)C(=O)OCC 4d5f4f390cffc8529d0d5ec24131af9f [1,0,0,0,0,0|1,0,0]=2 302 B10R0.33 CCN[C@H](CC)C(=O)OCC e36e79370d0388891ea824c68d47a43a [1,0,0,0,0,0|1,0,0]=2 303 B10R0.33 CCOC(=O)C(CC)NC#N 8936b2ae0e9c1a130464628aba3d3e9e [1,0,0,0,0,0|2,0,1]=4 304 B10R0.33 CCOC(=O)C(CC)NC=O 3e320f6251f4be0eb4c6f6859787a496 [1,0,0,0,0,0|2,0,1]=4 305 B10R0.33 CCOC(=O)C(CC)NCF 9a844364887fa198c56c9ce969d162fc [1,0,0,0,0,0|2,0,0]=3 306 B10R0.33 CCOC(=O)C(CC)NCO b84609196fa4626eeddec727a74b1852 [1,0,0,0,0,0|2,0,0]=3 307 B10R0.33 CCOC(=O)C(CC)OCC 3f4ab08b23daccfdcf6616c377ab4842 [1,0,0,0,0,0|1,0,0]=2 308 B10R0.33 CCOC(=O)C(CC)OCF ca798229d6d23a90f5dd0dae7cdc04e2 [1,0,0,0,0,0|2,0,0]=3 309 B10R0.33 CCOC(=O)[C@@H](CC)NC=O 2f8d29905e1e4933a5ff3525e976dc8a [1,0,0,0,0,0|2,0,1]=4 310 B10R0.33 CCOC(=O)[C@@H](CC)NCF a0a33849063603dc24c877828e4a6b01 [1,0,0,0,0,0|2,0,0]=3 311 B10R0.33 CCOC(=O)[C@@H](CC)NCO c218448badedfcdbd5789b615be04029 [1,0,0,0,0,0|2,0,0]=3 312 B10R0.33 CCOC(=O)[C@@H](CC)OCC 03ba06697cdf9e9aecbdc0c8ae9ff7dc [1,0,0,0,0,0|1,0,0]=2 313 B10R0.33 CCOC(=O)[C@@H](CC)OCF 9f9b679190b4f8b95b547086f8b2f04b [1,0,0,0,0,0|2,0,0]=3 314 B10R0.33 CCOC(=O)[C@H](CC)NC=O 4df37a536ec64b7b6d4a93c9c45eebcc [1,0,0,0,0,0|2,0,1]=4 315 B10R0.33 CCOC(=O)[C@H](CC)NCF 40cbb822675a29fd372864bbce57a32e [1,0,0,0,0,0|2,0,0]=3 316 B10R0.33 CCOC(=O)[C@H](CC)NCO 03ac7548124ef0f46dcb7e04d1098506 [1,0,0,0,0,0|2,0,0]=3 317 B10R0.33 CCOC(=O)[C@H](CC)OCC f0fef9817bee36b583fcef28d9ddd436 [1,0,0,0,0,0|1,0,0]=2 318 B10R0.33 CCOC(=O)[C@H](CC)OCF 2643d9525dbcc2754554a4a4919a824f [1,0,0,0,0,0|2,0,0]=3 319 B10R0.85 C#CC(=O)N(CC)CCCC cced24b5695688e9ece2cfd90388ae0e [1,0,0,0,0,0|1,0,2]=4 320 B10R0.85 C#CCNC(CC)C(=O)OC b1a6496da74b3bda7d1cc487d091f456 [1,0,0,0,0,0|1,0,2]=4 321 B10R0.85 C#CCN[C@@H](CC)C(=O)OC 0295229a4ea029a3582cc61744e30409 [1,0,0,0,0,0|1,0,2]=4 322 B10R0.85 C#CCN[C@H](CC)C(=O)OC 04c5f5bf6558d252480cd2c6a8b695c6 [1,0,0,0,0,0|1,0,2]=4 323 B10R0.85 C#CCOC(CC)C(=O)CC fa3cec99068d326d9b72b9b00cd0e1f9 [1,0,0,0,0,0|1,0,2]=4 324 B10R0.85 C#CCOC(CC)C(=O)OC 5ba98eb533056047029090f9428833a4 [1,0,0,0,0,0|1,0,2]=4 325 B10R0.85 C#CCO[C@@H](CC)C(=O)OC fa6a330f58fb1fd868f99d31e77a3b5a [1,0,0,0,0,0|1,0,2]=4 326 B10R0.85 C#CCO[C@H](CC)C(=O)OC e3abe4e526ca4e20b154b9691ff6fe08 [1,0,0,0,0,0|1,0,2]=4 327 B10R0.85 C=CC(=O)N(CC)CCCC 4ea2e0b0f4ca9eaf64537528ee514d35 [1,0,0,0,0,0|1,0,2]=4 328 B10R0.85 C=CC(OCCC)C(=O)OC b0d0c8e0593cbeddd3bf4958f762c8e9 [1,0,0,0,0,0|1,0,2]=4 329 B10R0.85 C=CCN[C@@H](CC)C(=O)OC 8d9d781421fd30ae8ede62b046a4e076 [1,0,0,0,0,0|1,0,2]=4 330 B10R0.85 C=CCN[C@H](CC)C(=O)OC be07d5f28ded9ba7cd6787772f5096e2 [1,0,0,0,0,0|1,0,2]=4 331 B10R0.85 C=CCOC(CC)C(=O)CC d1b736c772fba55fe5eaa3649798b8fd [1,0,0,0,0,0|1,0,2]=4 332 B10R0.85 C=CCOC(CC)C(=O)OC 31249244ad9b0c2928b7ff71f48a41df [1,0,0,0,0,0|1,0,2]=4 333 B10R0.85 C=CCO[C@@H](CC)C(=O)OC 4a4b2a2ae0fd158c122f0331a803fffd [1,0,0,0,0,0|1,0,2]=4 334 B10R0.85 C=CCO[C@H](CC)C(=O)OC 0c130ab35a5665c6e8337992ea798c3f [1,0,0,0,0,0|1,0,2]=4 335 B10R0.85 CCC(=O)C(CC)OCC#N a48e1174e48e6a6bebc88b2257a858ce [1,0,0,0,0,0|2,0,1]=4 336 B10R0.85 CCC(=O)C(CC)OCC=O 4e48fc0ee1b632f625cc3eb66a354d82 [1,0,0,0,0,0|2,0,1]=4 337 B10R0.85 CCC(=O)C(CC)OCCF 75b74e8ce00a46ac74c9c639c36e78c9 [1,0,0,0,0,0|2,0,0]=3 338 B10R0.85 CCC(=O)C(CC)OCCS e0423a54436b64363414ec3687e31104 [1,0,0,0,0,0|2,0,0]=3 339 B10R0.85 CCC(=O)C(CC)OCOC 40b5b336e2dd9e28340ddc46c2fa8974 [1,0,0,0,0,0|2,0,0]=3 340 B10R0.85 CCC(=O)C(CC)OCSC 537b0889dd9728c90e8831be93294461 [1,0,0,0,0,0|2,0,0]=3 341 B10R0.85 CCC(=O)N(CC)CCC#N 0925416bff6daa3d5b43c26fc9550ad4 [1,0,0,0,0,0|2,0,1]=4 342 B10R0.85 CCC(=O)N(CC)CCCO 97bdb96bb1b5f79cbd43881d8eb5b355 [1,0,0,0,0,0|2,0,0]=3 343 B10R0.85 CCC(=O)N(CC)CCOC 0c2ebe33be17a90035518bd0eaa037b0 [1,0,0,0,0,0|2,0,0]=3 344 B10R0.85 CCC(COCF)C(=O)OC 0a5ea1dc4d5ee0669612d9971011bdb2 [1,0,0,0,0,0|2,0,0]=3 345 B10R0.85 CCC(NCC#N)C(=O)OC 1f3444652895d698ae1e0feb3601b826 [1,0,0,0,0,0|2,0,1]=4 346 B10R0.85 CCC(NCCBr)C(=O)OC ccbae49e8d460a8fa4b37e34732b8520 [1,0,0,0,0,0|2,0,0]=3 347 B10R0.85 CCC(NCCF)C(=O)NC 863d26ce2c7d386b96b208ff4eb69421 [1,0,0,0,0,0|3,0,0]=4 348 B10R0.85 CCC(NCCF)C(=O)OC d98e31f01d1780a7972d848b87de994e [1,0,0,0,0,0|2,0,0]=3 349 B10R0.85 CCC(NCCI)C(=O)OC c2da8414a9f095e834dbd814d6824748 [1,0,0,0,0,0|2,0,0]=3 350 B10R0.85 CCC(NCCO)C(=O)NC 990da4db7715d697a4f5e256cf5a897e [1,0,0,0,0,0|3,0,0]=4 351 B10R0.85 CCC(NCCO)C(=O)OC 21c9aef4b02f5b1337d83c587eb03bc7 [1,0,0,0,0,0|2,0,0]=3 352 B10R0.85 CCC(NCCS)C(=O)NC 72ab3cd4bfdc1d20ef6d97da41cff445 [1,0,0,0,0,0|3,0,0]=4 353 B10R0.85 CCC(NCCS)C(=O)OC 78fa3b29b263d086b0aeae00fbcfe058 [1,0,0,0,0,0|2,0,0]=3 354 B10R0.85 CCC(NCOC)C(=O)NC 0d5392ee254bc5da321a40936631f87d [1,0,0,0,0,0|3,0,0]=4 355 B10R0.85 CCC(NCSC)C(=O)NC a9f17b8bb863794714d257c06cd3fe2c [1,0,0,0,0,0|3,0,0]=4 356 B10R0.85 CCC(OCC#N)C(=O)OC 229855c64bcd53ef4bd9272bbfbbd77e [1,0,0,0,0,0|2,0,1]=4 357 B10R0.85 CCC(OCC=O)C(=O)OC 914f8124d4bbc100529bfa14afe433ea [1,0,0,0,0,0|2,0,1]=4 358 B10R0.85 CCC(OCCF)C(=O)OC e3d7d9118967873947398758ab321989 [1,0,0,0,0,0|2,0,0]=3 359 B10R0.85 CCC(OCCS)C(=O)OC 02d9521ee03d91986db3ad680a7ddf24 [1,0,0,0,0,0|2,0,0]=3 360 B10R0.85 CCC(OCOC)C(=O)OC 11922f6f7a44fb599773f62d3c8e200f [1,0,0,0,0,0|2,0,0]=3 361 B10R0.85 CCC(OCSC)C(=O)OC 2d9b93e93162563f98303c78a32753f4 [1,0,0,0,0,0|2,0,0]=3 362 B10R0.85 CCCCC(CC)N(C)CC 4ef21946c7a1550ccea38db963a328df [1,0,0,0,0,0|2,0,0]=3 363 B10R0.85 CCCCC(CO)N(C)CC df29c854ee829cec70b3805893cdd49f [1,0,0,0,0,0|3,0,0]=4 364 B10R0.85 CCCCN(CC)C(=O)C=O 67bb28f9f8b1abd8592cfb48435c82e2 [1,0,0,0,0,0|2,0,1]=4 365 B10R0.85 CCCCN(CC)C(=O)CC 5d38b3c23aabe3c68049c8de2efbbedd [1,0,0,0,0,0|1,0,0]=2 366 B10R0.85 CCCCN(CC)C(=O)CF 7b11bf04f80d439ba0c2e4f0c8c03476 [1,0,0,0,0,0|2,0,0]=3 367 B10R0.85 CCCCN(CC)C(=O)CO c2dd0f94260c1736e017b78b5f3791f1 [1,0,0,0,0,0|2,0,0]=3 368 B10R0.85 CCCCN(CC)C(=O)CS 56e58ad442d96d52ea1c064f4803066c [1,0,0,0,0,0|2,0,0]=3 369 B10R0.85 CCCCN(CC)C(C)CC efcbf4b21d6703bca9d1a2f24dbf1761 [1,0,0,0,0,0|2,0,1]=4 370 B10R0.85 CCCNC(C#N)C(=O)OC f098e7721c4ea748decf9d9929986590 [1,0,0,0,0,0|2,0,1]=4 371 B10R0.85 CCCNC(C=O)C(=O)OC 027c378da87dd489070cc1931680c132 [1,0,0,0,0,0|2,0,1]=4 372 B10R0.85 CCCNC(CC)C(=O)NC 06f314566b9db920d787f01b46bda3d3 [1,0,0,0,0,0|2,0,0]=3 373 B10R0.85 CCCNC(CC)C(=O)NO 9e4e6a0e75b5e7a95c7f03d5f8e6dedd [1,0,0,0,0,0|3,0,0]=4 374 B10R0.85 CCCNC(CC)C(=O)OC 7c9391c2b011d1a844e878d37c53c8de [1,0,0,0,0,0|1,0,0]=2 375 B10R0.85 CCCNC(CC)C(O)CC 340361b5bdca30d324167b8b12a0fb3d [1,0,0,0,0,0|1,0,2]=4 376 B10R0.85 CCCNC(CO)C(=O)NC ab730c803edc4f1f1daf431e02476d69 [1,0,0,0,0,0|3,0,0]=4 377 B10R0.85 CCCNC(CO)C(=O)OC f31ff5f420e577c0872428c37d9181ed [1,0,0,0,0,0|2,0,0]=3 378 B10R0.85 CCCN[C@@H](CC)C(=O)OC 29b664aeaadc6d33629ac508d9be8d7d [1,0,0,0,0,0|1,0,0]=2 379 B10R0.85 CCCN[C@@H](CO)C(=O)OC 0ffb70c2e6c686706c76432a297374df [1,0,0,0,0,0|2,0,0]=3 380 B10R0.85 CCCN[C@@H](CS)C(=O)OC 609af816ff0e9a304129135b2d2b1764 [1,0,0,0,0,0|2,0,0]=3 381 B10R0.85 CCCN[C@H](CC)C(=O)OC 600d8876107e26e24a8ac0e19aae5d96 [1,0,0,0,0,0|1,0,0]=2 382 B10R0.85 CCCN[C@H](CO)C(=O)OC aced99f221f55359db091a5602fb3826 [1,0,0,0,0,0|2,0,0]=3 383 B10R0.85 CCCOC(C#N)C(=O)OC 0974711d1da1c7da58c258dc8a8a081e [1,0,0,0,0,0|2,0,1]=4 384 B10R0.85 CCCOC(C=O)C(=O)OC d9cbb49db090579835488a95b63e5c80 [1,0,0,0,0,0|2,0,1]=4 385 B10R0.85 CCCOC(CC)C(=O)CC 1b758d1db96329780a6bed9a40a41196 [1,0,0,0,0,0|1,0,0]=2 386 B10R0.85 CCCOC(CC)C(=O)OC e73c3966229c76cecb77a48c05533324 [1,0,0,0,0,0|1,0,0]=2 387 B10R0.85 CCCOC(OC)C(=O)OC 71d9bc5a3666d6c3eb78ee1ecec35836 [1,0,0,0,0,0|2,0,0]=3 388 B10R0.85 CCCO[C@@H](CC)C(=O)OC ebcf57738e956d021bd573d7c29f12f8 [1,0,0,0,0,0|1,0,0]=2 389 B10R0.85 CCCO[C@H](CC)C(=O)OC 3b1537b2e9ad8c49f909bceb4cdfa72e [1,0,0,0,0,0|1,0,0]=2 390 B10R0.85 CCN(CCCO)C(=O)CF 1548aa83f9efe4b8ae7604dd9f12ea19 [1,0,0,0,0,0|3,0,0]=4 391 B10R0.85 CCN(CCCO)C(=O)CO fcd6ba791e8d129aa22e3bdf4389a7d6 [1,0,0,0,0,0|3,0,0]=4 392 B10R0.85 CCN(CCCO)C(=O)CS 957145ab83539f59213ab3fa1a828a33 [1,0,0,0,0,0|3,0,0]=4 393 B10R0.85 CCN(CCOC)C(=O)CF 5265a3e536bb3462d8d7facb2b6a1a58 [1,0,0,0,0,0|3,0,0]=4 394 B10R0.85 CCN(CCOC)C(=O)CO 7329b2b4aaeb7e51d473ab396fd790c1 [1,0,0,0,0,0|3,0,0]=4 395 B10R0.85 CCN(CCOC)C(=O)CS 66748ed1a81b71c8712a20ec9a6c5bf8 [1,0,0,0,0,0|3,0,0]=4 396 B10R0.85 CCNCC(CC)N(C)CC 2ce0ffcb3bcb845012228f139f806be6 [1,0,0,0,0,0|3,0,0]=4 397 B10R0.85 CCOCC(CC)C(=O)OC 5de5971e1bffa9a4b2e1175dd52d6646 [1,0,0,0,0,0|1,0,0]=2 398 B10R0.85 CC[C@@H](NCC#N)C(=O)OC 49b9581d4d780b800c101966fa58e656 [1,0,0,0,0,0|2,0,1]=4 399 B10R0.85 CC[C@@H](NCC=O)C(=O)OC f5ab119f021a191b99006512ee4b3263 [1,0,0,0,0,0|2,0,1]=4 400 B10R0.85 CC[C@@H](NCCBr)C(=O)OC d52631156e5667474b065b508be5d2f4 [1,0,0,0,0,0|2,0,0]=3 401 B10R0.85 CC[C@@H](NCCF)C(=O)OC 1ac03bac1d9a333ec1684bdaf380d68c [1,0,0,0,0,0|2,0,0]=3 402 B10R0.85 CC[C@@H](NCCI)C(=O)OC 3f11d65910706bd9bb800a57ed0c4d45 [1,0,0,0,0,0|2,0,0]=3 403 B10R0.85 CC[C@@H](NCCO)C(=O)OC ed39855e0c78bf578c267bcd1269d39b [1,0,0,0,0,0|2,0,0]=3 404 B10R0.85 CC[C@@H](NCCS)C(=O)OC dd9147afde46b109833054e38bfbc904 [1,0,0,0,0,0|2,0,0]=3 405 B10R0.85 CC[C@@H](NCOC)C(=O)OC 3d3818f8b5fbfe3bc61c49ac9b8e859d [1,0,0,0,0,0|2,0,0]=3 406 B10R0.85 CC[C@@H](NCSC)C(=O)OC cd04724eeb2cd60eb8b551efe98fd33e [1,0,0,0,0,0|2,0,0]=3 407 B10R0.85 CC[C@@H](OCC#N)C(=O)OC 43fe92de305d7f9baf8f2c6365bfecd7 [1,0,0,0,0,0|2,0,1]=4 408 B10R0.85 CC[C@@H](OCC=O)C(=O)OC ca9ea790de213b87ef11b9e4a1190ae1 [1,0,0,0,0,0|2,0,1]=4 409 B10R0.85 CC[C@@H](OCCF)C(=O)OC 13bd7d6d56147e6a3f24df2a18eaa84d [1,0,0,0,0,0|2,0,0]=3 410 B10R0.85 CC[C@@H](OCCS)C(=O)OC db95c7df49cf230a1f46c738a7ab4044 [1,0,0,0,0,0|2,0,0]=3 411 B10R0.85 CC[C@@H](OCOC)C(=O)OC 5a9c63e7208af9e2536fe8c4c2913002 [1,0,0,0,0,0|2,0,0]=3 412 B10R0.85 CC[C@@H](OCSC)C(=O)OC 456d8d34330d76ee7f5d0dd0f27881be [1,0,0,0,0,0|2,0,0]=3 413 B10R0.85 CC[C@H](NCC#N)C(=O)OC 18bbb6749e68b0639053451307210419 [1,0,0,0,0,0|2,0,1]=4 414 B10R0.85 CC[C@H](NCC=O)C(=O)OC beb626c995485f4e885189d7e0fa801d [1,0,0,0,0,0|2,0,1]=4 415 B10R0.85 CC[C@H](NCCF)C(=O)OC c3df580353484c9a93a885b9be966b68 [1,0,0,0,0,0|2,0,0]=3 416 B10R0.85 CC[C@H](NCCO)C(=O)OC e1e09f6e0d734554fece50e7a0faae04 [1,0,0,0,0,0|2,0,0]=3 417 B10R0.85 CC[C@H](NCCS)C(=O)OC 276a8879b4392cf3f4342fac70d6b996 [1,0,0,0,0,0|2,0,0]=3 418 B10R0.85 CC[C@H](NCOC)C(=O)OC dd804617d05f24a69275941cbe61fe68 [1,0,0,0,0,0|2,0,0]=3 419 B10R0.85 CC[C@H](NCSC)C(=O)OC b59162f3d8f1d347734b2da88177a84c [1,0,0,0,0,0|2,0,0]=3 420 B10R0.85 CC[C@H](OCC#N)C(=O)OC 13ad82fe00d4fa9dba5093752afa61a2 [1,0,0,0,0,0|2,0,1]=4 421 B10R0.85 CC[C@H](OCC=O)C(=O)OC 8fa6da8d1a015b18093738ec0893ab47 [1,0,0,0,0,0|2,0,1]=4 422 B10R0.85 CC[C@H](OCCF)C(=O)OC 4eb4dfe1487909e4fee085f84829b3dd [1,0,0,0,0,0|2,0,0]=3 423 B10R0.85 CC[C@H](OCCS)C(=O)OC 4612a5dc7332939eabd03d8c61edf9c0 [1,0,0,0,0,0|2,0,0]=3 424 B10R0.85 CC[C@H](OCSC)C(=O)OC 11db6b0951f32bb3cbec4c8449105aeb [1,0,0,0,0,0|2,0,0]=3 425 B10R0.85 COC(=O)C(CO)NCCBr e8b9f8353d6a367ffecd29701edfed75 [1,0,0,0,0,0|3,0,0]=4 426 B10R0.85 COC(=O)C(CO)NCCF dd0072bb5d8385623d765058f63b3863 [1,0,0,0,0,0|3,0,0]=4 427 B10R0.85 COC(=O)C(CO)NCCI 48c037cf77492020efd459b79db93927 [1,0,0,0,0,0|3,0,0]=4 428 B10R0.85 COC(=O)C(CO)NCCO 14aab8cd18593f7b4ebeef5890d98a04 [1,0,0,0,0,0|3,0,0]=4 429 B10R0.85 COC(=O)C(CO)NCCS 133ec3c2bb9818c899c6f2c3cbc7be95 [1,0,0,0,0,0|3,0,0]=4 430 B10R0.85 COC(=O)C(CO)NCSC 1d033a99f1cae2a8db0794f277e7ce5e [1,0,0,0,0,0|3,0,0]=4 431 B10R0.85 COC(=O)C(OC)OCCF 53a8608ac700b48490f7b803055a4a02 [1,0,0,0,0,0|3,0,0]=4 432 B10R0.85 COC(=O)C(OC)OCCS 878b33dcfe8b8577235636732bddb632 [1,0,0,0,0,0|3,0,0]=4 433 B10R0.85 COC(=O)C(OC)OCSC adf01d7f2b78f7dab650786cd716f1aa [1,0,0,0,0,0|3,0,0]=4 434 B10R0.85 COC(=O)[C@@H](CO)NCCBr 17aa27daab53f3169391cc25af5b7627 [1,0,0,0,0,0|3,0,0]=4 435 B10R0.85 COC(=O)[C@@H](CO)NCCF 7fe858e4b8ecde63c85604a01531658b [1,0,0,0,0,0|3,0,0]=4 436 B10R0.85 COC(=O)[C@@H](CO)NCCI c509b0fd687af90f344a284218c97660 [1,0,0,0,0,0|3,0,0]=4 437 B10R0.85 COC(=O)[C@@H](CO)NCCO a25ebd9d934b4240a32145eb6bdb4ca3 [1,0,0,0,0,0|3,0,0]=4 438 B10R0.85 COC(=O)[C@@H](CO)NCCS e87d09d94e863eeae9165d8bcb92b07e [1,0,0,0,0,0|3,0,0]=4 439 B10R0.85 COC(=O)[C@@H](CO)NCSC 3375e2f3b6b329fe11a638d6555e5765 [1,0,0,0,0,0|3,0,0]=4 440 B10R0.85 COC(=O)[C@H](CO)NCCBr 594d34c5d5e3622efa743ee969cd3676 [1,0,0,0,0,0|3,0,0]=4 441 B10R0.85 COC(=O)[C@H](CO)NCCF 1a1202150656ea67d34088508e855e5b [1,0,0,0,0,0|3,0,0]=4 442 B10R0.85 COC(=O)[C@H](CO)NCCI c6389135a82445d61bff9677b07e588b [1,0,0,0,0,0|3,0,0]=4 443 B10R0.85 COC(=O)[C@H](CO)NCCO bc7f078ca245e97dd40d923a5833db83 [1,0,0,0,0,0|3,0,0]=4 444 B10R0.85 COC(=O)[C@H](CO)NCCS ae1055e5ad15849197d393f009c1d75b [1,0,0,0,0,0|3,0,0]=4 445 B10R0.85 COC(=O)[C@H](CO)NCSC 68d8a2dbbe03018a4342a37e46b8a180 [1,0,0,0,0,0|3,0,0]=4 446 B10R0.85 COC(=O)[C@H](CS)NCCF 6d94fdb623a54ef6984b9772d052d3c8 [1,0,0,0,0,0|3,0,0]=4 447 B10R0.85 COC(=O)[C@H](CS)NCCO 054c07f48297b7493394857c2a273b88 [1,0,0,0,0,0|3,0,0]=4 448 B10R0.85 COC(=O)[C@H](CS)NCCS 5a34b7198db5277cd9f57f634b39e446 [1,0,0,0,0,0|3,0,0]=4 449 B10R0.85 COCNC(CO)C(=O)OC 33235dc66f8367e60a4f977df60331c8 [1,0,0,0,0,0|3,0,0]=4 450 B10R0.85 COCN[C@@H](CO)C(=O)OC 98e6083ef965766a823074881ca63c64 [1,0,0,0,0,0|3,0,0]=4 451 B10R0.85 COCN[C@@H](CS)C(=O)OC 73637af6fc468f0fc79f689f229427b4 [1,0,0,0,0,0|3,0,0]=4 452 B10R0.85 COCN[C@H](CO)C(=O)OC 87d7167c7a9fe24efb8aa0a5eac5b13e [1,0,0,0,0,0|3,0,0]=4 453 B10R0.85 COCOC(OC)C(=O)OC 0ca7b7a87f23ef294d80b9b2c6e927b7 [1,0,0,0,0,0|3,0,0]=4 454 B12R0.8 C#CCN(C)C(CC)C(=O)OCC 6325e5ef117cfe0aff34b3c8ce7059a3 [0,1,0,0,0,0|1,0,2]=4 455 B12R0.8 C=CCN(C)C(CC)C(=O)OCC 48522e32644ddc285201d0baea7f6f2c [0,1,0,0,0,0|1,0,2]=4 456 B12R0.8 CCCC(=O)C(CC)N(C)CCC c1f45a0dc9d6c69d7321f68d9a557b21 [0,1,0,0,0,0|2,0,0]=3 457 B12R0.8 CCCC(=O)C(CC)N(C)CCF a76aff419be30f4d0a94434c2be9be77 [0,1,0,0,0,0|3,0,0]=4 458 B12R0.8 CCCC(=O)C(CC)N(C)CCO c65a848c89efa74d0e42ffed8e270d89 [0,1,0,0,0,0|3,0,0]=4 459 B12R0.8 CCCC(=O)N(CC)C(C)CCO b417f301dd71420ab61bcd46c894073e [0,1,0,0,0,0|3,0,0]=4 460 B12R0.8 CCCN(C)C(C=O)C(=O)OCC f2ea1163eb02718a00f7da5f9b3caea0 [0,1,0,0,0,0|2,0,1]=4 461 B12R0.8 CCCN(C)C(CC)C(=O)OCC fee57c5ad743fce6f9b2b335d9d90acf [0,1,0,0,0,0|1,0,0]=2 462 B12R0.8 CCCN(C)C(CO)C(=O)OCC 71434593c1e1f5290e20d58edc9a7ddf [0,1,0,0,0,0|2,0,0]=3 463 B12R0.8 CCCN(C)C(SC)C(=O)OCC 5b60d1f3b1298f3b0b0c7bac00f1d89e [0,1,0,0,0,0|2,0,0]=3 464 B12R0.8 CCOC(=O)C(CC)N(C)CC#N 75710dc20168843f203bf0cc06d39e46 [0,1,0,0,0,0|2,0,1]=4 465 B12R0.8 CCOC(=O)C(CC)N(C)CC=O a337e5341f8c1175afc60318a3b1a953 [0,1,0,0,0,0|2,0,1]=4 466 B12R0.8 CCOC(=O)C(CC)N(C)CCF ca0d31631cbc2110758b846648a89fb2 [0,1,0,0,0,0|2,0,0]=3 467 B12R0.8 CCOC(=O)C(CC)N(C)CCO 4da8f165915b1f2e8a9fa5dad7db94ea [0,1,0,0,0,0|2,0,0]=3 468 B12R0.8 CCOC(=O)C(CC)N(C)CCS 235011542c7f3b48434896c972c1614b [0,1,0,0,0,0|2,0,0]=3 469 B12R0.8 CCOC(=O)C(CC)N(C)COC 4ed4944cb8ebca6b2260d15c6bc5c19f [0,1,0,0,0,0|2,0,0]=3 470 B12R0.8 CCOC(=O)C(CC)N(C)CSC e386514864765ddbf7865c4f415c48cb [0,1,0,0,0,0|2,0,0]=3 471 B12R0.8 CCOC(=O)C(CO)N(C)CCF 4aa373637fb4f457f221aeea7eb68baf [0,1,0,0,0,0|3,0,0]=4 472 B12R0.8 CCOC(=O)C(CO)N(C)CCO 9e769d28d4022618cf53a0cdab2dd4a2 [0,1,0,0,0,0|3,0,0]=4 473 B12R0.8 CCOC(=O)C(SC)N(C)CCF 9ded394b646c4a5f27f819d06e595cd8 [0,1,0,0,0,0|3,0,0]=4 474 B12R0.11 C#CCNC(CCC)C(=O)OCC 58d7cb9f8885ea8746f6a173c32f5e93 [0,1,0,0,0,0|1,0,2]=4 475 B12R0.11 C#CCNC(OCC)C(=O)OCC a0ead9ceae8d24c716e306906d73aab3 [0,1,0,0,0,0|1,0,2]=4 476 B12R0.11 C#CCOC(CCC)C(=O)OCC c858d5d14672f7c474671a207bb4d191 [0,1,0,0,0,0|1,0,2]=4 477 B12R0.11 C#CCOC(OCC)C(=O)OCC 67be3c49ecb18d732ec14a52d796ce01 [0,1,0,0,0,0|1,0,2]=4 478 B12R0.11 C/C=C/C(=O)N(CCC)CCCC df527480c492558cb94ccbc37969ccd8 [0,1,0,0,0,0|2,0,1]=4 479 B12R0.11 C/C=C/C(=O)N(CCO)CCCC ace76f26a6e6c5c04764b7353c660672 [0,1,0,0,0,0|2,0,1]=4 480 B12R0.11 C/C=C/C(=O)N(CCS)CCCC 5dd2c2ede08995d10dea9dafc38ee3fc [0,1,0,0,0,0|2,0,1]=4 481 B12R0.11 C=CCC(OCCC)C(=O)OCC 3dad164fb5bd8eb2fcd53d0022db18d6 [0,1,0,0,0,0|1,0,1]=3 482 B12R0.11 C=CCC(OCCF)C(=O)OCC 2a2be6df45762c5f4c76300d9841cb0e [0,1,0,0,0,0|2,0,1]=4 483 B12R0.11 C=CCC(OCCS)C(=O)OCC fc3da78e01116af4a1ccc320ad1f4d67 [0,1,0,0,0,0|2,0,1]=4 484 B12R0.11 C=CCC(OCOC)C(=O)OCC 0c8458226b296e074bf84ed3ad80ef77 [0,1,0,0,0,0|2,0,1]=4 485 B12R0.11 C=CCC(OCSC)C(=O)OCC 980608472eaac24d3251b99a4012e236 [0,1,0,0,0,0|2,0,1]=4 486 B12R0.11 C=CCCC(NCC)C(=O)OCC b237d2cb93dc9eee1bab1611fdfa8e7f [0,1,0,0,0,0|0,0,2]=3 487 B12R0.11 C=CCCC(NCF)C(=O)OCC 72182ffa3b8bbc93717f8b0a4d465c6e [0,1,0,0,0,0|1,0,2]=4 488 B12R0.11 C=CCCC(NCO)C(=O)OCC 24b9a1441ae2555712d82934c701a075 [0,1,0,0,0,0|1,0,2]=4 489 B12R0.11 C=CCOC(CCC)C(=O)OCC 18060bf084588f2c849341c7916ad1d3 [0,1,0,0,0,0|1,0,2]=4 490 B12R0.11 CC#CC(=O)N(CCC)CCCC f5a42eabeb50e2936f00a8b152ba260f [0,1,0,0,0,0|2,0,1]=4 491 B12R0.11 CC#CC(=O)N(CCO)CCCC bab7ce20ca62d0d82484983e420e3bd9 [0,1,0,0,0,0|2,0,1]=4 492 B12R0.11 CC#CC(=O)N(CCS)CCCC 326d8abde8d088d8e915c93075481448 [0,1,0,0,0,0|2,0,1]=4 493 B12R0.11 CCCC(=O)C(CCC)OCCF c2448ab8f1a02d8fa45f760a82ce82f6 [0,1,0,0,0,0|3,0,0]=4 494 B12R0.11 CCCC(=O)C(CCC)OCCS 8ee080522380ca346a9e27dc3b7ea13f [0,1,0,0,0,0|3,0,0]=4 495 B12R0.11 CCCC(=O)C(CCC)OCOC a5f7e5562906c05663b9a44c5d93a9a7 [0,1,0,0,0,0|3,0,0]=4 496 B12R0.11 CCCC(=O)C(CCC)OCSC a3c2cc9e13faf5f238eff359b4a04b7d [0,1,0,0,0,0|3,0,0]=4 497 B12R0.11 CCCC(=O)N(CCC)CCCO 4567bb1b42869cf5a0fa0c8fc92d19bd [0,1,0,0,0,0|3,0,0]=4 498 B12R0.11 CCCC(=O)N(CCC)CCOC f9645717f96775b0da6e403fa25693e1 [0,1,0,0,0,0|3,0,0]=4 499 B12R0.11 CCCC(=O)N(CCO)CCCO 85128db8c8eabdc5f89d6d67adef8f06 [0,1,0,0,0,0|3,0,0]=4 500 B12R0.11 CCCC(NCC#N)C(=O)OCC f9960883b3e892b41a43f824007630a9 [0,1,0,0,0,0|2,0,1]=4 501 B12R0.11 CCCC(NCCBr)C(=O)OCC c42fb2ff1e7ac8dadb6905fd507bce19 [0,1,0,0,0,0|2,0,0]=3 502 B12R0.11 CCCC(NCCF)C(=O)OCC 40f4dc3712d76722f0d204a58e31fc8d [0,1,0,0,0,0|2,0,0]=3 503 B12R0.11 CCCC(NCCI)C(=O)OCC 1804deb1f69e53a542683f06be3ff3af [0,1,0,0,0,0|2,0,0]=3 504 B12R0.11 CCCC(NCCO)C(=O)OCC 685b469a944a6f986ff4e0cf4763bb87 [0,1,0,0,0,0|2,0,0]=3 505 B12R0.11 CCCC(NCCS)C(=O)OCC 7b21e13aa6f7063e99b7fbb1f9c6f91e [0,1,0,0,0,0|2,0,0]=3 506 B12R0.11 CCCC(OCC#N)C(=O)OCC 934b21214d3b98e7ffa9f4bd668aacf5 [0,1,0,0,0,0|2,0,1]=4 507 B12R0.11 CCCC(OCC=O)C(=O)OCC ca9683488488730111da688c9eaa9fdf [0,1,0,0,0,0|2,0,1]=4 508 B12R0.11 CCCC(OCCF)C(=O)OCC f3b3010be9569b83c4a1db25c9988fec [0,1,0,0,0,0|2,0,0]=3 509 B12R0.11 CCCC(OCCS)C(=O)OCC 5684b74e19eed272d4c59009fe7a43e9 [0,1,0,0,0,0|2,0,0]=3 510 B12R0.11 CCCC(OCOC)C(=O)OCC abe6290397c68b9c1e28c1ff474ff216 [0,1,0,0,0,0|2,0,0]=3 511 B12R0.11 CCCC(OCSC)C(=O)OCC 6c58695a917505666c4b18765b20cd5f [0,1,0,0,0,0|2,0,0]=3 512 B12R0.11 CCCCC(NC#N)C(=O)OCC d73d3b8a7b180c2770e1fe8803b04838 [0,1,0,0,0,0|1,0,1]=3 513 B12R0.11 CCCCC(OCC)C(C)CCC 42cfd554856ef3d39711085db2e25738 [0,1,0,0,0,0|2,0,1]=4 514 B12R0.11 CCCCN(CC#N)C(=O)CCC 61483c63631287d4a99f460ad584cc4b [0,1,0,0,0,0|2,0,1]=4 515 B12R0.11 CCCCN(CCC)C(=O)CCC 5476f7d149516a2688382fa1c68036f7 [0,1,0,0,0,0|2,0,0]=3 516 B12R0.11 CCCCN(CCC)C(=O)CCF 656302b7ce7dc4f04bfe4a379d479529 [0,1,0,0,0,0|3,0,0]=4 517 B12R0.11 CCCCN(CCC)C(=O)CCO 1bd9ed1b840d222070ee92f9dfbdb032 [0,1,0,0,0,0|3,0,0]=4 518 B12R0.11 CCCCN(CCC)C(=O)CCS 8dcc5eb04d796d910d137a3b2307c69c [0,1,0,0,0,0|3,0,0]=4 519 B12R0.11 CCCCN(CCC)C(=O)COC 787daa15308d50fda8b056f88f7f6d01 [0,1,0,0,0,0|3,0,0]=4 520 B12R0.11 CCCCN(CCC)C(=O)CSC b22584d0d1851babab82269e13d3ee32 [0,1,0,0,0,0|3,0,0]=4 521 B12R0.11 CCCCN(CCO)C(=O)CCC 4f2576a93508fac606c5a59522655907 [0,1,0,0,0,0|2,0,0]=3 522 B12R0.11 CCCCN(CCO)C(=O)CCF 940dc4ec3747efcb9639a823f5f8ad59 [0,1,0,0,0,0|3,0,0]=4 523 B12R0.11 CCCCN(CCO)C(=O)CCO 5db80242aa2a12c2d5e4f4e19eaa2014 [0,1,0,0,0,0|3,0,0]=4 524 B12R0.11 CCCCN(CCO)C(=O)CCS b33aa4acea44b31ef2ccf762736735a8 [0,1,0,0,0,0|3,0,0]=4 525 B12R0.11 CCCCN(CCO)C(=O)COC a3c4cf6b94b6b6bde0066d214eaa02ba [0,1,0,0,0,0|3,0,0]=4 526 B12R0.11 CCCCN(CCO)C(=O)CSC 3f2e65e52d39c0e5b88368a258d5e088 [0,1,0,0,0,0|3,0,0]=4 527 B12R0.11 CCCCN(CCS)C(=O)CCC 5465ff08c864131692175699492db935 [0,1,0,0,0,0|2,0,0]=3 528 B12R0.11 CCCCN(CCS)C(=O)CCF 387b058d1a518a32681d9f9290d4d353 [0,1,0,0,0,0|3,0,0]=4 529 B12R0.11 CCCCN(CCS)C(=O)CCO 5f6ff775842459631c8627ce832733b7 [0,1,0,0,0,0|3,0,0]=4 530 B12R0.11 CCCCN(CCS)C(=O)CCS 6c88b433b0f6fc8edd0f719b56d2e89e [0,1,0,0,0,0|3,0,0]=4 531 B12R0.11 CCCCN(CCS)C(=O)COC 7d4e2c3bf87ed35ce0b14068b538dd49 [0,1,0,0,0,0|3,0,0]=4 532 B12R0.11 CCCCN(CCS)C(=O)CSC 86e6f44237b34f264a162f435fb09338 [0,1,0,0,0,0|3,0,0]=4 533 B12R0.11 CCCNC(CCC)C(=O)OCC d5bcbeb36b09f6d80a46d30e1c1d0545 [0,1,0,0,0,0|1,0,0]=2 534 B12R0.11 CCCNC(OCC)C(=O)OCC 2eb316b4e080cda0faed2439c799f6de [0,1,0,0,0,0|1,0,0]=2 535 B12R0.11 CCCOC(CCC)C(=O)CCC a5fce8e38a1eaeaacea1a3f8c1b2445b [0,1,0,0,0,0|2,0,0]=3 536 B12R0.11 CCCOC(CCC)C(=O)OCC ddc9c5189ab003ecc05caef2851aa607 [0,1,0,0,0,0|1,0,0]=2 537 B12R0.11 CCCOC(OCC)C(=O)OCC ed8b194d55e900cfe09c4d18e3c3a5c9 [0,1,0,0,0,0|1,0,0]=2 538 B12R0.11 CCOC(=O)C(NCCI)OCC 3838606abc1356243161a06df5328f37 [0,1,0,0,0,0|2,0,0]=3 539 B12R0.11 CCOC(=O)C(NCCO)OCC 030857acff131b4c9b1cc40db0d29367 [0,1,0,0,0,0|2,0,0]=3 540 B12R0.11 CCOC(=O)C(NCCS)OCC 9bc57a7bfcb8aef9272050b0257a5522 [0,1,0,0,0,0|2,0,0]=3 541 B12R0.11 CCOC(=O)C(OCC)OCC#N 17590d1e50e9b4772473d3c3d39244a7 [0,1,0,0,0,0|2,0,1]=4 542 B12R0.11 CCOC(=O)C(OCC)OCCS 9165ddcdbab464f8966ce67538846e39 [0,1,0,0,0,0|2,0,0]=3 543 B12R0.11 CCOC(=O)C(OCC)OCOC 785fa387de058f8324ff434383a93439 [0,1,0,0,0,0|2,0,0]=3 544 B12R0.77 C#CC(OCC(C)C)C(=O)OCC c37b4e1c6f0ea1249f265eb5be5acc89 [0,1,0,0,0,0|1,0,2]=4 545 B12R0.77 C=C(Br)CNC(CC)C(=O)OCC 85372f183465a0a5ac4df185bdddfd0e [0,1,0,0,0,0|1,0,2]=4 546 B12R0.77 C=C(Br)CN[C@@H](CC)C(=O)OCC 38a274faacc7ddefa86e738ba988c926 [0,1,0,0,0,0|1,0,2]=4 547 B12R0.77 C=C(Br)CN[C@H](CC)C(=O)OCC 733c2690a363b3957edbd072ede099ac [0,1,0,0,0,0|1,0,2]=4 548 B12R0.77 C=C(Br)COC(CC)C(=O)OCC 0d59962ef5938985f5a6b203e8834454 [0,1,0,0,0,0|1,0,2]=4 549 B12R0.77 C=C(Br)CO[C@@H](CC)C(=O)OCC 97c71aa710adaad2aa30f91f55ea8972 [0,1,0,0,0,0|1,0,2]=4 550 B12R0.77 C=C(Br)CO[C@H](CC)C(=O)OCC aa9dd290e8eebb46e7c423a3be2438ce [0,1,0,0,0,0|1,0,2]=4 551 B12R0.77 C=C(C)CNC(CC)C(=O)CCC a5a3334d16173bb85ba6b1fc83d19afd [0,1,0,0,0,0|2,0,1]=4 552 B12R0.77 C=C(C)CNC(CC)C(=O)NCC fe4ff68fb0da0eed74dcc8dffc0b1f68 [0,1,0,0,0,0|2,0,1]=4 553 B12R0.77 C=C(C)CNC(CC)C(=O)OCC 4d56b05d1aed64478aa458adbc5c8956 [0,1,0,0,0,0|1,0,1]=3 554 B12R0.77 C=C(C)CNC(CO)C(=O)OCC b30ad06dcfa4ab2375dbf4c9faaa0bd2 [0,1,0,0,0,0|2,0,1]=4 555 B12R0.77 C=C(C)CNC(SC)C(=O)OCC 697cd852a8993ef78ae542e95a8414db [0,1,0,0,0,0|2,0,1]=4 556 B12R0.77 C=C(C)CN[C@@H](CC)C(=O)OCC a12407b0974568c659f85f479698ea3e [0,1,0,0,0,0|1,0,1]=3 557 B12R0.77 C=C(C)CN[C@H](CC)C(=O)OCC 01eaf72685dbe18eb40fed2802ccac3c [0,1,0,0,0,0|1,0,1]=3 558 B12R0.77 C=C(C)COC(CC)C(=O)CCC 4780d38e0c608724670f3c3f49d2a8e1 [0,1,0,0,0,0|2,0,1]=4 559 B12R0.77 C=C(C)COC(CC)C(=O)OCC e698d7d12c7e126a8a73c6a51258a9ae [0,1,0,0,0,0|1,0,1]=3 560 B12R0.77 C=C(C)CO[C@@H](CC)C(=O)OCC 351370567b30c7f3defbd77ef61b9a37 [0,1,0,0,0,0|1,0,1]=3 561 B12R0.77 C=C(C)CO[C@H](CC)C(=O)OCC bfec028ab7cb6c24197001b562a9be80 [0,1,0,0,0,0|1,0,1]=3 562 B12R0.77 C=C(Cl)CNC(CC)C(=O)OCC 2e647f8712356ecb5b66e6bb225f8601 [0,1,0,0,0,0|1,0,2]=4 563 B12R0.77 C=C(Cl)CN[C@@H](CC)C(=O)OCC 50ef47693954fcd1dfb27382b28d0240 [0,1,0,0,0,0|1,0,2]=4 564 B12R0.77 C=C(Cl)CN[C@H](CC)C(=O)OCC d23e529736043adc75b38cac98947168 [0,1,0,0,0,0|1,0,2]=4 565 B12R0.77 C=C(Cl)COC(CC)C(=O)OCC 19097008a08b04c2f01d4451679709ef [0,1,0,0,0,0|1,0,2]=4 566 B12R0.77 C=C(Cl)CO[C@@H](CC)C(=O)OCC 5159d67499be87191172237de457922f [0,1,0,0,0,0|1,0,2]=4 567 B12R0.77 C=C(Cl)CO[C@H](CC)C(=O)OCC 09756a913610cf2cd0b71c42e600220b [0,1,0,0,0,0|1,0,2]=4 568 B12R0.77 C=C(F)CNC(CC)C(=O)OCC 2590ab01a1e953bf28efb677820bc41d [0,1,0,0,0,0|1,0,2]=4 569 B12R0.77 C=C(F)CN[C@@H](CC)C(=O)OCC 590460a0423a7bdd020900075ef7d8d2 [0,1,0,0,0,0|1,0,2]=4 570 B12R0.77 C=C(F)CN[C@H](CC)C(=O)OCC 47510b9102e67d1594e5f596900b269f [0,1,0,0,0,0|1,0,2]=4 571 B12R0.77 C=C(F)COC(CC)C(=O)OCC c9742cf63a108d3873a475045d6bba07 [0,1,0,0,0,0|1,0,2]=4 572 B12R0.77 C=C(F)CO[C@@H](CC)C(=O)OCC 9481fb267df13336d7fef0b516ca9849 [0,1,0,0,0,0|1,0,2]=4 573 B12R0.77 C=C(F)CO[C@H](CC)C(=O)OCC a6515637d5f0ef43eead52d7b3b4ff87 [0,1,0,0,0,0|1,0,2]=4 574 B12R0.77 C=C(I)COC(CC)C(=O)OCC 885150397e800fd16055b2e573365cca [0,1,0,0,0,0|1,0,2]=4 575 B12R0.77 CCCC(=O)C(CC)NCC(=O)C f794a7db929e65bd3c127f6a3616d4f9 [0,1,0,0,0,0|2,0,1]=4 576 B12R0.77 CCCC(=O)C(CC)NCC(C)C 744a170f1a1742075965707385fa9f9c [0,1,0,0,0,0|2,0,0]=3 577 B12R0.77 CCCC(=O)C(CC)NCC(C)O 53a5f959f6496a3db4975a1afebb6ec0 [0,1,0,0,0,0|2,0,0]=3 578 B12R0.77 CCCC(=O)C(CC)NCC(F)F 4de9dc91a0c8dd94857a216947c66a21 [0,1,0,0,0,0|3,0,0]=4 579 B12R0.77 CCCC(=O)C(CC)NC[C@@H](C)O 85cc9bce7568184c0c0fc333106aeb35 [0,1,0,0,0,0|2,0,0]=3 580 B12R0.77 CCCC(=O)C(CC)NC[C@H](C)O 9c38de6508c42b3ba003e4543c9338e8 [0,1,0,0,0,0|2,0,0]=3 581 B12R0.77 CCCC(=O)C(CC)OCC(C)C 76fab7f387ef73402952ae45187f461e [0,1,0,0,0,0|2,0,0]=3 582 B12R0.77 CCCC(=O)C(CC)OCC(C)F b0046b66bcac727dd1c8bc33367c1cce [0,1,0,0,0,0|2,0,0]=3 583 B12R0.77 CCCC(=O)C(CC)OCC(C)S 91ab53e84d110eb1aca1e6b73ed6c238 [0,1,0,0,0,0|2,0,0]=3 584 B12R0.77 CCCC(=O)C(CC)OCC(F)F 4b294f68b6669c837dcdc79bab4355db [0,1,0,0,0,0|3,0,0]=4 585 B12R0.77 CCCC(=O)C(CC)OC[C@@H](C)F e11b646fe02f666815862750709c784b [0,1,0,0,0,0|2,0,0]=3 586 B12R0.77 CCCC(=O)C(CC)OC[C@H](C)F 0f16d7229ff43917269fa146b5676339 [0,1,0,0,0,0|2,0,0]=3 587 B12R0.77 CCCC(=O)N(CC)CCN(C)C 12831fea3e2f1d6e264404bed8e53158 [0,1,0,0,0,0|3,0,0]=4 588 B12R0.77 CCNC(=O)C(CC)NCC(C)C 5d63651f68f21be1d8823728365bfce9 [0,1,0,0,0,0|2,0,0]=3 589 B12R0.77 CCNC(=O)C(CC)NCC(C)O bba199088c10de3f0b051fc1c9316605 [0,1,0,0,0,0|2,0,0]=3 590 B12R0.77 CCNC(=O)C(CC)NCC(F)F 401869979d939f1068dc1adf8d548b9b [0,1,0,0,0,0|3,0,0]=4 591 B12R0.77 CCNC(=O)C(CC)NCN(C)C a72bb1e7d6bdf226082a51e392e3d2d6 [0,1,0,0,0,0|3,0,0]=4 592 B12R0.77 CCNC(=O)C(CC)NC[C@@H](C)O 06e3b42346e3d67a5b61adcad3e50b45 [0,1,0,0,0,0|2,0,0]=3 593 B12R0.77 CCNC(=O)C(CC)NC[C@H](C)O bd06df59e2cb5b68c4710984066268ae [0,1,0,0,0,0|2,0,0]=3 594 B12R0.77 CCOC(=O)C(C#N)NCC(C)C 85eb8799fa07c8829a16af8bc95a2dec [0,1,0,0,0,0|2,0,1]=4 595 B12R0.77 CCOC(=O)C(C#N)NCC(C)O 4f5be71acfdc765f91186a601a8da599 [0,1,0,0,0,0|2,0,1]=4 596 B12R0.77 CCOC(=O)C(C#N)NC[C@@H](C)O ef95bc8c3d9fc31912e5b04397e9cd42 [0,1,0,0,0,0|2,0,1]=4 597 B12R0.77 CCOC(=O)C(C#N)NC[C@H](C)O ba93774a9455be983f72d130d168d4fd [0,1,0,0,0,0|2,0,1]=4 598 B12R0.77 CCOC(=O)C(C=O)NCC(C)C 8b55d031a50aac52f1386f20296ee054 [0,1,0,0,0,0|2,0,1]=4 599 B12R0.77 CCOC(=O)C(C=O)NCC(C)O 8a535771e483c91f958bb8bb193ed260 [0,1,0,0,0,0|2,0,1]=4 600 B12R0.77 CCOC(=O)C(C=O)NC[C@@H](C)O 035e992f9230eadd8ce9e6c8a3ed70d2 [0,1,0,0,0,0|2,0,1]=4 601 B12R0.77 CCOC(=O)C(C=O)NC[C@H](C)O f5785534e4df22d58aae69f9e7c8ddf5 [0,1,0,0,0,0|2,0,1]=4 602 B12R0.77 CCOC(=O)C(C=O)OCC(C)C 982ceef562d174def8c391ee6eceb2c8 [0,1,0,0,0,0|2,0,1]=4 603 B12R0.77 CCOC(=O)C(C=O)OCC(C)F 1967301e301ee3484fc9738959b9ead5 [0,1,0,0,0,0|2,0,1]=4 604 B12R0.77 CCOC(=O)C(C=O)OCC(C)S 5a92cb7252036ff6ea61a8d9b18de5ba [0,1,0,0,0,0|2,0,1]=4 605 B12R0.77 CCOC(=O)C(C=O)OC[C@@H](C)F cc871c82bc635b0cbcb4c09d528ca895 [0,1,0,0,0,0|2,0,1]=4 606 B12R0.77 CCOC(=O)C(C=O)OC[C@H](C)F e3d31d5d5bd1f509fff5f5150060a462 [0,1,0,0,0,0|2,0,1]=4 607 B12R0.77 CCOC(=O)C(CC)NCC(=O)C 235bbd38c0f6a257cdd1fbdcdd5dcfa0 [0,1,0,0,0,0|1,0,1]=3 608 B12R0.77 CCOC(=O)C(CC)NCC(=O)N b39a8f15a8033465e2f21ce9eca2738d [0,1,0,0,0,0|2,0,1]=4 609 B12R0.77 CCOC(=O)C(CC)NCC(=O)O f41b0b36d1f030006327a7ccd183e1b7 [0,1,0,0,0,0|2,0,1]=4 610 B12R0.77 CCOC(=O)C(CC)NCC(C)C 933e8039ef42500e12467ab07dae25e5 [0,1,0,0,0,0|1,0,0]=2 611 B12R0.77 CCOC(=O)C(CC)NCC(C)O 8bdde96e66e12ab6de77577aa013636c [0,1,0,0,0,0|1,0,0]=2 612 B12R0.77 CCOC(=O)C(CC)NCC(F)F 777f2d38e12d42b23b05646183bac402 [0,1,0,0,0,0|2,0,0]=3 613 B12R0.77 CCOC(=O)C(CC)NCN(C)C 5160020ceebf075d3996d577cf3e0728 [0,1,0,0,0,0|2,0,0]=3 614 B12R0.77 CCOC(=O)C(CC)NC[C@@H](C)O b1fcb4a20a1a257fb448dd413dc4cf22 [0,1,0,0,0,0|1,0,0]=2 615 B12R0.77 CCOC(=O)C(CC)NC[C@H](C)O 2e3442476714e499a1168d91ba5ae415 [0,1,0,0,0,0|1,0,0]=2 616 B12R0.77 CCOC(=O)C(CC)NC[N+](=O)[O-] 65371ffface00f3e4110ba3c0eaa8b9f [0,1,0,0,0,0|3,0,0]=4 617 B12R0.77 CCOC(=O)C(CC)OCC(=O)N 19d8fdac245fa65d196eb04895354b53 [0,1,0,0,0,0|2,0,1]=4 618 B12R0.77 CCOC(=O)C(CC)OCC(=O)O 27cffd304b312681c10dac60c1c4196a [0,1,0,0,0,0|2,0,1]=4 619 B12R0.77 CCOC(=O)C(CC)OCC(C)C 1e5fcec4c8d7dc1628dc5e67ec51e63e [0,1,0,0,0,0|1,0,0]=2 620 B12R0.77 CCOC(=O)C(CC)OCC(C)F 94241f1c10b5ff2546b6a3cd180054a2 [0,1,0,0,0,0|1,0,0]=2 621 B12R0.77 CCOC(=O)C(CC)OCC(C)S 9dbdc2992278fc2b8090822cc85917eb [0,1,0,0,0,0|1,0,0]=2 622 B12R0.77 CCOC(=O)C(CC)OCC(F)F bb113267306ee303c02c4b2a494a7d03 [0,1,0,0,0,0|2,0,0]=3 623 B12R0.77 CCOC(=O)C(CC)OCN(C)C a099e15c6c9690cf7de72a355de40dce [0,1,0,0,0,0|2,0,0]=3 624 B12R0.77 CCOC(=O)C(CC)OCS(=O)O c689c5eedb6d336d2eadac0280ff23ea [0,1,0,0,0,0|3,0,0]=4 625 B12R0.77 CCOC(=O)C(CC)OC[C@@H](C)F 26f7a27c98bdb4f9abf5857dc370a2b4 [0,1,0,0,0,0|1,0,0]=2 626 B12R0.77 CCOC(=O)C(CC)OC[C@H](C)F 4e39ef4e05e67702eb1349e416996888 [0,1,0,0,0,0|1,0,0]=2 627 B12R0.77 CCOC(=O)C(CC)OC[N+](=O)[O-] 0240d411f451a39a89877603bd6a82c6 [0,1,0,0,0,0|3,0,0]=4 628 B12R0.77 CCOC(=O)C(CO)NCC(=O)C 875ae0d962768884ad2119f33dfd206b [0,1,0,0,0,0|2,0,1]=4 629 B12R0.77 CCOC(=O)C(CO)NCC(C)C 64e2241001b994319ebf27c0a480275c [0,1,0,0,0,0|2,0,0]=3 630 B12R0.77 CCOC(=O)C(CO)NCC(C)O dae84ed7f3c99b618feaec17ccf49b3f [0,1,0,0,0,0|2,0,0]=3 631 B12R0.77 CCOC(=O)C(CO)NCC(F)F 2b6dfe0f77f2b1e944573220e8654637 [0,1,0,0,0,0|3,0,0]=4 632 B12R0.77 CCOC(=O)C(CO)NC[C@@H](C)O 1e59dc3add4603eec91e9e9da5b498de [0,1,0,0,0,0|2,0,0]=3 633 B12R0.77 CCOC(=O)C(CO)NC[C@H](C)O 9633ec4a0b313f9e8fb8f9d088623b33 [0,1,0,0,0,0|2,0,0]=3 634 B12R0.77 CCOC(=O)C(OCC(F)F)SC b2a427dee16fb57cc38f6c880375c587 [0,1,0,0,0,0|3,0,0]=4 635 B12R0.77 CCOC(=O)[C@@H](CC)NCC(=O)N 965b3f83c55b6675f39279924bb7d512 [0,1,0,0,0,0|2,0,1]=4 636 B12R0.77 CCOC(=O)[C@@H](CC)NCC(=O)O 8b93a7d26b4da71fd70d17ceef9d350b [0,1,0,0,0,0|2,0,1]=4 637 B12R0.77 CCOC(=O)[C@@H](CC)NCC(C)C 1d4ed941bcb2aeccbbacb355404b8f3e [0,1,0,0,0,0|1,0,0]=2 638 B12R0.77 CCOC(=O)[C@@H](CC)NCC(C)O aad93a5bd2977d5c2d9e12f296b08de8 [0,1,0,0,0,0|1,0,0]=2 639 B12R0.77 CCOC(=O)[C@@H](CC)NCC(F)F 97a3eeacc67dfd61ccda928c1b04cc58 [0,1,0,0,0,0|2,0,0]=3 640 B12R0.77 CCOC(=O)[C@@H](CC)NCN(C)C 9b082822eebe5541b691e78df04ee2ec [0,1,0,0,0,0|2,0,0]=3 641 B12R0.77 CCOC(=O)[C@@H](CC)NC[C@@H](C)O 39e178c105810c36660669aff23b1ac6 [0,1,0,0,0,0|1,0,0]=2 642 B12R0.77 CCOC(=O)[C@@H](CC)NC[C@H](C)O ac7665b85da663f7ff014f47a2c86c7f [0,1,0,0,0,0|1,0,0]=2 643 B12R0.77 CCOC(=O)[C@@H](CC)NC[N+](=O)[O-] 6f6f8bc79cdf8fdff959f27751c10357 [0,1,0,0,0,0|3,0,0]=4 644 B12R0.77 CCOC(=O)[C@@H](CC)OCC(=O)N 629e500427d76fee21515c9a8b8f953b [0,1,0,0,0,0|2,0,1]=4 645 B12R0.77 CCOC(=O)[C@@H](CC)OCC(=O)O 5781c992292097ced6332ea8aa99fe92 [0,1,0,0,0,0|2,0,1]=4 646 B12R0.77 CCOC(=O)[C@@H](CC)OCC(C)C f49c2324a2f4f15865e58d07adbbc8d1 [0,1,0,0,0,0|1,0,0]=2 647 B12R0.77 CCOC(=O)[C@@H](CC)OCC(F)F 6fc2199d13b01d3c16a6712b0d853b0c [0,1,0,0,0,0|2,0,0]=3 648 B12R0.77 CCOC(=O)[C@@H](CC)OCN(C)C e3f54d89d1adc477686956e207bdbb49 [0,1,0,0,0,0|2,0,0]=3 649 B12R0.77 CCOC(=O)[C@@H](CC)OC[N+](=O)[O-] 633e52acb761652f309951cf48d9103d [0,1,0,0,0,0|3,0,0]=4 650 B12R0.77 CCOC(=O)[C@H](CC)NCC(=O)N 461821254486802a8b99fc5a92a594e2 [0,1,0,0,0,0|2,0,1]=4 651 B12R0.77 CCOC(=O)[C@H](CC)NCC(=O)O f1dcdc1c9679396d6ff7c4af85f1522e [0,1,0,0,0,0|2,0,1]=4 652 B12R0.77 CCOC(=O)[C@H](CC)NCC(C)C 7b0f065890e8dff484643572d2f1a4c3 [0,1,0,0,0,0|1,0,0]=2 653 B12R0.77 CCOC(=O)[C@H](CC)NCC(C)O e8ca4253fc174b3350f44756c82ee5ad [0,1,0,0,0,0|1,0,0]=2 654 B12R0.77 CCOC(=O)[C@H](CC)NCC(F)F 65bb4746a9b30cc0573ceea8853b13e5 [0,1,0,0,0,0|2,0,0]=3 655 B12R0.77 CCOC(=O)[C@H](CC)NCN(C)C b3684cef3af1bdfa7ad6a49312968334 [0,1,0,0,0,0|2,0,0]=3 656 B12R0.77 CCOC(=O)[C@H](CC)NC[C@@H](C)O eedab09bb66fb748a60ae461901b9318 [0,1,0,0,0,0|1,0,0]=2 657 B12R0.77 CCOC(=O)[C@H](CC)NC[C@H](C)O c22e230c25a70d835c9f4eea8a0cfb38 [0,1,0,0,0,0|1,0,0]=2 658 B12R0.77 CCOC(=O)[C@H](CC)NC[N+](=O)[O-] 3e01f72c33e5012fd8f3260f0f9109cd [0,1,0,0,0,0|3,0,0]=4 659 B12R0.77 CCOC(=O)[C@H](CC)OCC(=O)N 340d0dfed0eb8f7f8f6fa50f30730427 [0,1,0,0,0,0|2,0,1]=4 660 B12R0.77 CCOC(=O)[C@H](CC)OCC(=O)O e37e0dcde919644ed733389d53cffe9a [0,1,0,0,0,0|2,0,1]=4 661 B12R0.77 CCOC(=O)[C@H](CC)OCC(C)C a458c96c40873f7ca0ee5d2a72c28dc4 [0,1,0,0,0,0|1,0,0]=2 662 B12R0.77 CCOC(=O)[C@H](CC)OCC(F)F 13bf7a43cdb2957bd51aa46d16bb2cbc [0,1,0,0,0,0|2,0,0]=3 663 B12R0.77 CCOC(=O)[C@H](CC)OCN(C)C 42f31f6ba8cec77b749345c71bfec6f5 [0,1,0,0,0,0|2,0,0]=3 664 B12R0.77 CCOC(=O)[C@H](CC)OC[N+](=O)[O-] 466c918f29c4ca40fc15cd78d53a2682 [0,1,0,0,0,0|3,0,0]=4 665 B12R0.80 C#CC(C)NC(CC)C(=O)OCC c8a7912371cda325ade9eb5b2e9485cf [0,1,0,0,0,0|1,0,2]=4 666 B12R0.80 C#CC(C)N[C@@H](CC)C(=O)OCC 73949041d7ff24e0f8008bac381ce7d7 [0,1,0,0,0,0|1,0,2]=4 667 B12R0.80 C#CC(C)N[C@H](CC)C(=O)OCC 5479e00dbb1c6558e3f9ca5fd292b6b5 [0,1,0,0,0,0|1,0,2]=4 668 B12R0.80 C#CC(C)OC(CC)C(=O)OCC 35898856286d1e217f6e02df487dd32e [0,1,0,0,0,0|1,0,2]=4 669 B12R0.80 C#CC(C)O[C@@H](CC)C(=O)OCC b303abaf748794534653ca588237505d [0,1,0,0,0,0|1,0,2]=4 670 B12R0.80 C#CC(C)O[C@H](CC)C(=O)OCC 0d9d04f7e2c93fb44e76fc295fa35a33 [0,1,0,0,0,0|1,0,2]=4 671 B12R0.80 C#CC(OC(C)CC)C(=O)OCC f6a2b9130f397d01d03f1fda7135fcc1 [0,1,0,0,0,0|1,0,2]=4 672 B12R0.80 C#C[C@@H](C)NC(CC)C(=O)OCC 7845814fd079cb8ae7f882ada0a8e89b [0,1,0,0,0,0|1,0,2]=4 673 B12R0.80 C#C[C@@H](C)OC(CC)C(=O)OCC 3753234ecd65337b2230f59eb8791340 [0,1,0,0,0,0|1,0,2]=4 674 B12R0.80 C#C[C@H](C)NC(CC)C(=O)OCC de9cd6cd7c35d50e41820737d03bf4b3 [0,1,0,0,0,0|1,0,2]=4 675 B12R0.80 C#C[C@H](C)OC(CC)C(=O)OCC 3065c3bc63a13648b72dcd0723b26c22 [0,1,0,0,0,0|1,0,2]=4 676 B12R0.80 C/C=C/C(=O)N(CC)CC(O)CC 5322f79ae7cac7e3b1c3b91e824786fb [0,1,0,0,0,0|2,0,1]=4 677 B12R0.80 C=CC(C)NC(CC)C(=O)OCC 7387355b656a615b7065fc88443da263 [0,1,0,0,0,0|1,0,2]=4 678 B12R0.80 C=CC(C)N[C@@H](CC)C(=O)OCC 60af5cae32b4c9f3f7c865d2cbe8b246 [0,1,0,0,0,0|1,0,2]=4 679 B12R0.80 C=CC(C)N[C@H](CC)C(=O)OCC 37108d485d686d0eca23d4227ec3ae3f [0,1,0,0,0,0|1,0,2]=4 680 B12R0.80 C=CC(C)OC(CC)C(=O)OCC 25594c1452b75e57b608e5c58bd36155 [0,1,0,0,0,0|1,0,2]=4 681 B12R0.80 C=CC(C)O[C@@H](CC)C(=O)OCC 6f86f282a459654d6f012a5c453b2d6b [0,1,0,0,0,0|1,0,2]=4 682 B12R0.80 C=CC(C)O[C@H](CC)C(=O)OCC d746fdf4cbfcae4d9de959f9803435dc [0,1,0,0,0,0|1,0,2]=4 683 B12R0.80 C=C[C@H](C)OC(CC)C(=O)OCC bfe77a55f761ad19234ee6e46d5e3d60 [0,1,0,0,0,0|1,0,2]=4 684 B12R0.80 CC#CC(=O)N(CC)CC(O)CC 73de0733071571a4e5ff7abdd77b8bb9 [0,1,0,0,0,0|2,0,1]=4 685 B12R0.80 CCC(O)CN(CC)C(=O)CCF 1259999ddcdfd1f6322a22dcf209a81e [0,1,0,0,0,0|3,0,0]=4 686 B12R0.80 CCC(O)CN(CC)C(=O)CCO 4495aaf2cccd1a901f8b1f7f1d1d0e5b [0,1,0,0,0,0|3,0,0]=4 687 B12R0.80 CCC(O)CN(CC)C(=O)CCS 2116bd627181697bd91f93f34d5b4599 [0,1,0,0,0,0|3,0,0]=4 688 B12R0.80 CCC(O)CN(CC)C(=O)COC f69f645243f7958ef6430b159d9d57e0 [0,1,0,0,0,0|3,0,0]=4 689 B12R0.80 CCC(O)CN(CC)C(=O)CSC a4b42ee8acf4746c90b701fb82fe15c0 [0,1,0,0,0,0|3,0,0]=4 690 B12R0.80 CCCC(=O)C(CC)NC(C)CC 9d29edeeef3d1ec5819b235ed3c68366 [0,1,0,0,0,0|2,0,0]=3 691 B12R0.80 CCCC(=O)C(CC)NC(C)CO 941942441395427fdf4ccabcf53ea542 [0,1,0,0,0,0|3,0,0]=4 692 B12R0.80 CCCC(=O)C(CC)N[C@@H](C)CC ed68b5a8e4913332d5afde552a944f0e [0,1,0,0,0,0|2,0,0]=3 693 B12R0.80 CCCC(=O)C(CC)N[C@@H](C)CO 72199dd30862b542aa86b4b0d9c0d765 [0,1,0,0,0,0|3,0,0]=4 694 B12R0.80 CCCC(=O)C(CC)N[C@H](C)CC 44713d27f0d45f888ec4c0a322c62ebf [0,1,0,0,0,0|2,0,0]=3 695 B12R0.80 CCCC(=O)C(CC)N[C@H](C)CO 27b79af83c529067ac7af2b2a266d93e [0,1,0,0,0,0|3,0,0]=4 696 B12R0.80 CCCC(=O)C(CC)OC(C)CC 7ec9359fdadeaeff25ae9f4a6e6bdc35 [0,1,0,0,0,0|2,0,0]=3 697 B12R0.80 CCCC(=O)C(CC)OC(C)CF ced5de63bd6262fbf49d4da9f48a47d6 [0,1,0,0,0,0|3,0,0]=4 698 B12R0.80 CCCC(=O)C(CC)OC(C)CS d9d813187dad65801aaa8346ca467ec4 [0,1,0,0,0,0|3,0,0]=4 699 B12R0.80 CCCC(=O)C(CC)O[C@@H](C)CC 637370dd0e5d541f002d49657bc191bb [0,1,0,0,0,0|2,0,0]=3 700 B12R0.80 CCCC(=O)C(CC)O[C@H](C)CC b1d36ee46dc4f577010d7fc2008784c9 [0,1,0,0,0,0|2,0,0]=3 701 B12R0.80 CCCC(=O)C(CC)O[C@H](C)CS 33fb65e562fa636ef6328a6cb8540534 [0,1,0,0,0,0|3,0,0]=4 702 B12R0.80 CCCC(=O)N(CC)CC(O)CC 241ea74203218e21533b836421a414c6 [0,1,0,0,0,0|2,0,0]=3 703 B12R0.80 CCNC(=O)C(CC)NC(=O)CC 081ef7fca308d673e45850c90512bcca [0,1,0,0,0,0|2,0,1]=4 704 B12R0.80 CCNC(=O)C(CC)NC(C)CC 34052dd394a1075d33e1a9ad5876f2a1 [0,1,0,0,0,0|2,0,0]=3 705 B12R0.80 CCNC(=O)C(CC)NC(C)CO 9bb6379df78be7c795c49e9affb4775a [0,1,0,0,0,0|3,0,0]=4 706 B12R0.80 CCNC(=O)C(CC)N[C@@H](C)CO 58fea0d502f875801cea7194d40d626c [0,1,0,0,0,0|3,0,0]=4 707 B12R0.80 CCNC(=O)C(CC)N[C@H](C)CO 69af6d551f640032420476b28a93da33 [0,1,0,0,0,0|3,0,0]=4 708 B12R0.80 CCOC(=O)C(C#N)NC(C)CC 7e769a79b948e17e288f91085c90fe55 [0,1,0,0,0,0|2,0,1]=4 709 B12R0.80 CCOC(=O)C(C=O)NC(C)CC 82b7ce918403d45a1fc1a52e523c5908 [0,1,0,0,0,0|2,0,1]=4 710 B12R0.80 CCOC(=O)C(C=O)N[C@@H](C)CC d5875843df1e5f474d56c77c6d65a9cb [0,1,0,0,0,0|2,0,1]=4 711 B12R0.80 CCOC(=O)C(C=O)N[C@H](C)CC 90bd9b0ef82e45cfdb1a5f0bbbb9b0d9 [0,1,0,0,0,0|2,0,1]=4 712 B12R0.80 CCOC(=O)C(C=O)OC(C)CC 408adbffb42b71b8fcbf8fafca6947b8 [0,1,0,0,0,0|2,0,1]=4 713 B12R0.80 CCOC(=O)C(C=O)O[C@@H](C)CC 4bd7fc7545957bf2349f1f1910253500 [0,1,0,0,0,0|2,0,1]=4 714 B12R0.80 CCOC(=O)C(C=O)O[C@H](C)CC 371ce2729016bdcc6886859c8ef1fb71 [0,1,0,0,0,0|2,0,1]=4 715 B12R0.80 CCOC(=O)C(CC)NC(=O)CC 78ca07a5c55e3c2cf6260ba662e4179c [0,1,0,0,0,0|1,0,1]=3 716 B12R0.80 CCOC(=O)C(CC)NC(=O)CF ce96f2f8715d52c319c8724ae7925c2a [0,1,0,0,0,0|2,0,1]=4 717 B12R0.80 CCOC(=O)C(CC)NC(=O)CO 12be569914fa1a5623726c84e960bf4c [0,1,0,0,0,0|2,0,1]=4 718 B12R0.80 CCOC(=O)C(CC)NC(=O)CS dc51f150aa9062cfb19c34320e91c698 [0,1,0,0,0,0|2,0,1]=4 719 B12R0.80 CCOC(=O)C(CC)NC(C)C#N c104371a35b04710e57701f200660cba [0,1,0,0,0,0|2,0,1]=4 720 B12R0.80 CCOC(=O)C(CC)NC(C)C=O ccf78d961111459b034ec6a3a6bbf31e [0,1,0,0,0,0|2,0,1]=4 721 B12R0.80 CCOC(=O)C(CC)NC(C)CC 679f50ff446a4ff3ac1260aa638b238b [0,1,0,0,0,0|1,0,0]=2 722 B12R0.80 CCOC(=O)C(CC)NC(C)CO 3ae973840ca390183c7db8c25ef766b6 [0,1,0,0,0,0|2,0,0]=3 723 B12R0.80 CCOC(=O)C(CC)NC(F)C#N 695f1e1c0cb43200fd7077b62a6fd72b [0,1,0,0,0,0|2,0,1]=4 724 B12R0.80 CCOC(=O)C(CC)N[C@@H](C)CC 3ca0eb82cc82edffd85f442577796c8b [0,1,0,0,0,0|1,0,0]=2 725 B12R0.80 CCOC(=O)C(CC)N[C@@H](C)CO 74a7bd7779850db6a391639ba1c071d6 [0,1,0,0,0,0|2,0,0]=3 726 B12R0.80 CCOC(=O)C(CC)N[C@H](C)C=O 9e7d373697820d15322fecd438caf7c2 [0,1,0,0,0,0|2,0,1]=4 727 B12R0.80 CCOC(=O)C(CC)N[C@H](C)CC ecc911240da6e8018662a0c0b730a1bd [0,1,0,0,0,0|1,0,0]=2 728 B12R0.80 CCOC(=O)C(CC)N[C@H](C)CO 28c4d566b0b53f56b86debe8c7830199 [0,1,0,0,0,0|2,0,0]=3 729 B12R0.80 CCOC(=O)C(CC)OC(C)C#N 0ce58f593d0a6327ab09642d317cfe13 [0,1,0,0,0,0|2,0,1]=4 730 B12R0.80 CCOC(=O)C(CC)OC(C)C=O 2fa0f90383dfe3c678f7fb9ea1d64bf2 [0,1,0,0,0,0|2,0,1]=4 731 B12R0.80 CCOC(=O)C(CC)OC(C)CC 6f68b158cd5011394fe9d85802d474ef [0,1,0,0,0,0|1,0,0]=2 732 B12R0.80 CCOC(=O)C(CC)OC(C)CF 649b21539311d19ed9c49c07e205c18d [0,1,0,0,0,0|2,0,0]=3 733 B12R0.80 CCOC(=O)C(CC)OC(C)CS eba5413fae1818363da8fe95c8a679d9 [0,1,0,0,0,0|2,0,0]=3 734 B12R0.80 CCOC(=O)C(CC)O[C@@H](C)CC f717752dffb1d006a58d1998d8a3adcf [0,1,0,0,0,0|1,0,0]=2 735 B12R0.80 CCOC(=O)C(CC)O[C@H](C)C=O 3ec46c57e129821e6df2385766f6d23e [0,1,0,0,0,0|2,0,1]=4 736 B12R0.80 CCOC(=O)C(CC)O[C@H](C)CC 841e70619d97ce48f54a99e7f0e0ac39 [0,1,0,0,0,0|1,0,0]=2 737 B12R0.80 CCOC(=O)C(CC)O[C@H](C)CS eaff77a9886bf85625f8f2be4cf5cfd4 [0,1,0,0,0,0|2,0,0]=3 738 B12R0.80 CCOC(=O)C(CO)NC(C)CC 9479f2e2a030ceda67d6c22b4d1c501b [0,1,0,0,0,0|2,0,0]=3 739 B12R0.80 CCOC(=O)C(CO)NC(C)CO d9e88d991a79c28e2eda07f1f728a9cf [0,1,0,0,0,0|3,0,0]=4 740 B12R0.80 CCOC(=O)C(CO)N[C@@H](C)CC 6afcc011767f16d2013a8afaf688a941 [0,1,0,0,0,0|2,0,0]=3 741 B12R0.80 CCOC(=O)C(CO)N[C@@H](C)CO 46653d7c2b7a80d0a6c34d36a4cfd027 [0,1,0,0,0,0|3,0,0]=4 742 B12R0.80 CCOC(=O)C(CO)N[C@H](C)CC 4d7873ee19e7977d2453553d2aeb4aee [0,1,0,0,0,0|2,0,0]=3 743 B12R0.80 CCOC(=O)C(CO)N[C@H](C)CO d02122922e7863bc3a3476f3b0338f09 [0,1,0,0,0,0|3,0,0]=4 744 B12R0.80 CCOC(=O)C(OC(C)CC)SC 89c15473f41bb9a0dae38871f6dd4d5c [0,1,0,0,0,0|2,0,0]=3 745 B12R0.80 CCOC(=O)C(O[C@@H](C)CC)SC 149fa8c643e620fdfb4e18bb96d8f492 [0,1,0,0,0,0|2,0,0]=3 746 B12R0.80 CCOC(=O)C(O[C@H](C)CC)SC ec1ddc4315de633d2b851facd8918ae6 [0,1,0,0,0,0|2,0,0]=3 747 B12R0.80 CCOC(=O)[C@@H](CC)NC(=O)CC a67d25e26ab0c2c30015a03478ae596d [0,1,0,0,0,0|1,0,1]=3 748 B12R0.80 CCOC(=O)[C@@H](CC)NC(=O)CF 79b14051d0736062ff319ba62a9d0921 [0,1,0,0,0,0|2,0,1]=4 749 B12R0.80 CCOC(=O)[C@@H](CC)NC(=O)CO 5396f474e707f63265c6e13ca48cff0f [0,1,0,0,0,0|2,0,1]=4 750 B12R0.80 CCOC(=O)[C@@H](CC)NC(=O)CS ccd9892f72c8f52fafaaf63137bfc38d [0,1,0,0,0,0|2,0,1]=4 751 B12R0.80 CCOC(=O)[C@@H](CC)NC(C)C#N 1cbe514766e013d1f7cb0a5ff411b91f [0,1,0,0,0,0|2,0,1]=4 752 B12R0.80 CCOC(=O)[C@@H](CC)NC(C)C=O 841cfa746a47722a930851e525ef6914 [0,1,0,0,0,0|2,0,1]=4 753 B12R0.80 CCOC(=O)[C@@H](CC)NC(C)CC 3aaa3707c1a100ebf5f22e91d1563c28 [0,1,0,0,0,0|1,0,0]=2 754 B12R0.80 CCOC(=O)[C@@H](CC)NC(C)CO 097a22667c979a8ef61bd20262e9ebdc [0,1,0,0,0,0|2,0,0]=3 755 B12R0.80 CCOC(=O)[C@@H](CC)NC(F)C#N 4a8b5037f272ecfae0d202a6eeedc841 [0,1,0,0,0,0|2,0,1]=4 756 B12R0.80 CCOC(=O)[C@@H](CC)N[C@@H](C)CO 5442e515e15fb8653789fb6ec2af75f9 [0,1,0,0,0,0|2,0,0]=3 757 B12R0.80 CCOC(=O)[C@@H](CC)N[C@H](C)C=O 9ddf6405d15bcd481f5a138eaa923450 [0,1,0,0,0,0|2,0,1]=4 758 B12R0.80 CCOC(=O)[C@@H](CC)N[C@H](C)CO 98fa88afde07f75e2bdf75b0487106c8 [0,1,0,0,0,0|2,0,0]=3 759 B12R0.80 CCOC(=O)[C@@H](CC)OC(C)C#N 9914cabd97f37e11f20898da57ab7452 [0,1,0,0,0,0|2,0,1]=4 760 B12R0.80 CCOC(=O)[C@@H](CC)OC(C)C=O 7075b9ea047ecb6d7364cf41cc0eff23 [0,1,0,0,0,0|2,0,1]=4 761 B12R0.80 CCOC(=O)[C@@H](CC)OC(C)CC 3800821355f9e9279104483e7773348a [0,1,0,0,0,0|1,0,0]=2 762 B12R0.80 CCOC(=O)[C@@H](CC)O[C@H](C)C=O b76d2b26f8b7cbb4912bf1c6430f24d2 [0,1,0,0,0,0|2,0,1]=4 763 B12R0.80 CCOC(=O)[C@H](CC)NC(=O)CC 338c7a584acba0bdc5e02c53520b5d1c [0,1,0,0,0,0|1,0,1]=3 764 B12R0.80 CCOC(=O)[C@H](CC)NC(=O)CF 08ff29d7abe1e23a1da1632380d47089 [0,1,0,0,0,0|2,0,1]=4 765 B12R0.80 CCOC(=O)[C@H](CC)NC(=O)CO 000a174b6c81a5821e86349522e892d7 [0,1,0,0,0,0|2,0,1]=4 766 B12R0.80 CCOC(=O)[C@H](CC)NC(=O)CS 33099c5b2df9fad209d224a2c6cc03d4 [0,1,0,0,0,0|2,0,1]=4 767 B12R0.80 CCOC(=O)[C@H](CC)NC(C)C#N 7dc5b73a15f4c819ac8f34805da649dc [0,1,0,0,0,0|2,0,1]=4 768 B12R0.80 CCOC(=O)[C@H](CC)NC(C)C=O 99074617e2daf5cccfb293bc400d3aef [0,1,0,0,0,0|2,0,1]=4 769 B12R0.80 CCOC(=O)[C@H](CC)NC(C)CC 5bd8158087bcf442901fee8b649bf4a2 [0,1,0,0,0,0|1,0,0]=2 770 B12R0.80 CCOC(=O)[C@H](CC)NC(C)CO c6a2233ad3e758ab47b1bdefd9219ab6 [0,1,0,0,0,0|2,0,0]=3 771 B12R0.80 CCOC(=O)[C@H](CC)NC(F)C#N 65f50d9e7c297fb3e1bdbc0182eac7d7 [0,1,0,0,0,0|2,0,1]=4 772 B12R0.80 CCOC(=O)[C@H](CC)N[C@@H](C)CO 2f233302a18763524ca3e03cbc82211d [0,1,0,0,0,0|2,0,0]=3 773 B12R0.80 CCOC(=O)[C@H](CC)N[C@H](C)C=O 3925205cfc7c62ba0c6a379251f280a5 [0,1,0,0,0,0|2,0,1]=4 774 B12R0.80 CCOC(=O)[C@H](CC)N[C@H](C)CO 7444f61fcf48fc9738d4b6a390d8edee [0,1,0,0,0,0|2,0,0]=3 775 B12R0.80 CCOC(=O)[C@H](CC)OC(C)C#N 16f45233e083a5f3da60557e40242844 [0,1,0,0,0,0|2,0,1]=4 776 B12R0.80 CCOC(=O)[C@H](CC)OC(C)C=O c7f0661de2b7153b866509868632f629 [0,1,0,0,0,0|2,0,1]=4 777 B12R0.80 CCOC(=O)[C@H](CC)OC(C)CC 0ba008deb9bcabaff6b55485e5017961 [0,1,0,0,0,0|1,0,0]=2 778 B12R0.80 CCOC(=O)[C@H](CC)O[C@H](C)C=O 62de072841ff8a38dac3c8772ca3d314 [0,1,0,0,0,0|2,0,1]=4 779 B12R0.215 C=C(C)CC(=O)N(CC)CCCC c209c803d0e8b1cae44e64ae8c3dd652 [0,1,0,0,0,0|2,0,1]=4 780 B12R0.215 CCC(NCCBr)C(=O)NC(C)C b77a10e1a00373abe271c2ca9946fd2e [0,1,0,0,0,0|3,0,0]=4 781 B12R0.215 CCC(NCCF)C(=O)NC(C)C 4937d01b5669ec34f639763130d5ca85 [0,1,0,0,0,0|3,0,0]=4 782 B12R0.215 CCC(NCCI)C(=O)NC(C)C c3f9838a332c194e0f1a294b66c06cc9 [0,1,0,0,0,0|3,0,0]=4 783 B12R0.215 CCC(NCCO)C(=O)NC(C)C 57bca4b9e11286f03596ad2e8a3f7100 [0,1,0,0,0,0|3,0,0]=4 784 B12R0.215 CCC(NCCS)C(=O)NC(C)C 5b7f53e86a4df3e07502f92885736651 [0,1,0,0,0,0|3,0,0]=4 785 B12R0.215 CCC(OCCF)C(=O)NC(C)C c11e0c321f1e6974be892f0d58491a94 [0,1,0,0,0,0|3,0,0]=4 786 B12R0.215 CCC(OCCS)C(=O)NC(C)C eb80f14e6def87e7bc7bb81cdc176197 [0,1,0,0,0,0|3,0,0]=4 787 B12R0.215 CCC(OCOC)C(=O)NC(C)C 7e4774b9873fb066ca3bccdb4a5a1d41 [0,1,0,0,0,0|3,0,0]=4 788 B12R0.215 CCCCC(CC)N(C)CC(C)C 6fd1f30637a3ac52c16736069da046f3 [0,1,0,0,0,0|3,0,0]=4 789 B12R0.215 CCCCC(CC)N(C)CC(C)O 861ba0bcb13fd5246b1700f84dece676 [0,1,0,0,0,0|3,0,0]=4 790 B12R0.215 CCCCC(CC)N(C)C[C@H](C)O 22d5962643a237299a98f96b6d80ae5e [0,1,0,0,0,0|3,0,0]=4 791 B12R0.215 CCCCN(CC)C(=O)/C=C(/C)\Cl 30b352a4d4dbe77fee3d9294fbed753b [0,1,0,0,0,0|2,0,1]=4 792 B12R0.215 CCCCN(CC)C(=O)/C=C(/C)\I 99e6c94a2184aad7ffa01eaa9a9c31c0 [0,1,0,0,0,0|2,0,1]=4 793 B12R0.215 CCCCN(CC)C(=O)/C=C(\C)/Cl f4aab9090780a4241bfa29049d332ac6 [0,1,0,0,0,0|2,0,1]=4 794 B12R0.215 CCCCN(CC)C(=O)C=C(C)C a059a0578bcc55633666bfd81dd0d969 [0,1,0,0,0,0|2,0,1]=4 795 B12R0.215 CCCCN(CC)C(=O)C=C(C)I 6f83241e1ee7e51b14aca7dedefc4884 [0,1,0,0,0,0|2,0,1]=4 796 B12R0.215 CCCCN(CC)C(=O)CC(=O)C 0e43c24fd97ee255a8a8f362fb8fa8cd [0,1,0,0,0,0|2,0,1]=4 797 B12R0.215 CCCCN(CC)C(=O)CC(C)C 597cda60cf0442f201df77d307e975f9 [0,1,0,0,0,0|2,0,0]=3 798 B12R0.215 CCCCN(CC)C(=O)CC(C)O a05ffdd90546ab6435b23f81e8052136 [0,1,0,0,0,0|2,0,0]=3 799 B12R0.215 CCCCN(CC)C(=O)CC(F)F 95ac98d360e0f794c863147c2ce8e3ac [0,1,0,0,0,0|3,0,0]=4 800 B12R0.215 CCCCN(CC)C(=O)CN(C)C acc056aea087acebf7ee8c7e9456dfee [0,1,0,0,0,0|3,0,0]=4 801 B12R0.215 CCCCN(CC)C(=O)C[C@@H](C)O 82375a8ad0803c159587e6b238081641 [0,1,0,0,0,0|2,0,0]=3 802 B12R0.215 CCCCN(CC)C(=O)C[C@H](C)O 628b4843ddd7a8b8d314f1876f9d6fc4 [0,1,0,0,0,0|2,0,0]=3 803 B12R0.215 CCCNC(CC)C(=O)NC(C)C 1f04f708022d7b54d110b86779869f50 [0,1,0,0,0,0|2,0,0]=3 804 B12R0.215 CCCOC(CC)C(=O)NC(C)C 895ab038e028d661b4637da564d01394 [0,1,0,0,0,0|2,0,0]=3 805 B12R0.215 CCN(CCCO)C(=O)CC(C)C 28d7e77d352c98f0ce311a809c0b6baa [0,1,0,0,0,0|3,0,0]=4 806 B12R0.215 CCN(CCCO)C(=O)CC(C)O a570dc5bf9abc1e9a40e89979dcd6995 [0,1,0,0,0,0|3,0,0]=4 807 B12R0.215 CCN(CCCO)C(=O)C[C@@H](C)O e994fa838f207b8bb0714b1f2f835e02 [0,1,0,0,0,0|3,0,0]=4 808 B12R0.215 CCN(CCCO)C(=O)C[C@H](C)O aca09c98b072a21835b8c16fb627cde2 [0,1,0,0,0,0|3,0,0]=4 809 B12R0.215 CCN(CCOC)C(=O)CC(C)C 468b0542e0a90a64a1a7a6c5e6053085 [0,1,0,0,0,0|3,0,0]=4 810 B12R0.215 CCN(CCOC)C(=O)CC(C)O 151f6ee7097b59bc345d5a2b9ddf2408 [0,1,0,0,0,0|3,0,0]=4 811 B12R0.215 CCN(CCOC)C(=O)C[C@@H](C)O a746c51fce4955b2b018ffeeb3dd59eb [0,1,0,0,0,0|3,0,0]=4 812 B12R0.215 CCN(CCOC)C(=O)C[C@H](C)O e528a5ab9590f05c7e1d80f925feb751 [0,1,0,0,0,0|3,0,0]=4 813 B12R0.289 C#CC(OCC)C(CC)CCCC 256ac7f935e33bca72065ab1fd5ff9a9 [0,1,0,0,0,0|1,0,1]=3 814 B12R0.289 C#CC(OCF)C(CC)CCCC 42e6e79d27c153f4eb33134232c15958 [0,1,0,0,0,0|2,0,1]=4 815 B12R0.289 CCCCC(CC)N(CC)CCC 549b29d54c65b29526658a153644bb50 [0,1,0,0,0,0|3,0,0]=4 816 B12R0.290 C/C=C(/C)\C(=O)N(CC)CCCC b8028913aa1d640f74ca0840504731d5 [0,1,0,0,0,0|2,0,1]=4 817 B12R0.290 C/C=C(\Br)/C(=O)N(CC)CCCC f2ad4469a87dba928f8cc22422f5ebef [0,1,0,0,0,0|2,0,1]=4 818 B12R0.290 C/C=C(\C)/C(=O)N(CC)CCCC a23432836a395da306d1da45ae4d3dae [0,1,0,0,0,0|2,0,1]=4 819 B12R0.290 C/C=C(\Cl)/C(=O)N(CC)CCCC c495018a17951b8f4c4e8579af02f75c [0,1,0,0,0,0|2,0,1]=4 820 B12R0.290 C/C=C(\O)/C(=O)N(CC)CCCC c160cd3ccfa41a727eaa7d77c128c067 [0,1,0,0,0,0|2,0,1]=4 821 B12R0.290 C=C(CC)C(=O)N(CC)CCCC e56930285366ed6a0a3044b243a26546 [0,1,0,0,0,0|2,0,0]=3 822 B12R0.290 C=C(CC)C(=O)N(CC)CCCO 78aea09503c92f3034a853bbea7377fd [0,1,0,0,0,0|3,0,0]=4 823 B12R0.290 C=C(CC)C(=O)N(CC)CCOC ba24474da4be0a43eade78676448b4b3 [0,1,0,0,0,0|3,0,0]=4 824 B12R0.290 C=C(CO)C(=O)N(CC)CCCC 07414f98e38e52a343bb5cc4c1d9c4f7 [0,1,0,0,0,0|3,0,0]=4 825 B12R0.290 CC=C(C)C(=O)N(CC)CCCC 2730d941eba7787fd2a8813f38c67d59 [0,1,0,0,0,0|2,0,1]=4 826 B12R0.290 CCC(=O)C(=O)N(CC)CCCO cf63ad051392dfc2f3eb97e6fc935dc0 [0,1,0,0,0,0|3,0,0]=4 827 B12R0.290 CCC(=O)C(=O)N(CC)CCOC 9a4d7768d99823b79fb89fd4117ff15a [0,1,0,0,0,0|3,0,0]=4 828 B12R0.290 CCC(O)C(=O)N(CC)CCCO a81d463934215fe4202e4e5157f511c9 [0,1,0,0,0,0|3,0,0]=4 829 B12R0.290 CCC(O)C(=O)N(CC)CCOC 54212601a49253736a011331afd5a637 [0,1,0,0,0,0|3,0,0]=4 830 B12R0.290 CCCCC(CC)N(C)C(C)CC ff21a7d070f07144ec75f9d259f77b27 [0,1,0,0,0,0|3,0,0]=4 831 B12R0.290 CCCCN(CC)C(=O)C(=O)CC e4213aefa2303574e08737db9e0aef85 [0,1,0,0,0,0|2,0,0]=3 832 B12R0.290 CCCCN(CC)C(=O)C(=O)CS 21bb543b16932718304b68b8df2ae09f [0,1,0,0,0,0|3,0,0]=4 833 B12R0.290 CCCCN(CC)C(=O)C(=O)NC 3ebf5b51aef5205c652018a20d4d1c3e [0,1,0,0,0,0|3,0,0]=4 834 B12R0.290 CCCCN(CC)C(=O)C(=O)OC 7c55c3b24f47ceab8b91b83baf475cb0 [0,1,0,0,0,0|3,0,0]=4 835 B12R0.290 CCCCN(CC)C(=O)C(C)OC ff55ec6f7260b7301cbd347d5a8cd699 [0,1,0,0,0,0|3,0,0]=4 836 B12R0.290 CCCCN(CC)C(=O)C(C)SC d69df75746fcc7d987095eff9b660289 [0,1,0,0,0,0|3,0,0]=4 837 B12R0.290 CCCCN(CC)C(=O)C(O)CC 73b3531313a98cf1c56820aae6add9ce [0,1,0,0,0,0|2,0,0]=3 838 B12R0.290 CCCCN(CC)C(=O)C(O)CO 8f972cd6bbcd639b161c59ea533c8879 [0,1,0,0,0,0|3,0,0]=4 839 B12R0.290 CCCCN(CC)C(=O)[C@@H](C)OC 0d8d0c6d829822c4d865e154462f410b [0,1,0,0,0,0|3,0,0]=4 840 B12R0.290 CCCCN(CC)C(=O)[C@@H](O)CC b8c5eaf69d3db2c3672db5d57f674367 [0,1,0,0,0,0|2,0,0]=3 841 B12R0.290 CCCCN(CC)C(=O)[C@@H](O)CO 1944c109797fd3c0a6cbf6ba4aaafb4f [0,1,0,0,0,0|3,0,0]=4 842 B12R0.290 CCCCN(CC)C(=O)[C@@H](S)CC e9f8a3209b0991c3d94f91bb262c5937 [0,1,0,0,0,0|2,0,0]=3 843 B12R0.290 CCCCN(CC)C(=O)[C@H](C)OC 21b9cdc61583d08c98ffbb61e7a7e0da [0,1,0,0,0,0|3,0,0]=4 844 B12R0.290 CCCCN(CC)C(=O)[C@H](O)CC 908a9527049060fa367977361d8350be [0,1,0,0,0,0|2,0,0]=3 845 B12R0.290 CCCCN(CC)C(=O)[C@H](O)CF bd16806f4f97e720cead3de8c093469f [0,1,0,0,0,0|3,0,0]=4 846 B12R0.290 CCN(C)C(=O)C(CCSC)OC 2bb4d196ec07ff343f7cf2093ec36cb5 [0,1,0,0,0,0|3,0,0]=4 847 B12R0.290 CC[C@@H](O)C(=O)N(CC)CCCO 79104ee78c356d014073943ac492ec8a [0,1,0,0,0,0|3,0,0]=4 848 B12R0.290 CC[C@@H](O)C(=O)N(CC)CCOC 127bacde8706b6c1f8b70e1be5f2f81d [0,1,0,0,0,0|3,0,0]=4 849 B12R0.290 CC[C@H](O)C(=O)N(CC)CCCO 6c011b13df989bc573a572d65f964100 [0,1,0,0,0,0|3,0,0]=4 850 B12R0.290 CC[C@H](O)C(=O)N(CC)CCOC c8cf17ef01f30f04065d5ed0d996b3e0 [0,1,0,0,0,0|3,0,0]=4 851 B12R0.290 CC[C@H](S)C(=O)N(CC)CCCO 77d2fadfe58e575f8bad09aa3ca047c9 [0,1,0,0,0,0|3,0,0]=4 852 B12R0.290 CC[C@H](S)C(=O)N(CC)CCOC 3edcf365917f33d49318d1422c6289fa [0,1,0,0,0,0|3,0,0]=4 853 B12R0.337 C#CCNC(C(=O)OCC)C(C)C e2ad96119a165354c0a3aad5343a9a9c [0,1,0,0,0,0|1,0,2]=4 854 B12R0.337 C#CCN[C@@H](C(=O)OCC)C(C)C 9e05732f7558f5830fdd0cb3bfda4518 [0,1,0,0,0,0|1,0,2]=4 855 B12R0.337 C#CCN[C@H](C(=O)OCC)C(C)C 2fde4def803f799a6d591dc07dc3d12a [0,1,0,0,0,0|1,0,2]=4 856 B12R0.337 C#CCOC(C(=O)OCC)C(C)C a0daa893a72c0723a9624114e89ceaab [0,1,0,0,0,0|1,0,2]=4 857 B12R0.337 C#CCO[C@@H](C(=O)OCC)C(C)C 83703257dfb174b772aae94f87a74239 [0,1,0,0,0,0|1,0,2]=4 858 B12R0.337 C/C=C/C(=O)N(CCCC)C(C)C fab8b6ad15496dbd27b131d9331a0292 [0,1,0,0,0,0|2,0,1]=4 859 B12R0.337 C=CCNC(C(=O)OCC)C(C)C 1feadba0acb6a951b5ffec50d911aec4 [0,1,0,0,0,0|1,0,2]=4 860 B12R0.337 C=CCN[C@@H](C(=O)OCC)C(C)C 4381929248c8a9b4a35e4c999f794beb [0,1,0,0,0,0|1,0,2]=4 861 B12R0.337 C=CCN[C@H](C(=O)OCC)C(C)C 8f35851de22ee309587859e778a0192a [0,1,0,0,0,0|1,0,2]=4 862 B12R0.337 C=CCO[C@@H](C(=O)OCC)C(C)C 0fb5cc56135d1edaa479f07ffd093761 [0,1,0,0,0,0|1,0,2]=4 863 B12R0.337 CC#CC(=O)N(CCCC)C(C)C 4e029568d31779466155c2b0a983c3b0 [0,1,0,0,0,0|2,0,1]=4 864 B12R0.337 CCCC(=O)N(CCCO)C(C)C 514812d6295162f2e973c87af359a8d9 [0,1,0,0,0,0|3,0,0]=4 865 B12R0.337 CCCC(=O)N(CCOC)C(C)C 137de0e36d08f3e8b67941aed27414c8 [0,1,0,0,0,0|3,0,0]=4 866 B12R0.337 CCCCN(C(=O)CCC)C(C)C 72a06553feba11d8c80444fe4c0895ab [0,1,0,0,0,0|2,0,0]=3 867 B12R0.337 CCCCN(C(=O)CCF)C(C)C 6a60bcacd358da5b11eab35778aa2127 [0,1,0,0,0,0|3,0,0]=4 868 B12R0.337 CCCCN(C(=O)CCO)C(C)C 5272fe9f03963d725f20c8d03790b316 [0,1,0,0,0,0|3,0,0]=4 869 B12R0.337 CCCCN(C(=O)CCS)C(C)C dcaea7c4780c1e1e04b32b85d669f241 [0,1,0,0,0,0|3,0,0]=4 870 B12R0.337 CCCCN(C(=O)COC)C(C)C 9603d56395a958d09b664586e507af2e [0,1,0,0,0,0|3,0,0]=4 871 B12R0.337 CCCCN(C(=O)CSC)C(C)C e44df547893c7ef81ebdddcc9693b192 [0,1,0,0,0,0|3,0,0]=4 872 B12R0.337 CCCNC(C(=O)C)C(=O)OCC 669dbee6c26e1729930aee5cb36cade7 [0,1,0,0,0,0|1,0,1]=3 873 B12R0.337 CCCNC(C(=O)OCC)C(C)C 9787c30e9c80162c7a53422fb9f31736 [0,1,0,0,0,0|1,0,0]=2 874 B12R0.337 CCCN[C@@H](C(=O)OCC)C(C)C 33b86fe2b16724796dd01fc359c9e9cc [0,1,0,0,0,0|1,0,0]=2 875 B12R0.337 CCCN[C@H](C(=O)OCC)C(C)C c6b60a1cde88ba4504c2f2e6f3462f36 [0,1,0,0,0,0|1,0,0]=2 876 B12R0.337 CCCOC(C(=O)C)C(=O)OCC dec9e2932c90bfa1a2d70d7e93e7b38b [0,1,0,0,0,0|1,0,1]=3 877 B12R0.337 CCCOC(C(=O)OCC)C(C)C bbe6f4828f5872ee562fe55726354767 [0,1,0,0,0,0|1,0,0]=2 878 B12R0.337 CCCO[C@@H](C(=O)OCC)C(C)C 25f880b041d797ef430157cf4a5628af [0,1,0,0,0,0|1,0,0]=2 879 B12R0.337 CCOC(=O)C(NCC#N)C(C)C 3bbeb4475c7731ab53ad38b1fb668f8c [0,1,0,0,0,0|2,0,1]=4 880 B12R0.337 CCOC(=O)C(NCC=O)C(C)C 497eeaf5c320167bb162c10194cf5645 [0,1,0,0,0,0|2,0,1]=4 881 B12R0.337 CCOC(=O)C(NCCBr)C(=O)C 02b17aa8893a5be14c45fa64803584b6 [0,1,0,0,0,0|2,0,1]=4 882 B12R0.337 CCOC(=O)C(NCCBr)C(C)C 7c4dd95c2a7f82580bb727684d212dbf [0,1,0,0,0,0|2,0,0]=3 883 B12R0.337 CCOC(=O)C(NCCF)C(=O)C 93ff534f02159d91bc9863c676888d0f [0,1,0,0,0,0|2,0,1]=4 884 B12R0.337 CCOC(=O)C(NCCF)C(C)C 647f81a5744ee85acdeb4a17b90cd3a1 [0,1,0,0,0,0|2,0,0]=3 885 B12R0.337 CCOC(=O)C(NCCI)C(=O)C 4e0c8346817eaaa3fbf74bb749258e49 [0,1,0,0,0,0|2,0,1]=4 886 B12R0.337 CCOC(=O)C(NCCI)C(C)C 4b0b46ef99f08a7a25434d7f0f5a575d [0,1,0,0,0,0|2,0,0]=3 887 B12R0.337 CCOC(=O)C(NCCO)C(=O)C cdfb21fbff8715818c31469335162942 [0,1,0,0,0,0|2,0,1]=4 888 B12R0.337 CCOC(=O)C(NCCO)C(C)C d43dbe4a7171e5215d2dd1e5c7b209b6 [0,1,0,0,0,0|2,0,0]=3 889 B12R0.337 CCOC(=O)C(NCCS)C(=O)C 18cf2576ee0766daf383c989592918f0 [0,1,0,0,0,0|2,0,1]=4 890 B12R0.337 CCOC(=O)C(NCCS)C(C)C c6ef75b0acd5a193f21d401c282d9f07 [0,1,0,0,0,0|2,0,0]=3 891 B12R0.337 CCOC(=O)C(NCOC)C(C)C 75a6b2ac71792f9b549acc1cf362151e [0,1,0,0,0,0|2,0,0]=3 892 B12R0.337 CCOC(=O)C(NCSC)C(C)C d7d4025ff556b2d61e09ddcb599a59c7 [0,1,0,0,0,0|2,0,0]=3 893 B12R0.337 CCOC(=O)C(OCC#N)C(C)C ac7498e6ff31cb7a932aad58eb328405 [0,1,0,0,0,0|2,0,1]=4 894 B12R0.337 CCOC(=O)C(OCCF)C(C)C 810ebaf28acc828271299fb797f50563 [0,1,0,0,0,0|2,0,0]=3 895 B12R0.337 CCOC(=O)C(OCCS)C(=O)C 29840552be237e1b35b3bd14dbfd588b [0,1,0,0,0,0|2,0,1]=4 896 B12R0.337 CCOC(=O)C(OCCS)C(C)C 7a14dfef7f716e1f5cfe0c35be6d9c40 [0,1,0,0,0,0|2,0,0]=3 897 B12R0.337 CCOC(=O)C(OCOC)C(=O)C 420fbdd71130a4cf97dcfd272d3ed20e [0,1,0,0,0,0|2,0,1]=4 898 B12R0.337 CCOC(=O)C(OCOC)C(C)C 316b28061118c3678f6f957b0b60df37 [0,1,0,0,0,0|2,0,0]=3 899 B12R0.337 CCOC(=O)[C@@H](NCC#N)C(C)C b871ac9d568fb573428a3daf37c9cb89 [0,1,0,0,0,0|2,0,1]=4 900 B12R0.337 CCOC(=O)[C@@H](NCC=O)C(C)C 3031f2ad0ff442054d6e35f512587d8d [0,1,0,0,0,0|2,0,1]=4 901 B12R0.337 CCOC(=O)[C@@H](NCCF)C(C)C d5917efe336eca58944e27c4738ac7f3 [0,1,0,0,0,0|2,0,0]=3 902 B12R0.337 CCOC(=O)[C@@H](NCCO)C(C)C 5ef325a23231e1cf9a4e37067410317a [0,1,0,0,0,0|2,0,0]=3 903 B12R0.337 CCOC(=O)[C@@H](NCCS)C(C)C 5ba719760b871e14b02d70851533f8c6 [0,1,0,0,0,0|2,0,0]=3 904 B12R0.337 CCOC(=O)[C@@H](NCOC)C(C)C 29f7ebe2b11ef6998537923e380363a1 [0,1,0,0,0,0|2,0,0]=3 905 B12R0.337 CCOC(=O)[C@@H](NCSC)C(C)C 7e47209f9df86cfd994079cbd600a9a7 [0,1,0,0,0,0|2,0,0]=3 906 B12R0.337 CCOC(=O)[C@H](NCC#N)C(C)C 1a957fa98e280866794eab3d71e17acf [0,1,0,0,0,0|2,0,1]=4 907 B12R0.337 CCOC(=O)[C@H](NCC=O)C(C)C d4f69c30dbf6dac2fdb4b0f3133ebefd [0,1,0,0,0,0|2,0,1]=4 908 B12R0.337 CCOC(=O)[C@H](NCCBr)C(C)C 302f06864447163684096586ad2922d0 [0,1,0,0,0,0|2,0,0]=3 909 B12R0.337 CCOC(=O)[C@H](NCCF)C(C)C 009277044ac1d700a9a91ec9cd305587 [0,1,0,0,0,0|2,0,0]=3 910 B12R0.337 CCOC(=O)[C@H](NCCI)C(C)C ea69b26346ad25aa7e7ee1acc264419a [0,1,0,0,0,0|2,0,0]=3 911 B12R0.337 CCOC(=O)[C@H](NCCO)C(C)C 4e45eb7b65afecab98191035517ca5ea [0,1,0,0,0,0|2,0,0]=3 912 B12R0.337 CCOC(=O)[C@H](NCCS)C(C)C 25673a382e55e556e3ab8c1bcea5f5eb [0,1,0,0,0,0|2,0,0]=3 913 B12R0.337 CCOC(=O)[C@H](NCOC)C(C)C 5908cbdc811aa02e97c1ccfabe54c926 [0,1,0,0,0,0|2,0,0]=3 914 B12R0.337 CCOC(=O)[C@H](NCSC)C(C)C ef35939e96c53fcdf07b4d6c49f866a9 [0,1,0,0,0,0|2,0,0]=3 915 B12R0.337 CCOC(=O)[C@H](OCC#N)C(C)C cc18fe081373b7d5785e5e14710bc5b8 [0,1,0,0,0,0|2,0,1]=4 916 B12R0.337 CCOC(=O)[C@H](OCC=O)C(C)C c43dfe0a995307061d2d61c0aa42beea [0,1,0,0,0,0|2,0,1]=4 917 B12R0.337 CCOC(=O)[C@H](OCCF)C(C)C a136828d74eb97284a47894ca7127ac7 [0,1,0,0,0,0|2,0,0]=3 918 B12R0.337 CCOC(=O)[C@H](OCCS)C(C)C ce0d024a75b8b0904ddfb679edaa8563 [0,1,0,0,0,0|2,0,0]=3 919 B12R0.337 CCOC(=O)[C@H](OCOC)C(C)C 351e2a7d2fc282b91939567fc02200c5 [0,1,0,0,0,0|2,0,0]=3 920 B12R0.337 CCOC(=O)[C@H](OCSC)C(C)C c49c67eb7699491002047f488cf30d1f [0,1,0,0,0,0|2,0,0]=3 921 B12R0.351 C#CCCC(=O)N(CC)CCCC 4f43b9ae72582374502dd04505b34928 [0,1,0,0,0,0|2,0,1]=4 922 B12R0.351 C#CCNC(=O)N(CC)CCCC 3e458fb9c0e59445e3f66e9e041c8e7d [0,1,0,0,0,0|2,0,1]=4 923 B12R0.351 C/C=C/CC(=O)N(CC)CCCC a342d14cdcc3194a32d628196a0f11ea [0,1,0,0,0,0|2,0,1]=4 924 B12R0.351 C=CCCC(=O)N(CC)CCCC 73f0fb1d310d1d1e8925fa62f102b0f1 [0,1,0,0,0,0|2,0,1]=4 925 B12R0.351 CC#CCC(=O)N(CC)CCCC ab55be7a40c4651fce625949cad1c99b [0,1,0,0,0,0|2,0,1]=4 926 B12R0.351 CC/C=C/C(=O)N(CC)CCCC 0629a8641f73d5392022d9f9818926e9 [0,1,0,0,0,0|2,0,0]=3 927 B12R0.351 CC/C=C/C(=O)N(CC)CCCO 887797e8a344cdeecdd45e263c6409a1 [0,1,0,0,0,0|3,0,0]=4 928 B12R0.351 CC/C=C/C(=O)N(CC)CCOC eab7376cd7c0772b256af8b499caf579 [0,1,0,0,0,0|3,0,0]=4 929 B12R0.351 CC/C=C\C(=O)N(CC)CCCC 81c9fe5791de08a957df1a8874796230 [0,1,0,0,0,0|2,0,0]=3 930 B12R0.351 CC/C=C\C(=O)N(CC)CCCO 2c992871da385b62297cf86c02a7e3a0 [0,1,0,0,0,0|3,0,0]=4 931 B12R0.351 CC/C=C\C(=O)N(CC)CCOC 7de230428cc58c0c2d758b82d22dc69b [0,1,0,0,0,0|3,0,0]=4 932 B12R0.351 CCC#CC(=O)N(CC)CCCC 059a1ad46d76c737be8242a545da3d8c [0,1,0,0,0,0|2,0,0]=3 933 B12R0.351 CCC#CC(=O)N(CC)CCCO 723a3b28e5a5c6b608222b4964e1e146 [0,1,0,0,0,0|3,0,0]=4 934 B12R0.351 CCC#CC(=O)N(CC)CCOC 996e68df3cb34b907f80ed80c83c2ee3 [0,1,0,0,0,0|3,0,0]=4 935 B12R0.351 CCC=CC(=O)N(CC)CCCC 8dca77c8eac7fd6fef8efb2dea7dcebf [0,1,0,0,0,0|2,0,0]=3 936 B12R0.351 CCC=CC(=O)N(CC)CCCO 1d4e1073018a12fdb62bfe1acd4642f3 [0,1,0,0,0,0|3,0,0]=4 937 B12R0.351 CCC=CC(=O)N(CC)CCOC 27f97eb9c2600b60a17bb65abb6f1304 [0,1,0,0,0,0|3,0,0]=4 938 B12R0.351 CCCCC(=O)N(CC)CCCC e3e1de3ae2fd1c12da21b0b03c020cf0 [0,1,0,0,0,0|2,0,0]=3 939 B12R0.351 CCCCC(=O)N(CC)CCCO c74929df747d07f007f0f0321517e911 [0,1,0,0,0,0|3,0,0]=4 940 B12R0.351 CCCCC(=O)N(CC)CCOC 5e6be478c3547e8cd41469f4a3684733 [0,1,0,0,0,0|3,0,0]=4 941 B12R0.351 CCCCC(CC)N(C)CCCC 17440a999195827c25f5dc291fdd8455 [0,1,0,0,0,0|3,0,0]=4 942 B12R0.351 CCCCC(CC)N(C)CCCO 140440ca642d5562f80aa9f359ece4f8 [0,1,0,0,0,0|3,0,0]=4 943 B12R0.351 CCCCC(CC)N(C)CCOC 5ab33653feefb73fd9e66d34c9cfb375 [0,1,0,0,0,0|3,0,0]=4 944 B12R0.351 CCCCC(CC)N(C)CCSC c2a596e232bef329b39eaf610dd34f57 [0,1,0,0,0,0|3,0,0]=4 945 B12R0.351 CCCCN(CC)C(=O)/C=C/CF 2412ea962c2012c58835e76490af3a8b [0,1,0,0,0,0|2,0,1]=4 946 B12R0.351 CCCCN(CC)C(=O)/C=C/CO c1a632be457fc55779e2ff3b6d7f1d71 [0,1,0,0,0,0|2,0,1]=4 947 B12R0.351 CCCCN(CC)C(=O)/C=C/OC 000c6a58ba07711cc9d40d8c497dc31c [0,1,0,0,0,0|2,0,1]=4 948 B12R0.351 CCCCN(CC)C(=O)C#CCO 041a101dc431a21063e4d5fbe8e129d0 [0,1,0,0,0,0|2,0,1]=4 949 B12R0.351 CCCCN(CC)C(=O)C=CCO 2c617ea3d7b5c4ecfb4eacda49808b27 [0,1,0,0,0,0|2,0,1]=4 950 B12R0.351 CCCCN(CC)C(=O)C=COC b985e5d980473c3469091e96b61a3170 [0,1,0,0,0,0|2,0,1]=4 951 B12R0.351 CCCCN(CC)C(=O)CCC#N c859136e77b23b682381ffc547ebcd84 [0,1,0,0,0,0|2,0,1]=4 952 B12R0.351 CCCCN(CC)C(=O)CCC=O b0959006c98287af0fcc29978dd4cfa4 [0,1,0,0,0,0|2,0,1]=4 953 B12R0.351 CCCCN(CC)C(=O)CCCF 6bd52c287e8c3fde3606a60d69f5e089 [0,1,0,0,0,0|2,0,0]=3 954 B12R0.351 CCCCN(CC)C(=O)CCCS 135c422455c1d32b42ee0b9f89190cb4 [0,1,0,0,0,0|2,0,0]=3 955 B12R0.351 CCCCN(CC)C(=O)CCOC 64a099d61585164bcb8476e2fc23d69e [0,1,0,0,0,0|2,0,0]=3 956 B12R0.351 CCCCN(CC)C(=O)CCSC b6b3704868e92d4e248f24773fb40062 [0,1,0,0,0,0|2,0,0]=3 957 B12R0.351 CCCCN(CC)C(=O)COCC e951fba9b4db459709627036ec7d1b54 [0,1,0,0,0,0|1,0,0]=2 958 B12R0.351 CCCCN(CC)C(=O)CSCC ab3ca3cf5f00aed6359b99f5dd18052c [0,1,0,0,0,0|1,1,0]=3 959 B12R0.351 CCCCN(CC)C(=O)CSSC 1ca8bc8a9c266f55a3a101ceba37e697 [0,1,0,0,0,0|2,1,0]=4 960 B12R0.351 CCCCN(CC)C(=O)NCC#N 1518c199a526731cd9dad4219f50c00e [0,1,0,0,0,0|2,0,1]=4 961 B12R0.351 CCCCN(CC)C(=O)NCCC 987861560cd79d940d31d6bc77b1a882 [0,1,0,0,0,0|2,0,0]=3 962 B12R0.351 CCCCN(CC)C(=O)NCCF 87476d03cfa3e85d2f5846b546ab8203 [0,1,0,0,0,0|2,0,0]=3 963 B12R0.351 CCCCN(CC)C(=O)NCCN a5c4fd22c3f1ad2281f1511f1b653541 [0,1,0,0,0,0|2,0,0]=3 964 B12R0.351 CCCCN(CC)C(=O)NCCO de3eb8d726692de382a5d5acd0b9fcc8 [0,1,0,0,0,0|2,0,0]=3 965 B12R0.351 CCCCN(CC)C(=O)NCCS 38ff424475611faed45a5db89900f310 [0,1,0,0,0,0|2,0,0]=3 966 B12R0.351 CCCCN(CC)C(=S)NCCC 6d36c03aae56dd3feb5fcdcd30e79014 [0,1,0,0,0,0|2,1,0]=4 967 B12R0.351 CCCCN(CC)C(=S)NCCF 71e0d739ae650acf98f36e3374bd8b33 [0,1,0,0,0,0|2,1,0]=4 968 B12R0.351 CCCCN(CC)C(=S)NCCN d5af31b6f9351ce45620ad83542bc6fe [0,1,0,0,0,0|2,1,0]=4 969 B12R0.351 CCCCN(CC)C(=S)NCCO 3c8018cb9b761af95cf884e9d0f6cca4 [0,1,0,0,0,0|2,1,0]=4 970 B12R0.351 CCCCN(CC)C(=S)NCCS 82fe323b409fae9674bed2d804042bfc [0,1,0,0,0,0|2,1,0]=4 971 B12R0.351 CCCNC(=O)C(CC)NCCBr 434215f53c14943065d26c9618eaf4c2 [0,1,0,0,0,0|3,0,0]=4 972 B12R0.351 CCCNC(=O)C(CC)NCCC 55c3a452092de86bdfbe94c516e060a1 [0,1,0,0,0,0|2,0,0]=3 973 B12R0.351 CCCNC(=O)C(CC)NCCF ed78f6531008be5f0f1a75a0d47dd689 [0,1,0,0,0,0|3,0,0]=4 974 B12R0.351 CCCNC(=O)C(CC)NCCI 0c54fe8f39be8305c8f6505f1741c1bd [0,1,0,0,0,0|3,0,0]=4 975 B12R0.351 CCCNC(=O)C(CC)NCCO f474890da24d4d7486e7a1f24d61d985 [0,1,0,0,0,0|3,0,0]=4 976 B12R0.351 CCCNC(=O)C(CC)NCCS 38dcc2f34f94a679c5e94127b5ed9906 [0,1,0,0,0,0|3,0,0]=4 977 B12R0.351 CCCNC(=O)C(CC)OCCC c736ec5c1e9669fc628e9444f12d7072 [0,1,0,0,0,0|2,0,0]=3 978 B12R0.351 CCCNC(=O)C(CC)OCCF 932635414f3b85569dc8c717158c3964 [0,1,0,0,0,0|3,0,0]=4 979 B12R0.351 CCCNC(=O)C(CC)OCCS 52b42f0352b7dc08fcd779dccc6e1e12 [0,1,0,0,0,0|3,0,0]=4 980 B12R0.351 CCCNC(=O)C(CC)OCOC 03b944c2c76ddc38f9b4495185135fdc [0,1,0,0,0,0|3,0,0]=4 981 B12R0.351 CCCNC(=O)C(CCSC)OC bbbbb741dec0bad3a0d6b8a3d35aa436 [0,1,0,0,0,0|3,0,0]=4 982 B12R0.351 CCCNC(=O)N(CC)CCCO c8580353eb7363384666e56f67d7e7d2 [0,1,0,0,0,0|3,0,0]=4 983 B12R0.351 CCCNC(=O)N(CC)CCOC 8c42e196215895ce0f7b381ae02bb9b7 [0,1,0,0,0,0|3,0,0]=4 984 B12R0.351 CCCNC(=O)[C@H](CC)NCCC fa1cee9d596a93329159b880b3f1fa2e [0,1,0,0,0,0|2,0,0]=3 985 B12R0.351 CCCNC(=O)[C@H](CC)NCCF 30dd07b3c080be548e4ebbd7638e85b3 [0,1,0,0,0,0|3,0,0]=4 986 B12R0.351 CCCNC(=O)[C@H](CC)NCCO b480b7cee0bc5ac0942e470beb3e9781 [0,1,0,0,0,0|3,0,0]=4 987 B12R0.351 CCCNC(=O)[C@H](CC)NCCS 850c2d57ec62c5ca083f438eefed6bcd [0,1,0,0,0,0|3,0,0]=4 988 B12R0.351 CCCNC(=O)[C@H](CC)NCOC d320bd40c66156ad488d69f3b3d1f7d9 [0,1,0,0,0,0|3,0,0]=4 989 B12R0.351 CCCNC(=O)[C@H](CC)NCSC b36a3147111b6ee77bb35bbc54944b36 [0,1,0,0,0,0|3,0,0]=4 990 B12R0.351 CCN(CCCO)C(=O)CCCF 413c9abf8dceb522180f32ffd58d0ac0 [0,1,0,0,0,0|3,0,0]=4 991 B12R0.351 CCN(CCCO)C(=O)CCCS e69088faf46e37e6025f79fbde9e1427 [0,1,0,0,0,0|3,0,0]=4 992 B12R0.351 CCN(CCCO)C(=O)CCOC 686dcbc89f9f318f36294744eeb0152e [0,1,0,0,0,0|3,0,0]=4 993 B12R0.351 CCN(CCCO)C(=O)CCSC 1dfb7110b7a0555aa072bf14dca68171 [0,1,0,0,0,0|3,0,0]=4 994 B12R0.351 CCN(CCCO)C(=O)NCCF d40e8ab301966b03dadb07c5950f83cd [0,1,0,0,0,0|3,0,0]=4 995 B12R0.351 CCN(CCCO)C(=O)NCCN 4b33a81925afdb62ff02406525e19a12 [0,1,0,0,0,0|3,0,0]=4 996 B12R0.351 CCN(CCCO)C(=O)NCCO 389f8520e69da33c75fbf63a6caa2c14 [0,1,0,0,0,0|3,0,0]=4 997 B12R0.351 CCN(CCCO)C(=O)NCCS c78c406f2ebc7cb410437acb3ac19c79 [0,1,0,0,0,0|3,0,0]=4 998 B12R0.351 CCN(CCOC)C(=O)CCCF bb18e55ea186486e9a8614419b625871 [0,1,0,0,0,0|3,0,0]=4 999 B12R0.351 CCN(CCOC)C(=O)CCCS 0fadb52bfeb7fc3c20e67794a9dbaf57 [0,1,0,0,0,0|3,0,0]=4 1000 B12R0.351 CCN(CCOC)C(=O)CCOC f6e0558acbae58cea729f0cdfb8a6baf [0,1,0,0,0,0|3,0,0]=4 1001 B12R0.351 CCN(CCOC)C(=O)CCSC 106a8e6cb7ca8d07dc06292479b0a0ce [0,1,0,0,0,0|3,0,0]=4 1002 B12R0.351 CCN(CCOC)C(=O)NCCF 6bf7053395a053f681eaf5403d5355da [0,1,0,0,0,0|3,0,0]=4 1003 B12R0.351 CCN(CCOC)C(=O)NCCN 10917a2780dd1229bcf58fa6f7a923f3 [0,1,0,0,0,0|3,0,0]=4 1004 B12R0.351 CCN(CCOC)C(=O)NCCO 84070624e54c21f41ff2f31ccffef9cc [0,1,0,0,0,0|3,0,0]=4 1005 B12R0.351 CCN(CCOC)C(=O)NCCS a02c76936010690c9887fc5841086c41 [0,1,0,0,0,0|3,0,0]=4 1006 B12R0.351 CCOCC(=O)N(CC)CCC#N 82dbbde8c530e5ba4f6dba944c06aedb [0,1,0,0,0,0|2,0,1]=4 1007 B12R0.351 CCOCC(=O)N(CC)CCCO 3799efa2cb645ff6c48c733c23b43def [0,1,0,0,0,0|2,0,0]=3 1008 B12R0.351 CCOCC(=O)N(CC)CCOC 4981accea27a1e768c33a150bf2c0bd9 [0,1,0,0,0,0|2,0,0]=3 1009 B12R0.351 CCSCC(=O)N(CC)CCCO 4e441143c2f196bd90a0f1e57685bc31 [0,1,0,0,0,0|2,1,0]=4 1010 B12R0.351 CCSCC(=O)N(CC)CCOC ceb4fc176eadcf9051ec7df2718aa479 [0,1,0,0,0,0|2,1,0]=4 1011 B12R0.351 COC(CCSC)C(=O)NCCBr 09437d574d294e5227a3748ec926a93f [0,1,0,0,0,0|3,0,0]=4 1012 B12R0.351 COC(CCSC)C(=O)NCCF 2e5634b96f2452ac0b64ccd324b354e2 [0,1,0,0,0,0|3,0,0]=4 1013 B12R0.351 COC(CCSC)C(=O)NCCI 7b5ff90459879b3a3be6df756dbe9e21 [0,1,0,0,0,0|3,0,0]=4 1014 B12R0.351 COC(CCSC)C(=O)NCCO d77aa59fe2c6b8b3259c0c72d11f567e [0,1,0,0,0,0|3,0,0]=4 1015 B12R0.351 COC(CCSC)C(=O)NCCS 832cca36b351847d728a92100990bc3f [0,1,0,0,0,0|3,0,0]=4 1016 B12R0.363 C#CC(OCCCC)C(=O)OCC e3c32caffce98cf02b73ba20397a0ca0 [0,1,0,0,0,0|0,0,2]=3 1017 B12R0.363 C#CC(OCCCF)C(=O)OCC 20844cc24c9be3492a586c256a2e5cdf [0,1,0,0,0,0|1,0,2]=4 1018 B12R0.363 C#CC(OCCCS)C(=O)OCC 64e44f94a461dcdda7128bf91c1213cd [0,1,0,0,0,0|1,0,2]=4 1019 B12R0.363 C#CC(OCCOC)C(=O)OCC 55f1a610e0db1ffa47a99088a50c967b [0,1,0,0,0,0|1,0,2]=4 1020 B12R0.363 C#CC(OCCSC)C(=O)OCC c4d7ecb7f15f3cee45f616a9795eae0c [0,1,0,0,0,0|1,0,2]=4 1021 B12R0.363 C#CC(OCOCC)C(=O)OCC ae1cda77a005bf68a4bd3938c113767f [0,1,0,0,0,0|1,0,2]=4 1022 B12R0.363 C#CCCNC(CC)C(=O)CCC e998af08ee48b7c9cf7f73d999721a25 [0,1,0,0,0,0|1,0,2]=4 1023 B12R0.363 C#CCCNC(CC)C(=O)NCC 23f4de87059a9befba3238c0a7d83684 [0,1,0,0,0,0|1,0,2]=4 1024 B12R0.363 C#CCCNC(CC)C(=O)OCC 8b3f4c35e37409311ce7cce9c85d98ac [0,1,0,0,0,0|0,0,2]=3 1025 B12R0.363 C#CCCNC(CO)C(=O)OCC 1c9bb2eaefb8342bbc09b36f1731962f [0,1,0,0,0,0|1,0,2]=4 1026 B12R0.363 C#CCCN[C@@H](CC)C(=O)OCC adf0a9ce1d5adf2139da0c52f41ffa4b [0,1,0,0,0,0|0,0,2]=3 1027 B12R0.363 C#CCCN[C@H](CC)C(=O)OCC cc0914fe907055530b6769b484eb96e7 [0,1,0,0,0,0|0,0,2]=3 1028 B12R0.363 C#CCCOC(CC)C(=O)OCC 966104ccbc22df2333e2736e3c57d0b6 [0,1,0,0,0,0|0,0,2]=3 1029 B12R0.363 C#CCCO[C@@H](CC)C(=O)OCC 5d92d9aac1b91faaa21ec95e63f14228 [0,1,0,0,0,0|0,0,2]=3 1030 B12R0.363 C#CCCO[C@H](CC)C(=O)OCC 1615ee29e7471e5f095758660db14127 [0,1,0,0,0,0|0,0,2]=3 1031 B12R0.363 C/C=C/C(=O)N(CC)CCCCO 7f780f62c4d0c67a6c6a49fcb2a33576 [0,1,0,0,0,0|2,0,1]=4 1032 B12R0.363 C/C=C/C(=O)N(CC)CCCOC 16fa4158a40fe5d97845f63210bf30ec [0,1,0,0,0,0|2,0,1]=4 1033 B12R0.363 C/C=C/C(=O)N(CC)CCOCC d877ec7a401840def998c6db7877162c [0,1,0,0,0,0|2,0,1]=4 1034 B12R0.363 C/C=C/CNC(CC)C(=O)NCC 08584b32edf116bf0bb23257637bc79b [0,1,0,0,0,0|1,0,2]=4 1035 B12R0.363 C/C=C/CNC(CC)C(=O)OCC 3c4e1db80efab35b3e9aa69600134fdd [0,1,0,0,0,0|0,0,2]=3 1036 B12R0.363 C/C=C/CN[C@@H](CC)C(=O)OCC b174c29f804ccdffa88c23b98dc3063f [0,1,0,0,0,0|0,0,2]=3 1037 B12R0.363 C/C=C/CN[C@H](CC)C(=O)OCC cf913466446311aa3ccdb2627ca038c9 [0,1,0,0,0,0|0,0,2]=3 1038 B12R0.363 C/C=C/COC(CC)C(=O)OCC c9cb6893136a486f8d40b4c8d2934d50 [0,1,0,0,0,0|0,0,2]=3 1039 B12R0.363 C/C=C/COC(SC)C(=O)OCC eba8779acf06dd02e035caba871737c0 [0,1,0,0,0,0|1,0,2]=4 1040 B12R0.363 C/C=C/CO[C@@H](CC)C(=O)OCC e8ac1e99715f2ba7f8f080920c029fe6 [0,1,0,0,0,0|0,0,2]=3 1041 B12R0.363 C/C=C/CO[C@H](CC)C(=O)OCC 44f99c80d98ec72f2a96f1ba2a8b4c1c [0,1,0,0,0,0|0,0,2]=3 1042 B12R0.363 C/C=C\CNC(CC)C(=O)NCC d36accc78162b58f4334e8adc8f6ec57 [0,1,0,0,0,0|1,0,2]=4 1043 B12R0.363 C/C=C\CNC(CC)C(=O)OCC 30f26640aa1e1523df9dd25aeba46497 [0,1,0,0,0,0|0,0,2]=3 1044 B12R0.363 C/C=C\CN[C@@H](CC)C(=O)OCC 4be27d5286dc044736379cf6481fa826 [0,1,0,0,0,0|0,0,2]=3 1045 B12R0.363 C/C=C\CN[C@H](CC)C(=O)OCC 80a32a14d70de0b4e06b54924862d57c [0,1,0,0,0,0|0,0,2]=3 1046 B12R0.363 C/C=C\COC(CC)C(=O)OCC 2268afd90ceaed46d2d996c650bdc5a5 [0,1,0,0,0,0|0,0,2]=3 1047 B12R0.363 C/C=C\COC(SC)C(=O)OCC 38a08a6346272245cf396518eb102963 [0,1,0,0,0,0|1,0,2]=4 1048 B12R0.363 C/C=C\CO[C@@H](CC)C(=O)OCC d17a8b5960bd5f9af0cc0d19bc12e8ea [0,1,0,0,0,0|0,0,2]=3 1049 B12R0.363 C/C=C\CO[C@H](CC)C(=O)OCC 8ea2df7cd709a1260e4141119b98077b [0,1,0,0,0,0|0,0,2]=3 1050 B12R0.363 C=CCCNC(CC)C(=O)CCC c33744bc94d05f0db682d29386aad56e [0,1,0,0,0,0|1,0,2]=4 1051 B12R0.363 C=CCCNC(CC)C(=O)NCC 35ee7df1e0276777200a5890a636463c [0,1,0,0,0,0|1,0,2]=4 1052 B12R0.363 C=CCCNC(CC)C(=O)OCC 3e23c853897d79fe8484ded80b88544d [0,1,0,0,0,0|0,0,2]=3 1053 B12R0.363 C=CCCNC(CO)C(=O)OCC 98e5c37c4c1354f280553d13e6835245 [0,1,0,0,0,0|1,0,2]=4 1054 B12R0.363 C=CCCNC(SC)C(=O)OCC bc263fa943a7494092705a0eb6e3ed94 [0,1,0,0,0,0|1,0,2]=4 1055 B12R0.363 C=CCCN[C@@H](CC)C(=O)OCC 5bc3340501084a9bb5cb3b48b159be62 [0,1,0,0,0,0|0,0,2]=3 1056 B12R0.363 C=CCCN[C@H](CC)C(=O)OCC f82eb26897358644ef56b414d9aef565 [0,1,0,0,0,0|0,0,2]=3 1057 B12R0.363 C=CCCOC(CC)C(=O)CCC 6d046a5a28f2c05345ba662c0f606b3e [0,1,0,0,0,0|1,0,2]=4 1058 B12R0.363 C=CCCOC(CC)C(=O)OCC 3ef3573a78cfab1762a315ae5f8313de [0,1,0,0,0,0|0,0,2]=3 1059 B12R0.363 C=CCCO[C@@H](CC)C(=O)OCC 403cb531698b223b4640db9204142f67 [0,1,0,0,0,0|0,0,2]=3 1060 B12R0.363 C=CCCO[C@H](CC)C(=O)OCC 61c4b583d4de2d0d03e62e188b9b4aa3 [0,1,0,0,0,0|0,0,2]=3 1061 B12R0.363 CC#CC(=O)N(CC)CCCCO 16ecf00a384f64d8c1d42fbb56e11184 [0,1,0,0,0,0|2,0,1]=4 1062 B12R0.363 CC#CC(=O)N(CC)CCCOC f54e7e893b76018d121272646e8d1ac4 [0,1,0,0,0,0|2,0,1]=4 1063 B12R0.363 CC#CC(=O)N(CC)CCOCC ddbe3ea45a67d7065b2767d13e0d9839 [0,1,0,0,0,0|2,0,1]=4 1064 B12R0.363 CC#CCNC(CC)C(=O)CCC 67a540300880500008db9361911928bf [0,1,0,0,0,0|1,0,2]=4 1065 B12R0.363 CC#CCNC(CC)C(=O)OCC d4c85ec3b9fda6b2cffd9b78ad2f664a [0,1,0,0,0,0|0,0,2]=3 1066 B12R0.363 CC#CCNC(CO)C(=O)OCC bf692eb64847520c3cd871016f8a5d4d [0,1,0,0,0,0|1,0,2]=4 1067 B12R0.363 CC#CCOC(CC)C(=O)CCC d7a5f3ecf3b401f8d18affee5776b930 [0,1,0,0,0,0|1,0,2]=4 1068 B12R0.363 CC#CCOC(CC)C(=O)OCC 9403106ebc5c3ea49632faa1c17f4d71 [0,1,0,0,0,0|0,0,2]=3 1069 B12R0.363 CC=CCNC(CC)C(=O)CCC 3ae5458716d2e3bf0fc8e7da817a303a [0,1,0,0,0,0|1,0,2]=4 1070 B12R0.363 CC=CCNC(CC)C(=O)OCC e5ba546c5c2f5c8c450f3d38f1a452da [0,1,0,0,0,0|0,0,2]=3 1071 B12R0.363 CC=CCNC(CO)C(=O)OCC 495cf6105e2d34cfa3c8750123382b22 [0,1,0,0,0,0|1,0,2]=4 1072 B12R0.363 CC=CCNC(SC)C(=O)OCC 9c4efe76588830f36baaeee7cde73e78 [0,1,0,0,0,0|1,0,2]=4 1073 B12R0.363 CC=CCOC(CC)C(=O)OCC 9015a3e0e9ecb41c50ba7b3baa730bbb [0,1,0,0,0,0|0,0,2]=3 1074 B12R0.363 CC=CCOC(SC)C(=O)OCC 09a518fb8d8fd98a7c97ba121d01fc53 [0,1,0,0,0,0|1,0,2]=4 1075 B12R0.363 CCCC(=O)C(CC)NCCC#N 3439e9e4e456b7f671eee43a232313e0 [0,1,0,0,0,0|2,0,1]=4 1076 B12R0.363 CCCC(=O)C(CC)NCCCCl fd2c62fbbc506132aa0a7d1d08456457 [0,1,0,0,0,0|2,0,0]=3 1077 B12R0.363 CCCC(=O)C(CC)NCCCO 3f1a517ad0fa6b8a7806241e75ff546a [0,1,0,0,0,0|2,0,0]=3 1078 B12R0.363 CCCC(=O)C(CC)NCCOC dc993009b080781fceac9d81536ea8e5 [0,1,0,0,0,0|2,0,0]=3 1079 B12R0.363 CCCC(=O)C(CC)NCCON 1378120a1133cb35afddf42400289c1d [0,1,0,0,0,0|3,0,0]=4 1080 B12R0.363 CCCC(=O)C(CC)NCCSC 7f6fab20767666be344203d3a832f772 [0,1,0,0,0,0|2,0,0]=3 1081 B12R0.363 CCCC(=O)C(CC)OCCC#N 5621b4d7e91a0e460da7007e533e5feb [0,1,0,0,0,0|2,0,1]=4 1082 B12R0.363 CCCC(=O)C(CC)OCCCF a9b944278912a3c264af7463ecf61707 [0,1,0,0,0,0|2,0,0]=3 1083 B12R0.363 CCCC(=O)C(CC)OCCOC 9ddcbd298efbe16c0205b31f7975fdd6 [0,1,0,0,0,0|2,0,0]=3 1084 B12R0.363 CCCC(=O)N(CC)CCCCO 0f457157d074c578de2e1bbf821b15c4 [0,1,0,0,0,0|2,0,0]=3 1085 B12R0.363 CCCC(=O)N(CC)CCCOC eeef169cff0cba1d79d6aed85446648e [0,1,0,0,0,0|2,0,0]=3 1086 B12R0.363 CCCC(=O)N(CC)CCOCC 9d9aa1db099246d8dfb8fbee9e353cfa [0,1,0,0,0,0|2,0,0]=3 1087 B12R0.363 CCCCNC(C#N)C(=O)OCC fc922d8e814c7c7bbce810c232497250 [0,1,0,0,0,0|1,0,1]=3 1088 B12R0.363 CCCCNC(C=O)C(=O)OCC 08e42014c6f45221f0563cbe8e0ad52c [0,1,0,0,0,0|1,0,1]=3 1089 B12R0.363 CCCCNC(CC)C(=O)CCC 35f8a26e0b0c1bf18a3712b2f149bcf4 [0,1,0,0,0,0|1,0,0]=2 1090 B12R0.363 CCCCNC(CC)C(=O)NCC 7f64cc0f4bcc7a914e6099eb66b0f6ae [0,1,0,0,0,0|1,0,0]=2 1091 B12R0.363 CCCCNC(CC)C(=O)OCC 844e6479ebc2e0d53f4891802a771a4e [0,1,0,0,0,0|0,0,0]=1 1092 B12R0.363 CCCCNC(CO)C(=O)OCC cb75b7c493d46c4ca1b21110b15fa00a [0,1,0,0,0,0|1,0,0]=2 1093 B12R0.363 CCCCNC(SC)C(=O)OCC 1afb6678ed3fbc1aa86672d7ee33db49 [0,1,0,0,0,0|1,0,0]=2 1094 B12R0.363 CCCCN[C@@H](CC)C(=O)OCC c2c4fac10d32e05a7e2e51541bc99f89 [0,1,0,0,0,0|0,0,0]=1 1095 B12R0.363 CCCCN[C@H](CC)C(=O)OCC ad3937be404f51c2bce852333cfc11fd [0,1,0,0,0,0|0,0,0]=1 1096 B12R0.363 CCCCOC(C=O)C(=O)OCC 6d040e4140f314eb0c16f0a80d9ac13f [0,1,0,0,0,0|1,0,1]=3 1097 B12R0.363 CCCCOC(CC)C(=O)CCC 328e61b52f73fdce2e95b3ed35ccda0d [0,1,0,0,0,0|1,0,0]=2 1098 B12R0.363 CCCCOC(CC)C(=O)OCC a4017e2f869a25e3e58acb475f594ea0 [0,1,0,0,0,0|0,0,0]=1 1099 B12R0.363 CCCCOC(CC)C(C)CCC 4763b7a67418d578b0760eb5e4b99ac7 [0,1,0,0,0,0|2,0,1]=4 1100 B12R0.363 CCCCO[C@@H](CC)C(=O)OCC ee879e06d5fced0221657d5e65f8a9a6 [0,1,0,0,0,0|0,0,0]=1 1101 B12R0.363 CCCCO[C@H](CC)C(=O)OCC 35b67bec4174e10f0ffe24e3b61fb569 [0,1,0,0,0,0|0,0,0]=1 1102 B12R0.363 CCN(CCCCO)C(=O)CCF 95a3e9360718e4ce14ac5fabb3e3512e [0,1,0,0,0,0|3,0,0]=4 1103 B12R0.363 CCN(CCCCO)C(=O)CCO 79dd1eba7bdfbf7d0c7f19335b270882 [0,1,0,0,0,0|3,0,0]=4 1104 B12R0.363 CCN(CCCCO)C(=O)CCS 652e6eb1d4a6b7982b592954de33a4d7 [0,1,0,0,0,0|3,0,0]=4 1105 B12R0.363 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[0,1,0,0,0,0|1,0,0]=2 1192 B12R0.363 CCOC(=O)[C@H](CC)NCCCS 21badabfe98e4094cbc191772e88508d [0,1,0,0,0,0|1,0,0]=2 1193 B12R0.363 CCOC(=O)[C@H](CC)NCCOC 8ec8ec2b9dc8ceffeca1103d2f518f37 [0,1,0,0,0,0|1,0,0]=2 1194 B12R0.363 CCOC(=O)[C@H](CC)NCCSC 4f9ad34df6fe48ace7809c0c654bf340 [0,1,0,0,0,0|1,0,0]=2 1195 B12R0.363 CCOC(=O)[C@H](CC)NCSC#N a2033b196d16dd8e31369bd76fb8786f [0,1,0,0,0,0|2,0,1]=4 1196 B12R0.363 CCOC(=O)[C@H](CC)OC/C=C/Cl 870788a4e47ad05c5b2733ab086f9af9 [0,1,0,0,0,0|1,0,2]=4 1197 B12R0.363 CCOC(=O)[C@H](CC)OC/C=C\Cl ec867dc4394db8e71a79e409ac7207aa [0,1,0,0,0,0|1,0,2]=4 1198 B12R0.363 CCOC(=O)[C@H](CC)OCCC#N 3bf73c5291b5146ab9d4707de64c75d3 [0,1,0,0,0,0|1,0,1]=3 1199 B12R0.363 CCOC(=O)[C@H](CC)OCCC=O 129cc3c94d4fea59a98f0bce1dbceb63 [0,1,0,0,0,0|1,0,1]=3 1200 B12R0.363 CCOC(=O)[C@H](CC)OCCCF 1a950c69228fe7d2492e94ea9bf4d3ce [0,1,0,0,0,0|1,0,0]=2 1201 B12R0.363 CCOC(=O)[C@H](CC)OCCCS 3de43da7ee5480ac634ff63071ce994f [0,1,0,0,0,0|1,0,0]=2 1202 B12R0.363 CCOC(=O)[C@H](CC)OCCOC e9c9bdf35cf0a515ceeadfac4a0a8893 [0,1,0,0,0,0|1,0,0]=2 1203 B12R0.363 CCOC(=O)[C@H](CC)OCCSC d5aa91bb45cbc2ada998b163f22c4e31 [0,1,0,0,0,0|1,0,0]=2 1204 B12R0.363 CCOC(=O)[C@H](CC)OCSC#N 29fd370e7a533e93c325bdc45f3ef8c0 [0,1,0,0,0,0|2,0,1]=4 1205 B12R0.363 CCOCCN(CC)C(=O)CCF 2e28734c50373cfd2911f98e488b3dbc [0,1,0,0,0,0|3,0,0]=4 1206 B12R0.363 CCOCCN(CC)C(=O)CCO f206377aa7ff46fcc9a904960701a831 [0,1,0,0,0,0|3,0,0]=4 1207 B12R0.363 CCOCCN(CC)C(=O)CCS 44d5c7b53fdbc25cd39916748d3dd6ad [0,1,0,0,0,0|3,0,0]=4 1208 B12R0.363 CCOCCN(CC)C(=O)COC 542996b58aa8f3989052a8dde252926f [0,1,0,0,0,0|3,0,0]=4 1209 B12R0.363 CCOCCN(CC)C(=O)CSC 4eb9fdc079a1352e03203730570f855e [0,1,0,0,0,0|3,0,0]=4 1210 B12R0.363 CCOCNC(C#N)C(=O)OCC f05bff816f813f9549bdc178263b730c [0,1,0,0,0,0|2,0,1]=4 1211 B12R0.363 CCOCNC(CC)C(=O)OCC a3d0ac59023d5a04ca1773ba0b528d5b [0,1,0,0,0,0|1,0,0]=2 1212 B12R0.363 CCOCN[C@@H](CC)C(=O)OCC f3ccfd480d72f116178be9369596ce96 [0,1,0,0,0,0|1,0,0]=2 1213 B12R0.363 CCOCN[C@H](CC)C(=O)OCC 6fe04d5bbc30f93923a6178000e0a6f4 [0,1,0,0,0,0|1,0,0]=2 1214 B12R0.363 CCOCOC(CC)C(=O)OCC be6dd828042249d53952cffbc98f3d15 [0,1,0,0,0,0|1,0,0]=2 1215 B12R0.363 CCOCO[C@@H](CC)C(=O)OCC a70a4e3ebd52ab923be296e838ab1403 [0,1,0,0,0,0|1,0,0]=2 1216 B12R0.363 CCOCO[C@H](CC)C(=O)OCC fc8a62db5b66171d50d1005b4f1b45d1 [0,1,0,0,0,0|1,0,0]=2 1217 B12R1.16 C/C=C/C(=O)N1CCC(CC1)C 8eeab073a55f3a29f7c8bf18c1b72e71 [0,0,0,1,0,0|2,0,1]=4 1218 B12R1.16 CC#CC(=O)N1CCC(CC1)C bda9b02a90138c92986db00706eebb3e [0,0,0,1,0,0|2,0,1]=4 1219 B12R1.16 CC1CCN(CC1)C(=O)CCF 17e26a40d40bd1a74c4b48270bc9e143 [0,0,0,1,0,0|3,0,0]=4 1220 B12R1.16 CC1CCN(CC1)C(=O)CCO c8f1748164c80d52812c349d3809b12d [0,0,0,1,0,0|3,0,0]=4 1221 B12R1.16 CC1CCN(CC1)C(=O)CCS e6b3577333ceb086f3acae7dfcd77698 [0,0,0,1,0,0|3,0,0]=4 1222 B12R1.16 CCCC(=O)N1CCC(CC1)C 23c13642fbb293b1ecce1385e683f866 [0,0,0,1,0,0|2,0,0]=3 1223 B12R1.16 CCCC(=O)N1CCC(CC1)Cl 51f2d25419fc2497a9235127b7d16a04 [0,0,0,1,0,0|3,0,0]=4 1224 B12R1.16 CCCC(=O)N1CCC(CC1)F 1ce748132d23ea85b667f84b5ff4fb1d [0,0,0,1,0,0|3,0,0]=4 1225 B12R1.16 CCCC(=O)N1CCC(CC1)I 53f96568adaaa76b1cf02c498a33e122 [0,0,0,1,0,0|3,0,0]=4 1226 B12R1.16 CCCC(=O)N1CCC(CC1)O dff86cd76f333260b5737374b7da3c84 [0,0,0,1,0,0|3,0,0]=4 1227 B12R1.16 CCCC(=O)N1CCN(CC1)C 20bbeff5b6042cd07396b427898b8e7f [0,0,0,1,0,0|3,0,0]=4 1228 B12R1.16 CCCN(C)C1CCC(CC1)C ab63cf17369a2697fa21c8a35db58a71 [0,0,0,1,0,0|3,0,0]=4 1229 B12R1.16 CCCN(C)[C@H]1CC[C@@H](CC1)C 7511a1626912c3dd5c2764839f90b6e5 [0,0,0,1,0,0|3,0,0]=4 1230 B12R1.16 CCOC(C)C1CCN(CC1)C 0fd46c7f1b20d64a32d590229ea0f8b4 [0,0,0,1,0,0|2,0,1]=4 1231 B12R1.16 COCC(=O)N1CCC(CC1)C 5d393433f52b81ecaad68fd6a57b667e [0,0,0,1,0,0|3,0,0]=4 1232 B12R1.16 CSCC(=O)N1CCC(CC1)C 4fea61568fd8224756bf48cffe7036a9 [0,0,0,1,0,0|3,0,0]=4 1233 B12R1.18 CCCNC1CCCCCC1=O f3f393887363398b7fbe92d37dd3e1fa [0,0,0,1,0,0|2,0,0]=3 1234 B12R1.18 CCCNC1CCCCNC1=O 5d0e2872b61eb3c2267a59c55f8742c4 [0,0,0,1,0,0|2,0,0]=3 1235 B12R1.18 CCCN[C@@H]1CCCCNC1=O 8fcecb64fa38650420280a7152151968 [0,0,0,1,0,0|2,0,0]=3 1236 B12R1.18 CCCN[C@H]1CCCCNC1=O b31e0a64a7315e1106bc7fd59e79b4a3 [0,0,0,1,0,0|2,0,0]=3 1237 B12R1.18 CCCOC1CCCCCC1=O 4ba42e6fd237c418e07f214d26aae088 [0,0,0,1,0,0|2,0,0]=3 1238 B12R1.18 CCCOC1CCCCNC1=O 84e533f3c33adce4300be5f475cea46e [0,0,0,1,0,0|2,0,0]=3 1239 B12R1.18 CCOCN1CCCCCC1=O e87528f86aa0ece4ca14e3461284ca9e [0,0,0,1,0,0|3,0,0]=4 1240 B12R1.18 COCNC1CCCCNC1=O 9415e167b6545fb03c5fd2a10efabc86 [0,0,0,1,0,0|3,0,0]=4 1241 B12R1.18 COCN[C@@H]1CCCCNC1=O de95dfba567b13481180e26a66507753 [0,0,0,1,0,0|3,0,0]=4 1242 B12R1.18 COCN[C@H]1CCCCNC1=O 5303a12ee13638914480711f3b85b00f [0,0,0,1,0,0|3,0,0]=4 1243 B12R1.18 COCOC1CCCCCC1=O 10fecf3c88b91d89befb9b81f738b984 [0,0,0,1,0,0|3,0,0]=4 1244 B12R1.18 COCOC1CCCCNC1=O c16c5b28852f255d71146a865a41b042 [0,0,0,1,0,0|3,0,0]=4 1245 B12R1.18 CSCNC1CCCCNC1=O ca8f23607ec207478d4b4489cb383b62 [0,0,0,1,0,0|3,0,0]=4 1246 B12R1.18 CSCN[C@@H]1CCCCNC1=O 26c8260ea992622ac7344e554833ca22 [0,0,0,1,0,0|3,0,0]=4 1247 B12R1.18 CSCN[C@H]1CCCCNC1=O 024d226acc4a39edb80db32e1ed252b1 [0,0,0,1,0,0|3,0,0]=4 1248 B12R1.18 CSCOC1CCCCCC1=O d39e9fc8fb79a3e3963500dccc28099f [0,0,0,1,0,0|3,0,0]=4 1249 B12R1.18 O=C1CCCCCC1NCCI 34940666d4eebc8a7253549595a8e8bc [0,0,0,1,0,0|3,0,0]=4 1250 B12R1.18 O=C1CCCCCC1NCCO 6beeb3978b5a99290a2455388689137a [0,0,0,1,0,0|3,0,0]=4 1251 B12R1.18 O=C1CCCCCC1NCCS d449417aca75bbcd9e53a5784b706c12 [0,0,0,1,0,0|3,0,0]=4 1252 B12R1.18 O=C1CCCCCC1OCCF 0380f61176c2937d4ddefb5b274a6b0d [0,0,0,1,0,0|3,0,0]=4 1253 B12R1.18 O=C1CCCCCC1OCCS d0fc6788b006a9e800a1a34a31a9c831 [0,0,0,1,0,0|3,0,0]=4 1254 B12R1.18 O=C1NCCCCC1NCCF 8f3bf35e4bdfa3fae5e77f56fcc7b5ce [0,0,0,1,0,0|3,0,0]=4 1255 B12R1.18 O=C1NCCCCC1NCCI 04c34a585f13b4e1f3d67776ad3f6902 [0,0,0,1,0,0|3,0,0]=4 1256 B12R1.18 O=C1NCCCCC1NCCO 19bdec28b280ed6d260ec52a772d4dc4 [0,0,0,1,0,0|3,0,0]=4 1257 B12R1.18 O=C1NCCCCC1NCCS 92d14666ff2eeb28611f0d0b6556075b [0,0,0,1,0,0|3,0,0]=4 1258 B12R1.18 O=C1NCCCCC1OCCF 6458722d00820951bd14307ae9e8b8d9 [0,0,0,1,0,0|3,0,0]=4 1259 B12R1.18 O=C1NCCCCC1OCCS 3e9cdcaeff1a1bc5f738970286586a10 [0,0,0,1,0,0|3,0,0]=4 1260 B12R1.18 O=C1NCCCC[C@@H]1NCCF 12feeb1a7251068b07b75df1ded9aedb [0,0,0,1,0,0|3,0,0]=4 1261 B12R1.18 O=C1NCCCC[C@@H]1NCCO 300f89df3c268fcd664365864ba52872 [0,0,0,1,0,0|3,0,0]=4 1262 B12R1.18 O=C1NCCCC[C@@H]1NCCS a8116f314e3ccf9c7dd3700e75386f32 [0,0,0,1,0,0|3,0,0]=4 1263 B12R1.18 O=C1NCCCC[C@H]1NCCF b68e04a0fd3a292032e0dda4dfea4db6 [0,0,0,1,0,0|3,0,0]=4 1264 B12R1.18 O=C1NCCCC[C@H]1NCCO 281946993c09d6b68cfafdd800b61daa [0,0,0,1,0,0|3,0,0]=4 1265 B12R1.18 O=C1NCCCC[C@H]1NCCS 0861d695ac6335dcae3da33a0206d494 [0,0,0,1,0,0|3,0,0]=4 1266 B12R1.308 C/C=C/C(=O)N1CCCCC1C ac073b47dcae90ccc443eade762a5f01 [0,0,0,1,0,0|2,0,1]=4 1267 B12R1.308 C/C=C/C(=O)N1CCCC[C@@H]1C b17e7b8cd7f32f02e72f927c1e0660c7 [0,0,0,1,0,0|2,0,1]=4 1268 B12R1.308 C/C=C/C(=O)N1CCCC[C@H]1C cd7c5b96bef385c94ab1fc188ef2995d [0,0,0,1,0,0|2,0,1]=4 1269 B12R1.308 CC#CC(=O)N1CCCCC1C e52b13f08467f932dfb5dca531e1f1a0 [0,0,0,1,0,0|2,0,1]=4 1270 B12R1.308 CC#CC(=O)N1CCCC[C@@H]1C 76e59f81bb7c64eeb3ef8ed4ed17b928 [0,0,0,1,0,0|2,0,1]=4 1271 B12R1.308 CC#CC(=O)N1CCCC[C@H]1C 13f5e22de0383e6f6f0aa8119d837c34 [0,0,0,1,0,0|2,0,1]=4 1272 B12R1.308 CC1CCCCN1C(=O)CCF 7b8a5b460e8159c07dbad5e3c921a47c [0,0,0,1,0,0|3,0,0]=4 1273 B12R1.308 CC1CCCCN1C(=O)CCO 19c356f7216d272ff32bd4545ad884be [0,0,0,1,0,0|3,0,0]=4 1274 B12R1.308 CC1CCCCN1C(=O)CCS d2d9d594554916f20357a326c3f43458 [0,0,0,1,0,0|3,0,0]=4 1275 B12R1.308 CCCC(=O)N1CCCCC1C 7d075d0c0acf0d9446431e41494dcc3e [0,0,0,1,0,0|2,0,0]=3 1276 B12R1.308 CCCC(=O)N1CCCC[C@@H]1C 5e8ed4ab5c1c0bd8bb3ebc86f1d3822a [0,0,0,1,0,0|2,0,0]=3 1277 B12R1.308 CCCC(=O)N1CCCC[C@H]1C eb466f6802ecb7cb17e439645fd356fd [0,0,0,1,0,0|2,0,0]=3 1278 B12R1.308 CCCC(=O)N1CCOCC1C 67f11d72198c4e0ad84fe5a87f254c29 [0,0,0,1,0,0|3,0,0]=4 1279 B12R1.308 CCCC(=O)N1CCOC[C@@H]1C de7974f38d7981d624657fcb83be6501 [0,0,0,1,0,0|3,0,0]=4 1280 B12R1.308 CCCC(=O)N1CCOC[C@H]1C 5ed03702f0027c4b56db85ef9735dc22 [0,0,0,1,0,0|3,0,0]=4 1281 B12R1.308 CCCN(C)[C@H]1CCCC[C@H]1C c5612c1345b5359be3369a606808a2d7 [0,0,0,1,0,0|3,0,0]=4 1282 B12R1.308 COCC(=O)N1CCCCC1C fba159af9f1c69e71f1edfe954b7830b [0,0,0,1,0,0|3,0,0]=4 1283 B12R1.308 COCC(=O)N1CCCC[C@@H]1C 61ab9f316916c39a3a7a4be95036a412 [0,0,0,1,0,0|3,0,0]=4 1284 B12R1.308 COCC(=O)N1CCCC[C@H]1C 938ef73806a1e383b6391f3fcf736dd0 [0,0,0,1,0,0|3,0,0]=4 1285 B12R1.308 CSCC(=O)N1CCCCC1C 14a27e8d39b6374d7abc68da3a1ce64b [0,0,0,1,0,0|3,0,0]=4 1286 B12R1.308 CSCC(=O)N1CCCC[C@@H]1C 044ff204d2ad41dfe9fb7d4d636436ae [0,0,0,1,0,0|3,0,0]=4 1287 B12R1.308 CSCC(=O)N1CCCC[C@H]1C 2533225d2158143b6d105536f4812abb [0,0,0,1,0,0|3,0,0]=4 1288 B12R1.308 C[C@@H]1CCCCN1C(=O)CCF ceb9043a0baef29cf57044ffdc517d38 [0,0,0,1,0,0|3,0,0]=4 1289 B12R1.308 C[C@@H]1CCCCN1C(=O)CCO c3f94124ef8e1ea08c8e16a10c70c853 [0,0,0,1,0,0|3,0,0]=4 1290 B12R1.308 C[C@@H]1CCCCN1C(=O)CCS ee6d5fb342fc6fba89c25f2e9f4665f1 [0,0,0,1,0,0|3,0,0]=4 1291 B12R1.308 C[C@H]1CCCCN1C(=O)CCF a8bdaf06cd123d1100398ebe0a19ea09 [0,0,0,1,0,0|3,0,0]=4 1292 B12R1.308 C[C@H]1CCCCN1C(=O)CCO 74eed4db8a26914875a04cd88c8a2b70 [0,0,0,1,0,0|3,0,0]=4 1293 B12R1.308 C[C@H]1CCCCN1C(=O)CCS 5b4de33745f2d384510be5481d908e39 [0,0,0,1,0,0|3,0,0]=4 1294 B12R1.312 C/C=C/C(=O)N1CCC(C1)CC dfa1780f3ec1a7b066a2697303885301 [0,0,0,1,0,0|2,0,1]=4 1295 B12R1.312 CC#CC(=O)N1CCC(C1)CC 4b1db782cb90dc036536e48951e20568 [0,0,0,1,0,0|2,0,1]=4 1296 B12R1.312 CCC1CCN(C1)C(=O)CCF 8cbbc3c906fc44c8234d52e1da002cac [0,0,0,1,0,0|3,0,0]=4 1297 B12R1.312 CCC1CCN(C1)C(=O)CCO 47faea54ab668b9544769a1680a779b6 [0,0,0,1,0,0|3,0,0]=4 1298 B12R1.312 CCC1CCN(C1)C(=O)CCS f8aef378c009fb7590b341aab8b6c5e1 [0,0,0,1,0,0|3,0,0]=4 1299 B12R1.312 CCC1CCN(C1)C(=O)COC 16d924bf0a877ae7cf945792e5c4cc7b [0,0,0,1,0,0|3,0,0]=4 1300 B12R1.312 CCC1CCN(C1)C(=O)CSC 5106447a899c68cae075923dbfd1d09b [0,0,0,1,0,0|3,0,0]=4 1301 B12R1.312 CCCC(=O)N1CCC(C1)CC 523ef14985a1b1f4a940e3e5749e23c6 [0,0,0,1,0,0|2,0,0]=3 1302 B12R1.312 CCCC(=O)N1CCC(C1)CO 2a59f2aa7e047f8e613c435c25145cb2 [0,0,0,1,0,0|3,0,0]=4 1303 B12R1.312 CCCC(=O)N1CCC(C1)OC 1de80132e9e0a75cf199392b1d56e172 [0,0,0,1,0,0|3,0,0]=4 1304 B12R1.312 CCCC(=O)N1CC[C@@H](C1)CO b5740ab6ff447e1b7e5280fc9ed0e7f8 [0,0,0,1,0,0|3,0,0]=4 1305 B12R1.312 CCCC(=O)N1CC[C@@H](C1)OC a2bd47e9fea6d24dd0936f1f197b9166 [0,0,0,1,0,0|3,0,0]=4 1306 B12R1.312 CCCC(=O)N1CC[C@H](C1)CO b0208ea09607fc0a524395b32229c0b6 [0,0,0,1,0,0|3,0,0]=4 1307 B12R1.312 CCCC(=O)N1CC[C@H](C1)OC e0c35d5ec5791b8ea88a051665f55c28 [0,0,0,1,0,0|3,0,0]=4 1308 B12R1.312 CCNC(=O)C1CCN(C1)CC 2e79dcc8b7c8c3a8410549e667c69dd2 [0,0,0,1,0,0|2,0,0]=3 1309 B12R1.312 CCNC(=O)C1CCN(C1)CF 46cf1e189858fd032535412bb2116d19 [0,0,0,1,0,0|3,0,0]=4 1310 B12R1.312 CCNC(=O)C1CCN(C1)CO 3cb07514137075473c3b60a36a8a4b98 [0,0,0,1,0,0|3,0,0]=4 1311 B12R1.312 CCOC(=O)C1CCN(C1)C=O f51a975a1f6c1a72ad9d882fcee66513 [0,0,0,1,0,0|2,0,1]=4 1312 B12R1.312 CCOC(=O)C1CCN(C1)CC cbcc3667e624aaa41801c105d8271f91 [0,0,0,1,0,0|1,0,0]=2 1313 B12R1.312 CCOC(=O)C1CCN(C1)CF 3028ee1d5ae21067cc55942300290a9d [0,0,0,1,0,0|2,0,0]=3 1314 B12R1.312 CCOC(=O)C1CCN(C1)CO 8da8e670bcf654d6a90c4df4aca0df84 [0,0,0,1,0,0|2,0,0]=3 1315 B12R1.312 CCOC(=O)[C@H]1CCN(C1)C=O 6fde4ccccd59e12540cf0c2d8f2b1984 [0,0,0,1,0,0|2,0,1]=4 1316 B12R1.312 CCOC(=O)[C@H]1CCN(C1)CC fe9682f768cf4831a1cac150ebd7a850 [0,0,0,1,0,0|1,0,0]=2 1317 B12R1.312 CCOC(=O)[C@H]1CCN(C1)CF 8c1f839143b6f92da2fbd88ea6d6a028 [0,0,0,1,0,0|2,0,0]=3 1318 B12R1.312 CCOC(=O)[C@H]1CCN(C1)CO 6b843993b5b7be2dce4f0f23186d188d [0,0,0,1,0,0|2,0,0]=3 1319 B12R1.320 CCCCC1CCCC1NCC 0ce98edd89a206f3bb2a11291e2c2050 [0,0,0,1,0,0|2,0,1]=4 1320 B12R1.320 CCCCC1CCCN1CCC b5a2b6294e0043e42780d2363eb74ea3 [0,0,0,1,0,0|3,0,0]=4 1321 B12R1.535 CCCC(=O)N1CCC1CCO 4ebcb8437d3c75c4adfbbf8482523cc3 [0,0,0,1,0,0|3,0,0]=4 1322 B12R1.535 CCCC(=O)N1CCC1COC 4c23fb03021907cccd8f4393babe8e97 [0,0,0,1,0,0|3,0,0]=4 1323 B12R1.535 CCCC(=O)N1CC[C@@H]1COC 2c0c148b3925a405a0c0ff37185be227 [0,0,0,1,0,0|3,0,0]=4 1324 B12R1.535 CCCC(=O)N1CC[C@H]1COC 9cd6fa261a43687a30b7a7abc12def7a [0,0,0,1,0,0|3,0,0]=4 1325 B12R1.535 CCOC(=O)C1CCC1NC#N bb2aecc57b1aac53c3be22b41198cdc2 [0,0,0,1,0,0|2,0,1]=4 1326 B12R1.542 CCC1C(=O)NCCN1CCF ba9f85d2a1a73427458cb456f10426c1 [0,0,0,1,0,0|3,0,0]=4 1327 B12R1.542 CCC1C(=O)NCCN1CCO f695d01919cad032260b6962a04d8bdb [0,0,0,1,0,0|3,0,0]=4 1328 B12R1.542 CCC1C(=O)NCCN1CCS e5a051971b5411fa0d3226439115e9c5 [0,0,0,1,0,0|3,0,0]=4 1329 B12R1.542 CCC1C(=O)NCCN1COC 2286dfbe9d721d911339406021a8ea8f [0,0,0,1,0,0|3,0,0]=4 1330 B12R1.542 CCC1C(=O)NCCN1CSC 5d7003864a175bd381e926b203571564 [0,0,0,1,0,0|3,0,0]=4 1331 B12R1.542 CCCN1CCNC(=O)C1CC 459f9374ebcb2ea4ee16c7e8fe87fb61 [0,0,0,1,0,0|2,0,0]=3 1332 B12R1.1564 C/C=C/C(=O)N1CCCCCC1 9385866b96304f18026e9abc8938ff7f [0,0,0,1,0,0|2,0,1]=4 1333 B12R1.1564 CC#CC(=O)N1CCCCCC1 1edb6ffc6845ced5928170e8a0ce7d52 [0,0,0,1,0,0|2,0,1]=4 1334 B12R1.1564 CCCC(=O)N1CCCCCC1 c25794177b8e15af54f79094fb5eac9e [0,0,0,1,0,0|2,0,0]=3 1335 B12R1.1564 CCCC(=O)N1CCCOCC1 66461f91becce906ea921a3c4df23de2 [0,0,0,1,0,0|3,0,0]=4 1336 B12R1.1564 CCCN(C)C1CCCCCC1 9cfd8f841e2a0caeb3e9f961ad0eabfb [0,0,0,1,0,0|3,0,0]=4 1337 B12R1.1564 COCC(=O)N1CCCCCC1 dfb00865ff4a1fc706e130ab86e8f6a4 [0,0,0,1,0,0|3,0,0]=4 1338 B12R1.1564 CSCC(=O)N1CCCCCC1 d023aa99d82b342fd71c894f74c6f2ca [0,0,0,1,0,0|3,0,0]=4 1339 B12R1.1564 O=C(CCF)N1CCCCCC1 cb76c8a380ee604382f54b0ed8886c2e [0,0,0,1,0,0|3,0,0]=4 1340 B12R1.1564 O=C(CCO)N1CCCCCC1 4c754653de52cca260433e1838e42358 [0,0,0,1,0,0|3,0,0]=4 1341 B12R1.1564 O=C(CCS)N1CCCCCC1 b6fce1d6974e3d722d716b0d59cfdb5c [0,0,0,1,0,0|3,0,0]=4 1342 B12R1.1574 C/C=C/C(=O)N(CC)C1CCC1 2c152bd2e70fedda151190ffc93041df [0,0,0,1,0,0|2,0,1]=4 1343 B12R1.1574 CC#CC(=O)N(CC)C1CCC1 eeb920fb01d6b6dc2be7b57da3ada08b [0,0,0,1,0,0|2,0,1]=4 1344 B12R1.1574 CCCC(=O)C(CC)N1CCC1 96a95ef23e9ad8563c3956647876fd71 [0,0,0,1,0,0|2,0,0]=3 1345 B12R1.1574 CCCC(=O)N(CC)C1CCC1 7411387450dc6dab8ea84939c709bbf4 [0,0,0,1,0,0|2,0,0]=3 1346 B12R1.1574 CCCC(=O)N(CC)C1COC1 2d00242f44514b68baadf4dddc8ebf95 [0,0,0,1,0,0|3,0,0]=4 1347 B12R1.1574 CCCC(=O)N(CC)C1CSC1 6b1bd0241dfb301cc67ffd519d27ace3 [0,0,0,1,0,0|3,0,0]=4 1348 B12R1.1574 CCN(C(=O)CCF)C1CCC1 95903c3c78dc8ebb16d1df1c40ee7647 [0,0,0,1,0,0|3,0,0]=4 1349 B12R1.1574 CCN(C(=O)CCO)C1CCC1 4902de9e18213f08b243b457111df588 [0,0,0,1,0,0|3,0,0]=4 1350 B12R1.1574 CCN(C(=O)CCS)C1CCC1 1b5c83a6c70f13443886789b9af595df [0,0,0,1,0,0|3,0,0]=4 1351 B12R1.1574 CCN(C(=O)COC)C1CCC1 ac79cbe559e08e659bb3aa524640dcf5 [0,0,0,1,0,0|3,0,0]=4 1352 B12R1.1574 CCN(C(=O)CSC)C1CCC1 bb544446d5bb400be6e91db0e611fa9e [0,0,0,1,0,0|3,0,0]=4 1353 B12R1.1574 CCOC(=O)C(C=O)N1CCC1 ed986ab3a8128f8827b06bc240c40caa [0,0,0,1,0,0|2,0,1]=4 1354 B12R1.1574 CCOC(=O)C(CC)N1CCC1 f5a8131b7162b0de8af5e43d4d87fa4a [0,0,0,1,0,0|1,0,0]=2 1355 B12R1.1574 CCOC(=O)C(CO)N1CCC1 a49d3d4cb533721351f14e75dd0e6360 [0,0,0,1,0,0|2,0,0]=3 1356 B12R1.1574 CCOC(=O)C(SC)N1CCC1 d942c90d326085cdb92a6c9f889cd569 [0,0,0,1,0,0|2,0,0]=3 1357 B12R1.1576 C#CC(OC1CC1)C(=O)OCC aa1a07ab7d6e6d53d1d46ad7d09320f2 [0,0,0,1,0,0|1,0,2]=4 1358 B12R1.1576 C/C=C/C(=O)N(CC)CC1CC1 f21816ac1ec9eedd412ff12e3a29341d [0,0,0,1,0,0|2,0,1]=4 1359 B12R1.1576 CC#CC(=O)N(CC)CC1CC1 b87ab66fb59faff2bff8e86bc09abe32 [0,0,0,1,0,0|2,0,1]=4 1360 B12R1.1576 CCCC(=O)C(CC)NC1CC1 84c4d851b587b30b5cb71edc243a8180 [0,0,0,1,0,0|2,0,0]=3 1361 B12R1.1576 CCCC(=O)C(CC)OC1CC1 2d146957b32608a1127fe97f6ee82a28 [0,0,0,1,0,0|2,0,0]=3 1362 B12R1.1576 CCCC(=O)N(CC)CC1CC1 e352bb60f7c85b6e914dec64f5848046 [0,0,0,1,0,0|2,0,0]=3 1363 B12R1.1576 CCN(CC1CC1)C(=O)CCF 7b9c3132c4db05dcd2f8602564c624c5 [0,0,0,1,0,0|3,0,0]=4 1364 B12R1.1576 CCN(CC1CC1)C(=O)CCO 0c8579d06790319ab3aaf43f713d310b [0,0,0,1,0,0|3,0,0]=4 1365 B12R1.1576 CCN(CC1CC1)C(=O)CCS e511ac0de3e2a89604b66fc4dda2eeaf [0,0,0,1,0,0|3,0,0]=4 1366 B12R1.1576 CCN(CC1CC1)C(=O)COC 4d56c18e90942bd108903d737d37be21 [0,0,0,1,0,0|3,0,0]=4 1367 B12R1.1576 CCN(CC1CC1)C(=O)CSC a3cbeb4bc592a0367fd1033263b3352c [0,0,0,1,0,0|3,0,0]=4 1368 B12R1.1576 CCNC(=O)C(CC)NC1CC1 c8525e17faee71c1e906f969f96c8444 [0,0,0,1,0,0|2,0,0]=3 1369 B12R1.1576 CCOC(=O)C(C#N)NC1CC1 e41c9704c3e02018724a6448fe8347ab [0,0,0,1,0,0|2,0,1]=4 1370 B12R1.1576 CCOC(=O)C(C=O)NC1CC1 bee0630ce485055964ffb5aadf295c82 [0,0,0,1,0,0|2,0,1]=4 1371 B12R1.1576 CCOC(=O)C(C=O)OC1CC1 4f38018a10165d3e1a3a45aeb981edf0 [0,0,0,1,0,0|2,0,1]=4 1372 B12R1.1576 CCOC(=O)C(CC)NC1CC1 d4422c43e603bf09b839ff7628bdcec7 [0,0,0,1,0,0|1,0,0]=2 1373 B12R1.1576 CCOC(=O)C(CC)OC1CC1 7dcac5dd83ef8166e83898677162fdd6 [0,0,0,1,0,0|1,0,0]=2 1374 B12R1.1576 CCOC(=O)C(CO)NC1CC1 0b2713d452fa3c141d7b5c43c7887f9f [0,0,0,1,0,0|2,0,0]=3 1375 B12R1.1576 CCOC(=O)C(NC1CC1)SC 85f284fc1b5e75eabd5b181ea9cd63bf [0,0,0,1,0,0|2,0,0]=3 1376 B12R1.1576 CCOC(=O)[C@@H](CC)NC1CC1 666c89e28b4584de605b06005dcaeee0 [0,0,0,1,0,0|1,0,0]=2 1377 B12R1.1576 CCOC(=O)[C@@H](CC)OC1CC1 9fa67a806a33e0ed10d0ffd48b78d289 [0,0,0,1,0,0|1,0,0]=2 1378 B12R1.1576 CCOC(=O)[C@H](CC)NC1CC1 aa02526eb305e1426fd3e3567158117e [0,0,0,1,0,0|1,0,0]=2 1379 B12R1.1576 CCOC(=O)[C@H](CC)OC1CC1 66145545a62a4cd887970f64c30c178a [0,0,0,1,0,0|1,0,0]=2 1380 B12R1.1579 CCCC(=O)N1CCC(C1C)O 5e2ac15204006b04d3f39438b31542c1 [0,0,0,1,0,0|3,0,0]=4 1381 B12R1.1579 CCCC(=O)N1CC[C@@H]([C@@H]1C)O 3996ac3906ecd6f08b3c5c1ed57215bf [0,0,0,1,0,0|3,0,0]=4 1382 B12R1.1579 CCCC(=O)N1CC[C@H]([C@H]1C)O 6c0567ead425ddb5cfe7adb2860534ef [0,0,0,1,0,0|3,0,0]=4 1383 B12R1.1624 CCCOC1=C(C(OC1=O)C)C 0d2f3ffc729a512d21d7b240581e8f2a [0,0,0,1,0,0|1,0,2]=4 1384 B12R1.1765 CCCCC(CC)N(C)C1CC1 72ca7d783a08f0beac5049bf3bf2d502 [0,0,0,1,0,0|3,0,0]=4 1385 B12R1.1781 C#CCNC1(CC1)C(=O)OCC da59a36b9c51e930b0f41daf842d99af [0,0,0,1,0,0|1,0,2]=4 1386 B12R1.1781 C=CCNC1(CC1)C(=O)OCC 81f1fc13a8ed98f8fa22c9d63b1a2321 [0,0,0,1,0,0|1,0,2]=4 1387 B12R1.1781 CCCNC1(CC1)C(=O)OCC 70a403398e959b0a0b4c28c0d0ca1073 [0,0,0,1,0,0|1,0,0]=2 1388 B12R1.1781 CCNCC1(CC1)C(=O)OCC daa1f57887a4580a3d1c3e512ad9f3e4 [0,0,0,1,0,0|1,0,0]=2 1389 B12R1.1781 CCOC(=O)C1(CC1)CNC=O 662fda397f7cf71fa023c9bfd806faca [0,0,0,1,0,0|2,0,1]=4 1390 B12R1.1781 CCOC(=O)C1(CC1)CNCF b6f847578d53a5e7dc4d444559ff43ff [0,0,0,1,0,0|2,0,0]=3 1391 B12R1.1781 CCOC(=O)C1(CC1)CNCO 7b2857579d5218558a71694b23b6a198 [0,0,0,1,0,0|2,0,0]=3 1392 B12R1.1781 CCOC(=O)C1(CC1)COCF af772450d6a4a33ebebbbf3fa92553d1 [0,0,0,1,0,0|2,0,0]=3 1393 B12R1.1781 CCOC(=O)C1(CC1)NCC#N 501792575f5f1b2eca4a62c52acf257d [0,0,0,1,0,0|2,0,1]=4 1394 B12R1.1781 CCOC(=O)C1(CC1)NCC=O 757ef6075a63a2a8af3976301ef0906b [0,0,0,1,0,0|2,0,1]=4 1395 B12R1.1781 CCOC(=O)C1(CC1)NCCF bef26c2b94617b5fd11df9a1599b3ac1 [0,0,0,1,0,0|2,0,0]=3 1396 B12R1.1781 CCOC(=O)C1(CC1)NCCO 9d7e8971f5f4d588aafd9d33b61747ed [0,0,0,1,0,0|2,0,0]=3 1397 B12R1.1781 CCOC(=O)C1(CC1)NCCS 59e47d3198eab7ccc1f2b655fad6f68e [0,0,0,1,0,0|2,0,0]=3 1398 B12R1.1781 CCOC(=O)C1(CC1)NCSC f180e4c8e53dd8cc80fafa6019ad9578 [0,0,0,1,0,0|2,0,0]=3 1399 B12R1.1781 CCOCC1(CC1)C(=O)OCC 4a2ecd056b2aeb68b9a16b6270325027 [0,0,0,1,0,0|1,0,0]=2 1400 B12R0.607 C#CCCN(CC)CC(=O)OCC d5007dfdca8f91c15c77ff900a019148 [0,0,0,0,0,1|1,0,2]=4 1401 B12R0.607 C#CCOC(CC)CC(=O)OCC a376c76e1c3fea42c2f7be5a39f677b9 [0,0,0,0,0,1|1,0,2]=4 1402 B12R0.607 C/C=C/C(=O)NC(CO)CCCC 7c71b42b16ab3fae695ec6a20ca55594 [0,0,0,0,0,1|2,0,1]=4 1403 B12R0.607 C/C=C/C(=O)N[C@@H](CO)CCCC e564f81ce3004b2f0c463c1423883e8c [0,0,0,0,0,1|2,0,1]=4 1404 B12R0.607 C/C=C/C(=O)N[C@H](CO)CCCC 00dca9410921601716eeadc4f647d28a [0,0,0,0,0,1|2,0,1]=4 1405 B12R0.607 C/C=C/CN(CC)CC(=O)OCC 931a3332c575526a08914397302c0d1c [0,0,0,0,0,1|1,0,2]=4 1406 B12R0.607 C/C=C\CN(CC)CC(=O)OCC a13852f62f0936d42c7b56b80b3a9f7b [0,0,0,0,0,1|1,0,2]=4 1407 B12R0.607 C=CCCN(CC)CC(=O)OCC 76578197b85df21a6959e870a29acc4d [0,0,0,0,0,1|1,0,2]=4 1408 B12R0.607 C=CCOC(CC)CC(=O)OCC d738b1f5c33b4009df5b9ea57f8aecf7 [0,0,0,0,0,1|1,0,2]=4 1409 B12R0.607 C=COC(=O)CN(CC)CCCC 2c2e7bdb4c5cb228b72e18776009e238 [0,0,0,0,0,1|1,0,2]=4 1410 B12R0.607 CC#CC(=O)NC(CO)CCCC 9f9de2382b5bdab055904a76b9e75143 [0,0,0,0,0,1|2,0,1]=4 1411 B12R0.607 CC#CC(=O)N[C@@H](CO)CCCC d64e084c2b515415aff5f5e0d7060473 [0,0,0,0,0,1|2,0,1]=4 1412 B12R0.607 CC#CC(=O)N[C@H](CO)CCCC 840f27bd769da3f648d5220fb4ef340a [0,0,0,0,0,1|2,0,1]=4 1413 B12R0.607 CCCC(=O)CN(CC)CCCO d090189ab07598c042b6d400b5b46901 [0,0,0,0,0,1|3,0,0]=4 1414 B12R0.607 CCCC(=O)CN(CC)CCOC ff0b9de72b498668b4328427cbf673df [0,0,0,0,0,1|3,0,0]=4 1415 B12R0.607 CCCC(=O)NC(CO)CCCO 171d9e9d3dcb20ad7eaa6b15579a2b62 [0,0,0,0,0,1|3,0,0]=4 1416 B12R0.607 CCCC(=O)NC(CO)CCSC 7c84465dce9371628d54ee197421c678 [0,0,0,0,0,1|3,0,0]=4 1417 B12R0.607 CCCC(=O)N[C@@H](CO)CCSC 55ef5a1fa1fd7c75fdcc8287588b1543 [0,0,0,0,0,1|3,0,0]=4 1418 B12R0.607 CCCC(=O)N[C@H](CO)CCSC f331679a38d4131900e96dc15ec771a9 [0,0,0,0,0,1|3,0,0]=4 1419 B12R0.607 CCCCC(CC)CC(=O)NC#N 943e19f53252fc4e3aabdd9dc73e0a0c [0,0,0,0,0,1|2,0,1]=4 1420 B12R0.607 CCCCC(CC)CN(C)CCC 300ea01516d58e737fb6adc6f7437591 [0,0,0,0,0,1|3,0,0]=4 1421 B12R0.607 CCCCC(CC)NC(C)CCC d3d773a89ea54174e5414d25904fa7cf [0,0,0,0,0,1|2,0,1]=4 1422 B12R0.607 CCCCC(CC)N[C@@H](C)CCC 277f543ab16a6093a567d2e8d7fd835c [0,0,0,0,0,1|2,0,1]=4 1423 B12R0.607 CCCCC(CC)OC(=S)CCC 2a7284d543a0946667af6a094fc6b215 [0,0,0,0,0,1|1,1,0]=3 1424 B12R0.607 CCCCC(CC)OC(C)CCC b5b061d90c62b09464599744e4fde082 [0,0,0,0,0,1|2,0,1]=4 1425 B12R0.607 CCCCC(CC)O[C@@H](C)CCC 9be82abb77f213b7ccf3536e1199215a [0,0,0,0,0,1|2,0,1]=4 1426 B12R0.607 CCCCC(CC)O[C@H](C)CCC a4acbd8c3eb2ff8526846063a636a7ce [0,0,0,0,0,1|2,0,1]=4 1427 B12R0.607 CCCCC(CO)NC(=O)CCC 4f5d7e36be004acef1b526a33ebdbae3 [0,0,0,0,0,1|2,0,0]=3 1428 B12R0.607 CCCCC(CO)NC(=O)CCF 3fc8282d12ae0516eb15cef17f0cdd48 [0,0,0,0,0,1|3,0,0]=4 1429 B12R0.607 CCCCC(CO)NC(=O)CCO 87adac494e652bdffa391263597206b5 [0,0,0,0,0,1|3,0,0]=4 1430 B12R0.607 CCCCC(CO)NC(=O)CCS a62d075d5375b273c5350503a46c2238 [0,0,0,0,0,1|3,0,0]=4 1431 B12R0.607 CCCCC(CO)NC(=O)COC d52154b59b1c18cf89dbc066971dccbd [0,0,0,0,0,1|3,0,0]=4 1432 B12R0.607 CCCCC(CO)NC(=O)CSC 1af0c83a75f8a9cf3d8ffe8af7ee5f42 [0,0,0,0,0,1|3,0,0]=4 1433 B12R0.607 CCCCN(C=O)CC(=O)OCC b382a91acb2ab3589c7f85b2cc5a46e9 [0,0,0,0,0,1|2,0,1]=4 1434 B12R0.607 CCCCN(CC)CC(=O)CCC bda2c7050a1baba12b3197f0a2fa84b2 [0,0,0,0,0,1|2,0,0]=3 1435 B12R0.607 CCCCN(CC)CC(=O)NCC e6e3240c2ee8c05ea33463d2bd952eaa [0,0,0,0,0,1|2,0,0]=3 1436 B12R0.607 CCCCN(CC)CC(=O)NCO 78f67f45dce7f82ed2188b71d6ed9b61 [0,0,0,0,0,1|3,0,0]=4 1437 B12R0.607 CCCCN(CC)CC(=O)OCC b5c7f11c007e57c059ea6c39dbfa5b44 [0,0,0,0,0,1|1,0,0]=2 1438 B12R0.607 CCCCN(CF)CC(=O)OCC ca4f912a4591b8fb8029950a744393b4 [0,0,0,0,0,1|2,0,0]=3 1439 B12R0.607 CCCCN(CO)CC(=O)OCC 0c9aa509f9eb7522e1a24766b3fca29a [0,0,0,0,0,1|2,0,0]=3 1440 B12R0.607 CCCC[C@@H](CC)CN(C)CCC 3498eedaf3a7d356911f4ec828eee273 [0,0,0,0,0,1|3,0,0]=4 1441 B12R0.607 CCCC[C@@H](CO)NC(=O)CCC a2f3e6d648d41b6ee98d61faba6d2211 [0,0,0,0,0,1|2,0,0]=3 1442 B12R0.607 CCCC[C@@H](CO)NC(=O)CCF 0cdd2b7f86ae6266669301524643cb60 [0,0,0,0,0,1|3,0,0]=4 1443 B12R0.607 CCCC[C@@H](CO)NC(=O)CCO 22f25662fee7b071f623a80f1a521adb [0,0,0,0,0,1|3,0,0]=4 1444 B12R0.607 CCCC[C@@H](CO)NC(=O)CCS 3f23f7d7ba0af0900b79ac7cdc43cef8 [0,0,0,0,0,1|3,0,0]=4 1445 B12R0.607 CCCC[C@@H](CO)NC(=O)COC d6184a9c3dedc12f9ff1d0e2e7936678 [0,0,0,0,0,1|3,0,0]=4 1446 B12R0.607 CCCC[C@@H](CO)NC(=O)CSC cdc73cfa126dee9d21ad88b85fe5ccb3 [0,0,0,0,0,1|3,0,0]=4 1447 B12R0.607 CCCC[C@H](CO)NC(=O)CCC ad0a967deffe77377bb3fd581eb9384a [0,0,0,0,0,1|2,0,0]=3 1448 B12R0.607 CCCC[C@H](CO)NC(=O)CCF 660a774b3604b0b768c71050be64eafe [0,0,0,0,0,1|3,0,0]=4 1449 B12R0.607 CCCC[C@H](CO)NC(=O)CCO b1aede72f41b102e621ea45432072c4a [0,0,0,0,0,1|3,0,0]=4 1450 B12R0.607 CCCC[C@H](CO)NC(=O)CCS ce810b6d1d050ca82e720470f3f5eb87 [0,0,0,0,0,1|3,0,0]=4 1451 B12R0.607 CCCC[C@H](CO)NC(=O)COC e789090170ef3c108aaa87f2774c5fa4 [0,0,0,0,0,1|3,0,0]=4 1452 B12R0.607 CCCC[C@H](CO)NC(=O)CSC 38233a83aaa62899f4acced9299af7a5 [0,0,0,0,0,1|3,0,0]=4 1453 B12R0.607 CCCNC(C=O)CC(=O)OCC b62a9917e4b1dc9fca21ff1ce671dbde [0,0,0,0,0,1|2,0,1]=4 1454 B12R0.607 CCCOC(C=O)CC(=O)OCC 747d2b9b42ce34b0341986dd5b2bbc93 [0,0,0,0,0,1|2,0,1]=4 1455 B12R0.607 CCCOC(CC)CC(=O)OCC dafd4b9e27ca4544fc02ccd58170a2a4 [0,0,0,0,0,1|1,0,0]=2 1456 B12R0.607 CCNC(=O)CN(CC)CCCF 235996bf88461b33a1f23cb99ad72a19 [0,0,0,0,0,1|3,0,0]=4 1457 B12R0.607 CCNC(=O)CN(CC)CCCO e688c290e6c4bd2cb112f659c07cde13 [0,0,0,0,0,1|3,0,0]=4 1458 B12R0.607 CCNC(=O)CN(CC)CCCS 3e508c09deacea493f237535a8bd8309 [0,0,0,0,0,1|3,0,0]=4 1459 B12R0.607 CCNC(=O)CN(CC)CCOC d494a88a698dd5c8a2f21aa2a7a7e6b4 [0,0,0,0,0,1|3,0,0]=4 1460 B12R0.607 CCNC(=O)CN(CC)CCSC faf450afaa0b17d56e66cf59d416d851 [0,0,0,0,0,1|3,0,0]=4 1461 B12R0.607 CCNC(=O)CN(CC)COCC 4b391b72f1dcb044b44c3c633f555e18 [0,0,0,0,0,1|3,0,0]=4 1462 B12R0.607 CCOC(=O)CC(CC)OCC#N 3952dec02b2f9d95d1552a3acc8bfbbd [0,0,0,0,0,1|2,0,1]=4 1463 B12R0.607 CCOC(=O)CC(CC)OCC=O c4c84bc3ee5d357990ccd7bfad6a2975 [0,0,0,0,0,1|2,0,1]=4 1464 B12R0.607 CCOC(=O)CC(CC)OCCF bf73cec277a4550239ab1654a80656b7 [0,0,0,0,0,1|2,0,0]=3 1465 B12R0.607 CCOC(=O)CC(CC)OCCS 7029d934b0963c8d6fef80f70b31c5ea [0,0,0,0,0,1|2,0,0]=3 1466 B12R0.607 CCOC(=O)CC(CC)OCOC ec95fefac540e2581e2d29ed0cca4551 [0,0,0,0,0,1|2,0,0]=3 1467 B12R0.607 CCOC(=O)CC(CC)OCSC 1b02cc22248a78e5d0ddacb861a65966 [0,0,0,0,0,1|2,0,0]=3 1468 B12R0.607 CCOC(=O)CN(CC)CCC#N 11cae8f27440f8a52272d9adf4f5c449 [0,0,0,0,0,1|2,0,1]=4 1469 B12R0.607 CCOC(=O)CN(CC)CCC=O b4b1659fa03fd6001106b6fdf2beb42b [0,0,0,0,0,1|2,0,1]=4 1470 B12R0.607 CCOC(=O)CN(CC)CCCF 98a648050591bb8d5e91b2277db82cb7 [0,0,0,0,0,1|2,0,0]=3 1471 B12R0.607 CCOC(=O)CN(CC)CCCO 1a76ef73d1a6f2e81328124715ec8014 [0,0,0,0,0,1|2,0,0]=3 1472 B12R0.607 CCOC(=O)CN(CC)CCCS 971d548d2ebc3391bccb338ade31f217 [0,0,0,0,0,1|2,0,0]=3 1473 B12R0.607 CCOC(=O)CN(CC)CCOC 4f7a1d365ba15a95c4f9b030c3b2cbc0 [0,0,0,0,0,1|2,0,0]=3 1474 B12R0.607 CCOC(=O)CN(CC)CCSC 12f5e6f4d24d87cda5cb83ee199bb395 [0,0,0,0,0,1|2,0,0]=3 1475 B9R0.18 CCCCC(C)COCC 58365c9c9e662717f1bbd5e7f384f400 [2,0,0,0,0,0|0,0,1]=3 1476 B9R0.18 CCCCC(C)COCF 09ffbdc6b473e3828f87d6ed9dd457d6 [2,0,0,0,0,0|1,0,1]=4 1477 B9R0.18 CCCCC(C)NCCC 2d290a5f42eca09ba83265f4a79377f0 [2,0,0,0,0,0|2,0,0]=4 1478 B9R0.18 CCCCC(C)OCCC 03a9a54da7ce8074115dc5963e2487d3 [2,0,0,0,0,0|2,0,0]=4 1479 B9R0.18 CCCCN(C)COCC d499f711adfc90243a4d04f7325fe0b5 [2,0,0,0,0,0|1,0,1]=4 1480 B9R0.18 CCCC[C@@H](C)NCCC 681a66d3f2656eddcb965975aeb1cfd0 [2,0,0,0,0,0|2,0,0]=4 1481 B9R0.18 CCCC[C@@H](C)OCCC 3919e2b8d370ec3c53a10b41264f7777 [2,0,0,0,0,0|2,0,0]=4 1482 B9R0.18 CCCC[C@H](C)OCCC 66356f9f032d16fe1fbfbbab77eafd41 [2,0,0,0,0,0|2,0,0]=4 1483 B9R0.18 CCCOC(C)COCC f8832bba2994252896d2ff4eb2c06c9a [2,0,0,0,0,0|1,0,1]=4 1484 B9R0.18 CCOCC(C)COCC 445e6d2aca05018d9465f1ebee3aaa14 [2,0,0,0,0,0|1,0,1]=4 1485 B9R0.40 C#CC(CCCC)OCC 34d6f2f805b337e2f29baefe308de38a [2,0,0,0,0,0|0,0,2]=4 1486 B9R0.40 C=CC(CCCC)OCC debe70a957bdc231f9f5bc09ebab038f [2,0,0,0,0,0|0,0,2]=4 1487 B9R0.40 CC#CCC(CC)OCC 98fc717f974d650c43400775964c5901 [2,0,0,0,0,0|0,0,2]=4 1488 B9R0.40 CCCC(CC)COCC 0aa20e7bc483c4759592262d2d2171e2 [2,0,0,0,0,0|0,0,1]=3 1489 B9R0.40 CCCC(CC)COCF 2bcff68a716d0105b919208253aa7c54 [2,0,0,0,0,0|1,0,1]=4 1490 B9R0.40 CCCCC(CC)OCC f8505015964e9c49dca586a5dee77bc8 [2,0,0,0,0,0|0,0,0]=2 1491 B9R0.40 CCCCC(CC)OCF 0e987e381d58de15ad70b5901cf1f3fd [2,0,0,0,0,0|1,0,0]=3 1492 B9R0.40 CCCCC(CO)NCC cbdc55a29bd13eaa9ee05a36cd59633e [2,0,0,0,0,0|2,0,0]=4 1493 B9R0.40 CCCCN(CC)CCC bbfe6bddeb2b2437e55039b1b4ca5bd6 [2,0,0,0,0,0|1,0,1]=4 1494 B9R0.40 CCCCN(CC)COC f7250b9cd7d36cb9a0263de37f7e6d98 [2,0,0,0,0,0|1,0,1]=4 1495 B9R0.40 CCCC[C@@H](CO)NCC 121df069b48b9b87eed058e1439748b2 [2,0,0,0,0,0|2,0,0]=4 1496 B9R0.40 CCCC[C@H](CO)NCC 2425dfd511abed0be64d5a661c637ade [2,0,0,0,0,0|2,0,0]=4 1497 B9R0.40 CCCN(CC)COCC 387a597847335a4467a7a4d0cac42949 [2,0,0,0,0,0|1,0,1]=4 1498 B9R0.40 CCCNC(CC)CCC 0ce2a51fd039fcaf9a76eb2b4964f8f6 [2,0,0,0,0,0|1,0,1]=4 1499 B9R0.40 CCCNC(CC)COC e4d1daa05374e355358d2cd25aa439ac [2,0,0,0,0,0|1,0,1]=4 1500 B9R0.40 CCCOC(CC)CCC 8238dc4250141f806af223944c1e9f3d [2,0,0,0,0,0|1,0,1]=4 1501 B9R0.40 CCCOC(CC)COC f1d33567396d0587ae337e3b1833bae8 [2,0,0,0,0,0|1,0,1]=4 1502 B9R0.40 CCCO[C@H](CC)CCC 769c614be648c7265a5a510d19215798 [2,0,0,0,0,0|1,0,1]=4 1503 B9R0.5 CCCCCC(C)OCC 730550df732f69eef1e6a549de510b2c [2,0,0,0,0,0|1,0,1]=4 1504 B9R0.5 CCCCC[C@@H](C)OCC 8f2bb2e64349b01f8c7137850e01df92 [2,0,0,0,0,0|1,0,1]=4 1505 B9R0.5 CCCCC[C@H](C)OCC 2cf9a829d5eb89110544892bd459dee4 [2,0,0,0,0,0|1,0,1]=4 1506 B9R0.5 CCCCNC(=O)CCC 2cce597b848ae107def59bee54a0a0bb [2,0,0,0,0,0|2,0,0]=4 1507 B9R0.5 CCCNCC(=O)CCC 3eec0edc7aa18c3c159d3b72b32db52a [2,0,0,0,0,0|2,0,0]=4 1508 B9R0.5 CCCNCC(=O)NCC ce07571aa3fa6f7b572f45c714e29f13 [2,0,0,0,0,0|2,0,0]=4 1509 B9R0.5 CCCNCC(=O)OCC 96e18210e8c47913fa01fa11b9b136be [2,0,0,0,0,0|1,0,0]=3 1510 B9R0.5 CCCOCC(=O)CCC 74c3c5e5bd02e359466cf1cc878b65e0 [2,0,0,0,0,0|2,0,0]=4 1511 B9R0.5 CCCOCC(=O)NCC 76f4c6de17f53497034323fd5e6ef599 [2,0,0,0,0,0|2,0,0]=4 1512 B9R0.5 CCCOCC(=O)OCC 0b34840e3da522061b00dd308581ea5c [2,0,0,0,0,0|1,0,0]=3 1513 B9R0.5 CCNCCC(=O)OCC 2335a4402c7edabd02b888af3e7ee79f [2,0,0,0,0,0|1,0,0]=3 1514 B9R0.5 CCOC(=O)CCNCF dc0e8e938f3e0f9376067101916fab11 [2,0,0,0,0,0|2,0,0]=4 1515 B9R0.5 CCOC(=O)CCNCO 0d43318aba0286304d28e6f5f875b75e [2,0,0,0,0,0|2,0,0]=4 1516 B9R0.5 CCOC(=O)CCOCF b923097280e6d745523067d0f7821723 [2,0,0,0,0,0|2,0,0]=4 1517 B9R0.5 CCOC(=O)CNCCBr 2d8ed3ea34766b7d343241f665b80229 [2,0,0,0,0,0|2,0,0]=4 1518 B9R0.5 CCOC(=O)CNCCF 99d39e110ac23618c63f1317b2282cce [2,0,0,0,0,0|2,0,0]=4 1519 B9R0.5 CCOC(=O)CNCCI 75072515d706cd5c15a349fb418110fa [2,0,0,0,0,0|2,0,0]=4 1520 B9R0.5 CCOC(=O)CNCCO a3891831c63b1d5fc3c5a1b6e875e04a [2,0,0,0,0,0|2,0,0]=4 1521 B9R0.5 CCOC(=O)CNCCS 2d2d40dfd5cc8614b9490097a11bc9af [2,0,0,0,0,0|2,0,0]=4 1522 B9R0.5 CCOC(=O)CNCOC 3338587ded14e7c228302d0aec1db622 [2,0,0,0,0,0|2,0,0]=4 1523 B9R0.5 CCOC(=O)CNCSC 83cee1aea68795d140c24e1cd1c34d73 [2,0,0,0,0,0|2,0,0]=4 1524 B9R0.5 CCOC(=O)COCCF 8ab9a071055414651ab59279d1d89a94 [2,0,0,0,0,0|2,0,0]=4 1525 B9R0.5 CCOC(=O)COCCS 5b2c52a4049396ac0e633dc62c60b2f2 [2,0,0,0,0,0|2,0,0]=4 1526 B9R0.5 CCOC(=O)COCOC cae80a72de3b9dd4c77bad68b601ad39 [2,0,0,0,0,0|2,0,0]=4 1527 B9R0.5 CCOC(=O)COCSC d1c9bb1a8c14847f19476af8bd4e260f [2,0,0,0,0,0|2,0,0]=4 1528 B9R0.5 CCOCCC(=O)OCC 09e1caf8e51242de5bdcbf4174bb2e9c [2,0,0,0,0,0|1,0,0]=3 1529 B9R0.8 CCC(=O)C(C)NCCBr 64e34f4df5f4e8d1bef3f4978862f1f8 [2,0,0,0,0,0|2,0,0]=4 1530 B9R0.8 CCC(=O)C(C)NCCF 5e70f984eb2d5dc4c1903fcb0a3e2f41 [2,0,0,0,0,0|2,0,0]=4 1531 B9R0.8 CCC(=O)C(C)NCCI bc4fd901bdb585c117088feb170c7ea7 [2,0,0,0,0,0|2,0,0]=4 1532 B9R0.8 CCC(=O)C(C)NCCO a6ca7b75b4dcee243dcdf60254103368 [2,0,0,0,0,0|2,0,0]=4 1533 B9R0.8 CCC(=O)C(C)NCCS bb59428fe74c12422654a92f73d8b77f [2,0,0,0,0,0|2,0,0]=4 1534 B9R0.8 CCC(=O)C(C)OCCF a2a3e7db9ccfd3c538c971c8b56be4b0 [2,0,0,0,0,0|2,0,0]=4 1535 B9R0.8 CCC(=O)C(C)OCCS 972e0b806873bc366e31ae5f8572a7b3 [2,0,0,0,0,0|2,0,0]=4 1536 B9R0.8 CCC(=O)C(C)OCOC 3addba24d482e33b3f3ace5923030d28 [2,0,0,0,0,0|2,0,0]=4 1537 B9R0.8 CCC(=O)N(C)CCCO abe1c532feffa5d924432cc826e9ba1a [2,0,0,0,0,0|2,0,0]=4 1538 B9R0.8 CCC(=O)N(C)CCOC f7bd9d478d8c782d3736c126b1486194 [2,0,0,0,0,0|2,0,0]=4 1539 B9R0.8 CCC(=O)N(C)CCSC aab6c2a6f5f967173dcbf121b5f2b04a [2,0,0,0,0,0|2,0,0]=4 1540 B9R0.8 CCCCC(C)N(C)CC 25e984dace972a269fa32aa91c455cba [2,0,0,0,0,0|2,0,0]=4 1541 B9R0.8 CCCCN(C)C(=O)CC 0e002209ec811d39c4d1fc3cb831356f [2,0,0,0,0,0|1,0,0]=3 1542 B9R0.8 CCCCN(C)C(=O)CF f74557b45a03626a8ff166c34b446fd4 [2,0,0,0,0,0|2,0,0]=4 1543 B9R0.8 CCCCN(C)C(=O)CO 4ba88839945a674ab9ac3fbe8c51fb1c [2,0,0,0,0,0|2,0,0]=4 1544 B9R0.8 CCCCN(C)C(=O)CS 062af0d1684fb716d13d17c60980012b [2,0,0,0,0,0|2,0,0]=4 1545 B9R0.8 CCCNC(C)C(=O)CC 0217f82457b5f9eb91d7c99d41f3f7e0 [2,0,0,0,0,0|1,0,0]=3 1546 B9R0.8 CCCNC(C)C(=O)NC 7e671fb821570ee51777de2cb4346876 [2,0,0,0,0,0|2,0,0]=4 1547 B9R0.8 CCCNC(C)C(=O)OC 31247040e57fcd82f8a5006ea35f44b3 [2,0,0,0,0,0|1,0,0]=3 1548 B9R0.8 CCCN[C@@H](C)C(=O)OC 59d491ac2868b6f8a0c3d1e8728d0ebe [2,0,0,0,0,0|1,0,0]=3 1549 B9R0.8 CCCN[C@H](C)C(=O)OC 341714f23671a6f279f2ba9d2fc394e9 [2,0,0,0,0,0|1,0,0]=3 1550 B9R0.8 CCCOC(C)C(=O)CC 8ed9139bb3e33585a0fa3a410f80c3d4 [2,0,0,0,0,0|1,0,0]=3 1551 B9R0.8 CCCOC(C)C(=O)NC 6c6db500b3d123e7885d4c8a3542da86 [2,0,0,0,0,0|2,0,0]=4 1552 B9R0.8 CCCOC(C)C(=O)OC 6aeb6cf87a11cad68a57c617fd4dd6b3 [2,0,0,0,0,0|1,0,0]=3 1553 B9R0.8 CCCO[C@@H](C)C(=O)OC 74882931e69b82142f87fd9cd5771d40 [2,0,0,0,0,0|1,0,0]=3 1554 B9R0.8 CCCO[C@H](C)C(=O)OC df7cac25b325230b3fd4729465a84aae [2,0,0,0,0,0|1,0,0]=3 1555 B9R0.8 CCNCC(C)C(=O)OC 23788628878427ebf06f8ab1848fc209 [2,0,0,0,0,0|1,0,0]=3 1556 B9R0.8 CCOCC(C)C(=O)OC 80236c9332b15389a08a7441e9591cd6 [2,0,0,0,0,0|1,0,0]=3 1557 B9R0.8 CCOCC(F)C(=O)OC 293289f16cf9b946a849bc2001cde08d [2,0,0,0,0,0|2,0,0]=4 1558 B9R0.8 CCOC[C@@H](C)C(=O)OC 906e0220267f0d94eef2fb7d2be7e97d [2,0,0,0,0,0|1,0,0]=3 1559 B9R0.8 CCOC[C@H](C)C(=O)OC d76376f8be763bf61f075f3cd3189478 [2,0,0,0,0,0|1,0,0]=3 1560 B9R0.8 COC(=O)C(C)CNCF cb798ae47354359e4aa3ce08e5780b21 [2,0,0,0,0,0|2,0,0]=4 1561 B9R0.8 COC(=O)C(C)CNCO 39ae0c3a7f42291995fad179d22a5a37 [2,0,0,0,0,0|2,0,0]=4 1562 B9R0.8 COC(=O)C(C)COCF 44c811abb8c01f8301de11413ac270b8 [2,0,0,0,0,0|2,0,0]=4 1563 B9R0.8 COC(=O)C(C)NCCBr 318217e792ebb1d973731bba243d49af [2,0,0,0,0,0|2,0,0]=4 1564 B9R0.8 COC(=O)C(C)NCCF 71d141bda7d2e6224ae3a7dfa1cc21b5 [2,0,0,0,0,0|2,0,0]=4 1565 B9R0.8 COC(=O)C(C)NCCI 808cf0c74c9ef45588975ce10780d025 [2,0,0,0,0,0|2,0,0]=4 1566 B9R0.8 COC(=O)C(C)NCCO 3704bd53df6df337c4b06e83d714ea07 [2,0,0,0,0,0|2,0,0]=4 1567 B9R0.8 COC(=O)C(C)NCCS d967f38e4459ed498d224e4b3cdd61d6 [2,0,0,0,0,0|2,0,0]=4 1568 B9R0.8 COC(=O)C(C)OCCF 100059756fd900098c62556a2ae1ce35 [2,0,0,0,0,0|2,0,0]=4 1569 B9R0.8 COC(=O)C(C)OCCS e7025bf903a8d5f820d0296de478345d [2,0,0,0,0,0|2,0,0]=4 1570 B9R0.8 COC(=O)C(C)OCSC ebd918713d697a3d130a3e5b592f95ea [2,0,0,0,0,0|2,0,0]=4 1571 B9R0.8 COC(=O)[C@@H](C)COCF 1a2bfc633e0045cecdf11723a1d5a8ff [2,0,0,0,0,0|2,0,0]=4 1572 B9R0.8 COC(=O)[C@@H](C)NCCBr a7727686203549a3c6c9f0e726c31918 [2,0,0,0,0,0|2,0,0]=4 1573 B9R0.8 COC(=O)[C@@H](C)NCCF 854f6045fdda5f63c114321a012dcb77 [2,0,0,0,0,0|2,0,0]=4 1574 B9R0.8 COC(=O)[C@@H](C)NCCI bff6d9e508b7c6d11972d1a2df59cf2b [2,0,0,0,0,0|2,0,0]=4 1575 B9R0.8 COC(=O)[C@@H](C)NCCO b68c9ce4d70e10c92b29d39f736b232c [2,0,0,0,0,0|2,0,0]=4 1576 B9R0.8 COC(=O)[C@@H](C)NCCS 16fd58839d6241df4620a33b0b32294f [2,0,0,0,0,0|2,0,0]=4 1577 B9R0.8 COC(=O)[C@@H](C)OCCF d1c1991f25a8b884548cfd60d33876dd [2,0,0,0,0,0|2,0,0]=4 1578 B9R0.8 COC(=O)[C@@H](C)OCCS 9ef70f4f282a66cce9dfb1e835575055 [2,0,0,0,0,0|2,0,0]=4 1579 B9R0.8 COC(=O)[C@@H](C)OCSC 28e79a44863d047cc528276a78c0c9cd [2,0,0,0,0,0|2,0,0]=4 1580 B9R0.8 COC(=O)[C@H](C)COCF 2f05fad9d2d30bccec9db2790e196eb9 [2,0,0,0,0,0|2,0,0]=4 1581 B9R0.8 COC(=O)[C@H](C)NCCBr 931d0ff08d117885f89eb4b7587512d9 [2,0,0,0,0,0|2,0,0]=4 1582 B9R0.8 COC(=O)[C@H](C)NCCF 74e88c5906e78f07303f636bab0e6889 [2,0,0,0,0,0|2,0,0]=4 1583 B9R0.8 COC(=O)[C@H](C)NCCI 8a19482f865475e7e3188051cf1bf197 [2,0,0,0,0,0|2,0,0]=4 1584 B9R0.8 COC(=O)[C@H](C)NCCO cdd55a005482a8e8a4c2e356ff4de70b [2,0,0,0,0,0|2,0,0]=4 1585 B9R0.8 COC(=O)[C@H](C)NCCS 908f3e3fb039ce6a81955ab5f0462302 [2,0,0,0,0,0|2,0,0]=4 1586 B9R0.8 COC(=O)[C@H](C)OCCF 29fbfe09a06b54c89987b94c571cc4e4 [2,0,0,0,0,0|2,0,0]=4 1587 B9R0.8 COC(=O)[C@H](C)OCCS cacca195083b683b3e20b6ded7274a88 [2,0,0,0,0,0|2,0,0]=4 1588 B9R0.8 COC(=O)[C@H](C)OCSC 18a62ed2db31e4b687bb63a6d3283424 [2,0,0,0,0,0|2,0,0]=4 1589 B9R0.8 COCOC(C)C(=O)OC 9848f05d221db1285aa396c5cdb54009 [2,0,0,0,0,0|2,0,0]=4 1590 B9R0.8 COCO[C@@H](C)C(=O)OC d3164128e1fe62adbc450c7289f3cf7d [2,0,0,0,0,0|2,0,0]=4 1591 B9R0.8 COCO[C@H](C)C(=O)OC 17521579f3e79d24afec0b769bf2889d [2,0,0,0,0,0|2,0,0]=4 1592 B9R0.35 CCCC(=O)N(C)CCC 4f10a4b8ce3fe8d6db7f1b42323fcb3d [2,0,0,0,0,0|2,0,0]=4 1593 B9R0.35 CCNC(=O)[C@H](C)NCC 214401333582d701d8596737f61e8294 [2,0,0,0,0,0|2,0,0]=4 1594 B9R0.35 CCN[C@H](C)C(=O)OCC 6875bcc526feb7ae66bd8400bcf3b7da [2,0,0,0,0,0|1,0,0]=3 1595 B9R0.35 CCOC(=O)C(C)OCC f445527160852fc0c43d12c8fe5320cc [2,0,0,0,0,0|1,0,0]=3 1596 B9R0.35 CCOC(=O)C(C)OCF b72a5184b9f7f92b79234cb6ae816d22 [2,0,0,0,0,0|2,0,0]=4 1597 B9R0.35 CCOC(=O)[C@@H](C)NCF a34a0072dde6c8449b3b5e27f2813cc5 [2,0,0,0,0,0|2,0,0]=4 1598 B9R0.35 CCOC(=O)[C@@H](C)NCO 3ba9ba881d44f88d48cc363193979b75 [2,0,0,0,0,0|2,0,0]=4 1599 B9R0.35 CCOC(=O)[C@@H](C)OCC 631e97abb6fd65233abf22b379a869bf [2,0,0,0,0,0|1,0,0]=3 1600 B9R0.35 CCOC(=O)[C@@H](C)OCF db29af7be0cd6ce5187adc16610b9c75 [2,0,0,0,0,0|2,0,0]=4 1601 B9R0.35 CCOC(=O)[C@H](C)OCC 62fff8344bfc0cb3adfb9e62dd68064a [2,0,0,0,0,0|1,0,0]=3 1602 B9R0.35 CCOC(=O)[C@H](C)OCF 58d923bf5f6e3bf0a31b0bd24fb6ba13 [2,0,0,0,0,0|2,0,0]=4 1603 B9R0.12 CCC(=O)C(CC)OCF 30176e795eb511b0d2971de7316e1c2d [2,0,0,0,0,0|2,0,0]=4 1604 B9R0.12 CCC(=O)N(CC)CCCl 5abad85758db26153afc55d5fcc1b3c1 [2,0,0,0,0,0|2,0,0]=4 1605 B9R0.12 CCC(=O)N(CC)CCO a49d55b4de1d5751c610236dcc0af865 [2,0,0,0,0,0|2,0,0]=4 1606 B9R0.12 CCC(OCF)C(=O)OC 55687e90d4b2f1392f8b02b104acbf03 [2,0,0,0,0,0|2,0,0]=4 1607 B9R0.12 CCCC(CC)N(C)CC f1cb18a1e26f87a4fb802245c7eb4248 [2,0,0,0,0,0|2,0,0]=4 1608 B9R0.12 CCCN(CC)C(=O)CC cb71ae41710f8d3a5ad167a9d95c6ac7 [2,0,0,0,0,0|1,0,0]=3 1609 B9R0.12 CCCN(CC)C(=O)CF 3d2f2763b8a620aa56d6ebbecfb48f96 [2,0,0,0,0,0|2,0,0]=4 1610 B9R0.12 CCCN(CC)C(=O)CO 560b89c92582f9173a4199876e21858a [2,0,0,0,0,0|2,0,0]=4 1611 B9R0.12 CCCN(CC)C(=O)CS f1a6f4306ac96c5ec9491d28032a38ac [2,0,0,0,0,0|2,0,0]=4 1612 B9R0.12 CCNC(CC)C(=O)NC 2e9e59786ec48c057ad8574cac760264 [2,0,0,0,0,0|2,0,0]=4 1613 B9R0.12 CCNC(CO)C(=O)OC 70d20069b7c2c33b6735ce5c2d2d9890 [2,0,0,0,0,0|2,0,0]=4 1614 B9R0.12 CCN[C@@H](CC)C(=O)OC 999d31d45781ad98aaae06f410e03277 [2,0,0,0,0,0|1,0,0]=3 1615 B9R0.12 CCN[C@@H](CO)C(=O)OC 783f1436070e4ef27e239c2bc5ae76f8 [2,0,0,0,0,0|2,0,0]=4 1616 B9R0.12 CCN[C@@H](CS)C(=O)OC a3ae20d2eca73c3d6eb7c5baec80f314 [2,0,0,0,0,0|2,0,0]=4 1617 B9R0.12 CCN[C@H](CC)C(=O)OC 56b2ee816420f8b5360e16d9be2a9530 [2,0,0,0,0,0|1,0,0]=3 1618 B9R0.12 CCN[C@H](CO)C(=O)OC 7e7907490e3448d34d068e96647db937 [2,0,0,0,0,0|2,0,0]=4 1619 B9R0.12 CCOC(CC)C(=O)CC dc229763be7b8d495a3c742a2765e48c [2,0,0,0,0,0|1,0,0]=3 1620 B9R0.12 CCOC(CC)C(=O)OC dafeac8a9e49a0ca9bcc192bdedd1ece [2,0,0,0,0,0|1,0,0]=3 1621 B9R0.12 CCOC(OC)C(=O)OC 739d4987749edc9d825824bfb39658eb [2,0,0,0,0,0|2,0,0]=4 1622 B9R0.12 CCO[C@@H](CC)C(=O)OC 5a2831785b533bb4fd647aebbcb4d403 [2,0,0,0,0,0|1,0,0]=3 1623 B9R0.12 CCO[C@H](CC)C(=O)OC 46c21ea7eed63401aa22bf6ce0cd90ba [2,0,0,0,0,0|1,0,0]=3 1624 B9R0.12 CC[C@@H](NCF)C(=O)OC b99a81de7d006795f75701e16779bfe5 [2,0,0,0,0,0|2,0,0]=4 1625 B9R0.12 CC[C@@H](NCO)C(=O)OC e3105b67df5bad4f92666a3b6e1173c4 [2,0,0,0,0,0|2,0,0]=4 1626 B9R0.12 CC[C@@H](OCF)C(=O)OC 45b802a0d43e9cd94252abf26ce09d6a [2,0,0,0,0,0|2,0,0]=4 1627 B9R0.12 CC[C@H](NCF)C(=O)OC fe09686712e657a883068fd953ef01ba [2,0,0,0,0,0|2,0,0]=4 1628 B9R0.12 CC[C@H](NCO)C(=O)OC 8463a4624e847aa288aa293e75dbf577 [2,0,0,0,0,0|2,0,0]=4 1629 B9R0.12 CC[C@H](OCF)C(=O)OC d6495aac60b87cd28fd4ef32e8fedf64 [2,0,0,0,0,0|2,0,0]=4 1630 B9R0.37 CCOC(C)C(CC)CC 28669fd5772db4c0bae67386c2ce6731 [2,0,0,0,0,0|1,0,1]=4 1631 B9R0.13 CCC(NCCBr)C(=O)O 60b3a5cec1771b7f3abdb67726cb92d4 [2,0,0,0,0,0|2,0,0]=4 1632 B9R0.13 CCC(NCCF)C(=O)O f00d042b671287c74e43c494b5cb091f [2,0,0,0,0,0|2,0,0]=4 1633 B9R0.13 CCC(NCCI)C(=O)O e2ba567d8906f9f386d4d3c7d9da02d9 [2,0,0,0,0,0|2,0,0]=4 1634 B9R0.13 CCC(NCCO)C(=O)O 1243b32011dafc3df4fb73416c3d434f [2,0,0,0,0,0|2,0,0]=4 1635 B9R0.13 CCC(NCCS)C(=O)O cf45ba956b95450629f68d6bc51c2075 [2,0,0,0,0,0|2,0,0]=4 1636 B9R0.13 CCC(NCOC)C(=O)O 29bdf399d9540f3750b5dbde7f57f2de [2,0,0,0,0,0|2,0,0]=4 1637 B9R0.13 CCC(NCSC)C(=O)O d79342730ef2d3fa4148bd4194f0c1b1 [2,0,0,0,0,0|2,0,0]=4 1638 B9R0.13 CCC(OCCF)C(=O)O c00ad7906612369696071846d56d58d6 [2,0,0,0,0,0|2,0,0]=4 1639 B9R0.13 CCC(OCCS)C(=O)O e3af5c4fd79a95335149ab48b00e4e02 [2,0,0,0,0,0|2,0,0]=4 1640 B9R0.13 CCC(OCOC)C(=O)O e6b9c845d6bb5735a4f158a19827bbda [2,0,0,0,0,0|2,0,0]=4 1641 B9R0.13 CCC(OCSC)C(=O)O ccd4ff15a6e6eec5f462ba7c168ece60 [2,0,0,0,0,0|2,0,0]=4 1642 B9R0.13 CCCCN(CC)C(=O)C 6dcc903ab553d1d8d7c18d1a9b5cfc71 [2,0,0,0,0,0|1,0,0]=3 1643 B9R0.13 CCCNC(CC)C(=O)N 667caeb7a94f8d9ae9b36913fbb97e0d [2,0,0,0,0,0|2,0,0]=4 1644 B9R0.13 CCCNC(CC)C(=O)O f069c353f507c75e209c8348074371d9 [2,0,0,0,0,0|1,0,0]=3 1645 B9R0.13 CCCNC(CCl)C(=O)O 83d744b2a78bac7ef1fc1246b7f75153 [2,0,0,0,0,0|2,0,0]=4 1646 B9R0.13 CCCNC(CF)C(=O)O 2674f23278ea23c1a3fd9e79cc64f417 [2,0,0,0,0,0|2,0,0]=4 1647 B9R0.13 CCCNC(CO)C(=O)O f78fc4da322d7ff361a6dd4f22023970 [2,0,0,0,0,0|2,0,0]=4 1648 B9R0.13 CCCNC(CS)C(=O)O 7ab935d1954160e0fa48d269e73468b7 [2,0,0,0,0,0|2,0,0]=4 1649 B9R0.13 CCCN[C@@H](CC)C(=O)N bb80f4d26611993ee0bd284d09039684 [2,0,0,0,0,0|2,0,0]=4 1650 B9R0.13 CCCN[C@@H](CC)C(=O)O 4af529648ddb980425c401ff5a4b13f1 [2,0,0,0,0,0|1,0,0]=3 1651 B9R0.13 CCCN[C@@H](CCl)C(=O)O dab0665f81f97191818ff25180caa069 [2,0,0,0,0,0|2,0,0]=4 1652 B9R0.13 CCCN[C@@H](CO)C(=O)O ddf3b03c8510fbc5ca4e2daff87a28f4 [2,0,0,0,0,0|2,0,0]=4 1653 B9R0.13 CCCN[C@@H](CS)C(=O)O e3a74b3aff5bc12b4b6807001695fe2d [2,0,0,0,0,0|2,0,0]=4 1654 B9R0.13 CCCN[C@H](CC)C(=O)O 61d39a4878aa39f0678d7acfbc68cb8c [2,0,0,0,0,0|1,0,0]=3 1655 B9R0.13 CCCN[C@H](CCl)C(=O)O 4dc35c1012b0d0bb7903731dd1c16a51 [2,0,0,0,0,0|2,0,0]=4 1656 B9R0.13 CCCN[C@H](CO)C(=O)O 8cf55344ec2a8ea73259764a0785501b [2,0,0,0,0,0|2,0,0]=4 1657 B9R0.13 CCCN[C@H](CS)C(=O)O a0487dcbe4739001e1f7043af5abb830 [2,0,0,0,0,0|2,0,0]=4 1658 B9R0.13 CCCOC(CC)C(=O)N 9fda2f7e2d6a6a11459fa617236d25bc [2,0,0,0,0,0|2,0,0]=4 1659 B9R0.13 CCCOC(CC)C(=O)O 3313398866cda9d19c5a77c88cc36eb1 [2,0,0,0,0,0|1,0,0]=3 1660 B9R0.13 CCCO[C@@H](CC)C(=O)O cc9a140b3b6be041090ec10f8ce0cd25 [2,0,0,0,0,0|1,0,0]=3 1661 B9R0.13 CCCO[C@H](CC)C(=O)O 8d217e6f2224fafe55f85fa98a7934d5 [2,0,0,0,0,0|1,0,0]=3 1662 B9R0.13 CCCO[C@H](CF)C(=O)O 29086d9c9cd694f8fc4088578e463f2a [2,0,0,0,0,0|2,0,0]=4 1663 B9R0.13 CCN(CCCO)C(=O)C e7ae570efef2e6ba7964a40dfee99a87 [2,0,0,0,0,0|2,0,0]=4 1664 B9R0.13 CCN(CCOC)C(=O)C 859fe7d575d98ccb55858cdb23984d45 [2,0,0,0,0,0|2,0,0]=4 1665 B9R0.13 CCNC[C@H](CC)C(=O)O cffe2fea12875251a32367199af5f540 [2,0,0,0,0,0|1,0,0]=3 1666 B9R0.13 CCNC[C@H](CO)C(=O)O a286bd4559b6a8b5982e2ab8701c93f1 [2,0,0,0,0,0|2,0,0]=4 1667 B9R0.13 CC[C@@H](CNCF)C(=O)O 981bb3911586f255abbfb5961cfb78eb [2,0,0,0,0,0|2,0,0]=4 1668 B9R0.13 CC[C@@H](CNCO)C(=O)O 68f9ed5f73d960fd989ccce413eebff8 [2,0,0,0,0,0|2,0,0]=4 1669 B9R0.13 CC[C@@H](NCCBr)C(=O)O bb6c187dee35d2ba390554d16dc4aa9c [2,0,0,0,0,0|2,0,0]=4 1670 B9R0.13 CC[C@@H](NCCF)C(=O)O b0e08cededed6f6c7a36fd6ec86e9e11 [2,0,0,0,0,0|2,0,0]=4 1671 B9R0.13 CC[C@@H](NCCI)C(=O)O 6c91d06ea51585e4b95ef8a66d270abe [2,0,0,0,0,0|2,0,0]=4 1672 B9R0.13 CC[C@@H](NCCO)C(=O)O e99f1fcc90431ea7ee28ab87555e864d [2,0,0,0,0,0|2,0,0]=4 1673 B9R0.13 CC[C@@H](NCCS)C(=O)O 14a5bfc0158c777ba30bd0f0cd7926c2 [2,0,0,0,0,0|2,0,0]=4 1674 B9R0.13 CC[C@@H](NCOC)C(=O)O afdab15192460f324c62f62289f5efe2 [2,0,0,0,0,0|2,0,0]=4 1675 B9R0.13 CC[C@@H](NCSC)C(=O)O 5454d4f202e581954955a2783886044d [2,0,0,0,0,0|2,0,0]=4 1676 B9R0.13 CC[C@@H](OCCF)C(=O)O 4399f51e9aa45bac3aec0e2f73a04ce4 [2,0,0,0,0,0|2,0,0]=4 1677 B9R0.13 CC[C@@H](OCCS)C(=O)O 66d55e860e2b27d00267a7f39525c672 [2,0,0,0,0,0|2,0,0]=4 1678 B9R0.13 CC[C@@H](OCOC)C(=O)O eaf672c9caead4abfc19e8f6a11051c8 [2,0,0,0,0,0|2,0,0]=4 1679 B9R0.13 CC[C@@H](OCSC)C(=O)O f1b1aa50116639e72a339c9ead522291 [2,0,0,0,0,0|2,0,0]=4 1680 B9R0.13 CC[C@H](NCCBr)C(=O)O e8e22504c7ea9404e3c376c4c793bb5c [2,0,0,0,0,0|2,0,0]=4 1681 B9R0.13 CC[C@H](NCCF)C(=O)O d1f8996afde19b0565d59a42f964550f [2,0,0,0,0,0|2,0,0]=4 1682 B9R0.13 CC[C@H](NCCI)C(=O)O 3a6efc8b485391f685b4ae297821e21f [2,0,0,0,0,0|2,0,0]=4 1683 B9R0.13 CC[C@H](NCCO)C(=O)O 1c6b8d756acf8f1db276283748fda969 [2,0,0,0,0,0|2,0,0]=4 1684 B9R0.13 CC[C@H](NCCS)C(=O)O c38a05c741bf6a8c2505ebb00a626765 [2,0,0,0,0,0|2,0,0]=4 1685 B9R0.13 CC[C@H](NCOC)C(=O)O 8ff3b44341478cbcc46f6485e982ee40 [2,0,0,0,0,0|2,0,0]=4 1686 B9R0.13 CC[C@H](NCSC)C(=O)O 215e8fc56b12daa5ff5365fc69da45a2 [2,0,0,0,0,0|2,0,0]=4 1687 B9R0.13 CC[C@H](OCCF)C(=O)O 516044a5d658494039eb40ae3a9e3d22 [2,0,0,0,0,0|2,0,0]=4 1688 B9R0.13 CC[C@H](OCCS)C(=O)O d0432edc92842a426feefec6e58ff53e [2,0,0,0,0,0|2,0,0]=4 1689 B9R0.13 CC[C@H](OCOC)C(=O)O 986ecf86f31a1bbe015cd3e780e6ebfd [2,0,0,0,0,0|2,0,0]=4 1690 B9R0.13 CC[C@H](OCSC)C(=O)O f2917a5a83a3472b302dcc248b0acae0 [2,0,0,0,0,0|2,0,0]=4 1691 B11R0.36 CCCCN(COCC)C(C)C e8b0fc1fc883e50b8064f9908169996f [1,1,0,0,0,0|1,0,1]=4 1692 B11R0.152 C#CCOCC(CC)CCCC 5b23556a7ceb2f197d89e0ff9b13433f [1,1,0,0,0,0|0,0,2]=4 1693 B11R0.152 C#CCOC[C@H](CC)CCCC 2c058711ba3ae5f6399891e1b70c8517 [1,1,0,0,0,0|0,0,2]=4 1694 B11R0.152 C=CCOCC(CC)CCCC 20d16bcab80894ff88c91e9e4de5ad55 [1,1,0,0,0,0|0,0,2]=4 1695 B11R0.152 CC/C=C/CN(CC)CCCC ff122ac436ae105f3e23da8f04a8f12e [1,1,0,0,0,0|2,0,0]=4 1696 B11R0.152 CCC/C=C(\CC)/COCCC cb50a8b11ecb973069fc700f8ab9351f [1,1,0,0,0,0|1,0,1]=4 1697 B11R0.152 CCCCC(CC)CCOCC d10689b361b044ef9215192bce787a09 [1,1,0,0,0,0|0,0,1]=3 1698 B11R0.152 CCCCC(CC)CCOCF e6d7ce7fa2831f9a99243022ebc22aa6 [1,1,0,0,0,0|1,0,1]=4 1699 B11R0.152 CCCCC(CC)CNCCBr 7a64963af072389348aafc258cd68233 [1,1,0,0,0,0|1,0,1]=4 1700 B11R0.152 CCCCC(CC)CNCCC 68ad1975366b4aac6f8a6533a24173f4 [1,1,0,0,0,0|1,0,1]=4 1701 B11R0.152 CCCCC(CC)CNCCF 5b8f804b2d80384c64439abcaf2edbd6 [1,1,0,0,0,0|1,0,1]=4 1702 B11R0.152 CCCCC(CC)CNCCI 5fe4772a999e706a52e528ba6c5b0747 [1,1,0,0,0,0|1,0,1]=4 1703 B11R0.152 CCCCC(CC)CNCCO 2cccb32d62388d9a66500d45dd1f3e16 [1,1,0,0,0,0|1,0,1]=4 1704 B11R0.152 CCCCC(CC)CNCCS 08d0ebae1e3ec17966f6485f9ee7dc51 [1,1,0,0,0,0|1,0,1]=4 1705 B11R0.152 CCCCC(CC)CNCOC e42a32978669721b3dcbc12c2a61647e [1,1,0,0,0,0|1,0,1]=4 1706 B11R0.152 CCCCC(CC)CNCSC b5d18f6a7a180e9a01315b426a7cdd7f [1,1,0,0,0,0|1,0,1]=4 1707 B11R0.152 CCCCC(CC)COCC#N 66ca56565881634dd100f440aaec0cbc [1,1,0,0,0,0|0,0,2]=4 1708 B11R0.152 CCCCC(CC)COCC=O 6c0f881ca75df0511a13222e27132e3f [1,1,0,0,0,0|0,0,2]=4 1709 B11R0.152 CCCCC(CC)COCCC 1596fb586f35d6257c58a437260e8f23 [1,1,0,0,0,0|0,0,1]=3 1710 B11R0.152 CCCCC(CC)COCCF 89e304f1eb3ad72b1e43c84adbace85f [1,1,0,0,0,0|0,0,1]=3 1711 B11R0.152 CCCCC(CC)COCCS f2dc16f1ed0b1891a46160d31334ec9b [1,1,0,0,0,0|0,0,1]=3 1712 B11R0.152 CCCCC(CC)COCOC 0a46ee225d3c302f1b29ce28b1281c92 [1,1,0,0,0,0|0,0,1]=3 1713 B11R0.152 CCCCC(CC)COCSC c7cacca3fc87e4304906d140931dff30 [1,1,0,0,0,0|0,0,1]=3 1714 B11R0.152 CCCCC(CC)NCCCCl 6633dfd8bb92219792bb5bc64d962eec [1,1,0,0,0,0|2,0,0]=4 1715 B11R0.152 CCCCC(CC)NCCCO c4dd78353ade1fc43c9028f5f689538b [1,1,0,0,0,0|2,0,0]=4 1716 B11R0.152 CCCCC(CC)NCCOC 6ca06bbf5ee49911b8df52f2511d5cc9 [1,1,0,0,0,0|2,0,0]=4 1717 B11R0.152 CCCCC(CC)NCCSC 6e57c4ac9d69711114f57b66bd3421bf [1,1,0,0,0,0|2,0,0]=4 1718 B11R0.152 CCCCC(CC)OCCCF 87b757998fef58278636d8d198e71690 [1,1,0,0,0,0|2,0,0]=4 1719 B11R0.152 CCCCC(CC)OCCCS 608785a7a50e15eaab2adae887dda12b [1,1,0,0,0,0|2,0,0]=4 1720 B11R0.152 CCCCC(CC)OCCOC 18eb75c977ddb45453d6d02a26c0c657 [1,1,0,0,0,0|2,0,0]=4 1721 B11R0.152 CCCCC(CC)OCCSC e34603a685d1109ce04bff26b9bf2111 [1,1,0,0,0,0|2,0,0]=4 1722 B11R0.152 CCCCC(CC)OCOCC 621997a8c4fb5e5da72c9381134bb7b1 [1,1,0,0,0,0|0,0,1]=3 1723 B11R0.152 CCCCC(CO)NCOCC 555f450adbd54468234f3b1dd1325789 [1,1,0,0,0,0|1,0,1]=4 1724 B11R0.152 CCCCCC(CC)COCC 4c88b6563313027b2d3f2d0ddd463d22 [1,1,0,0,0,0|0,0,1]=3 1725 B11R0.152 CCCCCC(CC)COCF 856d8aa94b91bae47127775f551e1bf4 [1,1,0,0,0,0|1,0,1]=4 1726 B11R0.152 CCCCCC(CC)OCCC eb8abd30125ee681a13a1a1c98757d32 [1,1,0,0,0,0|2,0,0]=4 1727 B11R0.152 CCCCC[C@H](CC)OCCC cd6f24cc3c62a85a2f8d47f083573856 [1,1,0,0,0,0|2,0,0]=4 1728 B11R0.152 CCCCN(CC)CCOCC 703291d986f0fdfb3b36517c2c27d8d0 [1,1,0,0,0,0|1,0,1]=4 1729 B11R0.152 CCCCNC(CC)CCCC d321950a6c3e89aba8ae946f5f6793a9 [1,1,0,0,0,0|1,0,1]=4 1730 B11R0.152 CCCCOC(CC)CCCC c1f3bbc6a563dbff01f8ab6ea3f3a6ef [1,1,0,0,0,0|1,0,1]=4 1731 B11R0.152 CCCC[C@@H](CC)CNCCBr 2380b06ab6a84d85ac72750f43301ce8 [1,1,0,0,0,0|1,0,1]=4 1732 B11R0.152 CCCC[C@@H](CC)CNCCC 04f28e4a45b5b9810b2dda6ded3a3568 [1,1,0,0,0,0|1,0,1]=4 1733 B11R0.152 CCCC[C@@H](CC)CNCCF fdd90dc132d84a24f07883ab267e71d7 [1,1,0,0,0,0|1,0,1]=4 1734 B11R0.152 CCCC[C@@H](CC)CNCCI 580c6e10c45d1d2259820cdd7113163c [1,1,0,0,0,0|1,0,1]=4 1735 B11R0.152 CCCC[C@@H](CC)CNCCO 076db43a0604f0dc4205592a805e7e1f [1,1,0,0,0,0|1,0,1]=4 1736 B11R0.152 CCCC[C@@H](CC)CNCCS d5a2f31ddbfdd4ad86468afd94926c6a [1,1,0,0,0,0|1,0,1]=4 1737 B11R0.152 CCCC[C@@H](CC)COCC#N f0c8d4af37517e0f0959ea78312cee34 [1,1,0,0,0,0|0,0,2]=4 1738 B11R0.152 CCCC[C@@H](CC)COCCC 59b28df42dea06fca802a12e7155a975 [1,1,0,0,0,0|0,0,1]=3 1739 B11R0.152 CCCC[C@@H](CC)COCCF 41f0e9f84aca8f68ef2e04d57c6cfecd [1,1,0,0,0,0|0,0,1]=3 1740 B11R0.152 CCCC[C@@H](CC)COCCS 0f5bb6aa44b617bca6a384dbdaf4ee59 [1,1,0,0,0,0|0,0,1]=3 1741 B11R0.152 CCCC[C@@H](CC)COCOC 1e1e31881779259e55922bcca747e919 [1,1,0,0,0,0|0,0,1]=3 1742 B11R0.152 CCCC[C@@H](CO)NCOCC de4e70a0f9add793b1dd1f6399eff906 [1,1,0,0,0,0|1,0,1]=4 1743 B11R0.152 CCCC[C@H](CO)NCOCC a86261dcee4b12208b54daeb3c141df9 [1,1,0,0,0,0|1,0,1]=4 1744 B11R0.152 CCOCCN(CC)COCC c7bee2cf07215c954944a262f7cd5e81 [1,1,0,0,0,0|1,0,1]=4 1745 B11R0.152 CCOCN(CC)CCCCO 0c02e3512d32fd2f175a06a0d0e002d1 [1,1,0,0,0,0|1,0,1]=4 1746 B11R0.152 CCOCN(CC)CCCOC 7bb16d1ff8d6ccb69a829c4996b160f2 [1,1,0,0,0,0|1,0,1]=4 1747 B11R0.158 CCCCC(CCC)COCC 019a82eef1c90729b74ce18537c58209 [1,1,0,0,0,0|0,0,1]=3 1748 B11R0.158 CCCCC(CCC)COCF 36183b5ec7b788b7cda2988bfbb2ec51 [1,1,0,0,0,0|1,0,1]=4 1749 B11R0.158 CCCCC(CCC)OCCC a071d9a926684cb5b0712140904ce688 [1,1,0,0,0,0|2,0,0]=4 1750 B11R0.158 CCCCC(CCCC)NCC c20d639030f68df03f28dfe04c4eaa7c [1,1,0,0,0,0|1,0,1]=4 1751 B11R0.158 CCCCC(CCCC)OCC 27444eaf06abe0efef41d97c6b841555 [1,1,0,0,0,0|1,0,1]=4 1752 B11R0.158 CCCCN(CCC)COCC 186efa6e84b771ea34f6183c3c50b625 [1,1,0,0,0,0|1,0,1]=4 1753 B11R0.158 CCCCN(CCO)COCC e0b9bfe46c3b2f5404e7d36122930d80 [1,1,0,0,0,0|1,0,1]=4 1754 B11R0.158 CCCCN(CCS)COCC 411e4d87660a381cb9ecfc8bd056ffe3 [1,1,0,0,0,0|1,0,1]=4 1755 B11R0.158 CCOCC(COCC)OCC ed8f544bedb387a00d3538f47c59e319 [1,1,0,0,0,0|1,0,1]=4 1756 B11R0.164 CCCCC(CC)CNC(C)C 599a461a8a26458c78ee43883c2d5e12 [1,1,0,0,0,0|1,0,1]=4 1757 B11R0.164 CCCCC(CC)COC(C)C 2e2d2beabb2cc9841345524783494e2d [1,1,0,0,0,0|0,0,1]=3 1758 B11R0.164 CCCCC(CC)NCC(C)C aaa408637bfdda066b792fd864c2b2ea [1,1,0,0,0,0|2,0,0]=4 1759 B11R0.164 CCCCC(CC)NCC(C)O f0c7f8caf14d557d61ebbcf8e86c1dec [1,1,0,0,0,0|2,0,0]=4 1760 B11R0.164 CCCCC(CC)NC[C@@H](C)O 84cea146ae8e7cd7ce101fc7c1fe4b67 [1,1,0,0,0,0|2,0,0]=4 1761 B11R0.164 CCCCC(CC)NC[C@H](C)O 36f975339a9cdcb22c3f47cb4949add0 [1,1,0,0,0,0|2,0,0]=4 1762 B11R0.164 CCCCC(CC)OCC(C)C 822fbfe7a64d297bdb2284e0712ce94e [1,1,0,0,0,0|2,0,0]=4 1763 B11R0.164 CCCCC(CC)OCC(C)F 9157c6481349feba6f756d0fcc0c07ec [1,1,0,0,0,0|2,0,0]=4 1764 B11R0.164 CCCCC(CC)OCC(C)S c94949915c14712c4da78f951efc4c5b [1,1,0,0,0,0|2,0,0]=4 1765 B11R0.164 CCCCC(CC)OC[C@@H](C)F 73b2e7fb4e34a7f8c21ab0d10c8c63c5 [1,1,0,0,0,0|2,0,0]=4 1766 B11R0.164 CCCCC(CC)OC[C@H](C)F 02213ccf9888fd63d32bd0dc76248896 [1,1,0,0,0,0|2,0,0]=4 1767 B11R0.164 CCCCN(CC)COC(C)C 9e596dbc8c2752a7fbcb7c608866c291 [1,1,0,0,0,0|1,0,1]=4 1768 B11R0.164 CCCC[C@@H](CC)COC(C)C 07a425637be45394426c6b20c3ee116f [1,1,0,0,0,0|0,0,1]=3 1769 B11R0.166 CCCCC(CC)CN(C)CC 70d53e6b6fd40025380bb3a887fae3bb [1,1,0,0,0,0|1,0,1]=4 1770 B11R0.166 CCCCC(CC)NC(C)CC 32bfd8a40202c0350c817b001b8b0790 [1,1,0,0,0,0|2,0,0]=4 1771 B11R0.166 CCCCC(CC)N[C@@H](C)CC d3dcb4790d12a92bde5ed3210c10a538 [1,1,0,0,0,0|2,0,0]=4 1772 B11R0.166 CCCCC(CC)N[C@H](C)CC 4ed8e23184f07ec1d3441346d72b3ef4 [1,1,0,0,0,0|2,0,0]=4 1773 B11R0.166 CCCCC(CC)OC(C)CC 6a82ced704ccfbfec9cabdbfd1f44e9d [1,1,0,0,0,0|2,0,0]=4 1774 B11R0.166 CCCCC(CC)O[C@@H](C)CC 61610b680f606b23ee63a4da299e10d5 [1,1,0,0,0,0|2,0,0]=4 1775 B11R0.166 CCCCC(CC)O[C@H](C)CC 1b65fcad7ed20e32b30f18df25b0d2ab [1,1,0,0,0,0|2,0,0]=4 1776 B11R0.166 CCCC[C@@H](CC)CN(C)CC bafb253c40c3f36a3b2faf73fa2e712b [1,1,0,0,0,0|1,0,1]=4 1777 B11R0.166 CCCOC(CC)CC(C)CC 1ea8ea6dfcac426199ca031c8ffa9688 [1,1,0,0,0,0|2,0,0]=4 1778 B11R0.166 CCOCN(CC)CC(O)CC 1d2ef76c9799c891d933c4dd477e05f0 [1,1,0,0,0,0|1,0,1]=4 1779 B11R0.11 C=CCOC(=O)[C@H](C)NCCC 8833bf154d9143ad1961ec58d4144120 [1,1,0,0,0,0|1,0,1]=4 1780 B11R0.11 CC/C=C/C(=O)N(C)CCCC ba2881e2daee3e5d22431b94f5d06917 [1,1,0,0,0,0|2,0,0]=4 1781 B11R0.11 CC/C=C\C(=O)N(C)CCCC 31d74eef32333eae03962c3f3c44fb7d [1,1,0,0,0,0|2,0,0]=4 1782 B11R0.11 CCC#CC(=O)N(C)CCCC b8a883e6bc22e67158e5b509c36151cd [1,1,0,0,0,0|2,0,0]=4 1783 B11R0.11 CCC=CC(=O)N(C)CCCC 45b99ca61563efe1def59eef0accd30b [1,1,0,0,0,0|2,0,0]=4 1784 B11R0.11 CCCCC(=O)N(C)CCCC 7dad5d8e8bfe9b0ddfef2e09d45a8eda [1,1,0,0,0,0|2,0,0]=4 1785 B11R0.11 CCCCC(O)C(=O)NCCC 08018766b6839562ad7bd788da1df983 [1,1,0,0,0,0|2,0,0]=4 1786 B11R0.11 CCCCC(O)C(=O)NCCF b54bf0d966ec10d1d066831bce774865 [1,1,0,0,0,0|2,0,0]=4 1787 B11R0.11 CCCCC(O)C(=O)NCCI 5d4e6792c586e00f102d94205b30a4a3 [1,1,0,0,0,0|2,0,0]=4 1788 B11R0.11 CCCCC(O)C(=O)NCCO 5149671f7e2069a8cea9eb99c58eed28 [1,1,0,0,0,0|2,0,0]=4 1789 B11R0.11 CCCCC(O)C(=O)NCCS 03efb6fd89818e7d8c7576f7b6647d99 [1,1,0,0,0,0|2,0,0]=4 1790 B11R0.11 CCCCN(C)C(=O)CCCF 9f40afa2d92b99be5de5abf1b028fbdd [1,1,0,0,0,0|2,0,0]=4 1791 B11R0.11 CCCCN(C)C(=O)CCCS 0221bb21ef873f339ce551eed9780b83 [1,1,0,0,0,0|2,0,0]=4 1792 B11R0.11 CCCCN(C)C(=O)CCOC d34a6e6c9c3a91482b3e5b0f0ebbe6dc [1,1,0,0,0,0|2,0,0]=4 1793 B11R0.11 CCCCN(C)C(=O)CCSC 72f40417428e79b41f72dac066910b9c [1,1,0,0,0,0|2,0,0]=4 1794 B11R0.11 CCCCN(C)C(=O)COCC b25351f0c8f155bad8decb46626aa368 [1,1,0,0,0,0|1,0,0]=3 1795 B11R0.11 CCCCN(C)C(=O)CSCC 73741d1539e5d7f6b198b9252c14215f [1,1,0,0,0,0|1,1,0]=4 1796 B11R0.11 CCCCN(C)C(=O)NCCC 05a16d8f5ddef3936b05506204558473 [1,1,0,0,0,0|2,0,0]=4 1797 B11R0.11 CCCCN(C)C(=O)NCCF f219bfa89c17468a5361d3ec387fd84f [1,1,0,0,0,0|2,0,0]=4 1798 B11R0.11 CCCCN(C)C(=O)NCCN 55e935ad42591cbfd0bc81e180aeafd4 [1,1,0,0,0,0|2,0,0]=4 1799 B11R0.11 CCCCN(C)C(=O)NCCO 61f0d81c79f0041f44feb2baafdc55c7 [1,1,0,0,0,0|2,0,0]=4 1800 B11R0.11 CCCCN(C)C(=O)NCCS a7ecbe9442b3573c0ae36d690c4b537a [1,1,0,0,0,0|2,0,0]=4 1801 B11R0.11 CCCC[C@@H](O)C(=O)NCCC b494a02b34c330a020a33f32c0dcfa27 [1,1,0,0,0,0|2,0,0]=4 1802 B11R0.11 CCCC[C@@H](O)C(=O)NCCF 3e633f05afcdc84aa9aa17b1590ec4c4 [1,1,0,0,0,0|2,0,0]=4 1803 B11R0.11 CCCC[C@@H](O)C(=O)NCCI 09bb7bf2c4507d3e1795a627fdf9e6c5 [1,1,0,0,0,0|2,0,0]=4 1804 B11R0.11 CCCC[C@@H](O)C(=O)NCCO 8fc2793404e364001d95d858d96f078f [1,1,0,0,0,0|2,0,0]=4 1805 B11R0.11 CCCC[C@@H](O)C(=O)NCCS b4bd831ce868c50ecccf2bca30bf7bc1 [1,1,0,0,0,0|2,0,0]=4 1806 B11R0.11 CCCC[C@H](O)C(=O)NCCC b77f17f943bd1faa8f4b7bb97452a886 [1,1,0,0,0,0|2,0,0]=4 1807 B11R0.11 CCCC[C@H](O)C(=O)NCCF e46aba56cbeffede8ff9b1a228ae4fa1 [1,1,0,0,0,0|2,0,0]=4 1808 B11R0.11 CCCC[C@H](O)C(=O)NCCI 294337f2d9e6fa3581c50c563cf50ea9 [1,1,0,0,0,0|2,0,0]=4 1809 B11R0.11 CCCC[C@H](O)C(=O)NCCO 4ca5908f106a4ae30204cd9bb01b3f81 [1,1,0,0,0,0|2,0,0]=4 1810 B11R0.11 CCCC[C@H](O)C(=O)NCCS 833ad9db1501d136e8e1d17ac3856269 [1,1,0,0,0,0|2,0,0]=4 1811 B11R0.11 CCCNC(=O)C(C)NCCC 7a48518f332890dcb8c6138ab791572d [1,1,0,0,0,0|2,0,0]=4 1812 B11R0.11 CCCNC(=O)C(C)OCCC 1de2e816ad9e83948061886135d6e923 [1,1,0,0,0,0|2,0,0]=4 1813 B11R0.11 CCCNC(C)C(=O)OCCC 39f5bc371d2278f8a0fde19bb4d45c08 [1,1,0,0,0,0|1,0,0]=3 1814 B11R0.11 CCCN[C@@H](C)C(=O)OCCC 6d5e148c7e1793253671fcfe52eb33cb [1,1,0,0,0,0|1,0,0]=3 1815 B11R0.11 CCCOC(=O)C(C)NCCBr 0b9ea4a9e488218ec2e6dc88a538cdd3 [1,1,0,0,0,0|2,0,0]=4 1816 B11R0.11 CCCOC(=O)C(C)NCCF 1ae914e3feb01bf2e3ffe5a19dda384b [1,1,0,0,0,0|2,0,0]=4 1817 B11R0.11 CCCOC(=O)C(C)NCCI 4e79b94265aa8f3b3edcb942eacabb0d [1,1,0,0,0,0|2,0,0]=4 1818 B11R0.11 CCCOC(=O)C(C)NCCO 91ccbfc8e5cb072e6ee246e06459d1b0 [1,1,0,0,0,0|2,0,0]=4 1819 B11R0.11 CCCOC(=O)C(C)NCCS 9978260cda7de332f93b05ab762c8f30 [1,1,0,0,0,0|2,0,0]=4 1820 B11R0.11 CCCOC(=O)C(C)NCOC 266365b564c93770ec15d05f4e6b9100 [1,1,0,0,0,0|2,0,0]=4 1821 B11R0.11 CCCOC(=O)C(C)NCSC 1cf3caf1965b7f84cddbca71b0bff9bc [1,1,0,0,0,0|2,0,0]=4 1822 B11R0.11 CCCOC(=O)C(C)OCCC e1e6326dfd25a114a204406121cbf89e [1,1,0,0,0,0|1,0,0]=3 1823 B11R0.11 CCCOC(=O)C(C)OCCF 333575422a7830a5335ea45e51441bae [1,1,0,0,0,0|2,0,0]=4 1824 B11R0.11 CCCOC(=O)C(C)OCCS 98d3265664178d1534d5a9f12c599033 [1,1,0,0,0,0|2,0,0]=4 1825 B11R0.11 CCCOC(=O)C(C)OCOC 26f4b52c07df7628dccd84ca7ebe1d51 [1,1,0,0,0,0|2,0,0]=4 1826 B11R0.11 CCCOC(=O)C(C)OCSC 363ed3ac455fda7a0fb44a5ff1ed0a0f [1,1,0,0,0,0|2,0,0]=4 1827 B11R0.11 CCCOC(=O)[C@H](C)NCCF b6619eda23ac0a0641e69fc9b982edec [1,1,0,0,0,0|2,0,0]=4 1828 B11R0.11 CCCOC(=O)[C@H](C)NCCO eeb6009e00560319bb373816f4ba3473 [1,1,0,0,0,0|2,0,0]=4 1829 B11R0.11 CCCOC(=O)[C@H](C)NCCS f2b5f7d79d3bcb85dce24dca5a7df255 [1,1,0,0,0,0|2,0,0]=4 1830 B11R0.11 CCCOC(=O)[C@H](C)NCOC da980b18ad5ee394c91613a93cb1c648 [1,1,0,0,0,0|2,0,0]=4 1831 B11R0.11 CCCOC(=O)[C@H](C)NCSC 1cb5b64e76f652cde5fd87990f13a1b8 [1,1,0,0,0,0|2,0,0]=4 1832 B11R0.11 CCCOC(=O)[C@H](C)OCCC 7e33cae870c8912c3eed794ebfa294da [1,1,0,0,0,0|1,0,0]=3 1833 B11R0.11 CCCOC(=O)[C@H](C)OCCF c95e40056efae04b8952d7223d41873b [1,1,0,0,0,0|2,0,0]=4 1834 B11R0.11 CCCOC(=O)[C@H](C)OCCS a6fe470dc226381a167c9216693ceb85 [1,1,0,0,0,0|2,0,0]=4 1835 B11R0.11 CCCOC(=O)[C@H](C)OCOC ef0a852b63fc21b2bd8e5f524e2200a1 [1,1,0,0,0,0|2,0,0]=4 1836 B11R0.11 CCCOC(=O)[C@H](C)OCSC 7b343e088b7c93f2b25a7e444bee981e [1,1,0,0,0,0|2,0,0]=4 1837 B11R0.11 CCCOC(C)C(=O)NCCF d7986605e1a4d27afa15c710fe03b3e4 [1,1,0,0,0,0|2,0,0]=4 1838 B11R0.11 CCCOC(C)C(=O)NCCI 1e84f7dae2811872fa7301d0d610f382 [1,1,0,0,0,0|2,0,0]=4 1839 B11R0.11 CCCOC(C)C(=O)NCCO 9efc0c43a66ed9fdb4f1dd16b2d34539 [1,1,0,0,0,0|2,0,0]=4 1840 B11R0.11 CCCOC(C)C(=O)NCCS 2a7e504acde71f31c3cd887464fce766 [1,1,0,0,0,0|2,0,0]=4 1841 B11R0.11 CCOCC(=O)N(C)CCCO 68e83a5c09b7af7b89b7334ba686e98b [1,1,0,0,0,0|2,0,0]=4 1842 B11R0.11 CCOCC(=O)N(C)CCOC 1c74b995c548225ce8f88361e231b577 [1,1,0,0,0,0|2,0,0]=4 1843 B11R0.11 CCOCC(=O)N(C)CCSC ab94e2fc36c5ef1a26a9de812459be15 [1,1,0,0,0,0|2,0,0]=4 1844 B11R0.43 CCCC(=O)N(C)CC(O)CC 3894a1f968761c7fbeea7ab37c07436e [1,1,0,0,0,0|2,0,0]=4 1845 B11R0.43 CCNC(=O)C(C)NC(C)CC 194b574d79f507de17e15476ca567cd4 [1,1,0,0,0,0|2,0,0]=4 1846 B11R0.43 CCNC(=O)C(C)N[C@@H](C)CC bb50341b69076d6c88ccefcc13a3440e [1,1,0,0,0,0|2,0,0]=4 1847 B11R0.43 CCNC(=O)C(C)N[C@H](C)CC 40db49409287f467b446b64598780ca1 [1,1,0,0,0,0|2,0,0]=4 1848 B11R0.43 CCNC(=O)C(C)OC(C)CC dc268ecfe8288139c21d5d201a30ef40 [1,1,0,0,0,0|2,0,0]=4 1849 B11R0.43 CCNC(=O)C(C)O[C@@H](C)CC 359130ea03f1c19755105e34b863fcab [1,1,0,0,0,0|2,0,0]=4 1850 B11R0.43 CCNC(=O)C(C)O[C@H](C)CC b79532514409712cb9cbf5ec6c47a486 [1,1,0,0,0,0|2,0,0]=4 1851 B11R0.43 CCNC(=O)[C@H](C)NC(C)CC 51e061dc12b41256ae71ab9a8a1022ed [1,1,0,0,0,0|2,0,0]=4 1852 B11R0.43 CCOC(=O)C(C)CN(C)CC b943d5fc6653c95f28b0592f98113ae6 [1,1,0,0,0,0|1,0,0]=3 1853 B11R0.43 CCOC(=O)C(C)CN(C)CF f72714f2767652d85c97fa39bc2f42fd [1,1,0,0,0,0|2,0,0]=4 1854 B11R0.43 CCOC(=O)C(C)CN(C)CO 6dab7e4fafddfb5494624da254d359b1 [1,1,0,0,0,0|2,0,0]=4 1855 B11R0.43 CCOC(=O)C(C)NC(C)CC 3ab069b5f9f34e8fefb1362a57bfce44 [1,1,0,0,0,0|1,0,0]=3 1856 B11R0.43 CCOC(=O)C(C)NC(C)CO 7d0b2caa945df2bea74deeacf25f8dd9 [1,1,0,0,0,0|2,0,0]=4 1857 B11R0.43 CCOC(=O)C(C)N[C@@H](C)CC c493d2552fb9dbc066e747fbbc62126b [1,1,0,0,0,0|1,0,0]=3 1858 B11R0.43 CCOC(=O)C(C)N[C@@H](C)CO 62b0961d77079dcb4b9b44836b65f47a [1,1,0,0,0,0|2,0,0]=4 1859 B11R0.43 CCOC(=O)C(C)N[C@H](C)CC 82469a415f3c7c4077c384f3ec6610f0 [1,1,0,0,0,0|1,0,0]=3 1860 B11R0.43 CCOC(=O)C(C)N[C@H](C)CO 5fde6e694a84cc050fb7728babd1f506 [1,1,0,0,0,0|2,0,0]=4 1861 B11R0.43 CCOC(=O)C(C)OC(C)CC 6bd2e09ef717ff98ca9f13d443b0ba76 [1,1,0,0,0,0|1,0,0]=3 1862 B11R0.43 CCOC(=O)C(C)OC(C)CF faebaa5a68d74f3e56b0123e768b3e70 [1,1,0,0,0,0|2,0,0]=4 1863 B11R0.43 CCOC(=O)C(C)OC(C)CS 099d28708e3a2b842d8e9aef3abd4610 [1,1,0,0,0,0|2,0,0]=4 1864 B11R0.43 CCOC(=O)C(C)O[C@@H](C)CC 0223618ece67748ec312418c35564848 [1,1,0,0,0,0|1,0,0]=3 1865 B11R0.43 CCOC(=O)C(C)O[C@H](C)CC c0640bf90627d52b0564b3ad56b6b614 [1,1,0,0,0,0|1,0,0]=3 1866 B11R0.43 CCOC(=O)C(C)O[C@H](C)CS 5d06ee18eee327f04b23d8581ea20212 [1,1,0,0,0,0|2,0,0]=4 1867 B11R0.43 CCOC(=O)C(F)NC(C)CC 057ec54321e8e0fa494aa7f553b80704 [1,1,0,0,0,0|2,0,0]=4 1868 B11R0.43 CCOC(=O)C(F)N[C@@H](C)CC b9b3de5fcc8eb9f1ec6509f53cae73dc [1,1,0,0,0,0|2,0,0]=4 1869 B11R0.43 CCOC(=O)C(F)N[C@H](C)CC 522bd1490a9784004cc5123b64694781 [1,1,0,0,0,0|2,0,0]=4 1870 B11R0.43 CCOC(=O)C(F)OC(C)CC d0eafbd8b33db39e041e9f2fb46d1c6e [1,1,0,0,0,0|2,0,0]=4 1871 B11R0.43 CCOC(=O)C(F)O[C@@H](C)CC f43ec6a84134786758454b33620e55a1 [1,1,0,0,0,0|2,0,0]=4 1872 B11R0.43 CCOC(=O)C(F)O[C@H](C)CC a6fb18b0bd454af354b4db61133508ac [1,1,0,0,0,0|2,0,0]=4 1873 B11R0.43 CCOC(=O)[C@@H](C)NC(=O)CC 76674455cb065b973c0f746e12ccddea [1,1,0,0,0,0|1,0,1]=4 1874 B11R0.43 CCOC(=O)[C@@H](C)NC(C)CC 0f57439771e48cbc44f926b2cd1f3dc0 [1,1,0,0,0,0|1,0,0]=3 1875 B11R0.43 CCOC(=O)[C@@H](C)NC(C)CO 29bb15d95d87983c5d68e9299cfdaa11 [1,1,0,0,0,0|2,0,0]=4 1876 B11R0.43 CCOC(=O)[C@@H](C)N[C@@H](C)CC ee60484e3ec06fd186bd6fa99869e9e6 [1,1,0,0,0,0|1,0,0]=3 1877 B11R0.43 CCOC(=O)[C@@H](C)N[C@@H](C)CO aab1a3d310808303c610e1c6486c28f0 [1,1,0,0,0,0|2,0,0]=4 1878 B11R0.43 CCOC(=O)[C@@H](C)N[C@H](C)CC 4efd52c01606e9171b73d80c16d19c61 [1,1,0,0,0,0|1,0,0]=3 1879 B11R0.43 CCOC(=O)[C@@H](C)N[C@H](C)CO c3fdd99607f837051301c911a7671b5d [1,1,0,0,0,0|2,0,0]=4 1880 B11R0.43 CCOC(=O)[C@@H](C)OC(C)CC 957855a49c273d56775ebce301f52d5e [1,1,0,0,0,0|1,0,0]=3 1881 B11R0.43 CCOC(=O)[C@@H](C)OC(C)CF 152949e6d93f6a607c14536a3a903ae3 [1,1,0,0,0,0|2,0,0]=4 1882 B11R0.43 CCOC(=O)[C@@H](C)OC(C)CS bd90b1b914c70bfe3b0924400bcf7eb0 [1,1,0,0,0,0|2,0,0]=4 1883 B11R0.43 CCOC(=O)[C@@H](C)O[C@@H](C)CC b6a0cff4e0d32f4884f11949241d6b1a [1,1,0,0,0,0|1,0,0]=3 1884 B11R0.43 CCOC(=O)[C@@H](C)O[C@H](C)CC e64f243b2e515ab0bafde2757dcd1f6d [1,1,0,0,0,0|1,0,0]=3 1885 B11R0.43 CCOC(=O)[C@@H](C)O[C@H](C)CS a879fb066c36f46baff649a91089a6e9 [1,1,0,0,0,0|2,0,0]=4 1886 B11R0.43 CCOC(=O)[C@H](C)NC(C)CC aa5d31e1aa5ca3d0cc968b2cca173a69 [1,1,0,0,0,0|1,0,0]=3 1887 B11R0.43 CCOC(=O)[C@H](C)NC(C)CO 7053afdc5355cacdf3d9f0eb508c8cac [1,1,0,0,0,0|2,0,0]=4 1888 B11R0.43 CCOC(=O)[C@H](C)N[C@@H](C)CC 0fca303090bbe7272bf858f5c9b5c5ef [1,1,0,0,0,0|1,0,0]=3 1889 B11R0.43 CCOC(=O)[C@H](C)N[C@@H](C)CO 7e9f465bdeae1bb98756940e3b790c59 [1,1,0,0,0,0|2,0,0]=4 1890 B11R0.43 CCOC(=O)[C@H](C)N[C@H](C)CC c37ed2401aa15460d8d4a50dbb731876 [1,1,0,0,0,0|1,0,0]=3 1891 B11R0.43 CCOC(=O)[C@H](C)N[C@H](C)CO a419375a1c9b791922965c315cb512c6 [1,1,0,0,0,0|2,0,0]=4 1892 B11R0.43 CCOC(=O)[C@H](C)OC(C)CC 0b1cf54ea4b246d9e1e7e4633ccfc109 [1,1,0,0,0,0|1,0,0]=3 1893 B11R0.43 CCOC(=O)[C@H](C)OC(C)CF 15b33f2c708ddd8dfc82b542b22160de [1,1,0,0,0,0|2,0,0]=4 1894 B11R0.43 CCOC(=O)[C@H](C)OC(C)CS 3de09192d10d0214bc8e12111fbedfb6 [1,1,0,0,0,0|2,0,0]=4 1895 B11R0.43 CCOC(=O)[C@H](C)O[C@@H](C)CC 7cdb03ebe30c936c9a60077929393565 [1,1,0,0,0,0|1,0,0]=3 1896 B11R0.43 CCOC(=O)[C@H](C)O[C@H](C)CC 5ce26c3b4e3bbef89fde9ccada082706 [1,1,0,0,0,0|1,0,0]=3 1897 B11R0.43 CCOC(=O)[C@H](C)O[C@H](C)CS 00b153a5667e6858ba1199f2cca306fc [1,1,0,0,0,0|2,0,0]=4 1898 B11R0.59 C=C(C)CNC(C)C(=O)OCC bf5312a36fc0097e6533d7fcd67a22b9 [1,1,0,0,0,0|1,0,1]=4 1899 B11R0.59 C=C(C)CN[C@@H](C)C(=O)OCC c17913ab461b12f54ef6f739ffe09968 [1,1,0,0,0,0|1,0,1]=4 1900 B11R0.59 C=C(C)CN[C@H](C)C(=O)OCC 9d7fb377bb948f40550d0a3b68210421 [1,1,0,0,0,0|1,0,1]=4 1901 B11R0.59 C=C(C)COC(C)C(=O)OCC cd0002171385d64b2ab1d161579bc481 [1,1,0,0,0,0|1,0,1]=4 1902 B11R0.59 C=C(C)CO[C@@H](C)C(=O)OCC 57832c0a94c96fdf687667a4c96a6d02 [1,1,0,0,0,0|1,0,1]=4 1903 B11R0.59 C=C(C)CO[C@H](C)C(=O)OCC 8bb226a0c6b2c01bce63e29644680661 [1,1,0,0,0,0|1,0,1]=4 1904 B11R0.59 CCCC(=O)N(C)CCC(C)C d0748a90e32b2c2f38887403fad9758b [1,1,0,0,0,0|2,0,0]=4 1905 B11R0.59 CCCC(=O)N(C)CCC(C)O eb55f08247fa4c04fa71079c1953e8b7 [1,1,0,0,0,0|2,0,0]=4 1906 B11R0.59 CCNC(=O)C(C)NCC(C)C 314860dd8f43ced386dfb2ce288589f0 [1,1,0,0,0,0|2,0,0]=4 1907 B11R0.59 CCNC(=O)C(C)NCC(C)O 047f37ebd36a506af8f4235070bb3f32 [1,1,0,0,0,0|2,0,0]=4 1908 B11R0.59 CCNC(=O)C(C)NC[C@@H](C)O 32a040488fce303d96b4b4970f95a70d [1,1,0,0,0,0|2,0,0]=4 1909 B11R0.59 CCNC(=O)C(C)NC[C@H](C)O 44dae0fbefd3e1682ffffbffa97cc01e [1,1,0,0,0,0|2,0,0]=4 1910 B11R0.59 CCNC(=O)C(C)OCC(C)C 1ab6d1427c238c6b7f939125f027a1a4 [1,1,0,0,0,0|2,0,0]=4 1911 B11R0.59 CCNC(=O)C(C)OCC(C)F 490eba5aa79d520a6f4d1e301ae72530 [1,1,0,0,0,0|2,0,0]=4 1912 B11R0.59 CCNC(=O)C(C)OCC(C)S 4c267862b19e43b57587cfa4a2da01e5 [1,1,0,0,0,0|2,0,0]=4 1913 B11R0.59 CCNC(=O)C(C)OC[C@@H](C)F 6f31f7fed2a9a51d9afb1f2226505ca1 [1,1,0,0,0,0|2,0,0]=4 1914 B11R0.59 CCNC(=O)C(C)OC[C@H](C)F b835620b773756c2eeb0e2d9f2c3116b [1,1,0,0,0,0|2,0,0]=4 1915 B11R0.59 CCNC(=O)[C@H](C)NCC(C)C ed279a16ec9b87f7808047984006f3dd [1,1,0,0,0,0|2,0,0]=4 1916 B11R0.59 CCNC(=O)[C@H](C)NCC(C)O b97dc8a210420e44185a35fec15517b9 [1,1,0,0,0,0|2,0,0]=4 1917 B11R0.59 CCNC(=O)[C@H](C)NC[C@@H](C)O e50a81ce810094c41e32e7ef601a544d [1,1,0,0,0,0|2,0,0]=4 1918 B11R0.59 CCNC(=O)[C@H](C)NC[C@H](C)O 30cbe70de03f7df5b57146a54ae6823d [1,1,0,0,0,0|2,0,0]=4 1919 B11R0.59 CCOC(=O)C(C)CNC(=O)C e13e4e2ad2f8446742126ea7b770ed42 [1,1,0,0,0,0|1,0,1]=4 1920 B11R0.59 CCOC(=O)C(C)CNC(C)C bc7a142ea044e32f1cee641cd4e6dac3 [1,1,0,0,0,0|1,0,0]=3 1921 B11R0.59 CCOC(=O)C(C)COC(C)C ccc25f570d0d7ec27bdce118125e7c34 [1,1,0,0,0,0|1,0,0]=3 1922 B11R0.59 CCOC(=O)C(C)NCC(=O)C b9173456fc3afaf4d95a6a5096fa4cd0 [1,1,0,0,0,0|1,0,1]=4 1923 B11R0.59 CCOC(=O)C(C)NCC(C)C 9c2f852d5042ee55b615db5a3640da77 [1,1,0,0,0,0|1,0,0]=3 1924 B11R0.59 CCOC(=O)C(C)NCC(C)O 27274b179d0c9e3c2d969c21d651961d [1,1,0,0,0,0|1,0,0]=3 1925 B11R0.59 CCOC(=O)C(C)NCC(F)F b6da37e04753e19189d6b6ba447e3675 [1,1,0,0,0,0|2,0,0]=4 1926 B11R0.59 CCOC(=O)C(C)NC[C@@H](C)O 3ed3ae0ed9ddcee765a8a73da57f4ca7 [1,1,0,0,0,0|1,0,0]=3 1927 B11R0.59 CCOC(=O)C(C)NC[C@H](C)O 76ab4bc5f71b8641bd118e1dbf10dd25 [1,1,0,0,0,0|1,0,0]=3 1928 B11R0.59 CCOC(=O)C(C)OCC(=O)C 8412da2b2118c216da53e6ddbce1313d [1,1,0,0,0,0|1,0,1]=4 1929 B11R0.59 CCOC(=O)C(C)OCC(C)C 465cae5bf31618dba1e615cc4f122cfb [1,1,0,0,0,0|1,0,0]=3 1930 B11R0.59 CCOC(=O)C(C)OCC(C)F dbb05eeb5de6eb283a0ecb89b5ccda97 [1,1,0,0,0,0|1,0,0]=3 1931 B11R0.59 CCOC(=O)C(C)OCC(C)S e4ad0583f321acb0dca8163f58380681 [1,1,0,0,0,0|1,0,0]=3 1932 B11R0.59 CCOC(=O)C(C)OCC(F)F d43e56a1da9b69119d4f0cd23b628935 [1,1,0,0,0,0|2,0,0]=4 1933 B11R0.59 CCOC(=O)C(C)OCN(C)C c038d87b71817b7c1b6b086daa92a4f6 [1,1,0,0,0,0|2,0,0]=4 1934 B11R0.59 CCOC(=O)C(C)OC[C@@H](C)F 079c3aac1418032ff837a7a5a9bef0ff [1,1,0,0,0,0|1,0,0]=3 1935 B11R0.59 CCOC(=O)C(C)OC[C@H](C)F 89add01705bdb8a5e093d7648bf4a875 [1,1,0,0,0,0|1,0,0]=3 1936 B11R0.59 CCOC(=O)C(F)NCC(C)C 1ab7f201439a17ecc8673a2a527873f2 [1,1,0,0,0,0|2,0,0]=4 1937 B11R0.59 CCOC(=O)C(F)NCC(C)O b2a3264d1c32ee2d54d3e7437d1bb8e9 [1,1,0,0,0,0|2,0,0]=4 1938 B11R0.59 CCOC(=O)C(F)NC[C@@H](C)O a2620629b4f064f7e031619a7aa746bb [1,1,0,0,0,0|2,0,0]=4 1939 B11R0.59 CCOC(=O)C(F)NC[C@H](C)O d2d5438038853b47aea95166fb129f57 [1,1,0,0,0,0|2,0,0]=4 1940 B11R0.59 CCOC(=O)C(F)OCC(C)C d21d24693337a3213aa906498cf57290 [1,1,0,0,0,0|2,0,0]=4 1941 B11R0.59 CCOC(=O)C(F)OCC(C)F dd8e35487d3af327bffe04a032268580 [1,1,0,0,0,0|2,0,0]=4 1942 B11R0.59 CCOC(=O)C(F)OCC(C)S e9d2666f13fb420fd0750e3e79e5a84c [1,1,0,0,0,0|2,0,0]=4 1943 B11R0.59 CCOC(=O)C(F)OC[C@@H](C)F 113c2b17d020c3431a477f2ec6577657 [1,1,0,0,0,0|2,0,0]=4 1944 B11R0.59 CCOC(=O)C(F)OC[C@H](C)F 0df3c6f05b79e830b6d4bb213d1e1795 [1,1,0,0,0,0|2,0,0]=4 1945 B11R0.59 CCOC(=O)[C@@H](C)NCC(=O)C 4f87a3ddeaf2f433d39230a48c052fbf [1,1,0,0,0,0|1,0,1]=4 1946 B11R0.59 CCOC(=O)[C@@H](C)NCC(C)C 5e81311f4d4aa2695b3824b525fed593 [1,1,0,0,0,0|1,0,0]=3 1947 B11R0.59 CCOC(=O)[C@@H](C)NCC(C)O 08a136690c86349297f9eb20bc4746ee [1,1,0,0,0,0|1,0,0]=3 1948 B11R0.59 CCOC(=O)[C@@H](C)NCC(F)F 09ef6fc0e66f649061922d44705d2e3d [1,1,0,0,0,0|2,0,0]=4 1949 B11R0.59 CCOC(=O)[C@@H](C)NCN(C)C 72424d3fbb391a61c60ee2336e57f6e8 [1,1,0,0,0,0|2,0,0]=4 1950 B11R0.59 CCOC(=O)[C@@H](C)NC[C@@H](C)O e20c09c44e252549269591091595e2ad [1,1,0,0,0,0|1,0,0]=3 1951 B11R0.59 CCOC(=O)[C@@H](C)NC[C@H](C)O ac1ae48984755d7a0b53b02ef5e9dec8 [1,1,0,0,0,0|1,0,0]=3 1952 B11R0.59 CCOC(=O)[C@@H](C)OCC(=O)C a09e14b7e2faebe403dd9514d500204f [1,1,0,0,0,0|1,0,1]=4 1953 B11R0.59 CCOC(=O)[C@@H](C)OCC(C)C 6a66ec71edf3e8fd42a76bcd9c3c8053 [1,1,0,0,0,0|1,0,0]=3 1954 B11R0.59 CCOC(=O)[C@@H](C)OCC(C)F b56489056ab6b8768e12f1e031b1fdd2 [1,1,0,0,0,0|1,0,0]=3 1955 B11R0.59 CCOC(=O)[C@@H](C)OCC(C)S eee2a5caf45cdf2b2dee10f126123caa [1,1,0,0,0,0|1,0,0]=3 1956 B11R0.59 CCOC(=O)[C@@H](C)OCC(F)F 2a7ff98a76c15ce3a78ca5d854a91bd6 [1,1,0,0,0,0|2,0,0]=4 1957 B11R0.59 CCOC(=O)[C@@H](C)OCN(C)C 206beb696809546c4e5e0c81bacd6450 [1,1,0,0,0,0|2,0,0]=4 1958 B11R0.59 CCOC(=O)[C@@H](C)OC[C@@H](C)F 0182feb00c6048ea6c1e4974baeac909 [1,1,0,0,0,0|1,0,0]=3 1959 B11R0.59 CCOC(=O)[C@@H](C)OC[C@H](C)F bba04c23f2bdbe2b6a597d4881196527 [1,1,0,0,0,0|1,0,0]=3 1960 B11R0.59 CCOC(=O)[C@H](C)NCC(=O)C eada8752976f8e13be6e0e5f7476b86f [1,1,0,0,0,0|1,0,1]=4 1961 B11R0.59 CCOC(=O)[C@H](C)NCC(C)C 4dc6f31d1786317dc0b8e9bd12ddab39 [1,1,0,0,0,0|1,0,0]=3 1962 B11R0.59 CCOC(=O)[C@H](C)NCC(C)O 3129ca05274fefaca134173eba43a6b5 [1,1,0,0,0,0|1,0,0]=3 1963 B11R0.59 CCOC(=O)[C@H](C)NCC(F)F e1a2eedc046ba15b8192e9c4aad561a7 [1,1,0,0,0,0|2,0,0]=4 1964 B11R0.59 CCOC(=O)[C@H](C)NC[C@@H](C)O 11dd5d01452975bef1f7e1c6eea63c99 [1,1,0,0,0,0|1,0,0]=3 1965 B11R0.59 CCOC(=O)[C@H](C)NC[C@H](C)O 8d5717d318852c2b378e82354af0bf31 [1,1,0,0,0,0|1,0,0]=3 1966 B11R0.59 CCOC(=O)[C@H](C)OCC(=O)C 3525853d9eff8dfdcc7fffd06846ca07 [1,1,0,0,0,0|1,0,1]=4 1967 B11R0.59 CCOC(=O)[C@H](C)OCC(C)C e3de72b10176763f0431820a9896f443 [1,1,0,0,0,0|1,0,0]=3 1968 B11R0.59 CCOC(=O)[C@H](C)OCC(C)F 6a7e0ad7bf7ba1666bd8e3c958e2498a [1,1,0,0,0,0|1,0,0]=3 1969 B11R0.59 CCOC(=O)[C@H](C)OCC(C)S 9f418ab5fa6b8950cde25757412edb4c [1,1,0,0,0,0|1,0,0]=3 1970 B11R0.59 CCOC(=O)[C@H](C)OCC(F)F b82b10973629e8ff0c97fe7719a1b3a2 [1,1,0,0,0,0|2,0,0]=4 1971 B11R0.59 CCOC(=O)[C@H](C)OCN(C)C 8a51c3b3e2903273e10771c46a89b36d [1,1,0,0,0,0|2,0,0]=4 1972 B11R0.59 CCOC(=O)[C@H](C)OC[C@@H](C)F ff473f9934127f726baefff74ab27943 [1,1,0,0,0,0|1,0,0]=3 1973 B11R0.59 CCOC(=O)[C@H](C)OC[C@H](C)F ebee3c8d7c62861eb820cc9ed919333b [1,1,0,0,0,0|1,0,0]=3 1974 B11R0.68 CC(C)OC(=O)C(C)NCCBr cd7730bf5ab7159a2f4fbc222cc25e2d [1,1,0,0,0,0|2,0,0]=4 1975 B11R0.68 CC(C)OC(=O)C(C)NCCF ca552553173f02aecaa82235b424f00b [1,1,0,0,0,0|2,0,0]=4 1976 B11R0.68 CC(C)OC(=O)C(C)NCCI 6893382fe7414ceb3459b511add7fad3 [1,1,0,0,0,0|2,0,0]=4 1977 B11R0.68 CC(C)OC(=O)C(C)NCCO c35f139e1b1a9063a8c60c162da5a33c [1,1,0,0,0,0|2,0,0]=4 1978 B11R0.68 CC(C)OC(=O)C(C)NCCS aa08a470dcd0211d048c33f01be5b009 [1,1,0,0,0,0|2,0,0]=4 1979 B11R0.68 CC(C)OC(=O)C(C)OCCF 2cdcdec8f6db1e96981a90df00ba9623 [1,1,0,0,0,0|2,0,0]=4 1980 B11R0.68 CC(C)OC(=O)C(C)OCCS 606376ca59c46edfd443c9ed52310da6 [1,1,0,0,0,0|2,0,0]=4 1981 B11R0.68 CC(C)OC(=O)[C@@H](C)OCCF c7f666bfda5d5fd3e298e062d755cbca [1,1,0,0,0,0|2,0,0]=4 1982 B11R0.68 CC(C)OC(=O)[C@@H](C)OCCS 6cd64d5e9c463d034c32a47ea0d609f6 [1,1,0,0,0,0|2,0,0]=4 1983 B11R0.68 CC(C)OC(=O)[C@H](C)OCCF 31359cb5a9b09af75307082ff8396624 [1,1,0,0,0,0|2,0,0]=4 1984 B11R0.68 CC(C)OC(=O)[C@H](C)OCCS 5469c7b80348dbb751bb9ea8a1c9a9bf [1,1,0,0,0,0|2,0,0]=4 1985 B11R0.68 CCCCN(C)C(=O)CC(C)C 5b3c7ceed1708fd2628189e535b93e1f [1,1,0,0,0,0|2,0,0]=4 1986 B11R0.68 CCCCN(C)C(=O)CC(C)O c77a97b1c467ee73cd77d27c6803800f [1,1,0,0,0,0|2,0,0]=4 1987 B11R0.68 CCCCN(C)C(=O)C[C@@H](C)O 152b28b22777887fb3a496e40248d033 [1,1,0,0,0,0|2,0,0]=4 1988 B11R0.68 CCCCN(C)C(=O)C[C@H](C)O a71268531fda49616579daf0a10dce0a [1,1,0,0,0,0|2,0,0]=4 1989 B11R0.68 CCCNC(C)C(=O)NC(C)C 5cb13a5b376799cf242a005b71a6af19 [1,1,0,0,0,0|2,0,0]=4 1990 B11R0.68 CCCNC(C)C(=O)OC(C)C 0c77539e399d960b3c825b744c317ba8 [1,1,0,0,0,0|1,0,0]=3 1991 B11R0.68 CCCOC(C)C(=O)NC(C)C 754657e3ad010fa679ba9074ff31589d [1,1,0,0,0,0|2,0,0]=4 1992 B11R0.68 CCCOC(C)C(=O)OC(C)C d2865d6efbd19244683d026dfcfebdc0 [1,1,0,0,0,0|1,0,0]=3 1993 B11R0.68 CCCO[C@@H](C)C(=O)OC(C)C 53866a62902f3edb1362573ab1e7137c [1,1,0,0,0,0|1,0,0]=3 1994 B11R0.68 CCCO[C@H](C)C(=O)OC(C)C 577822309a208f03106c7b7fa41738c1 [1,1,0,0,0,0|1,0,0]=3 1995 B11R0.68 COCOC(C)C(=O)OC(C)C ecd0cf57e6029cc256e98bb843ffe7ef [1,1,0,0,0,0|2,0,0]=4 1996 B11R0.68 COCO[C@@H](C)C(=O)OC(C)C 7613977b2269990a8fb31cd5dea479af [1,1,0,0,0,0|2,0,0]=4 1997 B11R0.68 COCO[C@H](C)C(=O)OC(C)C 8dd503ce8722cf1fd80b130cc5908bde [1,1,0,0,0,0|2,0,0]=4 1998 B11R0.68 CSCO[C@@H](C)C(=O)OC(C)C 7068501d7755ed1947cb8b7816ad595a [1,1,0,0,0,0|2,0,0]=4 1999 B11R0.68 CSCO[C@H](C)C(=O)OC(C)C ce849c5662009bdb544252bcb71672b6 [1,1,0,0,0,0|2,0,0]=4 2000 B11R0.73 C=C(CC)C(=O)N(C)CCCC b98146eaa61215389351b710e52876e4 [1,1,0,0,0,0|2,0,0]=4 2001 B11R0.73 CCCCC(O)C(=O)N(C)CC 4054431a57b0fc7d6e2b51d98f8c0997 [1,1,0,0,0,0|2,0,0]=4 2002 B11R0.73 CCCCN(C)C(=O)C(=O)CC 33ff3c59e016bd2636d2695a24dc7551 [1,1,0,0,0,0|2,0,0]=4 2003 B11R0.73 CCCCN(C)C(=O)C(O)CC 76d08337dc1a64063b9fa0183380fa67 [1,1,0,0,0,0|2,0,0]=4 2004 B11R0.73 CCCCN(C)C(=O)[C@@H](O)CC 85faee96d71d0919dfaae9616230f3cf [1,1,0,0,0,0|2,0,0]=4 2005 B11R0.73 CCCCN(C)C(=O)[C@@H](S)CC d1373e4b13e46734afda8a93af1a2a67 [1,1,0,0,0,0|2,0,0]=4 2006 B11R0.73 CCCCN(C)C(=O)[C@H](O)CC 0b568602d165ea2c27bc46c026f9789e [1,1,0,0,0,0|2,0,0]=4 2007 B11R0.73 CCCC[C@@H](O)C(=O)N(C)CC 55d84227ba0f8a3eaaa43e69a3b06123 [1,1,0,0,0,0|2,0,0]=4 2008 B11R0.73 CCCC[C@H](O)C(=O)N(C)CC 1c208b9ea16a4db1c42977b25d0f706e [1,1,0,0,0,0|2,0,0]=4 2009 B11R0.73 CCCNC(C)C(=O)N(C)CC d242b7802177233f36d3045d0da672f0 [1,1,0,0,0,0|2,0,0]=4 2010 B11R0.73 CCCOC(C)C(=O)N(C)CC 0295f985dacd63de42db9e975468a40e [1,1,0,0,0,0|2,0,0]=4 2011 B11R0.155 C#CCCNC(C)C(=O)OCC 6b11d5e025f848e2ad39e352edf3a4df [1,1,0,0,0,0|0,0,2]=4 2012 B11R0.155 C#CCCN[C@@H](C)C(=O)OCC 6ba6a2273d181f68b409f2b454a00560 [1,1,0,0,0,0|0,0,2]=4 2013 B11R0.155 C#CCCN[C@H](C)C(=O)OCC 8390c1f8a4258fce359d5ce505539de9 [1,1,0,0,0,0|0,0,2]=4 2014 B11R0.155 C#CCCOC(C)C(=O)OCC 96e4195ad5c3d9b0ae73ae5006c7315b [1,1,0,0,0,0|0,0,2]=4 2015 B11R0.155 C#CCCO[C@@H](C)C(=O)OCC ae060ff75c9074913b4ceae33648d66b [1,1,0,0,0,0|0,0,2]=4 2016 B11R0.155 C#CCCO[C@H](C)C(=O)OCC 655926479578fa309961d04aacca6954 [1,1,0,0,0,0|0,0,2]=4 2017 B11R0.155 C#CCNCC(C)C(=O)OCC e74e95ca02b6f86620fbf95db429f456 [1,1,0,0,0,0|0,0,2]=4 2018 B11R0.155 C#CCOCC(C)C(=O)OCC 0b0e8bc7d0fd945e48771fa456537803 [1,1,0,0,0,0|0,0,2]=4 2019 B11R0.155 C/C=C/CN[C@H](C)C(=O)OCC 54f0ef344871d0b9f22746a44ad284a1 [1,1,0,0,0,0|0,0,2]=4 2020 B11R0.155 C/C=C/COC(C)C(=O)OCC 7a6b9bd215b06138db62e39b5d1dbb96 [1,1,0,0,0,0|0,0,2]=4 2021 B11R0.155 C/C=C/CO[C@@H](C)C(=O)OCC 43d5eef4453e7dbfbbc2c77ed48b913f [1,1,0,0,0,0|0,0,2]=4 2022 B11R0.155 C/C=C/CO[C@H](C)C(=O)OCC 0c025075f5deb5c891a081c8f75197db [1,1,0,0,0,0|0,0,2]=4 2023 B11R0.155 C/C=C\CN[C@H](C)C(=O)OCC 453b2257ec6f3262a856f9c5fb163113 [1,1,0,0,0,0|0,0,2]=4 2024 B11R0.155 C/C=C\COC(C)C(=O)OCC 26d9aaf4525e8f83d5b161b5687caff5 [1,1,0,0,0,0|0,0,2]=4 2025 B11R0.155 C/C=C\CO[C@@H](C)C(=O)OCC 4aa20200845ec4a3307df99b8ba35162 [1,1,0,0,0,0|0,0,2]=4 2026 B11R0.155 C/C=C\CO[C@H](C)C(=O)OCC 5875c0bdf3997809d2d81d458fc061ea [1,1,0,0,0,0|0,0,2]=4 2027 B11R0.155 C=C(CNCCC)C(=O)OCC 114c43991694e4ba5b7c6f4379073d3b [1,1,0,0,0,0|0,0,2]=4 2028 B11R0.155 C=C(COCCC)C(=O)OCC 440a6138f45deca727c3c925ab1c9396 [1,1,0,0,0,0|0,0,2]=4 2029 B11R0.155 C=CCCNC(C)C(=O)OCC b7e2a2b35e115a8302eb85df231beb7b [1,1,0,0,0,0|0,0,2]=4 2030 B11R0.155 C=CCCN[C@@H](C)C(=O)OCC 528ad6f020a715114d55e8369f230fde [1,1,0,0,0,0|0,0,2]=4 2031 B11R0.155 C=CCCN[C@H](C)C(=O)OCC a992f009071526e5559e4f71e0ab53c8 [1,1,0,0,0,0|0,0,2]=4 2032 B11R0.155 C=CCCOC(C)C(=O)OCC 6ed21c9be4703cd23a336a1aa7fc8c27 [1,1,0,0,0,0|0,0,2]=4 2033 B11R0.155 C=CCCO[C@@H](C)C(=O)OCC 7231431901c5b757f98d8dbf63201b6c [1,1,0,0,0,0|0,0,2]=4 2034 B11R0.155 C=CCCO[C@H](C)C(=O)OCC d43c01ea7bf1cbd4f43695575fd73b83 [1,1,0,0,0,0|0,0,2]=4 2035 B11R0.155 C=CCNCC(C)C(=O)OCC 3137c8befb1598cf03c302e28e053d25 [1,1,0,0,0,0|0,0,2]=4 2036 B11R0.155 C=CCOCC(C)C(=O)OCC 8c06839295c5aa504d22533416940c8a [1,1,0,0,0,0|0,0,2]=4 2037 B11R0.155 CC#CCNC(C)C(=O)OCC 8fbd7c4415c32756bc7305d7e5826e1c [1,1,0,0,0,0|0,0,2]=4 2038 B11R0.155 CC#CCN[C@@H](C)C(=O)OCC 1c3f2e60279b0f92477a5a4fa573eae5 [1,1,0,0,0,0|0,0,2]=4 2039 B11R0.155 CC#CCN[C@H](C)C(=O)OCC 3fcf95194f31f92a5837b1a7b3633b90 [1,1,0,0,0,0|0,0,2]=4 2040 B11R0.155 CC#CCOC(C)C(=O)OCC d4e77d9dec6c836d22caba55480bae3f [1,1,0,0,0,0|0,0,2]=4 2041 B11R0.155 CC#CCO[C@@H](C)C(=O)OCC 51ee7e1019416b4bcfa25d2215748d5e [1,1,0,0,0,0|0,0,2]=4 2042 B11R0.155 CC#CCO[C@H](C)C(=O)OCC 9d12059f631cd0ce757a324c3c34d581 [1,1,0,0,0,0|0,0,2]=4 2043 B11R0.155 CC=CCNC(C)C(=O)OCC 609a7edae51e4a247381b83d70f31c2e [1,1,0,0,0,0|0,0,2]=4 2044 B11R0.155 CC=CCN[C@@H](C)C(=O)OCC 8834f253bd231dd86ab199747e9682f0 [1,1,0,0,0,0|0,0,2]=4 2045 B11R0.155 CC=CCN[C@H](C)C(=O)OCC f001a99157b0ca89cc34128296d8f31f [1,1,0,0,0,0|0,0,2]=4 2046 B11R0.155 CC=CCOC(C)C(=O)OCC 051e3b8d433b756467091e6a42ab91c2 [1,1,0,0,0,0|0,0,2]=4 2047 B11R0.155 CC=CCO[C@@H](C)C(=O)OCC ab0c7a8c076bf6677c858f227ea624b9 [1,1,0,0,0,0|0,0,2]=4 2048 B11R0.155 CC=CCO[C@H](C)C(=O)OCC ba9afed3262fedb5ebf15abf0c9f2a37 [1,1,0,0,0,0|0,0,2]=4 2049 B11R0.155 CCCC(=O)N(C)CCCCO 2264f20602147b18b25c4bae23d43ce7 [1,1,0,0,0,0|2,0,0]=4 2050 B11R0.155 CCCC(=O)N(C)CCCOC ca6ddc87898964380d534be3c3e8f289 [1,1,0,0,0,0|2,0,0]=4 2051 B11R0.155 CCCC(=O)N(C)CCOCC db00de519d1de829c327f6faf2225a0c [1,1,0,0,0,0|2,0,0]=4 2052 B11R0.155 CCCCCN(C)C(=O)CCC f69c208eb29980023e139971dcc14c2a [1,1,0,0,0,0|2,0,0]=4 2053 B11R0.155 CCCCNC(=O)C(=O)OCC bdfded043e796bb568818197108f941f [1,1,0,0,0,0|1,0,1]=4 2054 B11R0.155 CCCCNC(C)C(=O)NCC 25ede7ed1115d29044d246b13c012665 [1,1,0,0,0,0|1,0,0]=3 2055 B11R0.155 CCCCNC(C)C(=O)OCC 27af75240eb222adea8217305b21c51b [1,1,0,0,0,0|0,0,0]=2 2056 B11R0.155 CCCCNC(F)C(=O)OCC cbb807366c8271c89bf86ba45f8377d5 [1,1,0,0,0,0|1,0,0]=3 2057 B11R0.155 CCCCN[C@@H](C)C(=O)NCC a199182d551b45b3fde818ba43731bf0 [1,1,0,0,0,0|1,0,0]=3 2058 B11R0.155 CCCCN[C@@H](C)C(=O)OCC 0390b6bec150aae098e56d72342e2ab5 [1,1,0,0,0,0|0,0,0]=2 2059 B11R0.155 CCCCN[C@H](C)C(=O)OCC f67ac1c32543409fe1bcd146334bcbd6 [1,1,0,0,0,0|0,0,0]=2 2060 B11R0.155 CCCCOC(C)C(=O)NCC c61fa4a615c516c3363f1277f54e6ddd [1,1,0,0,0,0|1,0,0]=3 2061 B11R0.155 CCCCOC(C)C(=O)OCC 32fec4c2f5eb0ee354067915f63330a4 [1,1,0,0,0,0|0,0,0]=2 2062 B11R0.155 CCCCOC(F)C(=O)OCC c5b6a6f493ca1a347bfcca5c59811892 [1,1,0,0,0,0|1,0,0]=3 2063 B11R0.155 CCCCO[C@@H](C)C(=O)OCC 5e71c937499181f8c4615a2661d9385e [1,1,0,0,0,0|0,0,0]=2 2064 B11R0.155 CCCCO[C@H](C)C(=O)OCC 35add22490bf98674657b7331e8a0ce2 [1,1,0,0,0,0|0,0,0]=2 2065 B11R0.155 CCCNCC(C)C(=O)OCC 3544eda917d3f670b876734cc8040ed2 [1,1,0,0,0,0|0,0,0]=2 2066 B11R0.155 CCCNCC(O)C(=O)OCC a6dfe2f7e9169812dac058df308a7496 [1,1,0,0,0,0|1,0,0]=3 2067 B11R0.155 CCCOCC(C)C(=O)OCC aa8153ab2970b3d6980f7ec85c3b60b9 [1,1,0,0,0,0|0,0,0]=2 2068 B11R0.155 CCNC(=O)C(C)NCCCCl 58fe82bd43b8c4948373ce0a830bc0b9 [1,1,0,0,0,0|2,0,0]=4 2069 B11R0.155 CCNC(=O)C(C)NCCCO b379c1dfc55e688251b0b51bfafe5e55 [1,1,0,0,0,0|2,0,0]=4 2070 B11R0.155 CCNC(=O)C(C)NCCOC 165791e59d1159aa5ab8aad852c9dbe5 [1,1,0,0,0,0|2,0,0]=4 2071 B11R0.155 CCNC(=O)C(C)NCCSC a9c3a22612a6155749aaf6df9ac512aa [1,1,0,0,0,0|2,0,0]=4 2072 B11R0.155 CCNC(=O)C(C)OCCCF 142af4805f24ed34884a6882a9b92289 [1,1,0,0,0,0|2,0,0]=4 2073 B11R0.155 CCNC(=O)C(C)OCCCS 24307e48871f65c67aa0a4aeee05f8b3 [1,1,0,0,0,0|2,0,0]=4 2074 B11R0.155 CCNC(=O)C(C)OCCOC 29abaa708368ed24e375443fe9191596 [1,1,0,0,0,0|2,0,0]=4 2075 B11R0.155 CCNC(=O)C(C)OCCSC 418caef60952e7ae1401e3851faab10a [1,1,0,0,0,0|2,0,0]=4 2076 B11R0.155 CCNC(=O)[C@H](C)NCCCF 673d87481cb0b6bed1aec33b46987f6f [1,1,0,0,0,0|2,0,0]=4 2077 B11R0.155 CCNC(=O)[C@H](C)NCCCO 16c0c1a2377f4f16c4c1f60299203fd0 [1,1,0,0,0,0|2,0,0]=4 2078 B11R0.155 CCNC(=O)[C@H](C)NCCCS 017b39b152c68b255834658a6133fccb [1,1,0,0,0,0|2,0,0]=4 2079 B11R0.155 CCNC(=O)[C@H](C)NCCOC 97483c121af60d1a1b4f30a96293fa90 [1,1,0,0,0,0|2,0,0]=4 2080 B11R0.155 CCNC(=O)[C@H](C)NCCSC 6841a174ae420f9e52fec67255447964 [1,1,0,0,0,0|2,0,0]=4 2081 B11R0.155 CCNC(=O)[C@H](C)NCOCC cc0c93aa8345030daba4e3f718b4ca36 [1,1,0,0,0,0|2,0,0]=4 2082 B11R0.155 CCOC(=O)C(C)CNCC#N 202b6c80146e4f279486a47c1a1cba6c [1,1,0,0,0,0|1,0,1]=4 2083 B11R0.155 CCOC(=O)C(C)CNCC=O 151ac4236a241acc4ff9716d52576891 [1,1,0,0,0,0|1,0,1]=4 2084 B11R0.155 CCOC(=O)C(C)CNCCF a0408648455a11b9276c08ea623ecd77 [1,1,0,0,0,0|1,0,0]=3 2085 B11R0.155 CCOC(=O)C(C)CNCCO c6a8884ee7e3273fa834d806788f4030 [1,1,0,0,0,0|1,0,0]=3 2086 B11R0.155 CCOC(=O)C(C)CNCCS 39947c2d524a9a089459aeab21e9d277 [1,1,0,0,0,0|1,0,0]=3 2087 B11R0.155 CCOC(=O)C(C)CNCOC 9866188537ed854420047a9b5527e3eb [1,1,0,0,0,0|1,0,0]=3 2088 B11R0.155 CCOC(=O)C(C)CNCSC 3c22d593e8165ada8fcafb8088725ac1 [1,1,0,0,0,0|1,0,0]=3 2089 B11R0.155 CCOC(=O)C(C)COCC#N a569117d5fa3a320c4ab766c54a8c8b7 [1,1,0,0,0,0|1,0,1]=4 2090 B11R0.155 CCOC(=O)C(C)COCC=O a27c8f57743e099cd1ed248c0b8bc279 [1,1,0,0,0,0|1,0,1]=4 2091 B11R0.155 CCOC(=O)C(C)COCCF b024e0a0ae1a90edb2e1a6b6e8be88b7 [1,1,0,0,0,0|1,0,0]=3 2092 B11R0.155 CCOC(=O)C(C)COCCS 1cdf4f9ceb0606b6000bfa4dc3ad2de6 [1,1,0,0,0,0|1,0,0]=3 2093 B11R0.155 CCOC(=O)C(C)COCOC 26907770bb54809509d4f17afe25bf56 [1,1,0,0,0,0|1,0,0]=3 2094 B11R0.155 CCOC(=O)C(C)COCSC 489a75bd3006e4580deba0be93461bbb [1,1,0,0,0,0|1,0,0]=3 2095 B11R0.155 CCOC(=O)C(C)NCCC#N 3a4439c7eee6e0124c106286f00150aa [1,1,0,0,0,0|1,0,1]=4 2096 B11R0.155 CCOC(=O)C(C)NCCCCl c46423cde8ecdb7e20c96ecaad2ee472 [1,1,0,0,0,0|1,0,0]=3 2097 B11R0.155 CCOC(=O)C(C)NCCCO 8040a2d8b2c475069133d429ed68089f [1,1,0,0,0,0|1,0,0]=3 2098 B11R0.155 CCOC(=O)C(C)NCCOC dd66a3b50a12d22f6c3e02a4b138e352 [1,1,0,0,0,0|1,0,0]=3 2099 B11R0.155 CCOC(=O)C(C)NCCON e1e501403f94be8801b3b36e2a61c410 [1,1,0,0,0,0|2,0,0]=4 2100 B11R0.155 CCOC(=O)C(C)NCCSC fdd1030f064257ea8039f3b3299631ba [1,1,0,0,0,0|1,0,0]=3 2101 B11R0.155 CCOC(=O)C(C)OCCC#N 1af66c70e59b55bf747aa96f4cc1c39f [1,1,0,0,0,0|1,0,1]=4 2102 B11R0.155 CCOC(=O)C(C)OCCC=O 92598b17523890f99137346c638ab75f [1,1,0,0,0,0|1,0,1]=4 2103 B11R0.155 CCOC(=O)C(C)OCCCF 334c7e43bdb869c3a6c1d56a4688965d [1,1,0,0,0,0|1,0,0]=3 2104 B11R0.155 CCOC(=O)C(C)OCCCS e5a6aae2ecfe8adae63ff484714982b9 [1,1,0,0,0,0|1,0,0]=3 2105 B11R0.155 CCOC(=O)C(C)OCCOC 0e2b14125e94657d84764004504c2d61 [1,1,0,0,0,0|1,0,0]=3 2106 B11R0.155 CCOC(=O)C(C)OCCSC fcd7ff5a990037576b5734f9d39eadf8 [1,1,0,0,0,0|1,0,0]=3 2107 B11R0.155 CCOC(=O)C(F)NCCCCl 640143764a653bce08be23f711086906 [1,1,0,0,0,0|2,0,0]=4 2108 B11R0.155 CCOC(=O)C(F)NCCCO 31995b3373459452b2c10214a5caa352 [1,1,0,0,0,0|2,0,0]=4 2109 B11R0.155 CCOC(=O)C(F)NCCOC 284ea278e3fb67891dc36f5b42dab2ae [1,1,0,0,0,0|2,0,0]=4 2110 B11R0.155 CCOC(=O)C(F)NCCSC cc23bcd475822bb9b17ca766ed171d45 [1,1,0,0,0,0|2,0,0]=4 2111 B11R0.155 CCOC(=O)C(F)OCCCF 3a92eec47328508625ca251beb1e3a13 [1,1,0,0,0,0|2,0,0]=4 2112 B11R0.155 CCOC(=O)C(F)OCCCS 9cea787dc41996ee5e0b6dd9fb797edc [1,1,0,0,0,0|2,0,0]=4 2113 B11R0.155 CCOC(=O)C(F)OCCOC a3e77368b5e15667784edd8e34f1e7af [1,1,0,0,0,0|2,0,0]=4 2114 B11R0.155 CCOC(=O)C(F)OCCSC 138e6017fe2955081561133689ff2d99 [1,1,0,0,0,0|2,0,0]=4 2115 B11R0.155 CCOC(=O)C(O)CNCCBr 5df45cf3fd70ae87d13a7e099e49f9f3 [1,1,0,0,0,0|2,0,0]=4 2116 B11R0.155 CCOC(=O)C(O)CNCCF de4e2ba57b142434cecf0e4ae59a1cfd [1,1,0,0,0,0|2,0,0]=4 2117 B11R0.155 CCOC(=O)C(O)CNCCI 3954e1bcfe3afa3cf6a4cb5abd31b0af [1,1,0,0,0,0|2,0,0]=4 2118 B11R0.155 CCOC(=O)C(O)CNCCO 1d074576ce50442c245f332f8a67e7ab [1,1,0,0,0,0|2,0,0]=4 2119 B11R0.155 CCOC(=O)C(O)CNCCS 11960a5537a43baa410ec5c01950d1ef [1,1,0,0,0,0|2,0,0]=4 2120 B11R0.155 CCOC(=O)[C@@H](C)NCCC#N cb1f67145b915b0a0fe6b0d4c45ae032 [1,1,0,0,0,0|1,0,1]=4 2121 B11R0.155 CCOC(=O)[C@@H](C)NCCC=O 572f4f7f3762ce80ae630c674008c863 [1,1,0,0,0,0|1,0,1]=4 2122 B11R0.155 CCOC(=O)[C@@H](C)NCCCCl 567a3747076c348b46d72d659e8be254 [1,1,0,0,0,0|1,0,0]=3 2123 B11R0.155 CCOC(=O)[C@@H](C)NCCCF 38ed6df43764ce68fd3939c6c5b352fe [1,1,0,0,0,0|1,0,0]=3 2124 B11R0.155 CCOC(=O)[C@@H](C)NCCCO 4168fe0f81cdf3a010c5180e5665a846 [1,1,0,0,0,0|1,0,0]=3 2125 B11R0.155 CCOC(=O)[C@@H](C)NCCCS 0dfc035877ed75ad718c903029767f3e [1,1,0,0,0,0|1,0,0]=3 2126 B11R0.155 CCOC(=O)[C@@H](C)NCCOC 2800e22a18e58cb071d8e6a36c435712 [1,1,0,0,0,0|1,0,0]=3 2127 B11R0.155 CCOC(=O)[C@@H](C)NCCON 9248492498d7f78283a19f48a2d80707 [1,1,0,0,0,0|2,0,0]=4 2128 B11R0.155 CCOC(=O)[C@@H](C)NCCSC 1612e01836da9de3ca98db288a630e68 [1,1,0,0,0,0|1,0,0]=3 2129 B11R0.155 CCOC(=O)[C@@H](C)OCCC#N d03a2a445ff4d7c1452ec3272286ba10 [1,1,0,0,0,0|1,0,1]=4 2130 B11R0.155 CCOC(=O)[C@@H](C)OCCC=O ec4b0086850f35b3e5ed4e54ebc262fc [1,1,0,0,0,0|1,0,1]=4 2131 B11R0.155 CCOC(=O)[C@@H](C)OCCCF b4b97ebdedbf121222b68a61e665d085 [1,1,0,0,0,0|1,0,0]=3 2132 B11R0.155 CCOC(=O)[C@@H](C)OCCCS 1e4f317275ac36676931ffb5fac37b5a [1,1,0,0,0,0|1,0,0]=3 2133 B11R0.155 CCOC(=O)[C@@H](C)OCCOC 049a46d4788a5143cb062f9c3afd0055 [1,1,0,0,0,0|1,0,0]=3 2134 B11R0.155 CCOC(=O)[C@@H](C)OCCSC 0c5ecc0e0db40fd1f3bd7df535463633 [1,1,0,0,0,0|1,0,0]=3 2135 B11R0.155 CCOC(=O)[C@H](C)NCCC#N 4ca3cde3b0ad4fb7df472cc4f3bd3a37 [1,1,0,0,0,0|1,0,1]=4 2136 B11R0.155 CCOC(=O)[C@H](C)NCCCCl 246125ae96601abc878260352c6d619b [1,1,0,0,0,0|1,0,0]=3 2137 B11R0.155 CCOC(=O)[C@H](C)NCCCO 6e35cfc570ef4f79d546df6371de5b3a [1,1,0,0,0,0|1,0,0]=3 2138 B11R0.155 CCOC(=O)[C@H](C)NCCOC 15abcaa42eb0df02779285f627cd0e81 [1,1,0,0,0,0|1,0,0]=3 2139 B11R0.155 CCOC(=O)[C@H](C)NCCON a898658c27795fc92c7538de3cbff611 [1,1,0,0,0,0|2,0,0]=4 2140 B11R0.155 CCOC(=O)[C@H](C)NCCSC debbfce58c82b3be0282ef62236580b8 [1,1,0,0,0,0|1,0,0]=3 2141 B11R0.155 CCOC(=O)[C@H](C)OCCC#N 2a5c80c1ba81fafe5b5f992d370c56da [1,1,0,0,0,0|1,0,1]=4 2142 B11R0.155 CCOC(=O)[C@H](C)OCCC=O 2edd92d70ebbf9f5c7b77eb1eb74da37 [1,1,0,0,0,0|1,0,1]=4 2143 B11R0.155 CCOC(=O)[C@H](C)OCCCF 5373424f7c31d7ef3bb0df6d836f3409 [1,1,0,0,0,0|1,0,0]=3 2144 B11R0.155 CCOC(=O)[C@H](C)OCCCS 0c13dcbf741e534acddb62c32403b404 [1,1,0,0,0,0|1,0,0]=3 2145 B11R0.155 CCOC(=O)[C@H](C)OCCOC 25bd14220eeae999cc5cb96688bfeb33 [1,1,0,0,0,0|1,0,0]=3 2146 B11R0.155 CCOC(=O)[C@H](C)OCCSC 9bf3b12b6dcf636a224e86829e3a17ce [1,1,0,0,0,0|1,0,0]=3 2147 B11R0.155 CCOCN[C@H](C)C(=O)OCC 0e805be7c8a1282b84263e009789dec2 [1,1,0,0,0,0|1,0,0]=3 2148 B11R0.155 CCOCOC(C)C(=O)OCC d85397f77bbba604be801d553293d959 [1,1,0,0,0,0|1,0,0]=3 2149 B11R0.155 CCOCO[C@@H](C)C(=O)OCC 76eb618b949c7266e2b505d175f17b12 [1,1,0,0,0,0|1,0,0]=3 2150 B11R0.155 CCOCO[C@H](C)C(=O)OCC fc982a024f1853dd5a902c7519f9ff10 [1,1,0,0,0,0|1,0,0]=3 2151 B11R0.177 CCCN(C)C(C)C(=O)NCC 3a18c3b342456ce2557481fd518b1594 [1,1,0,0,0,0|2,0,0]=4 2152 B11R0.177 CCCN(C)C(C)C(=O)OCC f2361817de89f41f5f9bf4b66c632050 [1,1,0,0,0,0|1,0,0]=3 2153 B11R0.177 CCCN(C)C(F)C(=O)OCC 58852ad4866516d8344e4d7e473b349a [1,1,0,0,0,0|2,0,0]=4 2154 B11R0.177 CCCN(C)[C@@H](C)C(=O)OCC 2055de5aceeb63119adfb8cbfe61bdee [1,1,0,0,0,0|1,0,0]=3 2155 B11R0.177 CCCN(C)[C@H](C)C(=O)OCC 44830a44ca2c4cf5c26fadd5f2d625e6 [1,1,0,0,0,0|1,0,0]=3 2156 B11R0.177 CCOC(=O)C(C)N(C)CCF 90a535f6f9295ad7679261ebae2751ae [1,1,0,0,0,0|2,0,0]=4 2157 B11R0.177 CCOC(=O)C(C)N(C)CCO 657428ad464d959b15c5146494f17afc [1,1,0,0,0,0|2,0,0]=4 2158 B11R0.177 CCOC(=O)[C@@H](C)N(C)CCF 34a1d5a5e742b1ebd4671eea1f18949c [1,1,0,0,0,0|2,0,0]=4 2159 B11R0.177 CCOC(=O)[C@@H](C)N(C)CCO 5a2364dc4b5cf265fa3411c4026fa2bd [1,1,0,0,0,0|2,0,0]=4 2160 B11R0.177 CCOC(=O)[C@H](C)N(C)CCF 3a9cd012827bf7741abe73806a9d218f [1,1,0,0,0,0|2,0,0]=4 2161 B11R0.177 CCOC(=O)[C@H](C)N(C)CCO e2b02127a2a6e2a64923169999d7ece3 [1,1,0,0,0,0|2,0,0]=4 2162 B11R0.247 CCCNC(C)(C)C(=O)OCC c5bb6936cc66bb42503bfd70f2beccc4 [1,1,0,0,0,0|1,0,0]=3 2163 B11R0.247 CCNCC(C)(C)C(=O)OCC 199eb0187a96e46a144ab422b858cb21 [1,1,0,0,0,0|1,0,0]=3 2164 B11R0.247 CCOC(=O)C(C)(C)CNCF aee56fd42f401165165f3afe6ebbb13e [1,1,0,0,0,0|2,0,0]=4 2165 B11R0.247 CCOC(=O)C(C)(C)CNCO 1656128de2f1e22eb91f5f5e9df90ca5 [1,1,0,0,0,0|2,0,0]=4 2166 B11R0.247 CCOC(=O)C(C)(C)COCF e863e4d7c9e43d29233606a1c22ff0a1 [1,1,0,0,0,0|2,0,0]=4 2167 B11R0.247 CCOC(=O)C(C)(C)NCCF 664f2c916acd5819e69c63a84691ce15 [1,1,0,0,0,0|2,0,0]=4 2168 B11R0.247 CCOC(=O)C(C)(C)NCCO 8bbecfc0b6c06067077bd6bd577e27a0 [1,1,0,0,0,0|2,0,0]=4 2169 B11R0.247 CCOC(=O)C(C)(C)NCCS 79e5246bda34ee265161989c1738a677 [1,1,0,0,0,0|2,0,0]=4 2170 B11R0.247 CCOC(=O)C(C)(C)NCOC 6b4fe3474cf2cb7e0e6f8d6726a5ab89 [1,1,0,0,0,0|2,0,0]=4 2171 B11R0.247 CCOC(=O)C(C)(C)NCSC 0b99a25b500d8d66f8a172e09468d197 [1,1,0,0,0,0|2,0,0]=4 2172 B11R0.247 CCOCC(C)(C)C(=O)OCC b7b0c6d50c000fd6588f35cadb9aa348 [1,1,0,0,0,0|1,0,0]=3 2173 B11R0.247 CCOCC(F)(F)C(=O)OCC 5f37a4f4b5a550a4d2be0c5c4a31a4ee [1,1,0,0,0,0|2,0,0]=4 2174 B11R0.18 C=C(CC)C(=O)N(CC)CCC 22c9f9f22121d598255c1545c1aa92e8 [1,1,0,0,0,0|2,0,0]=4 2175 B11R0.18 CCCN(CC)C(=O)C(=O)CC ceff01b8b5a035bdcf13a0677fee860b [1,1,0,0,0,0|2,0,0]=4 2176 B11R0.18 CCCN(CC)C(=O)C(O)CC 796dd0a197f02dbc78ee7599a0ab75ff [1,1,0,0,0,0|2,0,0]=4 2177 B11R0.18 CCCN(CC)C(=O)[C@@H](O)CC ee074afb603c75100c04fe82dcf1f488 [1,1,0,0,0,0|2,0,0]=4 2178 B11R0.18 CCCN(CC)C(=O)[C@@H](S)CC 72566e25a96c9b01eec9c8d2c0e1fd41 [1,1,0,0,0,0|2,0,0]=4 2179 B11R0.18 CCCN(CC)C(=O)[C@H](O)CC aa3e0fcacf499249b575ec315947897f [1,1,0,0,0,0|2,0,0]=4 2180 B11R0.18 CCOC(CC)C(=O)N(C)CC 30cdcdc12b63ee2347db1b364697ba5a [1,1,0,0,0,0|2,0,0]=4 2181 B11R0.53 CCCC(=O)C(CC)N(C)CC e4a265fb68922910436a91ed034f7453 [1,1,0,0,0,0|2,0,0]=4 2182 B11R0.53 CCOC(=O)C(CC)N(C)CC 27ebcaad40e26d54723b92863fa80ece [1,1,0,0,0,0|1,0,0]=3 2183 B11R0.53 CCOC(=O)C(CC)N(C)CF a6d9c3a557b0284d57ac9008435a828d [1,1,0,0,0,0|2,0,0]=4 2184 B11R0.53 CCOC(=O)C(CC)N(C)CO 4ac03d2bfbfbc1194dbbc034bbce6fa1 [1,1,0,0,0,0|2,0,0]=4 2185 B11R0.53 CCOC(=O)C(CO)N(C)CC f88681dbfe971177cac7cb5f4958fbcd [1,1,0,0,0,0|2,0,0]=4 2186 B11R0.53 CCOC(=O)C(SC)N(C)CC 7cf44f3e4158abe6fae593068c56ff5e [1,1,0,0,0,0|2,0,0]=4 2187 B11R0.56 CCCC(=O)C(CC)OC(C)C 21d241554513ed51885dc9e9c1056dbe [1,1,0,0,0,0|2,0,0]=4 2188 B11R0.56 CCCC(=O)N(CC)CC(C)C be975915dbb199329f751f7351fee9db [1,1,0,0,0,0|2,0,0]=4 2189 B11R0.56 CCCC(=O)N(CC)CC(C)O 101af058128cd269dfe43c463653c048 [1,1,0,0,0,0|2,0,0]=4 2190 B11R0.56 CCCC(=O)N(CC)C[C@H](C)O 165a88c7d113d3af06c7d2f7653a46ba [1,1,0,0,0,0|2,0,0]=4 2191 B11R0.56 CCNC(=O)C(CC)NC(C)C 01d0794da2531fa27cf3e72d9fe1ebb0 [1,1,0,0,0,0|2,0,0]=4 2192 B11R0.56 CCOC(=O)C(CC)NC(=O)C 73a0da4d90110624a5cfef77285dcf45 [1,1,0,0,0,0|1,0,1]=4 2193 B11R0.56 CCOC(=O)C(CC)NC(C)C 5a1fa9485aab06e170bbd2d946cc6009 [1,1,0,0,0,0|1,0,0]=3 2194 B11R0.56 CCOC(=O)C(CC)OC(C)C a1078a17f4d4d850f17a2acb4621610a [1,1,0,0,0,0|1,0,0]=3 2195 B11R0.56 CCOC(=O)[C@@H](CC)NC(=O)C ddf00eec0806f22466df8876323e3092 [1,1,0,0,0,0|1,0,1]=4 2196 B11R0.56 CCOC(=O)[C@@H](CC)NC(C)C 6d9a76e45c591171c78e4abeadeb203b [1,1,0,0,0,0|1,0,0]=3 2197 B11R0.56 CCOC(=O)[C@@H](CC)OC(C)C a9e6184150fe5d9a3069668608dcd08f [1,1,0,0,0,0|1,0,0]=3 2198 B11R0.56 CCOC(=O)[C@H](CC)NC(=O)C e5abfeacf7b06bab42ab82200d3277b2 [1,1,0,0,0,0|1,0,1]=4 2199 B11R0.56 CCOC(=O)[C@H](CC)NC(C)C 7d98d6e767082baf2d4983e7c354faf6 [1,1,0,0,0,0|1,0,0]=3 2200 B11R0.56 CCOC(=O)[C@H](CC)OC(C)C dfb5ba69c53a283b817d8cf9609a1895 [1,1,0,0,0,0|1,0,0]=3 2201 B11R0.57 CCCC(=O)N(CCC)C(C)C 624f98193dedb37090a7fd4236fcc8a8 [1,1,0,0,0,0|2,0,0]=4 2202 B11R0.57 CCNC(C(=O)OCC)C(C)C e89e66c934fb51d709771f074e22a990 [1,1,0,0,0,0|1,0,0]=3 2203 B11R0.57 CCN[C@@H](C(=O)OCC)C(C)C d80fbe6eeea9b442f9a4cf50c1769e1b [1,1,0,0,0,0|1,0,0]=3 2204 B11R0.57 CCN[C@H](C(=O)OCC)C(C)C f195550a7d89c31f5ac721d9cb291f86 [1,1,0,0,0,0|1,0,0]=3 2205 B11R0.57 CCOC(=O)C(NCF)C(C)C 3eff18e040ddc3fa677407e0fe5622f1 [1,1,0,0,0,0|2,0,0]=4 2206 B11R0.57 CCOC(=O)C(NCO)C(C)C 3ae5954351913a29dd3cf5962b6f8f49 [1,1,0,0,0,0|2,0,0]=4 2207 B11R0.57 CCOC(=O)[C@@H](NCF)C(C)C ad81ad84d3c91ed7c254c6f57c807b02 [1,1,0,0,0,0|2,0,0]=4 2208 B11R0.57 CCOC(=O)[C@@H](NCO)C(C)C 6bf7413e9e083e09b2147d233bc05651 [1,1,0,0,0,0|2,0,0]=4 2209 B11R0.57 CCOC(=O)[C@H](NCF)C(C)C 61bd48dbc79c8a8f1c13b7ad02f38367 [1,1,0,0,0,0|2,0,0]=4 2210 B11R0.57 CCOC(=O)[C@H](NCO)C(C)C 92256bfb9cfd5c4ea258ddd93edcd20a [1,1,0,0,0,0|2,0,0]=4 2211 B11R0.57 CCOC(=O)[C@H](OCC)C(C)C 931ce97cf7ed2398c9def08192460e27 [1,1,0,0,0,0|1,0,0]=3 2212 B11R0.57 CCOC(=O)[C@H](OCF)C(C)C bf225e09b9fba6839d8b178f0cfec4c1 [1,1,0,0,0,0|2,0,0]=4 2213 B11R0.61 C=CCC(OCC)C(=O)OCC f22c4d9ff99c668ff40cd32644f888b5 [1,1,0,0,0,0|0,0,2]=4 2214 B11R0.61 CCCC(=O)C(CCC)OCC 2a85de6cde1d4b5e057725ae82c5dafd [1,1,0,0,0,0|1,0,0]=3 2215 B11R0.61 CCCC(=O)C(CCC)OCF 84e6a720b57c3929827c7aa588160606 [1,1,0,0,0,0|2,0,0]=4 2216 B11R0.61 CCCC(=O)N(CCC)CCC a3cdde45b2ec84ab28764c8b04e534d3 [1,1,0,0,0,0|2,0,0]=4 2217 B11R0.61 CCCC(=O)N(CCC)CCO bd2d9f6e71e872091efc960451471431 [1,1,0,0,0,0|2,0,0]=4 2218 B11R0.61 CCCC(NC#N)C(=O)OCC 78ee04d0416f9bbd50de578fcda2dea7 [1,1,0,0,0,0|1,0,1]=4 2219 B11R0.61 CCCC(OCC)C(=O)OCC 8189a0592193af935bc047cc7995f8e2 [1,1,0,0,0,0|0,0,0]=2 2220 B11R0.61 CCCC(OCF)C(=O)OCC d21752fc34b3876883448043bd6c2e82 [1,1,0,0,0,0|1,0,0]=3 2221 B11R0.133 CCCN(CC)C(=O)CC(C)C 6f5f4dde5d3b66a7e86fb0d4bdda379e [1,1,0,0,0,0|2,0,0]=4 2222 B11R0.133 CCCN(CC)C(=O)CC(C)O 54dae8bfd71235bd4134a9253d76c9c3 [1,1,0,0,0,0|2,0,0]=4 2223 B11R0.133 CCCN(CC)C(=O)C[C@@H](C)O ef8edad5195b88f426f28f698f235a30 [1,1,0,0,0,0|2,0,0]=4 2224 B11R0.133 CCCN(CC)C(=O)C[C@H](C)O 8a90ff2a52aa9a6044a557d1e3da56c7 [1,1,0,0,0,0|2,0,0]=4 2225 B11R0.38 C#CC[C@@H](NCCC)C(=O)OC 68d50270043790ec2e6b36a22c66c2fe [1,1,0,0,0,0|1,0,1]=4 2226 B11R0.38 C=CC[C@H](NCCC)C(=O)OC 65b960ae708d7d4ffaf23aaa70f2e95d [1,1,0,0,0,0|1,0,1]=4 2227 B11R0.38 CCC(=O)N(CCO)CCCO c73d6fc375ae232b9becf2bd921fc884 [1,1,0,0,0,0|2,0,0]=4 2228 B11R0.38 CCCC(NCCBr)C(=O)OC a8efca87fa0622bc5bb593f6ed7c5a9e [1,1,0,0,0,0|2,0,0]=4 2229 B11R0.38 CCCC(NCCF)C(=O)OC eda490bc613c15cdbb23caa57538f6e9 [1,1,0,0,0,0|2,0,0]=4 2230 B11R0.38 CCCC(NCCI)C(=O)OC c1cdd77fcd832ea3ad185e958b565db0 [1,1,0,0,0,0|2,0,0]=4 2231 B11R0.38 CCCC(NCCO)C(=O)OC 1546cc59a43d0745962bd2b811e13f1b [1,1,0,0,0,0|2,0,0]=4 2232 B11R0.38 CCCC(NCCS)C(=O)OC bc34eebb06a40073ede028a9a2d65964 [1,1,0,0,0,0|2,0,0]=4 2233 B11R0.38 CCCC(OCOC)C(=O)OC ed6c74b31b1241352b0bf3353ba5dba5 [1,1,0,0,0,0|2,0,0]=4 2234 B11R0.38 CCCCC(NC#N)C(=O)OC 5faa461351f1e998216c530493379d84 [1,1,0,0,0,0|1,0,1]=4 2235 B11R0.38 CCCCN(CC#N)C(=O)CC 9b6b48c5a60db298039a13993ad707e6 [1,1,0,0,0,0|1,0,1]=4 2236 B11R0.38 CCCCN(CCC)C(=O)CC 771986b5e786c62b94f633d1fb573702 [1,1,0,0,0,0|1,0,0]=3 2237 B11R0.38 CCCCN(CCC)C(=O)CF 29b6010c66ff6a7c3edbe9ca43d5c2f8 [1,1,0,0,0,0|2,0,0]=4 2238 B11R0.38 CCCCN(CCC)C(=O)CO 5f901ac129075d090c8e5e62133ffe2f [1,1,0,0,0,0|2,0,0]=4 2239 B11R0.38 CCCCN(CCC)C(=O)CS f27de02d57b082cd129f9b615d39728d [1,1,0,0,0,0|2,0,0]=4 2240 B11R0.38 CCCCN(CCO)C(=O)CC e0e12c92f60269ecc7eed26563d64967 [1,1,0,0,0,0|1,0,0]=3 2241 B11R0.38 CCCCN(CCO)C(=O)CF b1f73d658b866d4029fddbfb36c2a8ba [1,1,0,0,0,0|2,0,0]=4 2242 B11R0.38 CCCCN(CCO)C(=O)CO 8aa47abaee8b480600f88359e04a71bc [1,1,0,0,0,0|2,0,0]=4 2243 B11R0.38 CCCCN(CCO)C(=O)CS 2b75f4b3ecac2e11bcd83da928ee0c85 [1,1,0,0,0,0|2,0,0]=4 2244 B11R0.38 CCCCN(CCS)C(=O)CC eb016f8aa7075a1d29c2e9617a0a1661 [1,1,0,0,0,0|1,0,0]=3 2245 B11R0.38 CCCCN(CCS)C(=O)CF b2d31ee7c79d7366a59b58ba78d68e82 [1,1,0,0,0,0|2,0,0]=4 2246 B11R0.38 CCCCN(CCS)C(=O)CO f0fa70aaef67339d2ff26b57fc6942f8 [1,1,0,0,0,0|2,0,0]=4 2247 B11R0.38 CCCCN(CCS)C(=O)CS 705200fd2bb92ae751860100f137180e [1,1,0,0,0,0|2,0,0]=4 2248 B11R0.38 CCCN(CCCO)C(=O)CC d558b0d5bc5403fffc3280dc121ea185 [1,1,0,0,0,0|2,0,0]=4 2249 B11R0.38 CCCN(CCOC)C(=O)CC f83444936f0ce75bc81ad6e0f3c7fb0f [1,1,0,0,0,0|2,0,0]=4 2250 B11R0.38 CCCNC(CCC)C(=O)NC 4d0724cd6487806d2e92c0a3ef5bff01 [1,1,0,0,0,0|2,0,0]=4 2251 B11R0.38 CCCNC(CCC)C(=O)OC 8b73b840c1b17e24b5f8bfee453da52d [1,1,0,0,0,0|1,0,0]=3 2252 B11R0.38 CCCNC(COC)C(=O)OC 66be3c0e71a43aae60bbfb75ac019c91 [1,1,0,0,0,0|1,0,0]=3 2253 B11R0.38 CCCN[C@H](CCC)C(=O)OC f9551ffb0e70f852cdee8a0a78172ad2 [1,1,0,0,0,0|1,0,0]=3 2254 B11R0.38 CCCOC(CCC)C(=O)OC 74b60bee5b54c4b32e940b951b10c071 [1,1,0,0,0,0|1,0,0]=3 2255 B11R0.38 CCCOC(COC)C(=O)OC 818234c24b2b87ffc5029144a554635b [1,1,0,0,0,0|1,0,0]=3 2256 B11R0.38 CCCO[C@@H](COC)C(=O)OC 20d1917768edd8da3cf9f603fe6a30ed [1,1,0,0,0,0|1,0,0]=3 2257 B11R0.38 CCC[C@@H](NCCF)C(=O)OC 587b22448d3efcb50feef4b3b4cce414 [1,1,0,0,0,0|2,0,0]=4 2258 B11R0.38 CCC[C@@H](NCCO)C(=O)OC 4a7f777c9472c24515e0b71cd84ccb5b [1,1,0,0,0,0|2,0,0]=4 2259 B11R0.38 CCC[C@@H](NCCS)C(=O)OC 016367035c1cfb2a29a0e7f3d2ab8852 [1,1,0,0,0,0|2,0,0]=4 2260 B11R0.38 CCC[C@@H](NCOC)C(=O)OC 2163836abd74ed13a4b1094858f4ac42 [1,1,0,0,0,0|2,0,0]=4 2261 B11R0.38 CCC[C@@H](NCSC)C(=O)OC 3f83919b675c1a6517452d79401f3caa [1,1,0,0,0,0|2,0,0]=4 2262 B11R0.38 CCOC(CCSC)C(=O)OC 24210304cdf8235ecb9e75b2a00d7d54 [1,1,0,0,0,0|1,0,0]=3 2263 B11R0.38 COC(=O)C(CCSC)OCF 30650e9b3d48059324e29b06610240bd [1,1,0,0,0,0|2,0,0]=4 2264 B11R0.38 COCC(NCCBr)C(=O)OC 2409d7dbeac319a33b3dc7aace033aaf [1,1,0,0,0,0|2,0,0]=4 2265 B11R0.38 COCC(NCCF)C(=O)OC 9a5f37e77eecb5d4a23acac963125933 [1,1,0,0,0,0|2,0,0]=4 2266 B11R0.38 COCC(NCCI)C(=O)OC ed5a63100be073381e55b5d109cca1cb [1,1,0,0,0,0|2,0,0]=4 2267 B11R0.38 COCC(NCCO)C(=O)OC efe5f079483bd782ed2563dd56773da3 [1,1,0,0,0,0|2,0,0]=4 2268 B11R0.38 COCC(NCCS)C(=O)OC af4e01e8257ad9e9d83e7d0e4547cad3 [1,1,0,0,0,0|2,0,0]=4 2269 B11R0.38 COCC(OCCF)C(=O)OC 0cb1e260a440919fff52280e3038f4fe [1,1,0,0,0,0|2,0,0]=4 2270 B11R0.38 COCC(OCCS)C(=O)OC 3f4fa86609d3b660c0e99ec66753bc33 [1,1,0,0,0,0|2,0,0]=4 2271 B11R0.38 COCC(OCSC)C(=O)OC 4bfbaa9a2368b492522ff92e4d2a7ee0 [1,1,0,0,0,0|2,0,0]=4 2272 B11R0.38 COCOC(COC)C(=O)OC 2474b8e3bfe19cb37c6b622ce247e797 [1,1,0,0,0,0|2,0,0]=4 2273 B11R0.38 COCO[C@@H](COC)C(=O)OC 2691494cb20275f09fa209f68809ec41 [1,1,0,0,0,0|2,0,0]=4 2274 B11R0.38 COC[C@H](OCCF)C(=O)OC 6531d4d3bfb724609c036d48663f9e20 [1,1,0,0,0,0|2,0,0]=4 2275 B11R0.38 COC[C@H](OCCS)C(=O)OC ba93a37f41c0e7cb4e0977e12ef2ec23 [1,1,0,0,0,0|2,0,0]=4 2276 B11R0.38 COC[C@H](OCSC)C(=O)OC 6d411b96778a74ad89b6e46a6b2ad0f5 [1,1,0,0,0,0|2,0,0]=4 2277 B11R0.75 C#CCCNC(CC)C(=O)OC 19e09db7e5b26ba2a33ec47b41e7bdce [1,1,0,0,0,0|0,0,2]=4 2278 B11R0.75 C#CCCN[C@@H](CC)C(=O)OC 25bf9f04f44af1d26e976a4edb1359d6 [1,1,0,0,0,0|0,0,2]=4 2279 B11R0.75 C#CCCN[C@H](CC)C(=O)OC 0ccfbb998373075ef9ab657363682057 [1,1,0,0,0,0|0,0,2]=4 2280 B11R0.75 C#CCCOC(CC)C(=O)CC 60c06daabc1415fa3a6bd0928e228bce [1,1,0,0,0,0|0,0,2]=4 2281 B11R0.75 C#CCCOC(CC)C(=O)OC a69c1c0ed4fce796a6c1ed667851ea31 [1,1,0,0,0,0|0,0,2]=4 2282 B11R0.75 C#CCCO[C@@H](CC)C(=O)OC e75d898ab7ed88c3f18fc17ec257b1b0 [1,1,0,0,0,0|0,0,2]=4 2283 B11R0.75 C#CCCO[C@H](CC)C(=O)OC d3569a71cc4715c9eef80056fda0d7ee [1,1,0,0,0,0|0,0,2]=4 2284 B11R0.75 C#CCOCC(CC)C(=O)OC 77ae4d8bc4f7cb8db03dc29bf9729578 [1,1,0,0,0,0|0,0,2]=4 2285 B11R0.75 C/C=C/CN[C@@H](CC)C(=O)OC b4cd6caebc9fbcdc03dedd41ec96a22d [1,1,0,0,0,0|0,0,2]=4 2286 B11R0.75 C/C=C/CN[C@H](CC)C(=O)OC 13164f4b95b975e2010764ec98a231e3 [1,1,0,0,0,0|0,0,2]=4 2287 B11R0.75 C/C=C/COC(CC)C(=O)CC 51a75bacd2267f5e2671ab10ce94f7f2 [1,1,0,0,0,0|0,0,2]=4 2288 B11R0.75 C/C=C/COC(CC)C(=O)OC 135d2ea90a1b448f4d48de363b6f44cd [1,1,0,0,0,0|0,0,2]=4 2289 B11R0.75 C/C=C/CO[C@@H](CC)C(=O)OC 7a6d25d82b8f58e20bc0a16d31b4f75d [1,1,0,0,0,0|0,0,2]=4 2290 B11R0.75 C/C=C/CO[C@H](CC)C(=O)OC abb35ffaf4c3383193d5e49dfe8f059d [1,1,0,0,0,0|0,0,2]=4 2291 B11R0.75 C/C=C\CN[C@@H](CC)C(=O)OC d08f387cbc34036fe7da05cac4e78ee8 [1,1,0,0,0,0|0,0,2]=4 2292 B11R0.75 C/C=C\CN[C@H](CC)C(=O)OC e75dce0032d5e08c5d39df9268742167 [1,1,0,0,0,0|0,0,2]=4 2293 B11R0.75 C/C=C\COC(CC)C(=O)CC 96695867960183243fbf0ee50cfc894f [1,1,0,0,0,0|0,0,2]=4 2294 B11R0.75 C/C=C\COC(CC)C(=O)OC 0e214e6eb2be361a0e8075a437585273 [1,1,0,0,0,0|0,0,2]=4 2295 B11R0.75 C/C=C\CO[C@@H](CC)C(=O)OC 411f28b0e1bca52b92655c6c0a252a9a [1,1,0,0,0,0|0,0,2]=4 2296 B11R0.75 C/C=C\CO[C@H](CC)C(=O)OC c9f0287a142a83f40ff80f73c2bbf2d5 [1,1,0,0,0,0|0,0,2]=4 2297 B11R0.75 C=CC(OCCCC)C(=O)OC a0070a33595321fb285e67b49fc1a26d [1,1,0,0,0,0|0,0,2]=4 2298 B11R0.75 C=CCCNC(CC)C(=O)OC bcab19d253925e50707a8a09c570664d [1,1,0,0,0,0|0,0,2]=4 2299 B11R0.75 C=CCCN[C@@H](CC)C(=O)OC dd191aef5858dd0b4dc9945b87e64bb4 [1,1,0,0,0,0|0,0,2]=4 2300 B11R0.75 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CC=CCN[C@H](CC)C(=O)OC 0ae337091b681e5a9464e8b6065e1666 [1,1,0,0,0,0|0,0,2]=4 2312 B11R0.75 CCC(=O)C(CC)OCCC#N 357e1f75956688d9193d6e971ddcc49b [1,1,0,0,0,0|1,0,1]=4 2313 B11R0.75 CCC(=O)C(CC)OCCC=O 11c06407d721876e619ccb631338187f [1,1,0,0,0,0|1,0,1]=4 2314 B11R0.75 CCC(=O)C(CC)OCCCF 31c9833690dc616c264d219254809591 [1,1,0,0,0,0|1,0,0]=3 2315 B11R0.75 CCC(=O)C(CC)OCCCS a7c97ae93817cf0a9b1c18516051a6ae [1,1,0,0,0,0|1,0,0]=3 2316 B11R0.75 CCC(=O)C(CC)OCCOC a6ee2856cf7c01eee36d0831c8d36118 [1,1,0,0,0,0|1,0,0]=3 2317 B11R0.75 CCC(=O)C(CC)OCCSC cc52fba77b34b648cfc493508844d768 [1,1,0,0,0,0|1,0,0]=3 2318 B11R0.75 CCC(=O)N(CC)CCCCO a05e3a4c4c65077e75dc6ef83590bdf8 [1,1,0,0,0,0|1,0,0]=3 2319 B11R0.75 CCC(=O)N(CC)CCCOC 12057e6b584e7b1b6fb1093d26868f25 [1,1,0,0,0,0|1,0,0]=3 2320 B11R0.75 CCC(COCC#N)C(=O)OC 6974c794025f6b5d39ccab2eebd4c069 [1,1,0,0,0,0|1,0,1]=4 2321 B11R0.75 CCC(COCC=O)C(=O)OC aff4b6babb70c11e24980db98be8250b [1,1,0,0,0,0|1,0,1]=4 2322 B11R0.75 CCC(COCCF)C(=O)OC 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33f8e51b56bdf27e1ec7811ee9e82abc [1,1,0,0,0,0|2,0,0]=4 2434 B11R0.75 COCCN[C@@H](CS)C(=O)OC 40ce5b08b4558a7e23c97b9e0be3a4d4 [1,1,0,0,0,0|2,0,0]=4 2435 B11R0.75 COCCN[C@H](CO)C(=O)OC b352a628bf01bd30bdc475f24c9b9419 [1,1,0,0,0,0|2,0,0]=4 2436 B11R0.75 COCCOC(OC)C(=O)OC b61fa0a13b02a882c233c35a6510f8ab [1,1,0,0,0,0|2,0,0]=4 2437 B11R0.88 CCC(=O)C(CC)OC(C)CC 7194dff24a52b41b91506d643c98dac5 [1,1,0,0,0,0|1,0,0]=3 2438 B11R0.88 CCC(=O)N(CC)CC(O)CC 34f7958a56cdcbeff0dfab8935ea8bed [1,1,0,0,0,0|1,0,0]=3 2439 B11R0.88 CCC(=O)N[C@@H](CC)C(=O)OC 267485561b4d9a8520f0e7db43ea61d0 [1,1,0,0,0,0|1,0,1]=4 2440 B11R0.88 CCC(=O)N[C@H](CC)C(=O)OC 41e3818c380d0933699396f1da591308 [1,1,0,0,0,0|1,0,1]=4 2441 B11R0.88 CCC(C)NC(CC)C(=O)NC beddae16582a25bbe2cf7e61e13491f8 [1,1,0,0,0,0|2,0,0]=4 2442 B11R0.88 CCC(C)NC(CC)C(=O)OC a20cc25cd64962ab4f0d5b82296b67e3 [1,1,0,0,0,0|1,0,0]=3 2443 B11R0.88 CCC(C)NC(CO)C(=O)OC 900b53f53037d7384ecc419f6529c2ce [1,1,0,0,0,0|2,0,0]=4 2444 B11R0.88 CCC(C)N[C@@H](CC)C(=O)OC 3e90be97bcdfc75e7a88cfdca50e47ac [1,1,0,0,0,0|1,0,0]=3 2445 B11R0.88 CCC(C)N[C@@H](CO)C(=O)OC dfe24cd0d31bdfee1dff49e902b2559e [1,1,0,0,0,0|2,0,0]=4 2446 B11R0.88 CCC(C)N[C@@H](CS)C(=O)OC c6ca87935ee2f33afc732ee43d88c164 [1,1,0,0,0,0|2,0,0]=4 2447 B11R0.88 CCC(C)N[C@H](CC)C(=O)OC 3fff9b0271c524c0be68eb712d319e62 [1,1,0,0,0,0|1,0,0]=3 2448 B11R0.88 CCC(C)N[C@H](CO)C(=O)OC e5235b7a1fafe7e8bb831f29e0364882 [1,1,0,0,0,0|2,0,0]=4 2449 B11R0.88 CCC(C)OC(CC)C(=O)OC 6b1a87ea9d5a6dfb4d955e81495c0172 [1,1,0,0,0,0|1,0,0]=3 2450 B11R0.88 CCC(C)OC(OC)C(=O)OC d897ea7d3f480add8015127ce755ed0b [1,1,0,0,0,0|2,0,0]=4 2451 B11R0.88 CCC(C)O[C@@H](CC)C(=O)OC a62aaad5f5774a7e9ade7fce650aff63 [1,1,0,0,0,0|1,0,0]=3 2452 B11R0.88 CCC(C)O[C@H](CC)C(=O)OC e8b97d4f52ee48226c071d3e9f015c8d [1,1,0,0,0,0|1,0,0]=3 2453 B11R0.88 CCC(NC(C)CO)C(=O)OC 00d48b43e42f6ccb84cb69935ae40a84 [1,1,0,0,0,0|2,0,0]=4 2454 B11R0.88 CCC(N[C@@H](C)CC)C(=O)OC 64914397a26a9edf64cee6456bcd9aa8 [1,1,0,0,0,0|1,0,0]=3 2455 B11R0.88 CCC(N[C@@H](C)CO)C(=O)OC 4943365cd6cd2b7ba9a4e570996eb858 [1,1,0,0,0,0|2,0,0]=4 2456 B11R0.88 CCC(N[C@H](C)CC)C(=O)OC 54d0ca889065c33566b4422e2cb5e406 [1,1,0,0,0,0|1,0,0]=3 2457 B11R0.88 CCC(N[C@H](C)CO)C(=O)OC 318b4930bb63def629d97d894e4fa1da [1,1,0,0,0,0|2,0,0]=4 2458 B11R0.88 CCC(O)CN(CC)C(=O)CF 893650d2647593ae13d7fc550744a6fd [1,1,0,0,0,0|2,0,0]=4 2459 B11R0.88 CCC(O)CN(CC)C(=O)CO aa84f8a79e83a2f68eee1439d1828320 [1,1,0,0,0,0|2,0,0]=4 2460 B11R0.88 CCC(O)CN(CC)C(=O)CS 027cb507452e68381405cdf1093f30ee [1,1,0,0,0,0|2,0,0]=4 2461 B11R0.88 CCC(OC(C)CF)C(=O)OC f532fe6844220ebed8f751bc3dc6d934 [1,1,0,0,0,0|2,0,0]=4 2462 B11R0.88 CCC(OC(C)CS)C(=O)OC 21b80742fd6a224a3700b0fc30b1ba61 [1,1,0,0,0,0|2,0,0]=4 2463 B11R0.88 CCC(O[C@@H](C)CC)C(=O)OC 97a524767c2b62d58aa7868323c37fa2 [1,1,0,0,0,0|1,0,0]=3 2464 B11R0.88 CCC(O[C@H](C)CC)C(=O)OC 3b07a0367a4b453b7533bc2b1761c5df [1,1,0,0,0,0|1,0,0]=3 2465 B11R0.88 CCC(O[C@H](C)CS)C(=O)OC a3a2682b7e90ccb4de8c8294cade5b28 [1,1,0,0,0,0|2,0,0]=4 2466 B11R0.88 CC[C@@H](C)NC(CO)C(=O)OC fa7ba00a30241a882185def10833f3ef [1,1,0,0,0,0|2,0,0]=4 2467 B11R0.88 CC[C@@H](C)N[C@@H](CO)C(=O)OC 5b3e8c6aef1a1e553921a73e7f2f74ec [1,1,0,0,0,0|2,0,0]=4 2468 B11R0.88 CC[C@@H](C)N[C@H](CC)C(=O)OC 62bf9740a45291bd4edb6a2d0c2b8f5f [1,1,0,0,0,0|1,0,0]=3 2469 B11R0.88 CC[C@@H](C)N[C@H](CO)C(=O)OC 2c9dad588db9cf91b67c743f518df2e6 [1,1,0,0,0,0|2,0,0]=4 2470 B11R0.88 CC[C@@H](C)OC(OC)C(=O)OC 1df977bddb7356f0add5b5c32497c6ec [1,1,0,0,0,0|2,0,0]=4 2471 B11R0.88 CC[C@@H](C)O[C@H](CC)C(=O)OC 2639bfdcceefe15485ce2d7b25d674da [1,1,0,0,0,0|1,0,0]=3 2472 B11R0.88 CC[C@@H](NC(C)CO)C(=O)OC 0215c7cfe0c1c6a1a9138939d6242755 [1,1,0,0,0,0|2,0,0]=4 2473 B11R0.88 CC[C@@H](N[C@@H](C)CO)C(=O)OC 6b784a8f1a716aa4e3d6496270f7c65a [1,1,0,0,0,0|2,0,0]=4 2474 B11R0.88 CC[C@@H](N[C@H](C)CO)C(=O)OC b8c5983e4b4feb95444c10d508ad5a59 [1,1,0,0,0,0|2,0,0]=4 2475 B11R0.88 CC[C@@H](OC(C)CF)C(=O)OC afff27169f32a9067c100c7e56ddf314 [1,1,0,0,0,0|2,0,0]=4 2476 B11R0.88 CC[C@@H](OC(C)CS)C(=O)OC 32d6ffba8bd9931c1af01bfcbe34735a [1,1,0,0,0,0|2,0,0]=4 2477 B11R0.88 CC[C@@H](O[C@H](C)CS)C(=O)OC a5a04cc3831d16cf6779561e052e5701 [1,1,0,0,0,0|2,0,0]=4 2478 B11R0.88 CC[C@H](C)NC(CO)C(=O)OC d083d2cf021740f6973e346c8e02bc64 [1,1,0,0,0,0|2,0,0]=4 2479 B11R0.88 CC[C@H](C)N[C@@H](CO)C(=O)OC df51e987c76c1dcff1a8705bb8849aaa [1,1,0,0,0,0|2,0,0]=4 2480 B11R0.88 CC[C@H](C)N[C@H](CC)C(=O)OC 3a0acacdbb6fd079df4eaedd5d909ce5 [1,1,0,0,0,0|1,0,0]=3 2481 B11R0.88 CC[C@H](C)N[C@H](CO)C(=O)OC c7c3dd926cb8962363faca77223bc6dd [1,1,0,0,0,0|2,0,0]=4 2482 B11R0.88 CC[C@H](C)OC(OC)C(=O)OC b1e05a9d871eeec1cffee62f8dc10325 [1,1,0,0,0,0|2,0,0]=4 2483 B11R0.88 CC[C@H](C)O[C@H](CC)C(=O)OC aa590dc036b5d8be11409dbe08022572 [1,1,0,0,0,0|1,0,0]=3 2484 B11R0.88 CC[C@H](NC(C)CO)C(=O)OC 42a2b00f9de9225294fe2ecabdff73b0 [1,1,0,0,0,0|2,0,0]=4 2485 B11R0.88 CC[C@H](N[C@@H](C)CO)C(=O)OC b2190ee5014a244ae5de9d3f90240192 [1,1,0,0,0,0|2,0,0]=4 2486 B11R0.88 CC[C@H](N[C@H](C)CO)C(=O)OC 96be0d733d2b2facd8c4734214817f9b [1,1,0,0,0,0|2,0,0]=4 2487 B11R0.118 C=C(C)CNC(CC)C(=O)OC 168c0596f94d666e0991e382e9d547c1 [1,1,0,0,0,0|1,0,1]=4 2488 B11R0.118 C=C(C)CN[C@@H](CC)C(=O)OC 766dcd26eb3deb825f4a47dedbbd6df7 [1,1,0,0,0,0|1,0,1]=4 2489 B11R0.118 C=C(C)CN[C@H](CC)C(=O)OC ae4ae69feab022326493bf7d8189b8fe [1,1,0,0,0,0|1,0,1]=4 2490 B11R0.118 C=C(C)COC(CC)C(=O)CC 801e7ccaea46c8e49461ba575e83ec67 [1,1,0,0,0,0|1,0,1]=4 2491 B11R0.118 C=C(C)COC(CC)C(=O)OC b073603b50ef5b7003297d0720dab104 [1,1,0,0,0,0|1,0,1]=4 2492 B11R0.118 C=C(C)CO[C@@H](CC)C(=O)OC cd704b04075d1eba2ad3ba9516550be2 [1,1,0,0,0,0|1,0,1]=4 2493 B11R0.118 C=C(C)CO[C@H](CC)C(=O)OC 551c8c8d81fafa7f73506a478b1daa79 [1,1,0,0,0,0|1,0,1]=4 2494 B11R0.118 CCC(=O)C(CC)OCC(C)C d781d535d88d170cf89ea971db645a59 [1,1,0,0,0,0|1,0,0]=3 2495 B11R0.118 CCC(=O)C(CC)OCC(F)F 342edc0afd1e9c1850e64b9e08b293f1 [1,1,0,0,0,0|2,0,0]=4 2496 B11R0.118 CCC(=O)C(CC)OCN(C)C 13bae1f6450bb752c3adbf3d4424a059 [1,1,0,0,0,0|2,0,0]=4 2497 B11R0.118 CCC(=O)N(CC)CCN(C)C fd780cdb4c8cd9b0972e92b737e7cb26 [1,1,0,0,0,0|2,0,0]=4 2498 B11R0.118 CCC(COC(C)C)C(=O)OC 6436f025febdd99d3e39c0ccf1be4428 [1,1,0,0,0,0|1,0,0]=3 2499 B11R0.118 CCC(NCC(=O)C)C(=O)OC 78472a09be783126bed5ced1b9ce3d0e [1,1,0,0,0,0|1,0,1]=4 2500 B11R0.118 CCC(NCC(C)C)C(=O)NC ce9ce72a14ef6e7b9d9ea7c9957fdf97 [1,1,0,0,0,0|2,0,0]=4 2501 B11R0.118 CCC(NCC(C)C)C(=O)OC 7f0fab301020c96c85d0f2ab357cfb12 [1,1,0,0,0,0|1,0,0]=3 2502 B11R0.118 CCC(NCC(C)O)C(=O)NC e2edf01159e43c7bdc6d4063acf0b3eb [1,1,0,0,0,0|2,0,0]=4 2503 B11R0.118 CCC(NCC(C)O)C(=O)OC f64858d764393ce3ea1debe6fcf734fc [1,1,0,0,0,0|1,0,0]=3 2504 B11R0.118 CCC(NCC(F)F)C(=O)OC 40db832a445a4121b4e43ce00d5fc506 [1,1,0,0,0,0|2,0,0]=4 2505 B11R0.118 CCC(NC[C@@H](C)O)C(=O)NC 1aa143f2450d6231179ae6a2040dcab7 [1,1,0,0,0,0|2,0,0]=4 2506 B11R0.118 CCC(NC[C@@H](C)O)C(=O)OC ab7b54bdd843dfa3ebcbe8afd285fc3a [1,1,0,0,0,0|1,0,0]=3 2507 B11R0.118 CCC(NC[C@H](C)O)C(=O)NC 1b6429a2e584a721893cb2b9cc20e4ff [1,1,0,0,0,0|2,0,0]=4 2508 B11R0.118 CCC(NC[C@H](C)O)C(=O)OC 34c9695111f09e830ae0ea747a8235f0 [1,1,0,0,0,0|1,0,0]=3 2509 B11R0.118 CCC(OCC(C)C)C(=O)OC 7c327deaedbb5a93844ca3a7f9377476 [1,1,0,0,0,0|1,0,0]=3 2510 B11R0.118 CCC(OCC(F)F)C(=O)OC ce678f58c495c09bc4251b2913130dd5 [1,1,0,0,0,0|2,0,0]=4 2511 B11R0.118 CC[C@@H](NCC(=O)C)C(=O)OC 21b909df5addf48c24f41214ab4de738 [1,1,0,0,0,0|1,0,1]=4 2512 B11R0.118 CC[C@@H](NCC(C)C)C(=O)OC c99ab3033e8be2a6117bf96ebbeb14bd [1,1,0,0,0,0|1,0,0]=3 2513 B11R0.118 CC[C@@H](NCC(C)O)C(=O)OC f5a7d656fb8379b9dd71e2af934f77bc [1,1,0,0,0,0|1,0,0]=3 2514 B11R0.118 CC[C@@H](NCC(F)F)C(=O)OC b03be3ece1dc279b24c567bb85929df5 [1,1,0,0,0,0|2,0,0]=4 2515 B11R0.118 CC[C@@H](NCN(C)C)C(=O)OC 4e79ce9be81a47079a4c99cd49504e1b [1,1,0,0,0,0|2,0,0]=4 2516 B11R0.118 CC[C@@H](NC[C@@H](C)O)C(=O)OC 0d9f23bf638d19abdabb29e917b132d5 [1,1,0,0,0,0|1,0,0]=3 2517 B11R0.118 CC[C@@H](NC[C@H](C)O)C(=O)OC b090461eb1b3b624fcdd2ea2d2eb3809 [1,1,0,0,0,0|1,0,0]=3 2518 B11R0.118 CC[C@@H](OCC(C)C)C(=O)OC 312b7effa2fb30005187da49978854b8 [1,1,0,0,0,0|1,0,0]=3 2519 B11R0.118 CC[C@@H](OCC(F)F)C(=O)OC 30bd95d3a841dc54c5b6f2a7ad4842b2 [1,1,0,0,0,0|2,0,0]=4 2520 B11R0.118 CC[C@H](NCC(C)C)C(=O)OC d719730697a532abb9fcbfc616d3693a [1,1,0,0,0,0|1,0,0]=3 2521 B11R0.118 CC[C@H](NCC(C)O)C(=O)OC c76a8e77facb412e38688c7c0d16ddc8 [1,1,0,0,0,0|1,0,0]=3 2522 B11R0.118 CC[C@H](NCC(F)F)C(=O)OC 38c38c1d46ab2b4e042798445b04ac17 [1,1,0,0,0,0|2,0,0]=4 2523 B11R0.118 CC[C@H](NCN(C)C)C(=O)OC 718cb47090962ae24d8d8dc833b0b6b1 [1,1,0,0,0,0|2,0,0]=4 2524 B11R0.118 CC[C@H](NC[C@@H](C)O)C(=O)OC 349eaac311fa46c3d9711afd0802dd3a [1,1,0,0,0,0|1,0,0]=3 2525 B11R0.118 CC[C@H](NC[C@H](C)O)C(=O)OC 337465323ebf82f12b726ecf16c4097d [1,1,0,0,0,0|1,0,0]=3 2526 B11R0.118 CC[C@H](OCC(C)C)C(=O)OC 6d31750fd817a3ce890ff40c02f1d046 [1,1,0,0,0,0|1,0,0]=3 2527 B11R0.118 CC[C@H](OCC(F)F)C(=O)OC 4bba3554da7aaee1d94e85f2865cdfc1 [1,1,0,0,0,0|2,0,0]=4 2528 B11R0.118 COC(=O)C(CO)NCC(C)C da5fc8cf52525bb8d42b17145e05e372 [1,1,0,0,0,0|2,0,0]=4 2529 B11R0.118 COC(=O)C(CO)NCC(C)O aece91437c34c3522183597cec9fd453 [1,1,0,0,0,0|2,0,0]=4 2530 B11R0.118 COC(=O)C(CO)NC[C@@H](C)O be512b2ec0e6eb6db09b16ec5541e9be [1,1,0,0,0,0|2,0,0]=4 2531 B11R0.118 COC(=O)C(CO)NC[C@H](C)O b548a757776bbd54b4a3d0ddc00b5751 [1,1,0,0,0,0|2,0,0]=4 2532 B11R0.118 COC(=O)C(OC)OCC(C)C 16053cba138eb4b7619118c72e3aa41c [1,1,0,0,0,0|2,0,0]=4 2533 B11R0.118 COC(=O)[C@@H](CO)NCC(C)C e11b4ea4b739711dac7d01ae7d6ecff9 [1,1,0,0,0,0|2,0,0]=4 2534 B11R0.118 COC(=O)[C@@H](CO)NCC(C)O 2201a7f0ad106d373543d194c12b0aca [1,1,0,0,0,0|2,0,0]=4 2535 B11R0.118 COC(=O)[C@@H](CO)NC[C@@H](C)O f3129c477c8cf88ecc060956415b01af [1,1,0,0,0,0|2,0,0]=4 2536 B11R0.118 COC(=O)[C@@H](CO)NC[C@H](C)O 7580e216b2bcf77848cd610c256309d2 [1,1,0,0,0,0|2,0,0]=4 2537 B11R0.118 COC(=O)[C@H](CO)NCC(C)C f92ffd8e8ccd8781b2397c51dbe5014e [1,1,0,0,0,0|2,0,0]=4 2538 B11R0.118 COC(=O)[C@H](CO)NCC(C)O ee81a91f7c25823e4e16d061494f49cf [1,1,0,0,0,0|2,0,0]=4 2539 B11R0.118 COC(=O)[C@H](CO)NC[C@@H](C)O 61a4d655475d1f8b48f224e31a30ae10 [1,1,0,0,0,0|2,0,0]=4 2540 B11R0.118 COC(=O)[C@H](CO)NC[C@H](C)O 039774a1069b161006aae12a9c575023 [1,1,0,0,0,0|2,0,0]=4 2541 B11R0.118 COC(=O)[C@H](CS)NCC(C)C c1e16e9b44d20429ea844fa48cb53115 [1,1,0,0,0,0|2,0,0]=4 2542 B11R0.118 COC(=O)[C@H](CS)NCC(C)O 9a80a24eaaae9fdb5b4cd25af7c65ab3 [1,1,0,0,0,0|2,0,0]=4 2543 B11R0.118 COC(=O)[C@H](CS)NC[C@H](C)O 3bac125bd39ad38560738d0c0f162438 [1,1,0,0,0,0|2,0,0]=4 2544 B11R0.156 CCCCN(CC)C(C=O)CC b5bc78844d01246263ec4078fd952895 [1,1,0,0,0,0|1,0,1]=4 2545 B11R0.162 C=C(C)C(=O)N(CC)CCCC 00b4ff7f3a658fa3074a75e3234b8ed9 [1,1,0,0,0,0|1,0,1]=4 2546 B11R0.162 CCCCC(CC)N(C)C(C)C c8731bd791bb58acf7989df63ef03c79 [1,1,0,0,0,0|2,0,0]=4 2547 B11R0.162 CCCCN(CC)C(=O)C(=O)C 02bcdb3f330d6a8f53da8796d9807fda [1,1,0,0,0,0|1,0,1]=4 2548 B11R0.162 CCCCN(CC)C(=O)C(C)F ae3b4b1883e610613b0987be421d29ef [1,1,0,0,0,0|1,0,0]=3 2549 B11R0.162 CCCCN(CC)C(=O)C(C)O f800b0a8b3f5561c18c23aebbde31ca1 [1,1,0,0,0,0|1,0,0]=3 2550 B11R0.162 CCCCN(CC)C(=O)C(C)S e8ef53d1c712f0d9c17ac09fc0684b30 [1,1,0,0,0,0|1,0,0]=3 2551 B11R0.162 CCCCN(CC)C(=O)C(F)F 92b9464aeaf71b208c20d544256f5cff [1,1,0,0,0,0|2,0,0]=4 2552 B11R0.162 CCCCN(CC)C(=O)C(O)O 61f4882fd08145d9b13dc3e0c89f6dff [1,1,0,0,0,0|2,0,0]=4 2553 B11R0.162 CCCCN(CC)C(=O)[C@@H](C)F 73cd8f495d9534ca9e25cb7b60d84ab3 [1,1,0,0,0,0|1,0,0]=3 2554 B11R0.162 CCCCN(CC)C(=O)[C@@H](C)O ef7ccbbd01c1688b082ad5019555f618 [1,1,0,0,0,0|1,0,0]=3 2555 B11R0.162 CCCCN(CC)C(=O)[C@H](C)F 7cc4a12eea75e487650f5a95071ea381 [1,1,0,0,0,0|1,0,0]=3 2556 B11R0.162 CCCCN(CC)C(=O)[C@H](C)O 21b455f7790e2af45964bb1751116afb [1,1,0,0,0,0|1,0,0]=3 2557 B11R0.162 CCCNC(CC)C(=O)N(C)C 3fcb39ab7663a0b4044a6d17e4e9919e [1,1,0,0,0,0|2,0,0]=4 2558 B11R0.162 CCCOC(CC)C(=O)N(C)C 096b80ca1f90e909c1df2d7b5dbe392f [1,1,0,0,0,0|2,0,0]=4 2559 B11R0.162 CCN(CCCO)C(=O)C(C)F 565f9d19edd2a11ecb780416b5b1ea38 [1,1,0,0,0,0|2,0,0]=4 2560 B11R0.162 CCN(CCCO)C(=O)C(C)O 838c645c009e7bff7fc2079bfb9f2072 [1,1,0,0,0,0|2,0,0]=4 2561 B11R0.162 CCN(CCCO)C(=O)C(C)S 2a40b4ab5fe12d5fbc791288f056f8a2 [1,1,0,0,0,0|2,0,0]=4 2562 B11R0.162 CCN(CCCO)C(=O)[C@@H](C)F 9bb98a63294dbf9ca98ba55b2e23daa1 [1,1,0,0,0,0|2,0,0]=4 2563 B11R0.162 CCN(CCCO)C(=O)[C@@H](C)O 397b4bcf6f90b5d456ce1c6b2ba757b3 [1,1,0,0,0,0|2,0,0]=4 2564 B11R0.162 CCN(CCCO)C(=O)[C@H](C)F 40df31b25ab1efded7d4e05837d7ff9a [1,1,0,0,0,0|2,0,0]=4 2565 B11R0.162 CCN(CCCO)C(=O)[C@H](C)O c5832115cceecc745e770098b6304879 [1,1,0,0,0,0|2,0,0]=4 2566 B11R0.162 CCN(CCOC)C(=O)C(C)F 5e28bc6d37b53d876c3018a3d8e0cf13 [1,1,0,0,0,0|2,0,0]=4 2567 B11R0.162 CCN(CCOC)C(=O)C(C)O 125d5bd190a883c153c7d9584d6722a9 [1,1,0,0,0,0|2,0,0]=4 2568 B11R0.162 CCN(CCOC)C(=O)C(C)S 4fd23be982e80c01e0135d4aab081332 [1,1,0,0,0,0|2,0,0]=4 2569 B11R0.162 CCN(CCOC)C(=O)[C@@H](C)F a2e53d1bb60fb29c859e70d29a0a80fc [1,1,0,0,0,0|2,0,0]=4 2570 B11R0.162 CCN(CCOC)C(=O)[C@@H](C)O b2d6dd86026cd61cade1dcc604736d8e [1,1,0,0,0,0|2,0,0]=4 2571 B11R0.162 CCN(CCOC)C(=O)[C@H](C)F 286c0bc292dd1696de0a522a1891c920 [1,1,0,0,0,0|2,0,0]=4 2572 B11R0.162 CCN(CCOC)C(=O)[C@H](C)O 07ff9a15cc4b0fe9aa22d3cc06adea83 [1,1,0,0,0,0|2,0,0]=4 2573 B11R0.167 CCC(=O)N(CCCO)C(C)C 17ce093863cea9f9f7f7180ec2e77d5b [1,1,0,0,0,0|2,0,0]=4 2574 B11R0.167 CCC(=O)N(CCOC)C(C)C 04aac2f5c197ac73bd2bc16835bcbf3a [1,1,0,0,0,0|2,0,0]=4 2575 B11R0.167 CCCCN(C(=O)CC)C(C)C fd0f7defd4bc199bd4b3000f563aed3f [1,1,0,0,0,0|1,0,0]=3 2576 B11R0.167 CCCCN(C(=O)CF)C(C)C 7c8df56c067d29a36b615b6bdb9fd8db [1,1,0,0,0,0|2,0,0]=4 2577 B11R0.167 CCCCN(C(=O)CO)C(C)C 6ed9caa0b403b77639f8379eb9eedf85 [1,1,0,0,0,0|2,0,0]=4 2578 B11R0.167 CCCNC(C(=O)C)C(=O)OC 278fea9cd82ad1458b551ba7283b4b2b [1,1,0,0,0,0|1,0,1]=4 2579 B11R0.167 CCCNC(C(=O)OC)C(C)C a5229462c7c28df0cacee6a6719f4497 [1,1,0,0,0,0|1,0,0]=3 2580 B11R0.167 CCCNC(C(=O)OC)C(C)O 264b12ede902d9cecfbf6f41765eebef [1,1,0,0,0,0|1,0,0]=3 2581 B11R0.167 CCCN[C@H](C(=O)NC)C(C)C 36d329944f610f667ee195c15f899684 [1,1,0,0,0,0|2,0,0]=4 2582 B11R0.167 CCCN[C@H](C(=O)NC)[C@@H](C)O e85e9c8514a4b003279e3b73a72b9bf2 [1,1,0,0,0,0|2,0,0]=4 2583 B11R0.167 CCCN[C@H](C(=O)OC)C(C)C a7fbc681775511c0b330a892ddda817d [1,1,0,0,0,0|1,0,0]=3 2584 B11R0.167 CCCN[C@H](C(=O)OC)[C@@H](C)O 1cd9ff81e41181a2a028b5a15ba8a0fa [1,1,0,0,0,0|1,0,0]=3 2585 B11R0.167 CCCOC(C(=O)C)C(=O)OC ee45a6647971fcbbb1f962adfd5bbd5a [1,1,0,0,0,0|1,0,1]=4 2586 B11R0.167 CCCOC(C(=O)OC)C(C)C 85a78f77b3750b30c233f126f1ac3cd7 [1,1,0,0,0,0|1,0,0]=3 2587 B11R0.167 CCCO[C@@H](C(=O)OC)C(C)C 91a7efbb4a6d5345d01c337b11f55da9 [1,1,0,0,0,0|1,0,0]=3 2588 B11R0.167 CCCO[C@H](C(=O)OC)C(C)C 0ab1016fa71c064d5554163a356b1c1b [1,1,0,0,0,0|1,0,0]=3 2589 B11R0.167 COC(=O)C(NCCBr)C(C)C 015d05d2b3a2c1e32aad18155cba7845 [1,1,0,0,0,0|2,0,0]=4 2590 B11R0.167 COC(=O)C(NCCF)C(C)C 612d090e907fe96d360fba7a7d616afd [1,1,0,0,0,0|2,0,0]=4 2591 B11R0.167 COC(=O)C(NCCF)C(C)O bd5cda45b52212e92747bcece7d571ce [1,1,0,0,0,0|2,0,0]=4 2592 B11R0.167 COC(=O)C(NCCI)C(C)C 0b04b5afa1e7050fdd66f855e05d5f36 [1,1,0,0,0,0|2,0,0]=4 2593 B11R0.167 COC(=O)C(NCCO)C(C)C ff48f8148f17e5a4704e8fc392b4cef6 [1,1,0,0,0,0|2,0,0]=4 2594 B11R0.167 COC(=O)C(NCCO)C(C)O 8169f8041eb89b01ad3d024aa32482f3 [1,1,0,0,0,0|2,0,0]=4 2595 B11R0.167 COC(=O)C(NCCS)C(C)C 495cae1a101ed8149ee9fd4da2523f69 [1,1,0,0,0,0|2,0,0]=4 2596 B11R0.167 COC(=O)C(NCCS)C(C)O 6c98cb24a0ab9717b9c245f743a9dc66 [1,1,0,0,0,0|2,0,0]=4 2597 B11R0.167 COC(=O)C(NCSC)C(C)O 6ba1895663b05d66d6cc14984a9856c0 [1,1,0,0,0,0|2,0,0]=4 2598 B11R0.167 COC(=O)C(OCCF)C(C)C e723a762e19c85989beb0d53b1a8f8d6 [1,1,0,0,0,0|2,0,0]=4 2599 B11R0.167 COC(=O)C(OCCS)C(C)C 42e83784dfc92b07049f018c6840ccdb [1,1,0,0,0,0|2,0,0]=4 2600 B11R0.167 COC(=O)C(OCSC)C(C)C 3015a26d755998a63fb4d93ebef5b99c [1,1,0,0,0,0|2,0,0]=4 2601 B11R0.167 COC(=O)[C@@H](NCCF)C(C)C 6f5ab3e39baf1e1dcaba931862171fed [1,1,0,0,0,0|2,0,0]=4 2602 B11R0.167 COC(=O)[C@@H](NCCF)[C@@H](C)O 33e23f1d49ca8ed76badcddf7f57f9d2 [1,1,0,0,0,0|2,0,0]=4 2603 B11R0.167 COC(=O)[C@@H](NCCO)C(C)C 43e7812558fe357ded0095750decb278 [1,1,0,0,0,0|2,0,0]=4 2604 B11R0.167 COC(=O)[C@@H](NCCO)[C@@H](C)O 6a85841ff8b2ee39f0c50bd71ed267eb [1,1,0,0,0,0|2,0,0]=4 2605 B11R0.167 COC(=O)[C@@H](NCCS)C(C)C ffd8476ba1fa4c48dd72d2b2a23b1a52 [1,1,0,0,0,0|2,0,0]=4 2606 B11R0.167 COC(=O)[C@@H](NCCS)[C@@H](C)O 32edebc624445f2445aeeb9e223d163e [1,1,0,0,0,0|2,0,0]=4 2607 B11R0.167 COC(=O)[C@@H](NCSC)C(C)C bd96088ac05522a2fe5024b13e4998d4 [1,1,0,0,0,0|2,0,0]=4 2608 B11R0.167 COC(=O)[C@@H](NCSC)[C@@H](C)O 3899db157c3bdae6abb382b66677ec12 [1,1,0,0,0,0|2,0,0]=4 2609 B11R0.167 COC(=O)[C@@H](OCCF)C(C)C 1b4c77d4412756575338d6664751d765 [1,1,0,0,0,0|2,0,0]=4 2610 B11R0.167 COC(=O)[C@@H](OCCS)C(C)C 267045f23cf14435686a921ac7534fbc [1,1,0,0,0,0|2,0,0]=4 2611 B11R0.167 COC(=O)[C@@H](OCSC)C(C)C 52a9455448888aa22d59020fca0ea131 [1,1,0,0,0,0|2,0,0]=4 2612 B11R0.167 COC(=O)[C@H](OCCF)C(C)C f2e5adb1a318bf4ff92cf97d30fbccce [1,1,0,0,0,0|2,0,0]=4 2613 B11R0.167 COC(=O)[C@H](OCCS)C(C)C 06c8acd02624bd58e9cd3848db5bb2f5 [1,1,0,0,0,0|2,0,0]=4 2614 B11R0.167 COC(=O)[C@H](OCSC)C(C)C 6adce3a969f54c18f438e3096b2f4809 [1,1,0,0,0,0|2,0,0]=4 2615 B11R0.167 COCNC(C(=O)OC)C(C)O b4e8bc043312d9fb255a8cbddb9aa38f [1,1,0,0,0,0|2,0,0]=4 2616 B11R0.167 COCN[C@H](C(=O)OC)C(C)C 5c7e580c25f1150cc27e3e71274c4c85 [1,1,0,0,0,0|2,0,0]=4 2617 B11R0.167 COCN[C@H](C(=O)OC)[C@@H](C)O 8a38c32f3ff87df438620554df26cf28 [1,1,0,0,0,0|2,0,0]=4 2618 B11R0.167 COCOC(C(=O)OC)C(C)C 8eb6eb846a6e3c851e893c5286997f03 [1,1,0,0,0,0|2,0,0]=4 2619 B11R0.167 COCO[C@@H](C(=O)OC)C(C)C cb0e3df301b4595212f7527bd8943146 [1,1,0,0,0,0|2,0,0]=4 2620 B11R0.167 COCO[C@H](C(=O)OC)C(C)C cbee679579ebab78d071684386194561 [1,1,0,0,0,0|2,0,0]=4 2621 B11R0.215 CCC(C)(NCCF)C(=O)OC 210a89dc13d45a49ba0e7560c69081fd [1,1,0,0,0,0|2,0,0]=4 2622 B11R0.215 CCC(C)(NCCO)C(=O)OC d13e0a11d0cdb1f2ad88218523857712 [1,1,0,0,0,0|2,0,0]=4 2623 B11R0.215 CCC(C)(NCCS)C(=O)OC 942cae46e995006f875167f5d40b9eb1 [1,1,0,0,0,0|2,0,0]=4 2624 B11R0.215 CCC(C)(NCOC)C(=O)OC a297e641d1f8d505b545f01891d89b40 [1,1,0,0,0,0|2,0,0]=4 2625 B11R0.215 CCC(C)(NCSC)C(=O)OC 0f7f960c68a44fdbbd14cf61e1411d05 [1,1,0,0,0,0|2,0,0]=4 2626 B11R0.215 CCCNC(C)(CC)C(=O)OC 9b7aab5f6e93ca04fc10f15b389606a7 [1,1,0,0,0,0|1,0,0]=3 2627 B13R0.26 C=C(C)COC(CC)CC(=O)OCC 9ac7821946591c81b31918da5e2b0934 [0,1,0,0,0,1|1,0,1]=4 2628 B13R0.26 CCNC(=O)CN(CC)CCC(C)C 76bf2b99752b9685c01704c6f293ff8d [0,1,0,0,0,1|2,0,0]=4 2629 B13R0.26 CCNC(=O)CN(CC)CCC(C)O 192298aa846543709394581a835608b3 [0,1,0,0,0,1|2,0,0]=4 2630 B13R0.26 CCOC(=O)CC(CC)OCC(C)C ff2e4e68f7a7e6a5ec3fbc045fd8233d [0,1,0,0,0,1|1,0,0]=3 2631 B13R0.26 CCOC(=O)CC(CC)OCC(F)F 2c7947a888cbce57b0ce424201f39963 [0,1,0,0,0,1|2,0,0]=4 2632 B13R0.26 CCOC(=O)CC(CC)OCN(C)C 8f523df8a60a7b38442a241f727715a8 [0,1,0,0,0,1|2,0,0]=4 2633 B13R0.26 CCOC(=O)CN(CC)CCC(=O)C 8de0ab5f6fc3e2c04e3fd4e60cdb218a [0,1,0,0,0,1|1,0,1]=4 2634 B13R0.26 CCOC(=O)CN(CC)CCC(C)C 377a5372b560740e253b3d9c303ad39b [0,1,0,0,0,1|1,0,0]=3 2635 B13R0.26 CCOC(=O)CN(CC)CCC(C)O 688990dc57ea73ba8fc7455e60d3934c [0,1,0,0,0,1|1,0,0]=3 2636 B13R0.26 CCOC(=O)CN(CC)CCN(C)C fd7cbca97eaadd060fa17266a5615eac [0,1,0,0,0,1|2,0,0]=4 2637 B13R0.26 CCOC(=O)CN(CC)CCS(=O)C bfbbd03a969d171ca18fa0b6316796c2 [0,1,0,0,0,1|2,0,0]=4 2638 B13R0.26 CCOC(=O)CN(CC)COC(C)C b3a7d772ccca9006896d96db4e8f3f14 [0,1,0,0,0,1|2,0,0]=4 2639 B13R0.28 CCCC(=O)CN(CC)CC(O)CC c80c377e596730002c4051744f6c2234 [0,1,0,0,0,1|2,0,0]=4 2640 B13R0.28 CCNC(=O)CN(CC)CC(C)CC a3c91ba7464bf497205b399e4be30826 [0,1,0,0,0,1|2,0,0]=4 2641 B13R0.28 CCNC(=O)CN(CC)CC(O)CC 7139e397f382cf199fd570d82ddae8c8 [0,1,0,0,0,1|2,0,0]=4 2642 B13R0.28 CCNC(=O)CN(CC)C[C@@H](C)CC 7811f5e335e2b0d63136059c5f27d89b [0,1,0,0,0,1|2,0,0]=4 2643 B13R0.28 CCNC(=O)CN(CC)C[C@H](C)CC 74676fe16f370dd9c4c9ca6b118f2350 [0,1,0,0,0,1|2,0,0]=4 2644 B13R0.28 CCOC(=O)CC(CC)OC(C)CC a4191d77731dde7d134c3aa3b8c725f2 [0,1,0,0,0,1|1,0,0]=3 2645 B13R0.28 CCOC(=O)CN(CC)CC(=O)CC ade5768095bd2104b477b50b3aed236a [0,1,0,0,0,1|1,0,1]=4 2646 B13R0.28 CCOC(=O)CN(CC)CC(C)CC 5bf726f049e2895a8314c6dd4b93926f [0,1,0,0,0,1|1,0,0]=3 2647 B13R0.28 CCOC(=O)CN(CC)CC(C)CO d6de6bcb8ba9c380ba496027a5359a90 [0,1,0,0,0,1|2,0,0]=4 2648 B13R0.28 CCOC(=O)CN(CC)CC(C)OC b1651ceb3ecab4f8616b3ef5e23d0745 [0,1,0,0,0,1|2,0,0]=4 2649 B13R0.28 CCOC(=O)CN(CC)CC(O)CC fc5ac3d3c365105015a83b1789bd3c59 [0,1,0,0,0,1|1,0,0]=3 2650 B13R0.28 CCOC(=O)CN(CC)CC(O)CF fad1486657bf1b98d7e4aa38b65457a1 [0,1,0,0,0,1|2,0,0]=4 2651 B13R0.28 CCOC(=O)CN(CC)CC(O)CO cf79e242e054bc2bdbdb79612307be64 [0,1,0,0,0,1|2,0,0]=4 2652 B13R0.28 CCOC(=O)CN(CC)C[C@@H](C)CC 2acc8cea176652529572ecbb55bd3cb0 [0,1,0,0,0,1|1,0,0]=3 2653 B13R0.28 CCOC(=O)CN(CC)C[C@@H](C)CO 6dd9df4a67ec438e2a48ebfb0177e3f1 [0,1,0,0,0,1|2,0,0]=4 2654 B13R0.28 CCOC(=O)CN(CC)C[C@@H](C)OC 3095d2d8d23c3e2288815a14d391319a [0,1,0,0,0,1|2,0,0]=4 2655 B13R0.28 CCOC(=O)CN(CC)C[C@@H](O)CO b46b287434fdc71b52a34e552efc508d [0,1,0,0,0,1|2,0,0]=4 2656 B13R0.28 CCOC(=O)CN(CC)C[C@H](C)CC bb8947e604fb528d394c73f433d78148 [0,1,0,0,0,1|1,0,0]=3 2657 B13R0.28 CCOC(=O)CN(CC)C[C@H](C)CO 8510be0e540d4e740a46279395a4581e [0,1,0,0,0,1|2,0,0]=4 2658 B13R0.28 CCOC(=O)CN(CC)C[C@H](C)OC 0a5d7e1b8d4b89409e7d24e5dae5fb10 [0,1,0,0,0,1|2,0,0]=4 2659 B13R0.28 CCOC(=O)CN(CC)C[C@H](O)CO 3235b764f13efdf689815df1cd22f84f [0,1,0,0,0,1|2,0,0]=4 2660 B13R0.114 C#CCNC(=O)CC(CC)CCCC b42eb32dfd08900e8131b68f32cec733 [0,1,0,0,0,1|1,0,1]=4 2661 B13R0.114 C=C(CN(CC)CCCC)OCOC f0843a997553abd554d0b8dd92ca4a60 [0,1,0,0,0,1|2,0,0]=4 2662 B13R0.114 C=CCOC(=O)CN(CC)CCCC 876897efe616a3e5b02558f30b12f161 [0,1,0,0,0,1|1,0,1]=4 2663 B13R0.114 CC/C=C/C(=O)NC(CO)CCCC f10008b606e5d70cc2f9c3af9b3fa4ea [0,1,0,0,0,1|2,0,0]=4 2664 B13R0.114 CC/C=C/C(=O)N[C@@H](CO)CCCC ad6fd392b592cfc0bd9c82143720d138 [0,1,0,0,0,1|2,0,0]=4 2665 B13R0.114 CC/C=C/C(=O)N[C@H](CO)CCCC 14ffbcf3477769384bb0375ba6f7febf [0,1,0,0,0,1|2,0,0]=4 2666 B13R0.114 CC/C=C\C(=O)NC(CO)CCCC d9efccd41eb23a1d2e93f7c2af3f4796 [0,1,0,0,0,1|2,0,0]=4 2667 B13R0.114 CC/C=C\C(=O)N[C@@H](CO)CCCC ab7cb373d1be2fbfdf0610e35c9db316 [0,1,0,0,0,1|2,0,0]=4 2668 B13R0.114 CC/C=C\C(=O)N[C@H](CO)CCCC 82d4d4aec7ca18b57db21c8cbae1ea7d [0,1,0,0,0,1|2,0,0]=4 2669 B13R0.114 CCC#CC(=O)NC(CO)CCCC ec134d4896bb98f3fa93557d9fa06465 [0,1,0,0,0,1|2,0,0]=4 2670 B13R0.114 CCC#CC(=O)N[C@@H](CO)CCCC 2139604d4afe2c43162900816ea4b1a9 [0,1,0,0,0,1|2,0,0]=4 2671 B13R0.114 CCC#CC(=O)N[C@H](CO)CCCC 88ee1bc583e91c0257b66ec6bded7ead [0,1,0,0,0,1|2,0,0]=4 2672 B13R0.114 CCC=CC(=O)NC(CO)CCCC cce07788a38ebeaa875dcf6b6fd3b8b6 [0,1,0,0,0,1|2,0,0]=4 2673 B13R0.114 CCC=CC(=O)N[C@@H](CO)CCCC 2cb202e9d8bb450932069a9280c8c278 [0,1,0,0,0,1|2,0,0]=4 2674 B13R0.114 CCC=CC(=O)N[C@H](CO)CCCC 3fdb5f2b898e0b3bf737550e4360d3ea [0,1,0,0,0,1|2,0,0]=4 2675 B13R0.114 CCCCC(=O)NC(CO)CCCC 26d4ea5092dd4c52d78fbbee36def664 [0,1,0,0,0,1|2,0,0]=4 2676 B13R0.114 CCCCC(=O)N[C@@H](CO)CCCC 7cf9938901bcfeda60024bd5f366ce2c [0,1,0,0,0,1|2,0,0]=4 2677 B13R0.114 CCCCC(=O)N[C@H](CO)CCCC 7ad722b73cb7d29692d93fe77566c7c3 [0,1,0,0,0,1|2,0,0]=4 2678 B13R0.114 CCCCC(CC)CC(=O)NCC#N 9e2dcf71350665ab0c2857e8e89dc443 [0,1,0,0,0,1|1,0,1]=4 2679 B13R0.114 CCCCC(CC)CC(=O)NCCBr 24b8743524ec468d00b0267557db70c8 [0,1,0,0,0,1|1,0,0]=3 2680 B13R0.114 CCCCC(CC)CC(=O)NCCC be6cdefb428edcad386e9ac1da667b32 [0,1,0,0,0,1|1,0,0]=3 2681 B13R0.114 CCCCC(CC)CC(=O)NCCF dd3ec47251ba3aa2cced0fbd3f5b9b64 [0,1,0,0,0,1|1,0,0]=3 2682 B13R0.114 CCCCC(CC)CC(=O)NCCI e22adf886493601d8b1614cd8b3f7e44 [0,1,0,0,0,1|1,0,0]=3 2683 B13R0.114 CCCCC(CC)CC(=O)NCCO 39e03a0e1cd5e1efdacb2b079fd0b861 [0,1,0,0,0,1|1,0,0]=3 2684 B13R0.114 CCCCC(CC)CC(=O)NCCS 43386302154fdfa6dc123d877217886e [0,1,0,0,0,1|1,0,0]=3 2685 B13R0.114 CCCCC(CC)OC(C)COCC 56b1a5b6cd5d6251b36ede5d54088bbb [0,1,0,0,0,1|1,0,1]=4 2686 B13R0.114 CCCCC(CO)NC(=O)CCCF 4d3dcc692a287f660efd6dacb544bfce [0,1,0,0,0,1|2,0,0]=4 2687 B13R0.114 CCCCC(CO)NC(=O)CCCS 7b6bdd5b07d236ea0777bd1fb043afbc [0,1,0,0,0,1|2,0,0]=4 2688 B13R0.114 CCCCC(CO)NC(=O)CCOC 5e99b89f6ecbf1e4da98dd17a4aa59ba [0,1,0,0,0,1|2,0,0]=4 2689 B13R0.114 CCCCC(CO)NC(=O)CCSC af887d96081b4cf218de8b924a57d71d [0,1,0,0,0,1|2,0,0]=4 2690 B13R0.114 CCCCC(CO)NC(=O)COCC 15d6c7472c70ebe875b0bc3e613c80af [0,1,0,0,0,1|1,0,0]=3 2691 B13R0.114 CCCCC(CO)NC(=O)CSCC a1d60ae5bca3dbd83f4e862012390540 [0,1,0,0,0,1|1,1,0]=4 2692 B13R0.114 CCCCC(CO)NC(=O)NCCC 370bd8b9886d2b4d45e4956116733827 [0,1,0,0,0,1|2,0,0]=4 2693 B13R0.114 CCCCC(CO)NC(=O)NCCF 3e0562c8d22cb4593dcd02938c943c94 [0,1,0,0,0,1|2,0,0]=4 2694 B13R0.114 CCCCC(CO)NC(=O)NCCN b2f556cb55a5894c82f89a99d5bf17bd [0,1,0,0,0,1|2,0,0]=4 2695 B13R0.114 CCCCC(CO)NC(=O)NCCO 4dfee28d35eb59c2ee22fee869fbe45c [0,1,0,0,0,1|2,0,0]=4 2696 B13R0.114 CCCCC(CO)NC(=O)NCCS bc6316ff7b5146a01d3ab2e56a9cc20b [0,1,0,0,0,1|2,0,0]=4 2697 B13R0.114 CCCCN(CC)CC(=O)CCSC c2289c33c531a703f80fae171d86fa63 [0,1,0,0,0,1|2,0,0]=4 2698 B13R0.114 CCCCN(CC)CC(=O)NCCC 1060cadf8355a3ba091f32466b3db2b2 [0,1,0,0,0,1|2,0,0]=4 2699 B13R0.114 CCCCN(CC)CC(=O)OCCC 051db59551235b93f5dedb3aa4525b2f [0,1,0,0,0,1|1,0,0]=3 2700 B13R0.114 CCCC[C@@H](CO)NC(=O)CCCF 08591db97bcd96e3a67cbc9977f31f22 [0,1,0,0,0,1|2,0,0]=4 2701 B13R0.114 CCCC[C@@H](CO)NC(=O)CCCS 25e2c3076587fe38f0205aca21085f37 [0,1,0,0,0,1|2,0,0]=4 2702 B13R0.114 CCCC[C@@H](CO)NC(=O)CCOC ceb4348ffb9a54f048fb01eb7b39e5f0 [0,1,0,0,0,1|2,0,0]=4 2703 B13R0.114 CCCC[C@@H](CO)NC(=O)CCSC 8d79b0e129e33b1790fbd878957068ca [0,1,0,0,0,1|2,0,0]=4 2704 B13R0.114 CCCC[C@@H](CO)NC(=O)COCC f7ef59f3894bf91ab5bff6bb83a1f1d6 [0,1,0,0,0,1|1,0,0]=3 2705 B13R0.114 CCCC[C@@H](CO)NC(=O)CSCC 8c6336dc8a10f32f2d8fe84c39b751b0 [0,1,0,0,0,1|1,1,0]=4 2706 B13R0.114 CCCC[C@@H](CO)NC(=O)NCCC d59bc69e6b13066bd2461686ae2ea524 [0,1,0,0,0,1|2,0,0]=4 2707 B13R0.114 CCCC[C@@H](CO)NC(=O)NCCF fb612388bfdd68deb2695c5a4e4c5c92 [0,1,0,0,0,1|2,0,0]=4 2708 B13R0.114 CCCC[C@@H](CO)NC(=O)NCCN eaea02627a2ac46c40c20e23d19f4396 [0,1,0,0,0,1|2,0,0]=4 2709 B13R0.114 CCCC[C@@H](CO)NC(=O)NCCO 4881d567d1b12526bbca175150402cf8 [0,1,0,0,0,1|2,0,0]=4 2710 B13R0.114 CCCC[C@@H](CO)NC(=O)NCCS aaea1c394dca528969a1cb6810139cca [0,1,0,0,0,1|2,0,0]=4 2711 B13R0.114 CCCC[C@H](CO)NC(=O)CCCF 6fa6467caa01fc685d823f873466b239 [0,1,0,0,0,1|2,0,0]=4 2712 B13R0.114 CCCC[C@H](CO)NC(=O)CCCS a3a1b1ca46ecbbb87e9e21c9b7cb2a13 [0,1,0,0,0,1|2,0,0]=4 2713 B13R0.114 CCCC[C@H](CO)NC(=O)CCOC 3ccb988221c777482a75f8287f290fb5 [0,1,0,0,0,1|2,0,0]=4 2714 B13R0.114 CCCC[C@H](CO)NC(=O)CCSC 5de2e807ed7f2648faad059d26ad35d9 [0,1,0,0,0,1|2,0,0]=4 2715 B13R0.114 CCCC[C@H](CO)NC(=O)COCC fe593533c4e6afea32d13e08f322e3f9 [0,1,0,0,0,1|1,0,0]=3 2716 B13R0.114 CCCC[C@H](CO)NC(=O)CSCC e2f0383f494a4b0567ecac80c1303370 [0,1,0,0,0,1|1,1,0]=4 2717 B13R0.114 CCCC[C@H](CO)NC(=O)NCCC 33d7e437cdc5d7709ed05bbcbc3e586a [0,1,0,0,0,1|2,0,0]=4 2718 B13R0.114 CCCC[C@H](CO)NC(=O)NCCF e65953a6b1e3234ba927ee0a5624c3ad [0,1,0,0,0,1|2,0,0]=4 2719 B13R0.114 CCCC[C@H](CO)NC(=O)NCCN 55c33c3f4048a02462e6da28ba76df37 [0,1,0,0,0,1|2,0,0]=4 2720 B13R0.114 CCCC[C@H](CO)NC(=O)NCCO a82e9a4aa91845828d76c8c2c1abd11d [0,1,0,0,0,1|2,0,0]=4 2721 B13R0.114 CCCC[C@H](CO)NC(=O)NCCS 621c4c768cb9f86be06d8eddc87aac6f [0,1,0,0,0,1|2,0,0]=4 2722 B13R0.114 CCCOC(=O)CC(CC)OCCC 60e4a67e1e39d0bded6cddcdcde746bb [0,1,0,0,0,1|1,0,0]=3 2723 B13R0.114 CCCOC(=O)CC(CC)OCCF a7ce59f26f24cceab95c73c2319f5178 [0,1,0,0,0,1|2,0,0]=4 2724 B13R0.114 CCCOC(=O)CC(CC)OCCS d6f95d04823ea156411a9a3dfbee5f5e [0,1,0,0,0,1|2,0,0]=4 2725 B13R0.114 CCCOC(=O)CC(CC)OCOC 426818a97d1aecfb3ef36506176c9076 [0,1,0,0,0,1|2,0,0]=4 2726 B13R0.114 CCCOC(=O)CC(CC)OCSC af228a3f18e5eb8daaf180f6494c6c19 [0,1,0,0,0,1|2,0,0]=4 2727 B13R0.114 CCCOC(=O)CN(CC)CCCO 4d4b643f2c1e4d6887227892cb5753a2 [0,1,0,0,0,1|2,0,0]=4 2728 B13R0.114 CCCOC(=O)CN(CC)CCOC 051a1ef04850ca4b4e622924c9df23b5 [0,1,0,0,0,1|2,0,0]=4 2729 B13R0.114 CCOCC(=O)NC(CO)CCCO 909fa422d0be8a4b5b3169295bf334cb [0,1,0,0,0,1|2,0,0]=4 2730 B13R0.114 CCOCC(=O)NC(CO)CCSC 075ea076c3d4d67bdb565c201e423298 [0,1,0,0,0,1|2,0,0]=4 2731 B13R0.114 CCOCC(=O)N[C@@H](CO)CCSC 68ea98a11f21482a444fc8424a2143de [0,1,0,0,0,1|2,0,0]=4 2732 B13R0.114 CCOCC(=O)N[C@H](CO)CCSC 2a594be36cbfaf547d752e6703124516 [0,1,0,0,0,1|2,0,0]=4 2733 B13R0.225 CCCC(=O)N(CC)CC(=O)OCC da521400e4fcf3d20e3acd976c018572 [0,1,0,0,0,1|1,0,1]=4 2734 B13R0.225 CCCC(C)N(CC)CC(=O)NCC 3132f3f33e03ce04d52b0b90d8f5de16 [0,1,0,0,0,1|2,0,0]=4 2735 B13R0.225 CCCC(C)N(CC)CC(=O)OCC e00a9923a4095afa4a906d8e35bd814d [0,1,0,0,0,1|1,0,0]=3 2736 B13R0.225 CCOC(=O)CN(CC)C(C)CCO c511fb28591ad63697fa1ef78ae8f618 [0,1,0,0,0,1|2,0,0]=4 2737 B13R0.225 CCOC(=O)CN(CC)C(C)COC f48fc025490c9638d87d4da4e95699f2 [0,1,0,0,0,1|2,0,0]=4 2738 B13R0.522 C#CCN(CCCC)CC(=O)OCC e99abb9e8f7cfc42d8147b65ef8f1c74 [0,1,0,0,0,1|1,0,1]=4 2739 B13R0.522 C=CCN(CCCC)CC(=O)OCC 460eaf05b4aae278d8e88bfdc15d4a94 [0,1,0,0,0,1|1,0,1]=4 2740 B13R0.522 CCCC(CC(=O)OCC)OCCF 39ccde60f5464471168d2fcb62daec95 [0,1,0,0,0,1|2,0,0]=4 2741 B13R0.522 CCCC(CC(=O)OCC)OCCS 399539bfa92dd4bbdac88306333d5af0 [0,1,0,0,0,1|2,0,0]=4 2742 B13R0.522 CCCC(CC(=O)OCC)OCOC aeb1249bef42bd282827669b8e6b0f77 [0,1,0,0,0,1|2,0,0]=4 2743 B13R0.522 CCCC(CC(=O)OCC)OCSC 84e42f7f43fa3ffbd494a7ef81644bdc [0,1,0,0,0,1|2,0,0]=4 2744 B13R0.522 CCCCC(CC(=O)OCC)OCC 7693b6f573dd6ccaebc40874a97741fb [0,1,0,0,0,1|0,0,0]=2 2745 B13R0.522 CCCCC(CC(=O)OCC)OCF 883a8965074148dbb7467b94c089acf3 [0,1,0,0,0,1|1,0,0]=3 2746 B13R0.522 CCCCN(CC#N)CC(=O)OCC 75ed8d9524b3a2eeb318f57889e64465 [0,1,0,0,0,1|1,0,1]=4 2747 B13R0.522 CCCCN(CC=O)CC(=O)OCC efc5e3cdf897dad194a9ce0d82832d4d [0,1,0,0,0,1|1,0,1]=4 2748 B13R0.522 CCCCN(CCC)CC(=O)CCC 1e2b15fd8dfd39fc59eaf7e64d309a29 [0,1,0,0,0,1|2,0,0]=4 2749 B13R0.522 CCCCN(CCC)CC(=O)NCC 83221fae1e72097ebb0b14129fec4771 [0,1,0,0,0,1|2,0,0]=4 2750 B13R0.522 CCCCN(CCC)CC(=O)OCC 254b76724605762fed2a1e000bada27c [0,1,0,0,0,1|1,0,0]=3 2751 B13R0.522 CCCCN(CCF)CC(=O)OCC 31df9af8c177e12da4ba54276956cc7e [0,1,0,0,0,1|1,0,0]=3 2752 B13R0.522 CCCCN(CCO)CC(=O)CCC 970e0b9eafdf445d96018114d2d67497 [0,1,0,0,0,1|2,0,0]=4 2753 B13R0.522 CCCCN(CCO)CC(=O)NCC 1459a2e2b12eb61b9996e50818731f8f [0,1,0,0,0,1|2,0,0]=4 2754 B13R0.522 CCCCN(CCO)CC(=O)OCC 32b81f1376838ff2da723d99bb567116 [0,1,0,0,0,1|1,0,0]=3 2755 B13R0.522 CCCCN(CCS)CC(=O)CCC a6b7e9c773e637e0c1708a9e38145dde [0,1,0,0,0,1|2,0,0]=4 2756 B13R0.522 CCCCN(CCS)CC(=O)NCC 34dc8afe84316f440580e0db55b3429b [0,1,0,0,0,1|2,0,0]=4 2757 B13R0.522 CCCCN(CCS)CC(=O)OCC ac63e219fab77c4743c376ef2fab1179 [0,1,0,0,0,1|1,0,0]=3 2758 B13R0.522 CCCCN(COC)CC(=O)OCC d3ec9fca53fc77bd7175a76c39d01c42 [0,1,0,0,0,1|1,0,0]=3 2759 B13R0.522 CCCCN(CSC)CC(=O)OCC e6fbf0b42a4996cc58cc3c9596e081b4 [0,1,0,0,0,1|1,0,0]=3 2760 B13R0.522 CCCN(CCCF)CC(=O)OCC 1572c4f967fc38ff8916937e28d19afa [0,1,0,0,0,1|2,0,0]=4 2761 B13R0.522 CCCN(CCCO)CC(=O)OCC a47a8c2c0ababd69a971e386f57e9a5c [0,1,0,0,0,1|2,0,0]=4 2762 B13R0.522 CCCN(CCCS)CC(=O)OCC 729c424a2cecb54d80cc9c6242a587ac [0,1,0,0,0,1|2,0,0]=4 2763 B13R0.522 CCCN(CCOC)CC(=O)OCC ae30d8f4c985ecec51bd7ffd3a3df60a [0,1,0,0,0,1|2,0,0]=4 2764 B13R0.522 CCCN(CCSC)CC(=O)OCC 83b712415fd4f4a4b79174633dda141f [0,1,0,0,0,1|2,0,0]=4 2765 B13R0.522 CCCN(COCC)CC(=O)OCC 06086ed2eb557f42275f20ab438c930b [0,1,0,0,0,1|2,0,0]=4 2766 B13R0.522 CCCOC(CC#N)CC(=O)OCC 6bf623c0ab8039f0e67ac043da871348 [0,1,0,0,0,1|1,0,1]=4 2767 B13R0.522 CCCOC(CCC)CC(=O)OCC 03eb1c1c7f2e150518b5dfa3e112a55a [0,1,0,0,0,1|1,0,0]=3 2768 B13R0.522 CCCO[C@@H](CC#N)CC(=O)OCC f45bac5ffaf051e4664d9c0f3e034a8b [0,1,0,0,0,1|1,0,1]=4 2769 B13R0.522 CCCO[C@@H](CCC)CC(=O)OCC 548f7bfe6205ab901ff1f094b99ce451 [0,1,0,0,0,1|1,0,0]=3 2770 B13R0.522 CCCO[C@H](CC#N)CC(=O)OCC 7fe1a33eb58f047e42b9ed501f60bea6 [0,1,0,0,0,1|1,0,1]=4 2771 B13R0.522 CCC[C@@H](CC(=O)OCC)OCCF 3e8955909f342102e1ad47e7007b06d4 [0,1,0,0,0,1|2,0,0]=4 2772 B13R0.522 CCC[C@@H](CC(=O)OCC)OCCS c824bcdc5344e032d8130bc26348c8e5 [0,1,0,0,0,1|2,0,0]=4 2773 B13R0.522 CCC[C@@H](CC(=O)OCC)OCOC c412292e57f64c89113a3ab3ca57ad37 [0,1,0,0,0,1|2,0,0]=4 2774 B13R0.522 CCC[C@@H](CC(=O)OCC)OCSC 3c1087992c6a1fdcad00a963599171af [0,1,0,0,0,1|2,0,0]=4 2775 B13R0.522 CCOC(=O)CN(CCO)CCCO 4da992dc3066ea17e7adbd8dc623bd0c [0,1,0,0,0,1|2,0,0]=4 2776 B13R0.1051 C#CCCCN(CC)CC(=O)OCC 1c16671e56219469aab8f556cd7af2fc [0,1,0,0,0,1|1,0,1]=4 2777 B13R0.1051 C#CCCOC(CC)CC(=O)OCC 90376d32af99804980c09a8c000f4439 [0,1,0,0,0,1|0,0,2]=4 2778 B13R0.1051 C/C=C/COC(CC)CC(=O)OCC 0229a674331219be24a5cd698a8d082f [0,1,0,0,0,1|0,0,2]=4 2779 B13R0.1051 C/C=C\COC(CC)CC(=O)OCC ec031908e74a5faf64f4fe8f859f462e [0,1,0,0,0,1|0,0,2]=4 2780 B13R0.1051 C=CCCCN(CC)CC(=O)OCC 2fdab1f93f16f672c9254c4a9c037bc7 [0,1,0,0,0,1|1,0,1]=4 2781 B13R0.1051 C=CCCOC(CC)CC(=O)OCC 79e4417e6ed9d2413b497c8799ede5d5 [0,1,0,0,0,1|0,0,2]=4 2782 B13R0.1051 CC/C=C/CN(CC)CC(=O)OCC 02592c38972a1e4001796a6b279dd0ca [0,1,0,0,0,1|1,0,1]=4 2783 B13R0.1051 CCCC(=O)CN(CC)CCCCO b0dbf7b74ed5c2a50692528805b1ca80 [0,1,0,0,0,1|2,0,0]=4 2784 B13R0.1051 CCCC(=O)CN(CC)CCCOC dd273e06475a622baebe2c86fb284900 [0,1,0,0,0,1|2,0,0]=4 2785 B13R0.1051 CCCC(=O)CN(CC)CCOCC ac8a0c2d898306599424a74e341ab74f [0,1,0,0,0,1|2,0,0]=4 2786 B13R0.1051 CCCCCN(CC)CC(=O)NCC eccfeffd386889971b48dbd31b8a7af5 [0,1,0,0,0,1|2,0,0]=4 2787 B13R0.1051 CCCCCN(CC)CC(=O)OCC fa18b670902c994fadb67c1020b81449 [0,1,0,0,0,1|1,0,0]=3 2788 B13R0.1051 CCCCNC(C=O)CC(=O)OCC 2ae472bb06296e399ac938d47f410791 [0,1,0,0,0,1|1,0,1]=4 2789 B13R0.1051 CCCCOC(C=O)CC(=O)OCC 85180e6b3968c96588e6913f6f95a27a [0,1,0,0,0,1|1,0,1]=4 2790 B13R0.1051 CCCCOC(CC)CC(=O)OCC 05dc97b7bd047cb529cae9cedeedd8e7 [0,1,0,0,0,1|0,0,0]=2 2791 B13R0.1051 CCNC(=O)CN(CC)CCCCF c92581c2145fbb1d9992bb3f4a481007 [0,1,0,0,0,1|2,0,0]=4 2792 B13R0.1051 CCNC(=O)CN(CC)CCCCO 4456251aeca00df563c324413976ab1b [0,1,0,0,0,1|2,0,0]=4 2793 B13R0.1051 CCNC(=O)CN(CC)CCCOC db413763e41c8a00044f2a6e63e73144 [0,1,0,0,0,1|2,0,0]=4 2794 B13R0.1051 CCNC(=O)CN(CC)CCCSC b9586e9a4a47be63efb29656e616cafc [0,1,0,0,0,1|2,0,0]=4 2795 B13R0.1051 CCNC(=O)CN(CC)CCOCC 0ea995ad18b14d616a01c047646e4353 [0,1,0,0,0,1|2,0,0]=4 2796 B13R0.1051 CCNC(=O)CN(CC)CCSCC 99dd743c1de470a8988dddad2f8fd939 [0,1,0,0,0,1|2,0,0]=4 2797 B13R0.1051 CCOC(=O)CC(CC)OCCC#N 70cb544287263e6453e720f72d9f56ae [0,1,0,0,0,1|1,0,1]=4 2798 B13R0.1051 CCOC(=O)CC(CC)OCCC=O 236463fde63033ce9d76c3ce6c6a0049 [0,1,0,0,0,1|1,0,1]=4 2799 B13R0.1051 CCOC(=O)CC(CC)OCCCF 0a7be5981d7f29cab5cf3dfd6ec24f66 [0,1,0,0,0,1|1,0,0]=3 2800 B13R0.1051 CCOC(=O)CC(CC)OCCCS 8030f4e492888a8114936d06624f4cad [0,1,0,0,0,1|1,0,0]=3 2801 B13R0.1051 CCOC(=O)CC(CC)OCCOC 5ab8967efdf371268232cee5005ff7b3 [0,1,0,0,0,1|1,0,0]=3 2802 B13R0.1051 CCOC(=O)CC(CC)OCCSC 03467ed89659cbe82cdeed2722b23e39 [0,1,0,0,0,1|1,0,0]=3 2803 B13R0.1051 CCOC(=O)CN(CC)CCCC#N 1940ab71705f3c248700062784dc5453 [0,1,0,0,0,1|1,0,1]=4 2804 B13R0.1051 CCOC(=O)CN(CC)CCCC=O bf3aa6bc3751d4304fbb9d7fdf09f80a [0,1,0,0,0,1|1,0,1]=4 2805 B13R0.1051 CCOC(=O)CN(CC)CCCCF 2ec0c048bb6ac0e4eeea115301f05b61 [0,1,0,0,0,1|1,0,0]=3 2806 B13R0.1051 CCOC(=O)CN(CC)CCCCO 03d219de0da291e1b70db1227098a2ef [0,1,0,0,0,1|1,0,0]=3 2807 B13R0.1051 CCOC(=O)CN(CC)CCCOC 75c99bbcdb0c8d1afa21f1b94669bc70 [0,1,0,0,0,1|1,0,0]=3 2808 B13R0.1051 CCOC(=O)CN(CC)CCCSC ed995d709b471cdf7272ff3dbf352c73 [0,1,0,0,0,1|1,0,0]=3 2809 B13R0.1051 CCOC(=O)CN(CC)CCSCC 98f25e1887c6dc725eaa12a198c9fc23 [0,1,0,0,0,1|1,0,0]=3 2810 B13R0.1051 CCOCCN(CC)CC(=O)OCC bd06f2fa10f1f56f59507d47d0d592d4 [0,1,0,0,0,1|1,0,0]=3 2811 B13R0.1051 CCOCOC(CC)CC(=O)OCC a19ed71591de4ba1f115d8ca858eb2d5 [0,1,0,0,0,1|1,0,0]=3 2812 B13R0.1186 CCC(CC(=O)OC(C)C)OCCF 2b5e3fbf07316c82029dd85b2a3f1657 [0,1,0,0,0,1|2,0,0]=4 2813 B13R0.1186 CCC(CC(=O)OC(C)C)OCCS 7d14649d91f3b6b8e47020ba280cc900 [0,1,0,0,0,1|2,0,0]=4 2814 B13R0.1186 CCC(CC(=O)OC(C)C)OCOC 1e263351d0342214aeaff2310a499e10 [0,1,0,0,0,1|2,0,0]=4 2815 B13R0.1186 CCC(CC(=O)OC(C)C)OCSC aad234244f2eefc812d94dd21577a9d9 [0,1,0,0,0,1|2,0,0]=4 2816 B13R0.1186 CCCCC(CO)NC(=O)CC(C)C 4b5f7c8f48fd8405102e621c7861e6c7 [0,1,0,0,0,1|2,0,0]=4 2817 B13R0.1186 CCCCC(CO)NC(=O)CC(C)O 8f438fb3cd5b7f7a58628bf961199823 [0,1,0,0,0,1|2,0,0]=4 2818 B13R0.1186 CCCCC(CO)NC(=O)C[C@@H](C)O e7a291d118881120ff457a188f370482 [0,1,0,0,0,1|2,0,0]=4 2819 B13R0.1186 CCCCC(CO)NC(=O)C[C@H](C)O 162774a39bcbf15b1378e9627861d84a [0,1,0,0,0,1|2,0,0]=4 2820 B13R0.1186 CCCCN(CC)CC(=O)CC(C)C 41116ce5309ee745090210803ec8cbe0 [0,1,0,0,0,1|2,0,0]=4 2821 B13R0.1186 CCCCN(CC)CC(=O)NC(C)C af8825e932cce24a5368baeff5e9755a [0,1,0,0,0,1|2,0,0]=4 2822 B13R0.1186 CCCCN(CC)CC(=O)OC(C)C 156374932f4a2e4e945a207d2dc96c0b [0,1,0,0,0,1|1,0,0]=3 2823 B13R0.1186 CCCC[C@@H](CO)NC(=O)CC(C)C a2bfe17a365bc66ffeef384a0d44451c [0,1,0,0,0,1|2,0,0]=4 2824 B13R0.1186 CCCC[C@@H](CO)NC(=O)CC(C)O 1975f5f5c1885efbb1aa59bf36344444 [0,1,0,0,0,1|2,0,0]=4 2825 B13R0.1186 CCCC[C@@H](CO)NC(=O)C[C@@H](C)O 818d1ab64ef5a169cd7f84a2609eab91 [0,1,0,0,0,1|2,0,0]=4 2826 B13R0.1186 CCCC[C@@H](CO)NC(=O)C[C@H](C)O bc3fb92c5b9b900020e8ff039b5a4c44 [0,1,0,0,0,1|2,0,0]=4 2827 B13R0.1186 CCCC[C@H](CO)NC(=O)CC(C)C ba6026e57f4f1780828ad10eeaf20873 [0,1,0,0,0,1|2,0,0]=4 2828 B13R0.1186 CCCC[C@H](CO)NC(=O)CC(C)O dc41e92527e3cdafcae0a5fa688da41d [0,1,0,0,0,1|2,0,0]=4 2829 B13R0.1186 CCCC[C@H](CO)NC(=O)C[C@@H](C)O 86e222554325ded96e7c20cb142b405e [0,1,0,0,0,1|2,0,0]=4 2830 B13R0.1186 CCCC[C@H](CO)NC(=O)C[C@H](C)O 7393f6b13a625d9c6a0d2e9c3f522fe6 [0,1,0,0,0,1|2,0,0]=4 2831 B13R0.1186 CCCOC(CC)CC(=O)OC(C)C 20fc2c814886d2f5806371a53ba5c52c [0,1,0,0,0,1|1,0,0]=3 2832 B13R0.1186 CCN(CCCO)CC(=O)OC(C)C 03e3fc22082f46ff6edc09fe405ec237 [0,1,0,0,0,1|2,0,0]=4 2833 B13R0.1186 CCN(CCOC)CC(=O)OC(C)C aa3f9ad9c8accae6f87bbb40b0b4f1a2 [0,1,0,0,0,1|2,0,0]=4 2834 B13R0.1189 CCCCN(CC)C(=O)C(=O)CCC f54330f6af23d9122be04eff011113df [0,1,0,0,0,1|2,0,0]=4 2835 B13R0.1189 CCCCN(CC)C(=O)C(=O)NCC ab72215cf82f5f791cd08abe3313ce00 [0,1,0,0,0,1|2,0,0]=4 2836 B13R0.1189 CCCCN(CC)C(=O)C(=O)OCC 60ddbf8ad3815d48ce22ed89ae1f2ad9 [0,1,0,0,0,1|1,0,0]=3 2837 B13R0.1189 CCCCN(CC)C(C)C(=O)NCC e0276662ad92f44780499c8ea23a7d0e [0,1,0,0,0,1|2,0,0]=4 2838 B13R0.1189 CCCCN(CC)C(C)C(=O)OCC d1d9bd6b3ef6ea4e91e1a7c4daf72d45 [0,1,0,0,0,1|1,0,0]=3 2839 B13R0.1189 CCCCN(CC)C(F)C(=O)OCC 9daad20b1070914d5788db9f4e1bb156 [0,1,0,0,0,1|1,0,0]=3 2840 B13R0.1189 CCCCN(CC)[C@@H](C)C(=O)OCC d5bf0cb75ae2d539bfe375cf90577cb3 [0,1,0,0,0,1|1,0,0]=3 2841 B13R0.1189 CCCCN(CC)[C@H](C)C(=O)OCC 38b460e2f92c96fa602e2be59cfbe7de [0,1,0,0,0,1|1,0,0]=3 2842 B13R0.1189 CCCNC(CC)C(=O)C(=O)OCC 9bd70da93be89abc520dc1608fccd699 [0,1,0,0,0,1|1,0,0]=3 2843 B13R0.1189 CCCOC(CC)C(=O)C(=O)OCC 3b0cca7f05c6570cc345522e631e2b9b [0,1,0,0,0,1|1,0,0]=3 2844 B13R0.1189 CCOC(=O)C(=O)C(CC)NCCBr f83e6425055dee3d998051973cd616c8 [0,1,0,0,0,1|2,0,0]=4 2845 B13R0.1189 CCOC(=O)C(=O)C(CC)NCCF 192e555fc4d1145a641efa920a34c9f6 [0,1,0,0,0,1|2,0,0]=4 2846 B13R0.1189 CCOC(=O)C(=O)C(CC)NCCI 057643cda7b4dc208ca2df45808208a4 [0,1,0,0,0,1|2,0,0]=4 2847 B13R0.1189 CCOC(=O)C(=O)C(CC)NCCO 0e7f4286137dab18a45865c602f291a1 [0,1,0,0,0,1|2,0,0]=4 2848 B13R0.1189 CCOC(=O)C(=O)C(CC)NCCS dc04591d164bd4744c5a8fefa3cb67ca [0,1,0,0,0,1|2,0,0]=4 2849 B13R0.1189 CCOC(=O)C(=O)C(CC)OCCS abd6ea55c352977062c0523c1e194e09 [0,1,0,0,0,1|2,0,0]=4 2850 B13R0.1189 CCOC(=O)C(=O)C(CC)OCOC 2939b6ba5e390c4267ef9cfc9aed6a4a [0,1,0,0,0,1|2,0,0]=4 2851 B13R0.1189 CCOC(=O)C(=O)N(CC)CCCO 090d8ca1960eebf15157674b159cda14 [0,1,0,0,0,1|2,0,0]=4 2852 B13R0.1189 CCOC(=O)C(=O)N(CC)CCOC 6e89ddc82ed540ca6ac9611e00cba3b2 [0,1,0,0,0,1|2,0,0]=4 2853 B13R0.1189 CCOC(=O)C(C)N(CC)CCCO 4e3666030f1be29cded630e5ebeec71a [0,1,0,0,0,1|2,0,0]=4 2854 B13R0.1189 CCOC(=O)C(C)N(CC)CCOC 453f7b5ca93b997dc93c9e7004639ea8 [0,1,0,0,0,1|2,0,0]=4 2855 B13R0.1189 CCOC(=O)C(F)N(CC)CCCO 89caee7fff16f02fc6d47b648d4ae3c3 [0,1,0,0,0,1|2,0,0]=4 2856 B13R0.1189 CCOC(=O)[C@@H](C)N(CC)CCCO 4af94e701f52f3770b469375871e6bde [0,1,0,0,0,1|2,0,0]=4 2857 B13R0.1189 CCOC(=O)[C@@H](C)N(CC)CCOC 305a5d8f74013ab783804019b386c854 [0,1,0,0,0,1|2,0,0]=4 2858 B13R0.1189 CCOC(=O)[C@H](C)N(CC)CCCO d9947ce65e8bd4e5ffb5d46f500c009e [0,1,0,0,0,1|2,0,0]=4 2859 B13R0.1189 CCOC(=O)[C@H](C)N(CC)CCOC b7b2b031c2ce3b523510511499047118 [0,1,0,0,0,1|2,0,0]=4 2860 B13R0.1197 C=C(CC)C(=O)NC(CO)CCCC a5bfba840ab9ba542cbbfee81e715124 [0,1,0,0,0,1|2,0,0]=4 2861 B13R0.1197 C=C(CC)C(=O)N[C@@H](CO)CCCC 1bc0948a3a5865b60d61589ed067fd56 [0,1,0,0,0,1|2,0,0]=4 2862 B13R0.1197 C=C(CC)C(=O)N[C@H](CO)CCCC 8720a3f4f07e2bad8bdf886c8e8fe4f3 [0,1,0,0,0,1|2,0,0]=4 2863 B13R0.1197 CCCCC(CC)CC(=O)N(C)CC ea13c855fb8ba44bd0cb974226dc5fb9 [0,1,0,0,0,1|1,0,0]=3 2864 B13R0.1197 CCCCC(CO)NC(=O)C(=O)CC 2568e6643c5a7f08924f31e68fee4881 [0,1,0,0,0,1|2,0,0]=4 2865 B13R0.1197 CCCCC(CO)NC(=O)C(O)CC ce0c63eb3a2086ed7678401be6c407da [0,1,0,0,0,1|2,0,0]=4 2866 B13R0.1197 CCCCC(CO)NC(=O)N(C)CC e80a40fe0fa7d7dcf7c34a542fb43263 [0,1,0,0,0,1|2,0,0]=4 2867 B13R0.1197 CCCCC(CO)NC(=O)[C@@H](O)CC cf9779a868c121eaf5d84531b85acae4 [0,1,0,0,0,1|2,0,0]=4 2868 B13R0.1197 CCCCC(CO)NC(=O)[C@@H](S)CC ecdb42c862688d41aba7ff8e62b1b988 [0,1,0,0,0,1|2,0,0]=4 2869 B13R0.1197 CCCCC(CO)NC(=O)[C@H](O)CC ab9ad12f2a12108d7249f2badb5ea406 [0,1,0,0,0,1|2,0,0]=4 2870 B13R0.1197 CCCCN(CC)CC(=O)C(C)CC c5204ffc2ca0febe07eb981c59b7f3bf [0,1,0,0,0,1|2,0,0]=4 2871 B13R0.1197 CCCCN(CC)CC(=O)N(C)CC 316718c52d95aaa3a65917072e560db7 [0,1,0,0,0,1|2,0,0]=4 2872 B13R0.1197 CCCC[C@@H](CO)NC(=O)C(=O)CC d1c8ebec10b2f15af21314a962e0f9bd [0,1,0,0,0,1|2,0,0]=4 2873 B13R0.1197 CCCC[C@@H](CO)NC(=O)C(O)CC f7981d96d0f36b8a5c98fe78e8e5722d [0,1,0,0,0,1|2,0,0]=4 2874 B13R0.1197 CCCC[C@@H](CO)NC(=O)N(C)CC 79136e9117c6a01e3cd0aa7ebb60295b [0,1,0,0,0,1|2,0,0]=4 2875 B13R0.1197 CCCC[C@@H](CO)NC(=O)[C@@H](O)CC b605a804814a10bfe18e7f3c5ed0bb37 [0,1,0,0,0,1|2,0,0]=4 2876 B13R0.1197 CCCC[C@@H](CO)NC(=O)[C@@H](S)CC b1dc4cf3ec203515722f685c26d7cdf5 [0,1,0,0,0,1|2,0,0]=4 2877 B13R0.1197 CCCC[C@@H](CO)NC(=O)[C@H](O)CC e9c702058a4b627966e9c4c6dfb7bad2 [0,1,0,0,0,1|2,0,0]=4 2878 B13R0.1197 CCCC[C@H](CO)NC(=O)C(=O)CC 8d72e51a957e278bb03c8b980f5f24e5 [0,1,0,0,0,1|2,0,0]=4 2879 B13R0.1197 CCCC[C@H](CO)NC(=O)C(O)CC 6aa765a6bcc309d6ca1c764c2094ef16 [0,1,0,0,0,1|2,0,0]=4 2880 B13R0.1197 CCCC[C@H](CO)NC(=O)N(C)CC ab79edc4d954a267f0bdd8f1949027b8 [0,1,0,0,0,1|2,0,0]=4 2881 B13R0.1197 CCCC[C@H](CO)NC(=O)[C@@H](O)CC 59aa0b6d3921a0987b38847c754ec37e [0,1,0,0,0,1|2,0,0]=4 2882 B13R0.1197 CCCC[C@H](CO)NC(=O)[C@@H](S)CC fc589160881727083848b814b9b0ae1a [0,1,0,0,0,1|2,0,0]=4 2883 B13R0.1197 CCCC[C@H](CO)NC(=O)[C@H](O)CC 0897acc506e5c3225869e52df4ed3638 [0,1,0,0,0,1|2,0,0]=4 2884 B13R0.1306 CCCCN(CC(=O)CCC)C(C)C 30a8cb9ca2d69696605a33c6c53f64d1 [0,1,0,0,0,1|2,0,0]=4 2885 B13R0.1306 CCCCN(CC(=O)NCC)C(C)C bbbfdad6df7725c460022726989b41d3 [0,1,0,0,0,1|2,0,0]=4 2886 B13R0.1306 CCCCN(CC(=O)OCC)C(=O)C fe712109e59c7256cced0e1ffb610095 [0,1,0,0,0,1|1,0,1]=4 2887 B13R0.1306 CCCCN(CC(=O)OCC)C(C)C 709494a769c94b359e72d3e76a06119f [0,1,0,0,0,1|1,0,0]=3 2888 B13R0.1306 CCCNC(CC(=O)OCC)C(=O)C d8a36720754b4880ade1bc267785b8d1 [0,1,0,0,0,1|1,0,1]=4 2889 B13R0.1306 CCCOC(CC(=O)OCC)C(=O)C 25bb706611d7f4a61722c26a464fb28b [0,1,0,0,0,1|1,0,1]=4 2890 B13R0.1306 CCCOC(CC(=O)OCC)C(C)C 63bcd6c0c34dc2597de043870a76d4c8 [0,1,0,0,0,1|1,0,0]=3 2891 B13R0.1306 CCOC(=O)CC(OCCF)C(C)C 337f446e325286b154bf5de70b947d6c [0,1,0,0,0,1|2,0,0]=4 2892 B13R0.1306 CCOC(=O)CC(OCCS)C(C)C aa976c42465e9823c51ec34b4a08f479 [0,1,0,0,0,1|2,0,0]=4 2893 B13R0.1306 CCOC(=O)CC(OCOC)C(C)C 223476b167c6af93fc66e32ee83ad361 [0,1,0,0,0,1|2,0,0]=4 2894 B13R0.1306 CCOC(=O)CC(OCSC)C(C)C f63e9f8f5094e89b76ff689c5e5cf7bc [0,1,0,0,0,1|2,0,0]=4 2895 B13R0.1306 CCOC(=O)CN(CCCF)C(C)C 32bda915b8736e909f346e3159c5165b [0,1,0,0,0,1|2,0,0]=4 2896 B13R0.1306 CCOC(=O)CN(CCCO)C(C)C 9efed94a0fb4df05d25314539936cc14 [0,1,0,0,0,1|2,0,0]=4 2897 B13R0.1306 CCOC(=O)CN(CCCS)C(C)C 9d79145cd5beb927f9688d5e441a80d0 [0,1,0,0,0,1|2,0,0]=4 2898 B13R0.1306 CCOC(=O)CN(CCOC)C(C)C e869a5e21e24903792a7b04c0224c758 [0,1,0,0,0,1|2,0,0]=4 2899 B13R0.1306 CCOC(=O)CN(CCSC)C(C)C 9e0760b482d0cf3d05823360d0e657eb [0,1,0,0,0,1|2,0,0]=4 2900 B13R0.7 CCCC(=O)C(CC)N(CC)CCC eff631778ba267671d834df044af6db5 [0,2,0,0,0,0|2,0,0]=4 2901 B13R0.7 CCCN(CC)C(CC)C(=O)OCC e9c277b24856e0f0936007e7924a5571 [0,2,0,0,0,0|1,0,0]=3 2902 B13R0.7 CCCN(CC)C(CO)C(=O)OCC 69a2415a4cdce9a8fa57cdfc9561030b [0,2,0,0,0,0|2,0,0]=4 2903 B13R0.7 CCCN(CC)C(SC)C(=O)OCC 87d5bc0fa5f869c94e4ecdee2dc5ba13 [0,2,0,0,0,0|2,0,0]=4 2904 B13R0.7 CCOC(=O)C(CC)N(CC)CCCl 265dd036346e167652eb84bb45f4750a [0,2,0,0,0,0|2,0,0]=4 2905 B13R0.7 CCOC(=O)C(CC)N(CC)CCO 316666f2a26a1b1de2fbed7a3a4d6b42 [0,2,0,0,0,0|2,0,0]=4 2906 B13R0.7 CCOC(=O)C(CC)N(CO)CCO 24653c0ddf8a782ff8c46399e5098d22 [0,2,0,0,0,0|2,0,0]=4 2907 B13R0.8 CCCC(=O)C(CC)N(C)C(C)CC e11e4672676908b54c2e517a1eedd695 [0,2,0,0,0,0|2,0,0]=4 2908 B13R0.8 CCOC(=O)C(CC)N(C)C(=O)CC 86ee5699cecc62a7ba9a55ae422a68ea [0,2,0,0,0,0|1,0,1]=4 2909 B13R0.8 CCOC(=O)C(CC)N(C)C(C)CC ee5bd9d8358d6be4fef0bf6f2a431d69 [0,2,0,0,0,0|1,0,0]=3 2910 B13R0.8 CCOC(=O)C(CC)N(C)C(C)CO 52485441bd71f8810e5d4479e41ea3a2 [0,2,0,0,0,0|2,0,0]=4 2911 B13R0.8 CCOC(=O)C(CC)N(C)[C@@H](C)CO b8da203bf093b8eca33d86b4110e562e [0,2,0,0,0,0|2,0,0]=4 2912 B13R0.8 CCOC(=O)C(CC)N(C)[C@H](C)CO e88f7e33e986dee087544de695b654a0 [0,2,0,0,0,0|2,0,0]=4 2913 B13R0.8 CCOC(=O)C(CO)N(C)C(C)CC 0b5dd86aa5d068df6ae3413962ec1989 [0,2,0,0,0,0|2,0,0]=4 2914 B13R0.8 CCOC(=O)C(SC)N(C)C(C)CC bc94c62e48469d886528efdb9624b430 [0,2,0,0,0,0|2,0,0]=4 2915 B13R0.387 C#CCCN(C)C(CC)C(=O)OCC 9b35e3c02ad05bae037948422e4e7d44 [0,2,0,0,0,0|0,0,2]=4 2916 B13R0.387 C/C=C/CN(C)C(CC)C(=O)OCC 19c004aed2915d68468c53d2ad22c9a3 [0,2,0,0,0,0|0,0,2]=4 2917 B13R0.387 C/C=C\CN(C)C(CC)C(=O)OCC 8a1778a196c75468aeed825082288b79 [0,2,0,0,0,0|0,0,2]=4 2918 B13R0.387 C=CCCN(C)C(CC)C(=O)OCC 6703e9d349725dd068c4f51d0d14149a [0,2,0,0,0,0|0,0,2]=4 2919 B13R0.387 CCCC(=O)C(CC)N(C)CCCO 8963333ed31a8c4b180a97db57b9fd22 [0,2,0,0,0,0|2,0,0]=4 2920 B13R0.387 CCCC(=O)C(CC)N(C)CCOC 3836e2d40e24b523266444d547548a96 [0,2,0,0,0,0|2,0,0]=4 2921 B13R0.387 CCCC(=O)C(CC)N(C)CCSC c98b70ee392f70769ccabdece07eeb65 [0,2,0,0,0,0|2,0,0]=4 2922 B13R0.387 CCCCN(C)C(C=O)C(=O)OCC d97104b22fbcd87005530d17d9e7ac10 [0,2,0,0,0,0|1,0,1]=4 2923 B13R0.387 CCCCN(C)C(CC)C(=O)CCC c4b3b915dc7738d7c6782666b75b87f5 [0,2,0,0,0,0|1,0,0]=3 2924 B13R0.387 CCCCN(C)C(CC)C(=O)OCC 35548c00884aff6c935c28afdb4f083a [0,2,0,0,0,0|0,0,0]=2 2925 B13R0.387 CCCCN(C)C(CO)C(=O)OCC ef0c4507a280b94c19afa494a348b918 [0,2,0,0,0,0|1,0,0]=3 2926 B13R0.387 CCCNC(=O)C(CC)N(C)CCC e169bf56046eb8d677b0933df7d0c226 [0,2,0,0,0,0|2,0,0]=4 2927 B13R0.387 CCOC(=O)C(CC)N(C)CCC#N 4cc8047cb546559d9431077d6af3d17c [0,2,0,0,0,0|1,0,1]=4 2928 B13R0.387 CCOC(=O)C(CC)N(C)CCC=O 9956e7e9dfbd7909abccc1e74e7c394c [0,2,0,0,0,0|1,0,1]=4 2929 B13R0.387 CCOC(=O)C(CC)N(C)CCCF 393b4c3bc12f7b58e0ed109df96bd165 [0,2,0,0,0,0|1,0,0]=3 2930 B13R0.387 CCOC(=O)C(CC)N(C)CCCO eb91b86b4fd99d9beaab1c1e1dc8feff [0,2,0,0,0,0|1,0,0]=3 2931 B13R0.387 CCOC(=O)C(CC)N(C)CCCS beb623e0c1e9b14d67b83e691bd890fb [0,2,0,0,0,0|1,0,0]=3 2932 B13R0.387 CCOC(=O)C(CC)N(C)CCOC 35d6191bf6ccafb7f38435d88396e049 [0,2,0,0,0,0|1,0,0]=3 2933 B13R0.387 CCOC(=O)C(CC)N(C)CCON e7ce678497015d4dcdd7720e1c29e060 [0,2,0,0,0,0|2,0,0]=4 2934 B13R0.387 CCOC(=O)C(CC)N(C)CCSC 647e17719682935454514902cd48952e [0,2,0,0,0,0|1,0,0]=3 2935 B13R0.387 CCOC(=O)C(CO)N(C)CCCO 557b077a5d63711815e4282fd0276e26 [0,2,0,0,0,0|2,0,0]=4 2936 B13R0.387 CCOC(=O)C(CO)N(C)CCSC 6d922c4abb4e0609a4b5191c23aa5f3f [0,2,0,0,0,0|2,0,0]=4 2937 B13R0.387 CCOC(=O)C(SC)N(C)CCSC 9bb2fa6b2c61f08f361007dc34c76234 [0,2,0,0,0,0|2,0,0]=4 2938 B13R0.387 CCOCC(=O)N(CC)C(C)CCO 89752f0079087f6066b924132e18a901 [0,2,0,0,0,0|2,0,0]=4 2939 B13R0.387 CCOCN(C)C(CC)C(=O)OCC d7a58ae83e3197c9bf3d4a889493561b [0,2,0,0,0,0|1,0,0]=3 2940 B13R0.750 C=C(C)CN(C)C(CC)C(=O)OCC 8e9c92ee1c03d407f3f771320d4c4a2f [0,2,0,0,0,0|1,0,1]=4 2941 B13R0.750 CCCC(=O)C(CC)N(C)CC(C)C 47329bf1dba08992a7a6f1d93fc4ed63 [0,2,0,0,0,0|2,0,0]=4 2942 B13R0.750 CCCC(=O)C(CC)N(C)CC(C)O 0f7b0d3a4aa7ba7d5741a847e358a522 [0,2,0,0,0,0|2,0,0]=4 2943 B13R0.750 CCCC(=O)C(CC)N(C)C[C@H](C)O 1e785b64e79b3517e6a8def397641e41 [0,2,0,0,0,0|2,0,0]=4 2944 B13R0.750 CCCN(C)C(CC)C(=O)NC(C)C fc9642c78736e0485c53f4ad8b57f586 [0,2,0,0,0,0|2,0,0]=4 2945 B13R0.750 CCOC(=O)C(CC)N(C)CC(C)C 6ef2a94126fe123d6999afd5fb977ccb [0,2,0,0,0,0|1,0,0]=3 2946 B13R0.750 CCOC(=O)C(CC)N(C)CC(C)O 29840fc05e932ba3a65d35fbf73227f0 [0,2,0,0,0,0|1,0,0]=3 2947 B13R0.750 CCOC(=O)C(CC)N(C)CC(F)F 894ff89adbe4f528f4528bcc632080cb [0,2,0,0,0,0|2,0,0]=4 2948 B13R0.750 CCOC(=O)C(CC)N(C)CN(C)C b9e0da1b0a65e40843cfa7a7138aa9ea [0,2,0,0,0,0|2,0,0]=4 2949 B13R0.750 CCOC(=O)C(CC)N(C)C[C@@H](C)O ecccb9a7d5289a5be59067cba6f6158c [0,2,0,0,0,0|1,0,0]=3 2950 B13R0.750 CCOC(=O)C(CC)N(C)C[C@H](C)O 64f25267ecb953fd95ea34df270195b2 [0,2,0,0,0,0|1,0,0]=3 2951 B13R0.750 CCOC(=O)C(CO)N(C)CC(C)C 2a75206009924dc7cc01214c7151f97b [0,2,0,0,0,0|2,0,0]=4 2952 B13R0.750 CCOC(=O)C(CO)N(C)CC(C)O fe427b30e7e293c847cbc45c30cb4c88 [0,2,0,0,0,0|2,0,0]=4 2953 B13R0.750 CCOC(=O)C(CO)N(C)C[C@H](C)O c14d00765d34b55ffc92f032ee1df0c5 [0,2,0,0,0,0|2,0,0]=4 2954 B13R0.750 CCOC(=O)C(SC)N(C)CC(C)C 19bcaec42afaced0c6ed3ef7b954af09 [0,2,0,0,0,0|2,0,0]=4 2955 B13R0.750 CCOC(=O)C(SC)N(C)CC(C)O 12affbfc9cfb9d316ffa5912e2f80074 [0,2,0,0,0,0|2,0,0]=4 2956 B13R0.750 CCOC(=O)C(SC)N(C)C[C@H](C)O 7bede82f66b5b10afbfaedb073283938 [0,2,0,0,0,0|2,0,0]=4 2957 B13R0.753 CCCN(C)C(C(=O)OCC)C(C)C 715479f85213e4c83acc598c70203771 [0,2,0,0,0,0|1,0,0]=3 2958 B13R0.753 CCCN(C)[C@@H](C(=O)OCC)C(C)C a1bb20f83ca2ce76c8a6907444b76f11 [0,2,0,0,0,0|1,0,0]=3 2959 B13R0.753 CCOC(=O)C(C(C)C)N(C)CCF ba007518d58a80ffd5064a55a38ca64f [0,2,0,0,0,0|2,0,0]=4 2960 B13R0.753 CCOC(=O)C(C(C)C)N(C)CCO cab4dfab59c9eff022078b98a2204ee1 [0,2,0,0,0,0|2,0,0]=4 2961 B13R0.753 CCOC(=O)[C@@H](C(C)C)N(C)CCF 4bada40ae8885ac549b24f4d59415211 [0,2,0,0,0,0|2,0,0]=4 2962 B13R0.753 CCOC(=O)[C@@H](C(C)C)N(C)CCO 7c8c840a0d83c9dc786fa110b3d7653c [0,2,0,0,0,0|2,0,0]=4 2963 B13R0.1176 CCCC(C(=O)OCC)N(C)CCC f1cee8f6ab44f523544e3a492f2fef98 [0,2,0,0,0,0|1,0,0]=3 2964 B13R0.1176 CCCC(C(=O)OCC)N(C)CCF ff69ab911005bac5b3f0790447eac958 [0,2,0,0,0,0|2,0,0]=4 2965 B13R0.1176 CCNC(C(=O)OCC)C(=O)OCC 88ea4f7ac0286e3b3fef5dfb2974e780 [0,2,0,0,0,0|1,0,1]=4 2966 B13R0.1176 CCOC(=O)C(OCC)C(=O)OCC 837cda70888a49058a681c5ccb4736f7 [0,2,0,0,0,0|1,0,1]=4 2967 B13R0.15 C=C(CC)C(=O)N(CCC)CCCC 3cafd8d94e7f6e316c1d06fd45dd50f9 [0,2,0,0,0,0|2,0,0]=4 2968 B13R0.15 C=C(CC)C(=O)N(CCO)CCCC 83e97f7f2380d1ca5977c3e81f09fd01 [0,2,0,0,0,0|2,0,0]=4 2969 B13R0.15 C=C(CC)C(=O)N(CCS)CCCC 5389427d920606ad9392d6b1841ed15b [0,2,0,0,0,0|2,0,0]=4 2970 B13R0.15 CCCCN(CCC)C(=O)C(=O)CC 35fd29ef3dc074ef4f64010a631b3434 [0,2,0,0,0,0|2,0,0]=4 2971 B13R0.15 CCCCN(CCC)C(=O)C(O)CC 06cf827f5c4e8e8257b89bbef43df2e9 [0,2,0,0,0,0|2,0,0]=4 2972 B13R0.15 CCCCN(CCC)C(=O)[C@@H](O)CC 90ba00026dc6e2ddec030ca53f396877 [0,2,0,0,0,0|2,0,0]=4 2973 B13R0.15 CCCCN(CCC)C(=O)[C@@H](S)CC 4ba385b93279be5209dee70eb45b4d6f [0,2,0,0,0,0|2,0,0]=4 2974 B13R0.15 CCCCN(CCC)C(=O)[C@H](O)CC 8b03303f97ca0d70df7c991d7e9c7774 [0,2,0,0,0,0|2,0,0]=4 2975 B13R0.15 CCCCN(CCO)C(=O)C(=O)CC 7bb3e24c2ce7d6e5071beb3081ceebe1 [0,2,0,0,0,0|2,0,0]=4 2976 B13R0.15 CCCCN(CCO)C(=O)C(O)CC aacf93729fc77a4a0c89322a571031fc [0,2,0,0,0,0|2,0,0]=4 2977 B13R0.15 CCCCN(CCO)C(=O)[C@@H](O)CC 8c85e8a65e25eb818919c26ef50f115b [0,2,0,0,0,0|2,0,0]=4 2978 B13R0.15 CCCCN(CCO)C(=O)[C@@H](S)CC 1d8abfeaeb7607379731c33aeab20b23 [0,2,0,0,0,0|2,0,0]=4 2979 B13R0.15 CCCCN(CCO)C(=O)[C@H](O)CC d01c85cc049c32bd9363c5a5f69342dc [0,2,0,0,0,0|2,0,0]=4 2980 B13R0.15 CCCCN(CCS)C(=O)C(=O)CC e900e8f26b2e5f715e9f5ed147c4cd24 [0,2,0,0,0,0|2,0,0]=4 2981 B13R0.15 CCCCN(CCS)C(=O)C(O)CC 331934c541473229b019010ca580eedb [0,2,0,0,0,0|2,0,0]=4 2982 B13R0.15 CCCCN(CCS)C(=O)[C@@H](O)CC 5575bd66f1cb2fa5d1b18ad7132549a7 [0,2,0,0,0,0|2,0,0]=4 2983 B13R0.15 CCCCN(CCS)C(=O)[C@@H](S)CC c489940baf484401a04c82b538f4a12d [0,2,0,0,0,0|2,0,0]=4 2984 B13R0.15 CCCCN(CCS)C(=O)[C@H](O)CC 000200aa6d6e1c2ceba559ab5ee9b04d [0,2,0,0,0,0|2,0,0]=4 2985 B13R0.123 CC/C=C/C(=O)N(CCC)CCCC fed4c65d10361e442180803f6390ed7f [0,2,0,0,0,0|2,0,0]=4 2986 B13R0.123 CC/C=C/C(=O)N(CCO)CCCC b9517882785136de6f0f4a0b92d94481 [0,2,0,0,0,0|2,0,0]=4 2987 B13R0.123 CC/C=C/C(=O)N(CCS)CCCC 161758207f7117ea477c60e82675d3da [0,2,0,0,0,0|2,0,0]=4 2988 B13R0.123 CC/C=C\C(=O)N(CCC)CCCC b55bc63f6f8f52190b48b38200b3be22 [0,2,0,0,0,0|2,0,0]=4 2989 B13R0.123 CC/C=C\C(=O)N(CCO)CCCC c84e7e731401d1895c27ec4e3a1226e7 [0,2,0,0,0,0|2,0,0]=4 2990 B13R0.123 CC/C=C\C(=O)N(CCS)CCCC 233e420c74b928ae6b3d9a7708c53fa0 [0,2,0,0,0,0|2,0,0]=4 2991 B13R0.123 CCC#CC(=O)N(CCC)CCCC 32370d8cd323e833b3503f891710cba4 [0,2,0,0,0,0|2,0,0]=4 2992 B13R0.123 CCC#CC(=O)N(CCO)CCCC 35f4728dce7e08c7aea355517b546325 [0,2,0,0,0,0|2,0,0]=4 2993 B13R0.123 CCC#CC(=O)N(CCS)CCCC a47294df11e459b762a04e0d207cf3a3 [0,2,0,0,0,0|2,0,0]=4 2994 B13R0.123 CCC=CC(=O)N(CCC)CCCC 16a8c809dd36470c4c5b249e98bdaf13 [0,2,0,0,0,0|2,0,0]=4 2995 B13R0.123 CCC=CC(=O)N(CCO)CCCC 3711b71f6239c66054354b8119d5b5f1 [0,2,0,0,0,0|2,0,0]=4 2996 B13R0.123 CCC=CC(=O)N(CCS)CCCC e497fb800970c66ea14ac78944da4c40 [0,2,0,0,0,0|2,0,0]=4 2997 B13R0.123 CCCCC(=O)C(CCCC)OCC bf6088420fa7c2de7a3aebe1bf451a57 [0,2,0,0,0,0|1,0,0]=3 2998 B13R0.123 CCCCC(=O)C(CCCC)OCF cfe94306fc53783e36bc4b1bc14cc9d8 [0,2,0,0,0,0|2,0,0]=4 2999 B13R0.123 CCCCC(=O)N(CCC)CCCC 7a36e335959a5d6452f7378b6311c597 [0,2,0,0,0,0|2,0,0]=4 3000 B13R0.123 CCCCC(=O)N(CCO)CCCC 0b15b3e68a151639c17ddad005c74852 [0,2,0,0,0,0|2,0,0]=4 3001 B13R0.123 CCCCC(=O)N(CCS)CCCC f4d3ef4325c4a1a623e71124ae2ec04b [0,2,0,0,0,0|2,0,0]=4 3002 B13R0.123 CCCCN(CC#N)C(=O)COCC 55e2d90ee596fe45872818bef9f0f600 [0,2,0,0,0,0|1,0,1]=4 3003 B13R0.123 CCCCN(CCC)C(=O)CCCF 79967eaa58abc24ceec3fe311897cf0c [0,2,0,0,0,0|2,0,0]=4 3004 B13R0.123 CCCCN(CCC)C(=O)CCCS a0b280e668b3a8db14f99083f39870ac [0,2,0,0,0,0|2,0,0]=4 3005 B13R0.123 CCCCN(CCC)C(=O)CCOC 8b8a609714c1eb88f36fee37d0dce5d8 [0,2,0,0,0,0|2,0,0]=4 3006 B13R0.123 CCCCN(CCC)C(=O)CCSC 706aeb764dcac2235c42dcee1f080472 [0,2,0,0,0,0|2,0,0]=4 3007 B13R0.123 CCCCN(CCC)C(=O)COCC beef141845a8f18e88a55aa45ba9aa21 [0,2,0,0,0,0|1,0,0]=3 3008 B13R0.123 CCCCN(CCC)C(=O)CSCC 889e877cf3888b574716938e27a629a6 [0,2,0,0,0,0|1,1,0]=4 3009 B13R0.123 CCCCN(CCC)C(=O)NCCC 94d92e26f4ff08fd9474677e6a5ace67 [0,2,0,0,0,0|2,0,0]=4 3010 B13R0.123 CCCCN(CCC)C(=O)NCCF 216b47d5607e628dc206d9280d805dc1 [0,2,0,0,0,0|2,0,0]=4 3011 B13R0.123 CCCCN(CCC)C(=O)NCCN aec4ea602728dc8a2979a06ef6e74830 [0,2,0,0,0,0|2,0,0]=4 3012 B13R0.123 CCCCN(CCC)C(=O)NCCO 98dd3ad6be93d5cef66e8afea3b659a7 [0,2,0,0,0,0|2,0,0]=4 3013 B13R0.123 CCCCN(CCC)C(=O)NCCS c8c139db86d661f7da92597f194e4307 [0,2,0,0,0,0|2,0,0]=4 3014 B13R0.123 CCCCN(CCO)C(=O)CCCF 8c55b035e59b191fa2d563f6d4458dc5 [0,2,0,0,0,0|2,0,0]=4 3015 B13R0.123 CCCCN(CCO)C(=O)CCCS 9a1ba243ec3be350f7a0c563fb977f57 [0,2,0,0,0,0|2,0,0]=4 3016 B13R0.123 CCCCN(CCO)C(=O)CCOC 6fc44ce9a34bb706cf0c1319edd70aa3 [0,2,0,0,0,0|2,0,0]=4 3017 B13R0.123 CCCCN(CCO)C(=O)CCSC d2e3c4f9e7c0a0c6ba658a32064caa91 [0,2,0,0,0,0|2,0,0]=4 3018 B13R0.123 CCCCN(CCO)C(=O)COCC e2fe5f431fe272bb1862203ac5b6979e [0,2,0,0,0,0|1,0,0]=3 3019 B13R0.123 CCCCN(CCO)C(=O)CSCC 21ac306b726359317a18c349b47db95e [0,2,0,0,0,0|1,1,0]=4 3020 B13R0.123 CCCCN(CCO)C(=O)NCCC 916a875b8fe7e9e2bc4078baa4b22de9 [0,2,0,0,0,0|2,0,0]=4 3021 B13R0.123 CCCCN(CCO)C(=O)NCCF b6b2655e7fef6b86b638e246dc31b195 [0,2,0,0,0,0|2,0,0]=4 3022 B13R0.123 CCCCN(CCO)C(=O)NCCN 91060f93f378280f3cadb72ecdf79323 [0,2,0,0,0,0|2,0,0]=4 3023 B13R0.123 CCCCN(CCO)C(=O)NCCO 11ebc48effec396bb5814c3e841ec568 [0,2,0,0,0,0|2,0,0]=4 3024 B13R0.123 CCCCN(CCO)C(=O)NCCS eb2e8f804a34eb143289c561b932f388 [0,2,0,0,0,0|2,0,0]=4 3025 B13R0.123 CCCCN(CCS)C(=O)CCCF 1dc88997cf8b2b875271592e5716e410 [0,2,0,0,0,0|2,0,0]=4 3026 B13R0.123 CCCCN(CCS)C(=O)CCCS 76708587c715cf37a68875344f09ad71 [0,2,0,0,0,0|2,0,0]=4 3027 B13R0.123 CCCCN(CCS)C(=O)CCOC 167fd18e52917e1caf2af7e4f6bb4683 [0,2,0,0,0,0|2,0,0]=4 3028 B13R0.123 CCCCN(CCS)C(=O)CCSC f40c11de551331c12669d83888d54742 [0,2,0,0,0,0|2,0,0]=4 3029 B13R0.123 CCCCN(CCS)C(=O)COCC af2ba067e46fa40b2d72c1be792b4ba4 [0,2,0,0,0,0|1,0,0]=3 3030 B13R0.123 CCCCN(CCS)C(=O)CSCC 4c1f774c557f697794d955ec1f212dc9 [0,2,0,0,0,0|1,1,0]=4 3031 B13R0.123 CCCCN(CCS)C(=O)NCCC fd2c366fe1c37fcaa63edd51061aa7ab [0,2,0,0,0,0|2,0,0]=4 3032 B13R0.123 CCCCN(CCS)C(=O)NCCF 0f5c8cd8e1fdd4cba7851322d4967f23 [0,2,0,0,0,0|2,0,0]=4 3033 B13R0.123 CCCCN(CCS)C(=O)NCCN 6c89bec219a689111aa0f10718686880 [0,2,0,0,0,0|2,0,0]=4 3034 B13R0.123 CCCCN(CCS)C(=O)NCCO 3df0b918c2d1bdd905fe75396d7b0f5d [0,2,0,0,0,0|2,0,0]=4 3035 B13R0.123 CCCCN(CCS)C(=O)NCCS 8864a639ed34c78bdacb9afe68dfd059 [0,2,0,0,0,0|2,0,0]=4 3036 B13R0.123 CCCN(CCCO)C(=O)COCC 877486901e703c96efdaddeed436941f [0,2,0,0,0,0|2,0,0]=4 3037 B13R0.123 CCCN(CCOC)C(=O)COCC 92166411033c1d6b5f8e41d65bbe6d14 [0,2,0,0,0,0|2,0,0]=4 3038 B13R0.123 CCOCC(=O)N(CCO)CCCO 0a805fd3b219a2c8b08a0b865e213aab [0,2,0,0,0,0|2,0,0]=4 3039 B13R0.159 C=CCCC(NC(C)C)C(=O)OCC be99c8112b3b27e4ff6f2d85531e032e [0,2,0,0,0,0|0,0,2]=4 3040 B13R0.159 CCCCC(OC(C)C)C(=O)OCC 718ada360ebff7666764b5204e855375 [0,2,0,0,0,0|0,0,0]=2 3041 B13R0.159 CCCNC(CC(C)C)C(=O)OCC 5a7669bcef48923462e3c00df9c5be0d [0,2,0,0,0,0|1,0,0]=3 3042 B13R0.159 CCCN[C@@H](CC(=O)O)C(=O)OCC ff3036b04d2e59fede9c7e55c2503c5e [0,2,0,0,0,0|1,0,1]=4 3043 B13R0.159 CCCN[C@@H](CC(C)C)C(=O)OCC d2241318e1c37413b679ab93f50f9abf [0,2,0,0,0,0|1,0,0]=3 3044 B13R0.159 CCCOC(CC(C)C)C(=O)OCC d8449b675eed938d0a143dc28c7a3ca3 [0,2,0,0,0,0|1,0,0]=3 3045 B13R0.159 CCCOC(NC(=O)C)C(=O)OCC 998ae40489a0ecc502785f5b23786852 [0,2,0,0,0,0|1,0,1]=4 3046 B13R0.159 CCOC(=O)C(CC(C)C)NCCBr abcfe66b8cc52d2139a8536e96c81f1a [0,2,0,0,0,0|2,0,0]=4 3047 B13R0.159 CCOC(=O)C(CC(C)C)NCCF f4024b32fdbb6fbc7cd0c8c3bdba3d8e [0,2,0,0,0,0|2,0,0]=4 3048 B13R0.159 CCOC(=O)C(CC(C)C)NCCI 16f895b51a7223d00760690f1d7f6944 [0,2,0,0,0,0|2,0,0]=4 3049 B13R0.159 CCOC(=O)C(CC(C)C)NCCO 9b2bd02ba5146bbdad12787d1ec4297a [0,2,0,0,0,0|2,0,0]=4 3050 B13R0.159 CCOC(=O)C(CC(C)C)NCCS 4a093f649af665b4fab51ecb9b748fbd [0,2,0,0,0,0|2,0,0]=4 3051 B13R0.159 CCOC(=O)C(CC(C)C)NCOC f3963d96be53ee411f0034e11c9ad81a [0,2,0,0,0,0|2,0,0]=4 3052 B13R0.159 CCOC(=O)C(CC(C)C)NCSC 59f2c1b74f3b67bbc18d297315d70677 [0,2,0,0,0,0|2,0,0]=4 3053 B13R0.159 CCOC(=O)C(CC(C)C)OCCF b94becc49692a248de7b5adafae40b4f [0,2,0,0,0,0|2,0,0]=4 3054 B13R0.159 CCOC(=O)C(CC(C)C)OCCS 3cd6eb7816b269ba5db4e75e9f4ab63c [0,2,0,0,0,0|2,0,0]=4 3055 B13R0.159 CCOC(=O)C(CC(C)C)OCOC f7630001cc5098ed823c264080fede0b [0,2,0,0,0,0|2,0,0]=4 3056 B13R0.159 CCOC(=O)C(CC(C)C)OCSC aba8c7033e215adfd61ceb1fba7a31c8 [0,2,0,0,0,0|2,0,0]=4 3057 B13R0.159 CCOC(=O)[C@H](CC(C)C)NCCF 6702a4f1f117455e6278635b959b680a [0,2,0,0,0,0|2,0,0]=4 3058 B13R0.159 CCOC(=O)[C@H](CC(C)C)NCCO a36b8b2322a055206c32bcfd8ab05b64 [0,2,0,0,0,0|2,0,0]=4 3059 B13R0.159 CCOC(=O)[C@H](CC(C)C)NCCS f39fd9c14e81e1eea0d270ae8f8dd2c7 [0,2,0,0,0,0|2,0,0]=4 3060 B13R0.159 CCOC(=O)[C@H](CC(C)C)NCOC 7b4235a9653d26889ce2a4828aeada6a [0,2,0,0,0,0|2,0,0]=4 3061 B13R0.159 CCOC(=O)[C@H](CC(C)C)NCSC d826db1f611b4acf79f2671c5229ca5f [0,2,0,0,0,0|2,0,0]=4 3062 B13R0.390 C#CCCNC(CCC)C(=O)OCC 8457595eb522df30594c26b6d457c706 [0,2,0,0,0,0|0,0,2]=4 3063 B13R0.390 C#CCCOC(CCC)C(=O)OCC 627944ef776b4dc2c4fec84a435c70c4 [0,2,0,0,0,0|0,0,2]=4 3064 B13R0.390 C/C=C/COC(CCC)C(=O)OCC 400cbe370cd974e86b341a4ae2f8a93b [0,2,0,0,0,0|0,0,2]=4 3065 B13R0.390 C/C=C\COC(CCC)C(=O)OCC 53987ee1ebe0948ffd6d8e50532c37b8 [0,2,0,0,0,0|0,0,2]=4 3066 B13R0.390 C=CCC(OCCCC)C(=O)OCC 6bb421d1335a6f77c446fae980a3f875 [0,2,0,0,0,0|0,0,1]=3 3067 B13R0.390 C=CCC(OCCCF)C(=O)OCC 61bc85ee2fead625b7994c850ef790fa [0,2,0,0,0,0|1,0,1]=4 3068 B13R0.390 C=CCC(OCCCS)C(=O)OCC 9f0daf51b17770d059ee4323a2c41346 [0,2,0,0,0,0|1,0,1]=4 3069 B13R0.390 C=CCC(OCCOC)C(=O)OCC b4e1639f47a86df151032297cd695cb8 [0,2,0,0,0,0|1,0,1]=4 3070 B13R0.390 C=CCC(OCCSC)C(=O)OCC 6234dd64f34709ed895f87f7090fe5e5 [0,2,0,0,0,0|1,0,1]=4 3071 B13R0.390 C=CCC(OCOCC)C(=O)OCC 9e8d23e69f11d780f65dece71c88f1e8 [0,2,0,0,0,0|1,0,1]=4 3072 B13R0.390 C=CCCNC(CCC)C(=O)OCC 98803e10a2879e38007c76f2c67fcb85 [0,2,0,0,0,0|0,0,2]=4 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[0,2,0,0,0,0|2,0,0]=4 3084 B13R0.390 CCCC(=O)C(CCC)OCCCS bd4121aaf9bb3a5f6549c122268227db [0,2,0,0,0,0|2,0,0]=4 3085 B13R0.390 CCCC(=O)C(CCC)OCCOC df8af9bb3357904904b01191c7c73b9a [0,2,0,0,0,0|2,0,0]=4 3086 B13R0.390 CCCC(=O)C(CCC)OCCSC 3b0d8f08ada78bbe25ae8ab0be47a041 [0,2,0,0,0,0|2,0,0]=4 3087 B13R0.390 CCCC(=O)C(CCC)OCOCC a3c3892e60c7e287102cf4e3cd8613a2 [0,2,0,0,0,0|2,0,0]=4 3088 B13R0.390 CCCC(NCCC#N)C(=O)OCC f86b0e49ba79dff543b156fd8a5dbf69 [0,2,0,0,0,0|1,0,1]=4 3089 B13R0.390 CCCC(NCCCCl)C(=O)OCC 27a053dc8563e6811cb0041a22063b9c [0,2,0,0,0,0|1,0,0]=3 3090 B13R0.390 CCCC(NCCCO)C(=O)OCC dd2116a1cd89a615cd2abc62843eb26d [0,2,0,0,0,0|1,0,0]=3 3091 B13R0.390 CCCC(NCCOC)C(=O)OCC a65b050ead44594d913ce76906512fb0 [0,2,0,0,0,0|1,0,0]=3 3092 B13R0.390 CCCC(NCCON)C(=O)OCC e8d4b3d2dc16dede02342f5596f6c713 [0,2,0,0,0,0|2,0,0]=4 3093 B13R0.390 CCCC(NCCSC)C(=O)OCC 8866abe9f3f5489e60677c1e086d0138 [0,2,0,0,0,0|1,0,0]=3 3094 B13R0.390 CCCC(OCCC#N)C(=O)OCC 3a6253de78fa7b3af05ef84b9cde565f [0,2,0,0,0,0|1,0,1]=4 3095 B13R0.390 CCCC(OCCC=O)C(=O)OCC 8a8229f1066814caf1613f93b034e957 [0,2,0,0,0,0|1,0,1]=4 3096 B13R0.390 CCCC(OCCCF)C(=O)OCC f3fe7ef0ef3e70df3716bbc8b28af872 [0,2,0,0,0,0|1,0,0]=3 3097 B13R0.390 CCCC(OCCCS)C(=O)OCC aa2e254b3d64b6bbcbf8102f871a4b8c [0,2,0,0,0,0|1,0,0]=3 3098 B13R0.390 CCCC(OCCOC)C(=O)OCC ea5c6a52a15dcdd96363b5bc9d5154e4 [0,2,0,0,0,0|1,0,0]=3 3099 B13R0.390 CCCC(OCCSC)C(=O)OCC 3ec48a904422f335b2280a04b62c2a29 [0,2,0,0,0,0|1,0,0]=3 3100 B13R0.390 CCCC(OCOCC)C(=O)OCC adefd49de4e3f114528d4a02043767ce [0,2,0,0,0,0|1,0,0]=3 3101 B13R0.390 CCCCCC(NC#N)C(=O)OCC 8b77b5eb4b2a31910c3614d63d254196 [0,2,0,0,0,0|1,0,1]=4 3102 B13R0.390 CCCCCN(CCC)C(=O)CCC b6d29cf652616dd1c25fcb5778cc00e1 [0,2,0,0,0,0|2,0,0]=4 3103 B13R0.390 CCCCCN(CCO)C(=O)CCC fb23548a9e8582da8ad3937f5f498b02 [0,2,0,0,0,0|2,0,0]=4 3104 B13R0.390 CCCCNC(CCC)C(=O)OCC ee3d9393aed03ee904f140c422af9d94 [0,2,0,0,0,0|0,0,0]=2 3105 B13R0.390 CCCCNC(OCC)C(=O)OCC 7d63f2adb528e959fc307dc59de9a16e [0,2,0,0,0,0|0,0,0]=2 3106 B13R0.390 CCCCOC(CCC)C(=O)CCC 6060fe482613660f3b96e2a44b8aecfc [0,2,0,0,0,0|1,0,0]=3 3107 B13R0.390 CCCCOC(CCC)C(=O)OCC 3d3a14a99ae0ff8fc51e847889b08cc1 [0,2,0,0,0,0|0,0,0]=2 3108 B13R0.390 CCOC(=O)C(NCCC#N)OCC 047aaf12853a83a9863be3709515faae [0,2,0,0,0,0|1,0,1]=4 3109 B13R0.390 CCOC(=O)C(NCCCCl)OCC 0fb5456d333ed35a6493b1b518a90b62 [0,2,0,0,0,0|1,0,0]=3 3110 B13R0.390 CCOC(=O)C(NCCCO)OCC 2849950507814134742b2eaef8312d9d [0,2,0,0,0,0|1,0,0]=3 3111 B13R0.390 CCOC(=O)C(NCCOC)OCC 01aab2b02bb7cfa7db631321a68f1b30 [0,2,0,0,0,0|1,0,0]=3 3112 B13R0.390 CCOC(=O)C(NCCSC)OCC cffcffb2e23a6fb31f7eea614a02a50d [0,2,0,0,0,0|1,0,0]=3 3113 B13R0.390 CCOC(=O)C(OCC)OCCC#N 01eaf9f72494296eb8181094972be3ab [0,2,0,0,0,0|1,0,1]=4 3114 B13R0.390 CCOC(=O)C(OCC)OCCC=O 466947e02a4400fa132e2082843e9604 [0,2,0,0,0,0|1,0,1]=4 3115 B13R0.390 CCOC(=O)C(OCC)OCCCF d1964a202bed3329fb71e146586ed65e [0,2,0,0,0,0|1,0,0]=3 3116 B13R0.390 CCOC(=O)C(OCC)OCCSC f849f5c3b9d9affac9730d7827be3768 [0,2,0,0,0,0|1,0,0]=3 3117 B13R0.447 CCCCN(CCC)C(=O)CC(C)C f8bc3fe3756bdee20668cbf42beb31ae [0,2,0,0,0,0|2,0,0]=4 3118 B13R0.447 CCCCN(CCC)C(=O)CC(C)O ec1559672a7cbb595d26ab1f97f1005b [0,2,0,0,0,0|2,0,0]=4 3119 B13R0.447 CCCCN(CCC)C(=O)C[C@@H](C)O 38d733620f9857786b65a7543a67fbd5 [0,2,0,0,0,0|2,0,0]=4 3120 B13R0.447 CCCCN(CCC)C(=O)C[C@H](C)O 15f2778c2b27fd1d5d43b31feebe1159 [0,2,0,0,0,0|2,0,0]=4 3121 B13R0.447 CCCCN(CCO)C(=O)CC(C)C 8c703087b2bca7f9efd5739957086cf9 [0,2,0,0,0,0|2,0,0]=4 3122 B13R0.447 CCCCN(CCO)C(=O)CC(C)O 847cf3270cd5beb734cbf6478756e209 [0,2,0,0,0,0|2,0,0]=4 3123 B13R0.447 CCCCN(CCO)C(=O)C[C@@H](C)O 82338dc2fe3ed1416b9246e11e888c5f [0,2,0,0,0,0|2,0,0]=4 3124 B13R0.447 CCCCN(CCO)C(=O)C[C@H](C)O 06738fa536806e05cec0f68278037969 [0,2,0,0,0,0|2,0,0]=4 3125 B13R0.447 CCCCN(CCS)C(=O)CC(C)C 5a686763b895907032051586a48c709e [0,2,0,0,0,0|2,0,0]=4 3126 B13R0.447 CCCCN(CCS)C(=O)CC(C)O 07171c211cd39db5714516b09ca857fb [0,2,0,0,0,0|2,0,0]=4 3127 B13R0.447 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CCOC(=O)C(NC[C@H](C)O)OCC 6acdfe9a7f7798424045af647538a02f [0,2,0,0,0,0|1,0,0]=3 3180 B13R0.1177 CCOC(=O)C(OCC)OCC(C)F 3bfdc9f3f645f55e4a597842f8ebb5bb [0,2,0,0,0,0|1,0,0]=3 3181 B13R0.1177 CCOC(=O)C(OCC)OCC(C)S af64631d5d4b3f458bf2a09419720c2c [0,2,0,0,0,0|1,0,0]=3 3182 B13R0.1177 CCOC(=O)C(OCC)OCC(F)F b653fcb67e0bf61ae1428fbc81a8983a [0,2,0,0,0,0|2,0,0]=4 3183 B13R0.1177 CCOC(=O)C(OCC)OC[C@@H](C)F 839980f243b874d3ccb6a318e66bc599 [0,2,0,0,0,0|1,0,0]=3 3184 B13R0.1177 CCOC(=O)C(OCC)OC[C@H](C)F dc801d4f9723b9f918f6b35887dbaa78 [0,2,0,0,0,0|1,0,0]=3 3185 B13R0.1307 CCCCC(C(=O)OCC)N(C)CC 8331ed3eb79054ec85223b1f0e2defb2 [0,2,0,0,0,0|0,0,0]=2 3186 B13R0.1307 CCCN[C@H](C(=O)OCC)[C@@H](C)CC dd6e4917c90ac44320de402cc5235519 [0,2,0,0,0,0|1,0,0]=3 3187 B13R0.1307 CCCOC(C(=O)OCC)C(C)CC 75b8c6aa5c7bc877e2404c72e32aa02f [0,2,0,0,0,0|1,0,0]=3 3188 B13R0.1307 CCOC(=O)C(OCCF)C(C)CC 3ec3055639bb33a438d0aa5e2d39ce61 [0,2,0,0,0,0|2,0,0]=4 3189 B13R0.1307 CCOC(=O)C(OCCS)C(C)CC 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494f4e60d225431579dec2c836ff48a5 [0,2,0,0,0,0|1,0,0]=3 3200 B13R0.1317 C=CCCC(NCCF)C(=O)OCC f6bd35e4c6092f0683f39a51e97b8dbc [0,2,0,0,0,0|0,0,2]=4 3201 B13R0.1317 C=CCCC(NCCO)C(=O)OCC f4b176e975f6a98964b948fe362e0dea [0,2,0,0,0,0|0,0,2]=4 3202 B13R0.1317 C=CCCC(NCCS)C(=O)OCC f443cb811e85ae7558d62be663e865fd [0,2,0,0,0,0|0,0,2]=4 3203 B13R0.1317 C=CCCC(NCOC)C(=O)OCC 09170f48288b7a6a66ddf392ba7d8462 [0,2,0,0,0,0|0,0,2]=4 3204 B13R0.1317 C=CCCC(NCSC)C(=O)OCC 778476a4546424e0b7b968ef80481b23 [0,2,0,0,0,0|0,0,2]=4 3205 B13R0.1317 CCCCC(NCC#N)C(=O)OCC 00e52a3359090fe3b50957ab50aed833 [0,2,0,0,0,0|0,0,1]=3 3206 B13R0.1317 CCCCC(NCCBr)C(=O)OCC 2fd6903a28234648e88bac395a98d5d0 [0,2,0,0,0,0|0,0,0]=2 3207 B13R0.1317 CCCCC(NCCC)C(=O)OCC 31127ac17ff013f1598e54bf87d7fbb8 [0,2,0,0,0,0|0,0,0]=2 3208 B13R0.1317 CCCCC(NCCF)C(=O)OCC 7be2babc69c1743ac9e2aaebdf0e2050 [0,2,0,0,0,0|0,0,0]=2 3209 B13R0.1317 CCCCC(NCCI)C(=O)OCC 7b3ff661f971c81053c0629541faa063 [0,2,0,0,0,0|0,0,0]=2 3210 B13R0.1317 CCCCC(NCCO)C(=O)OCC 29f8c3a66550e9aeae4306892df7e44e [0,2,0,0,0,0|0,0,0]=2 3211 B13R0.1317 CCCCC(NCCS)C(=O)OCC b5e195abec24f1ddbb14d6fec3e42103 [0,2,0,0,0,0|0,0,0]=2 3212 B13R0.1317 CCCCC(OCC#N)C(=O)OCC 72097ce5ffbef7ef697ee4164e36fd35 [0,2,0,0,0,0|0,0,1]=3 3213 B13R0.1317 CCCCC(OCCC)C(=O)OCC dc2970f1333c5be487ccec6eab211bc4 [0,2,0,0,0,0|0,0,0]=2 3214 B13R0.1317 CCCCC(OCCS)C(=O)OCC 5abd3fedb8be48ccae2b6a9dc37dcc5a [0,2,0,0,0,0|0,0,0]=2 3215 B13R0.1317 CCCCC(OCOC)C(=O)OCC 35db163a2afea4fcfb28c68a3d09519a [0,2,0,0,0,0|0,0,0]=2 3216 B13R0.1317 CCCCN(CCC#N)C(=O)CCC 6c1a5bd5a7c25dc628fe079572f02138 [0,2,0,0,0,0|2,0,0]=4 3217 B13R0.1317 CCCCN(CCCC)C(=O)CCC 396ee35a67a487dfb5f3e01b37919488 [0,2,0,0,0,0|2,0,0]=4 3218 B13R0.84 CCCC(=O)C(CC)NC(C)C(C)C 03317e71589355d7262fba11224a9fa6 [0,2,0,0,0,0|2,0,0]=4 3219 B13R0.84 CCCC(=O)C(CC)NC(C)C(C)O 6bd0b79674ed9de56f44741b5021aaf4 [0,2,0,0,0,0|2,0,0]=4 3220 B13R0.84 CCCC(=O)C(CC)N[C@@H](C)C(C)C 762a660cb31c8e5f081d7cdc43b66b78 [0,2,0,0,0,0|2,0,0]=4 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CCOC(=O)[C@H](CC)NCC(=O)CO 797c079dedb001e60711200a8d57cc50 [0,2,0,0,0,0|1,0,1]=4 3500 B13R0.748 CCOC(=O)[C@H](CC)NCC(=O)NC 342cedd5799a81a3b148436aaa707400 [0,2,0,0,0,0|1,0,1]=4 3501 B13R0.748 CCOC(=O)[C@H](CC)NCC(=O)OC c11a9f637a8a64bbbc980d37f43c916c [0,2,0,0,0,0|1,0,1]=4 3502 B13R0.748 CCOC(=O)[C@H](CC)NCC(C)C#N ef7d8be4d844fda35b45bd0ac6efb915 [0,2,0,0,0,0|1,0,0]=3 3503 B13R0.748 CCOC(=O)[C@H](CC)NCC(C)CC f31a2f9d6b5eb0ef1f14248c246813d0 [0,2,0,0,0,0|0,0,0]=2 3504 B13R0.748 CCOC(=O)[C@H](CC)NCC(C)CO aa2494aaccda2677c0eb1c0aa8348679 [0,2,0,0,0,0|1,0,0]=3 3505 B13R0.748 CCOC(=O)[C@H](CC)NCC(C)OC 13c6eeeba05de4234c76b202133e6e58 [0,2,0,0,0,0|1,0,0]=3 3506 B13R0.748 CCOC(=O)[C@H](CC)NCC(O)CC 6763909ec006772ed00ca1aad9355698 [0,2,0,0,0,0|0,0,0]=2 3507 B13R0.748 CCOC(=O)[C@H](CC)NCC(O)CF 440ff9731a4314b9b74b23caaa1b89f8 [0,2,0,0,0,0|1,0,0]=3 3508 B13R0.748 CCOC(=O)[C@H](CC)NCC(O)CO 361da7f485c887fae0181bc1b38557bc [0,2,0,0,0,0|1,0,0]=3 3509 B13R0.748 CCOC(=O)[C@H](CC)NC[C@@H](C)CC 94a3855e5a9913b2b99b346331f6f294 [0,2,0,0,0,0|0,0,0]=2 3510 B13R0.748 CCOC(=O)[C@H](CC)NC[C@@H](C)CO ccd658bc7119e7872381910926d82ab7 [0,2,0,0,0,0|1,0,0]=3 3511 B13R0.748 CCOC(=O)[C@H](CC)NC[C@@H](C)OC 25a9a0d53c1956e7ba7da40c54f23eb8 [0,2,0,0,0,0|1,0,0]=3 3512 B13R0.748 CCOC(=O)[C@H](CC)NC[C@@H](O)CO 954fabf315303e1c1ed530b3a2f0401f [0,2,0,0,0,0|1,0,0]=3 3513 B13R0.748 CCOC(=O)[C@H](CC)NC[C@H](C)CC 81ce9665b21f217796f314933a613123 [0,2,0,0,0,0|0,0,0]=2 3514 B13R0.748 CCOC(=O)[C@H](CC)NC[C@H](C)CO 19c6c44ea0135e0257033654cb60c2dd [0,2,0,0,0,0|1,0,0]=3 3515 B13R0.748 CCOC(=O)[C@H](CC)NC[C@H](C)OC f0eeec1114de5935fd66fe4edd51bb02 [0,2,0,0,0,0|1,0,0]=3 3516 B13R0.748 CCOC(=O)[C@H](CC)NC[C@H](O)CO 5b94f5cef9a4249ffb978c99c68afa3a [0,2,0,0,0,0|1,0,0]=3 3517 B13R0.748 CCOC(=O)[C@H](CC)OCC(=O)CC 74a43dbfac17820f04228731f6fea7a1 [0,2,0,0,0,0|0,0,1]=3 3518 B13R0.748 CCOC(=O)[C@H](CC)OCC(=O)NC 6583aa5a33a57f283e952a1fb9fd6234 [0,2,0,0,0,0|1,0,1]=4 3519 B13R0.748 CCOC(=O)[C@H](CC)OCC(=O)OC 0a45e3bb6b852833e29fc3f437db7381 [0,2,0,0,0,0|1,0,1]=4 3520 B13R0.748 CCOC(=O)[C@H](CC)OCC(C)C#N 48c1d0a3ccd3e7591f5c7ccd0cbcbd61 [0,2,0,0,0,0|1,0,0]=3 3521 B13R0.748 CCOC(=O)[C@H](CC)OCC(C)CC 80bafc1015a3e650da2ae3e1d7b70eb5 [0,2,0,0,0,0|0,0,0]=2 3522 B13R0.748 CCOC(=O)[C@H](CC)OCC(C)OC b8855fae2c6a96bcb37bb2b8bea156df [0,2,0,0,0,0|1,0,0]=3 3523 B13R0.748 CCOC(=O)[C@H](CC)OC[C@@H](C)CC b10fbf09881951f7fb224c924cad301d [0,2,0,0,0,0|0,0,0]=2 3524 B13R0.748 CCOC(=O)[C@H](CC)OC[C@@H](C)OC 736f18d3c6339182ae1f8fdac8c26872 [0,2,0,0,0,0|1,0,0]=3 3525 B13R0.748 CCOC(=O)[C@H](CC)OC[C@H](C)CC a77aef0dafa41e224415bac1c27d571e [0,2,0,0,0,0|0,0,0]=2 3526 B13R0.748 CCOC(=O)[C@H](CC)OC[C@H](C)OC 93bc58521136b86378127c32978f7a15 [0,2,0,0,0,0|1,0,0]=3 3527 B13R0.749 CCCC(=O)C(CC)NCC(C)(C)C 822cadaccef3bfa5f41006036933872e [0,2,0,0,0,0|2,0,0]=4 3528 B13R0.749 CCCC(=O)C(CC)NCC(C)(C)O e7ec0b37898e51cf8b4b069c0e5c82a9 [0,2,0,0,0,0|2,0,0]=4 3529 B13R0.749 CCCC(=O)C(CC)OCC(C)(C)Br be9ed490dfd7b7d150aed67ce1dd23d8 [0,2,0,0,0,0|2,0,0]=4 3530 B13R0.749 CCCC(=O)C(CC)OCC(C)(C)C cbe4278e0c141a0d3705d055a8a1ac45 [0,2,0,0,0,0|2,0,0]=4 3531 B13R0.749 CCCC(=O)C(CC)OCC(C)(C)S 208017efb74a335b1d5a3132bb7975ea [0,2,0,0,0,0|2,0,0]=4 3532 B13R0.749 CCNC(=O)C(CC)NCC(C)(C)C acee16e9e065aa89d14ecdb863e8686b [0,2,0,0,0,0|2,0,0]=4 3533 B13R0.749 CCNC(=O)C(CC)NCC(C)(C)F 4ac2fbbdf945dfd56e664585dc22e608 [0,2,0,0,0,0|2,0,0]=4 3534 B13R0.749 CCNC(=O)C(CC)NCC(C)(C)O 70612d8118db0eadf85422ac6d683d58 [0,2,0,0,0,0|2,0,0]=4 3535 B13R0.749 CCNC(=O)C(CC)NCC(C)(F)F 8f492d94967e43f422a536348a800512 [0,2,0,0,0,0|2,0,0]=4 3536 B13R0.749 CCOC(=O)C(CC)NCC(C)(C)C 27d4119e51b62e2a622a90472029a654 [0,2,0,0,0,0|1,0,0]=3 3537 B13R0.749 CCOC(=O)C(CC)NCC(C)(C)F d515626691614df1ef994927aac4f44a [0,2,0,0,0,0|1,0,0]=3 3538 B13R0.749 CCOC(=O)C(CC)NCC(C)(C)O 98d9124cf026645fa3973b259ce07367 [0,2,0,0,0,0|1,0,0]=3 3539 B13R0.749 CCOC(=O)C(CC)NCC(C)(F)F c840a1f4ee25b9c3ccf4dd2a005d74d0 [0,2,0,0,0,0|1,0,0]=3 3540 B13R0.749 CCOC(=O)C(CC)NCC(F)(F)F a8d66ca6b00f5f9a9d6e3d2c5d33fc47 [0,2,0,0,0,0|2,0,0]=4 3541 B13R0.749 CCOC(=O)C(CC)NCS(=O)(=O)C a176f4caa8a769f16b2b66a90e779770 [0,2,0,0,0,0|2,0,0]=4 3542 B13R0.749 CCOC(=O)C(CC)OCC(C)(C)Br d2b98829f2611d5e3a469b7edaa21bc7 [0,2,0,0,0,0|1,0,0]=3 3543 B13R0.749 CCOC(=O)C(CC)OCC(C)(C)C c0aa4619df8ca33bd2507bfcef81e872 [0,2,0,0,0,0|1,0,0]=3 3544 B13R0.749 CCOC(=O)C(CC)OCC(C)(C)F 42795bca43eef5842c53f1b943e52205 [0,2,0,0,0,0|1,0,0]=3 3545 B13R0.749 CCOC(=O)C(CC)OCC(C)(C)O dd83d7d33e744669af66d4345a4e2115 [0,2,0,0,0,0|1,0,0]=3 3546 B13R0.749 CCOC(=O)C(CC)OCC(C)(C)S ef23d71ffef80d78d1abcb18a9efe85d [0,2,0,0,0,0|1,0,0]=3 3547 B13R0.749 CCOC(=O)C(CC)OCC(C)(F)F 9f6a14416755aff5dd65c9ff5a7c73a4 [0,2,0,0,0,0|1,0,0]=3 3548 B13R0.749 CCOC(=O)C(CC)OCC(F)(F)Cl 733f369835956be92d55e1ae1772b368 [0,2,0,0,0,0|2,0,0]=4 3549 B13R0.749 CCOC(=O)C(CC)OCC(F)(F)F e5c4f1b4eeb45cefe6164c9bce1bb7b1 [0,2,0,0,0,0|2,0,0]=4 3550 B13R0.749 CCOC(=O)C(CC)OCS(=O)(=O)C e273b13b4b4bd7d966951bfd1e761813 [0,2,0,0,0,0|2,0,0]=4 3551 B13R0.749 CCOC(=O)C(CO)NCC(C)(C)C a88a5a03d5f7e5f4e111cae91e356d4e [0,2,0,0,0,0|2,0,0]=4 3552 B13R0.749 CCOC(=O)C(CO)NCC(C)(C)O bffcfeb39f7a39ee6944d961ec8208c7 [0,2,0,0,0,0|2,0,0]=4 3553 B13R0.749 CCOC(=O)C(NCC(C)(C)O)SC ffc35ef0ee226f3bbb3ee3955b0e3c2e [0,2,0,0,0,0|2,0,0]=4 3554 B13R0.749 CCOC(=O)[C@@H](CC)NCC(C)(C)C 2be3642f6bbb62e804c0687c9cd00b2a [0,2,0,0,0,0|1,0,0]=3 3555 B13R0.749 CCOC(=O)[C@@H](CC)NCC(C)(C)F ba18c8186a74f02886da8d11822391d5 [0,2,0,0,0,0|1,0,0]=3 3556 B13R0.749 CCOC(=O)[C@@H](CC)NCC(C)(C)O d5e019350434afc0b371206e54d41e0a [0,2,0,0,0,0|1,0,0]=3 3557 B13R0.749 CCOC(=O)[C@@H](CC)NCC(C)(F)F a44738d780aef5c07abe897f4ff5244a [0,2,0,0,0,0|1,0,0]=3 3558 B13R0.749 CCOC(=O)[C@@H](CC)NCC(F)(F)F d299b0be50121abd53674320c17d10e9 [0,2,0,0,0,0|2,0,0]=4 3559 B13R0.749 CCOC(=O)[C@@H](CC)NCS(=O)(=O)C e61ee06c61376cc54b7be87d8dc31b72 [0,2,0,0,0,0|2,0,0]=4 3560 B13R0.749 CCOC(=O)[C@@H](CC)OCC(C)(C)C b37881bef7a8d92490c457c0b8e288c5 [0,2,0,0,0,0|1,0,0]=3 3561 B13R0.749 CCOC(=O)[C@@H](CC)OCC(C)(C)F 7a82feda98341dbbe35542054c2eb8be [0,2,0,0,0,0|1,0,0]=3 3562 B13R0.749 CCOC(=O)[C@@H](CC)OCC(C)(C)O 7e837d99357942afae829d47822ae417 [0,2,0,0,0,0|1,0,0]=3 3563 B13R0.749 CCOC(=O)[C@@H](CC)OCC(C)(F)F 194b1606802859ed45e030b6b50a2759 [0,2,0,0,0,0|1,0,0]=3 3564 B13R0.749 CCOC(=O)[C@@H](CC)OCC(F)(F)F bade51f51e22e3e79d2303c66961d1c7 [0,2,0,0,0,0|2,0,0]=4 3565 B13R0.749 CCOC(=O)[C@@H](CC)OCS(=O)(=O)C 92c137d0c43152871985abda488ef154 [0,2,0,0,0,0|2,0,0]=4 3566 B13R0.749 CCOC(=O)[C@H](CC)NCC(C)(C)C b3d14ae5cad206c3616c076e8c494d73 [0,2,0,0,0,0|1,0,0]=3 3567 B13R0.749 CCOC(=O)[C@H](CC)NCC(C)(C)F 149bfec48dfd8927288b9a789bd4eb30 [0,2,0,0,0,0|1,0,0]=3 3568 B13R0.749 CCOC(=O)[C@H](CC)NCC(C)(C)O ac113aa9cdd0d98bf9de802cfbff03bd [0,2,0,0,0,0|1,0,0]=3 3569 B13R0.749 CCOC(=O)[C@H](CC)NCC(C)(F)F 47a3518be3b4264e3a743762cb0d34cf [0,2,0,0,0,0|1,0,0]=3 3570 B13R0.749 CCOC(=O)[C@H](CC)NCC(F)(F)F d3b9cf43553c4ab91313dc4bfa2cbe7a [0,2,0,0,0,0|2,0,0]=4 3571 B13R0.749 CCOC(=O)[C@H](CC)NCS(=O)(=O)C b47b9e102b74334ef250e5938effb588 [0,2,0,0,0,0|2,0,0]=4 3572 B13R0.749 CCOC(=O)[C@H](CC)OCC(C)(C)C 89d1869cca02bc9bb9417e6f3dbd57a8 [0,2,0,0,0,0|1,0,0]=3 3573 B13R0.749 CCOC(=O)[C@H](CC)OCC(C)(C)F 8cfe7269b541293c2d79245f756d8f6e [0,2,0,0,0,0|1,0,0]=3 3574 B13R0.749 CCOC(=O)[C@H](CC)OCC(C)(C)O ae7bdaec7d1e12a2de3304cbeea269ae [0,2,0,0,0,0|1,0,0]=3 3575 B13R0.749 CCOC(=O)[C@H](CC)OCC(C)(F)F 7f535c5849e023f80e2f6d4b69d590fc [0,2,0,0,0,0|1,0,0]=3 3576 B13R0.749 CCOC(=O)[C@H](CC)OCC(F)(F)F 12292be3b236bde28378a4e828577bdd [0,2,0,0,0,0|2,0,0]=4 3577 B13R0.749 CCOC(=O)[C@H](CC)OCS(=O)(=O)C f0b1457f10338f7c4586b00a1bb583c4 [0,2,0,0,0,0|2,0,0]=4 3578 B13R0.1876 CCC(NCC(C)C)C(=O)NC(C)C 50c2863a3c7d506a77aabd527a0b53ff [0,2,0,0,0,0|2,0,0]=4 3579 B13R0.1876 CCC(NCC(C)O)C(=O)NC(C)C 53b5a093e9c0b9574eec260ec4514658 [0,2,0,0,0,0|2,0,0]=4 3580 B13R0.1876 CCC(NC[C@@H](C)O)C(=O)NC(C)C 2d8d3e0aa104be762dea3281006a3b20 [0,2,0,0,0,0|2,0,0]=4 3581 B13R0.1876 CCC(NC[C@H](C)O)C(=O)NC(C)C 809f320168e0574b907af7f948890765 [0,2,0,0,0,0|2,0,0]=4 3582 B13R0.1876 CCC(OCC(C)C)C(=O)NC(C)C 0735dfbf4010c189ab9ec51af5effed6 [0,2,0,0,0,0|2,0,0]=4 3583 B13R0.1876 CCC(OCC(C)F)C(=O)NC(C)C 5b7043cb8b31a586553f7ce60962e4d4 [0,2,0,0,0,0|2,0,0]=4 3584 B13R0.1876 CCC(OCC(C)S)C(=O)NC(C)C 3f9aecd1c76c59cfeba9bc1deaa89b75 [0,2,0,0,0,0|2,0,0]=4 3585 B13R0.1876 CCC(OC[C@@H](C)F)C(=O)NC(C)C 4ca28c891a7dd8a32c61a73a0e94178d [0,2,0,0,0,0|2,0,0]=4 3586 B13R0.1876 CCC(OC[C@H](C)F)C(=O)NC(C)C ad556776db1a25193931069759a2cf5d [0,2,0,0,0,0|2,0,0]=4 3587 B13R0.132 CC/C=C/C(=O)N(CC)CC(O)CC 73f10dc9d7cce0e51db2dccb282e8465 [0,2,0,0,0,0|2,0,0]=4 3588 B13R0.132 CC/C=C\C(=O)N(CC)CC(O)CC b96a8ef12ba9b9c96837f064b5f6d138 [0,2,0,0,0,0|2,0,0]=4 3589 B13R0.132 CCC#CC(=O)N(CC)CC(O)CC 557e2a6675265161e5f1c67bd215976c [0,2,0,0,0,0|2,0,0]=4 3590 B13R0.132 CCC(O)CN(CC)C(=O)CCCF 1b0d0b56dda8c7846f54b1164a4b1121 [0,2,0,0,0,0|2,0,0]=4 3591 B13R0.132 CCC(O)CN(CC)C(=O)CCCS 5e40c2c80b343b99263f6c978f484634 [0,2,0,0,0,0|2,0,0]=4 3592 B13R0.132 CCC(O)CN(CC)C(=O)CCOC 140e643322799e896284f9cb5bee3438 [0,2,0,0,0,0|2,0,0]=4 3593 B13R0.132 CCC(O)CN(CC)C(=O)CCSC 6c0a1c8f40d57d93f9e2171161aff886 [0,2,0,0,0,0|2,0,0]=4 3594 B13R0.132 CCC(O)CN(CC)C(=O)NCCF 679e8cc94a1d85b28b27bad9cdaea021 [0,2,0,0,0,0|2,0,0]=4 3595 B13R0.132 CCC(O)CN(CC)C(=O)NCCN df764404c2d2afe00cd9094466a46ac7 [0,2,0,0,0,0|2,0,0]=4 3596 B13R0.132 CCC(O)CN(CC)C(=O)NCCO 558334007600f01f5fcfad9dccc9f9be [0,2,0,0,0,0|2,0,0]=4 3597 B13R0.132 CCC(O)CN(CC)C(=O)NCCS b54392b3c6da6b7142ba2b4667dce96c [0,2,0,0,0,0|2,0,0]=4 3598 B13R0.132 CCC=CC(=O)N(CC)CC(O)CC 3416b0f331357c941b4a4a453c835e63 [0,2,0,0,0,0|2,0,0]=4 3599 B13R0.132 CCCCC(=O)N(CC)CC(O)CC fa149a3159277bbd13391cd584bf024f [0,2,0,0,0,0|2,0,0]=4 3600 B13R0.132 CCCNC(=O)C(CC)NC(C)CC 33cd8a37aed8b89ed10d2876d296ab5d [0,2,0,0,0,0|2,0,0]=4 3601 B13R0.132 CCCNC(=O)C(CC)N[C@@H](C)CC 68164e1aa3e12080b140f0ec22892e27 [0,2,0,0,0,0|2,0,0]=4 3602 B13R0.132 CCCNC(=O)C(CC)N[C@H](C)CC 8bcc11f3a90bd801cbe0936b21261586 [0,2,0,0,0,0|2,0,0]=4 3603 B13R0.132 CCCNC(=O)C(CC)OC(C)CC f4f2c97b3c52867d5d2ccb11b4bb54c7 [0,2,0,0,0,0|2,0,0]=4 3604 B13R0.132 CCCNC(=O)C(CC)O[C@@H](C)CC e5823ea67dae8543bab7cda375c22ed9 [0,2,0,0,0,0|2,0,0]=4 3605 B13R0.132 CCCNC(=O)C(CC)O[C@H](C)CC fb12ce570119dc4a39754a8df6b3dac8 [0,2,0,0,0,0|2,0,0]=4 3606 B13R0.132 CCCNC(=O)N(CC)CC(O)CC 6587c0b6929a67a82d6b1d4b76a8f1f8 [0,2,0,0,0,0|2,0,0]=4 3607 B13R0.132 CCCNC(=O)[C@H](CC)NC(C)CC f5bf1d068fc196974e0863e860ca3411 [0,2,0,0,0,0|2,0,0]=4 3608 B13R0.132 CCOCC(=O)N(CC)CC(O)CC e30fb33086a9ff71de1969043621c15a [0,2,0,0,0,0|1,0,0]=3 3609 B13R0.132 CCSCC(=O)N(CC)CC(O)CC c50d069d5aec40dcaa54ee3d9a230973 [0,2,0,0,0,0|1,1,0]=4 3610 B13R0.730 CCOC(=O)C(NC(=O)CC)C(C)C b7c69aaa5c3535f70c585a567447fec8 [0,2,0,0,0,0|1,0,1]=4 3611 B13R0.730 CCOC(=O)C(NC(C)CC)C(=O)C 988d3f0f56ed17545db76a2eca4c3603 [0,2,0,0,0,0|1,0,1]=4 3612 B13R0.730 CCOC(=O)C(NC(C)CC)C(C)C fcfe209d8ea2e3b43df0d745a30294a2 [0,2,0,0,0,0|1,0,0]=3 3613 B13R0.730 CCOC(=O)C(NC(C)CO)C(C)C b682d152b4f319dd4c2471034105922d [0,2,0,0,0,0|2,0,0]=4 3614 B13R0.730 CCOC(=O)C(N[C@@H](C)CC)C(=O)C 67bbaf7aa13d1d17e14a61c7762effcc [0,2,0,0,0,0|1,0,1]=4 3615 B13R0.730 CCOC(=O)C(N[C@@H](C)CC)C(C)C 308e23c916bb248694b2a6306be65441 [0,2,0,0,0,0|1,0,0]=3 3616 B13R0.730 CCOC(=O)C(N[C@@H](C)CO)C(C)C b26863aa9813f1fa4cb7f952ba964e0e [0,2,0,0,0,0|2,0,0]=4 3617 B13R0.730 CCOC(=O)C(N[C@H](C)CC)C(=O)C 220d1995ba2d778b501b8594f2ca7416 [0,2,0,0,0,0|1,0,1]=4 3618 B13R0.730 CCOC(=O)C(N[C@H](C)CC)C(C)C 2ee5613e283acf7059e38ac9ab3a8b8d [0,2,0,0,0,0|1,0,0]=3 3619 B13R0.730 CCOC(=O)C(N[C@H](C)CO)C(C)C ce22e394aa458da3800204bf293b4526 [0,2,0,0,0,0|2,0,0]=4 3620 B13R0.730 CCOC(=O)C(OC(C)CC)C(=O)C 28d188baaf3a0a4162ee8d2480871c59 [0,2,0,0,0,0|1,0,1]=4 3621 B13R0.730 CCOC(=O)C(OC(C)CC)C(C)C fc649b70e669db11fae0f696582b5a37 [0,2,0,0,0,0|1,0,0]=3 3622 B13R0.730 CCOC(=O)C(OC(C)CF)C(C)C 35c37f1bdbab9f6f9f3cbbcb7a05d995 [0,2,0,0,0,0|2,0,0]=4 3623 B13R0.730 CCOC(=O)C(OC(C)CS)C(C)C 20fe69ffccca84f200b9dd77b46014a8 [0,2,0,0,0,0|2,0,0]=4 3624 B13R0.730 CCOC(=O)C(O[C@@H](C)CC)C(=O)C a33f30aec2d4ab25f0c088b7de0b673b [0,2,0,0,0,0|1,0,1]=4 3625 B13R0.730 CCOC(=O)C(O[C@@H](C)CC)C(C)C 52b00a846313e7abb53742bd5357d6d2 [0,2,0,0,0,0|1,0,0]=3 3626 B13R0.730 CCOC(=O)C(O[C@H](C)CC)C(=O)C b0ed1b7e8141a9fb3ef6f0f7bca31533 [0,2,0,0,0,0|1,0,1]=4 3627 B13R0.730 CCOC(=O)C(O[C@H](C)CC)C(C)C 7258f124142a76620be4bce9280d04c1 [0,2,0,0,0,0|1,0,0]=3 3628 B13R0.730 CCOC(=O)C(O[C@H](C)CS)C(C)C dabc78faaac1671c74873ceaf6942003 [0,2,0,0,0,0|2,0,0]=4 3629 B13R0.730 CCOC(=O)[C@@H](NC(=O)CC)C(C)C 67ca5108ed6af3849fe5b449734a123e [0,2,0,0,0,0|1,0,1]=4 3630 B13R0.730 CCOC(=O)[C@@H](NC(C)CC)C(C)C cf8d18b58ca6887d8f201ab05267fd34 [0,2,0,0,0,0|1,0,0]=3 3631 B13R0.730 CCOC(=O)[C@@H](NC(C)CO)C(C)C 6a30f29cb93247d416cdb9f650c3a79d [0,2,0,0,0,0|2,0,0]=4 3632 B13R0.730 CCOC(=O)[C@@H](N[C@@H](C)CO)C(C)C 4ef8105cc9d6520d755827956f7c9b4e [0,2,0,0,0,0|2,0,0]=4 3633 B13R0.730 CCOC(=O)[C@@H](N[C@H](C)CO)C(C)C d6d5d1a23e025338a7afa2d6fbe02385 [0,2,0,0,0,0|2,0,0]=4 3634 B13R0.730 CCOC(=O)[C@H](NC(=O)CC)C(C)C 9ba1b44c25295bac161e582e372a35db [0,2,0,0,0,0|1,0,1]=4 3635 B13R0.730 CCOC(=O)[C@H](NC(C)CC)C(C)C 5df94fd8e9146169a436c4d70d9152af [0,2,0,0,0,0|1,0,0]=3 3636 B13R0.730 CCOC(=O)[C@H](NC(C)CO)C(C)C 7089b5b3d9849ab5861d51a3d8dccb09 [0,2,0,0,0,0|2,0,0]=4 3637 B13R0.730 CCOC(=O)[C@H](N[C@@H](C)CC)C(C)C 24d4e41e701c2036f395ebc2095725e6 [0,2,0,0,0,0|1,0,0]=3 3638 B13R0.730 CCOC(=O)[C@H](N[C@@H](C)CO)C(C)C 081d61d295be4e692450385fc20ea479 [0,2,0,0,0,0|2,0,0]=4 3639 B13R0.730 CCOC(=O)[C@H](N[C@H](C)CC)C(C)C 8f6350f69a7a69643cb168efdf03562c [0,2,0,0,0,0|1,0,0]=3 3640 B13R0.730 CCOC(=O)[C@H](N[C@H](C)CO)C(C)C 0910d6e3b22e12c5804a76ed94b66d4c [0,2,0,0,0,0|2,0,0]=4 3641 B13R0.730 CCOC(=O)[C@H](OC(C)CC)C(C)C b9d10ec996435a52465e61574e053f9d [0,2,0,0,0,0|1,0,0]=3 3642 B13R0.730 CCOC(=O)[C@H](OC(C)CF)C(C)C 31e2a57e111cf23a5e940313d9db2672 [0,2,0,0,0,0|2,0,0]=4 3643 B13R0.730 CCOC(=O)[C@H](OC(C)CS)C(C)C 62d82e33f1be4f5d0c6599a3a16c05a5 [0,2,0,0,0,0|2,0,0]=4 3644 B13R0.730 CCOC(=O)[C@H](O[C@@H](C)CC)C(C)C ab7a684d19bd16729020e7fc4f30d209 [0,2,0,0,0,0|1,0,0]=3 3645 B13R0.730 CCOC(=O)[C@H](O[C@H](C)CC)C(C)C 366e85cde76d6668d9de75c6eaf23e17 [0,2,0,0,0,0|1,0,0]=3 3646 B13R0.730 CCOC(=O)[C@H](O[C@H](C)CS)C(C)C 03bd7c04194ff61b8b8fed6abbe0fce3 [0,2,0,0,0,0|2,0,0]=4 3647 B13R0.751 C#CC(CC)OC(CC)C(=O)CCC 4d2f4d86ae7a1ba5f2e5df12b9517f65 [0,2,0,0,0,0|2,0,0]=4 3648 B13R0.751 C#CC(CC)OC(CC)C(=O)OCC 2b95bfd0323b14ba5974f3a8c2896c6e [0,2,0,0,0,0|1,0,0]=3 3649 B13R0.751 C#CC(CC)OC(SC)C(=O)OCC 05e5f693fd7c6e70cad9947e5d088224 [0,2,0,0,0,0|2,0,0]=4 3650 B13R0.751 C=CC(CC)OC(CC)C(=O)CCC 0143e34156347b125205d80eb147c623 [0,2,0,0,0,0|2,0,0]=4 3651 B13R0.751 C=CC(CC)OC(CC)C(=O)OCC 60791c1ef81770b25e99372e933eeec0 [0,2,0,0,0,0|1,0,0]=3 3652 B13R0.751 C=CC(CC)OC(SC)C(=O)OCC d1ead4c4c07f7d320f26e1b98fdfd8a8 [0,2,0,0,0,0|2,0,0]=4 3653 B13R0.751 C=C[C@@H](CO)NC(CC)C(=O)OCC 2f2a32011481fcb918dc1a5bb15b4b9d [0,2,0,0,0,0|2,0,0]=4 3654 B13R0.751 CCCC(=O)C(CC)NC(CC)CC 49d3b479a10b1062b1ea8d7e62e077dc [0,2,0,0,0,0|2,0,0]=4 3655 B13R0.751 CCCC(=O)C(CC)NC(CC)CO 68ebb14870cc015d1827e0ca4059205f [0,2,0,0,0,0|2,0,0]=4 3656 B13R0.751 CCCC(=O)C(CC)N[C@@H](CC)CO ac575d026e4efaf57de3d063c9c8e3fc [0,2,0,0,0,0|2,0,0]=4 3657 B13R0.751 CCCC(=O)C(CC)N[C@H](CC)CO ab3c7b414c22a1d2061c7283c6132dcf [0,2,0,0,0,0|2,0,0]=4 3658 B13R0.751 CCCC(=O)C(CC)OC(C#N)CC 66438227c7baa62c458999e6bec8b6ed [0,2,0,0,0,0|2,0,0]=4 3659 B13R0.751 CCCC(=O)C(CC)OC(CC)CC 4b8b047102f77e33ceb736cda9d7f2ca [0,2,0,0,0,0|2,0,0]=4 3660 B13R0.751 CCNC(=O)C(CC)NC(C=O)CC 2b583c851977191cfb399f2a2f6a4dc4 [0,2,0,0,0,0|2,0,0]=4 3661 B13R0.751 CCNC(=O)C(CC)NC(CC)CC eb0d9c0b09a82ce2cd7706e76051554f [0,2,0,0,0,0|2,0,0]=4 3662 B13R0.751 CCNC(=O)C(CC)NC(CC)CO 2d5c4b956a425caf0de276ad4d6b9eaf [0,2,0,0,0,0|2,0,0]=4 3663 B13R0.751 CCOC(=O)C(CC)NC(C=O)CC 82e6b18fc3c6311ec09996a972537e20 [0,2,0,0,0,0|1,0,0]=3 3664 B13R0.751 CCOC(=O)C(CC)NC(CC)CC a952c42dcd013f4d2bd1f9cc3fe4f629 [0,2,0,0,0,0|1,0,0]=3 3665 B13R0.751 CCOC(=O)C(CC)NC(CC)CO c8712f4d8ec332e3191471579ded3333 [0,2,0,0,0,0|1,0,0]=3 3666 B13R0.751 CCOC(=O)C(CC)NC(CO)CO 8689ad12b26109fc44140f797cc33d62 [0,2,0,0,0,0|2,0,0]=4 3667 B13R0.751 CCOC(=O)C(CC)N[C@@H](CC)CO 89f402e8a370c3af12026a811e87b2a1 [0,2,0,0,0,0|1,0,0]=3 3668 B13R0.751 CCOC(=O)C(CC)N[C@H](CC)CO e54dcaf2a634167ce022c9cd0d846494 [0,2,0,0,0,0|1,0,0]=3 3669 B13R0.751 CCOC(=O)C(CC)OC(C#N)CC d6c5a39edd744239b3a3fdfe788b4ae0 [0,2,0,0,0,0|1,0,0]=3 3670 B13R0.751 CCOC(=O)C(CC)OC(C=O)CC 9aaed35856498e56a1dfdb3ea7bcd7a7 [0,2,0,0,0,0|1,0,0]=3 3671 B13R0.751 CCOC(=O)C(CC)OC(CBr)CBr fe66936e78f44c5f923b9832e9edbe3d [0,2,0,0,0,0|2,0,0]=4 3672 B13R0.751 CCOC(=O)C(CC)OC(CC)CC aaef73858497f3725cc30155cd92b8fe [0,2,0,0,0,0|1,0,0]=3 3673 B13R0.751 CCOC(=O)C(CC)OC(CCl)CBr 14e2d4d58ca5b036c3579bf1a29c0db9 [0,2,0,0,0,0|2,0,0]=4 3674 B13R0.751 CCOC(=O)C(CC)OC(CCl)CCl 949fc36962ce5579b186da42ca0b4e9c [0,2,0,0,0,0|2,0,0]=4 3675 B13R0.751 CCOC(=O)C(CC)OC(CF)CF dbc06c55fcb41e050a3c3bb887bd6166 [0,2,0,0,0,0|2,0,0]=4 3676 B13R0.751 CCOC(=O)C(CC)OC(CO)CO 337dc71030aed8abd7ca82ba5b7710b2 [0,2,0,0,0,0|2,0,0]=4 3677 B13R0.751 CCOC(=O)C(CC)O[C@@H](CCl)CI e0c7778d4b5f14d15f7727459241e463 [0,2,0,0,0,0|2,0,0]=4 3678 B13R0.751 CCOC(=O)C(CC)O[C@H](CCl)CI 5b00950bfb6859ed15d47a1c5e9187b7 [0,2,0,0,0,0|2,0,0]=4 3679 B13R0.751 CCOC(=O)C(CO)NC(CC)CC 5de01391b94ac2e8c9aab1cd143262d5 [0,2,0,0,0,0|2,0,0]=4 3680 B13R0.751 CCOC(=O)C(CO)NC(CC)CO 35c6fc55137be9f05ce86d5bd974bb5f [0,2,0,0,0,0|2,0,0]=4 3681 B13R0.751 CCOC(=O)C(CO)N[C@@H](CC)CO 3d95e31ee6b8dcc41426551c71e7ef75 [0,2,0,0,0,0|2,0,0]=4 3682 B13R0.751 CCOC(=O)C(CO)N[C@H](CC)CO 7eb313dee0caa2250ca888a411394498 [0,2,0,0,0,0|2,0,0]=4 3683 B13R0.751 CCOC(=O)C(OC(C#N)CC)SC 9bcff9504da57a6caae02eb0a6a342fa [0,2,0,0,0,0|2,0,0]=4 3684 B13R0.751 CCOC(=O)C(OC(CC)CC)SC af8a689236c3351a9099933a54474692 [0,2,0,0,0,0|2,0,0]=4 3685 B13R0.751 CCOC(=O)[C@@H](CC)NC(C=O)CC 1f0f457ddfc5f0171d49e5ad66d41b9d [0,2,0,0,0,0|1,0,0]=3 3686 B13R0.751 CCOC(=O)[C@@H](CC)NC(CC)CC c1c3af7efe592fc85a7632417bf9d349 [0,2,0,0,0,0|1,0,0]=3 3687 B13R0.751 CCOC(=O)[C@@H](CC)NC(CC)CO 6813d0663456f05173fb4c2b78b41c9a [0,2,0,0,0,0|1,0,0]=3 3688 B13R0.751 CCOC(=O)[C@@H](CC)NC(CO)CO 0ec86045071eb86dfc93fc6e185dac52 [0,2,0,0,0,0|2,0,0]=4 3689 B13R0.751 CCOC(=O)[C@@H](CC)OC(C=O)CC b30479c4e39d55f0e34e10ac3ad68ef4 [0,2,0,0,0,0|1,0,0]=3 3690 B13R0.751 CCOC(=O)[C@@H](CC)OC(CC)CC 6c21a6f2998116caa6cabc4a827aea56 [0,2,0,0,0,0|1,0,0]=3 3691 B13R0.751 CCOC(=O)[C@@H](CC)OC(CO)CO f1b2c8e79433d3fe85cac7f90748b84c [0,2,0,0,0,0|2,0,0]=4 3692 B13R0.751 CCOC(=O)[C@H](CC)NC(C=O)CC 29259cadc66530e480edb313932e6d71 [0,2,0,0,0,0|1,0,0]=3 3693 B13R0.751 CCOC(=O)[C@H](CC)NC(CC)CC 6ee51cf5cabe195a24e8aada352dd090 [0,2,0,0,0,0|1,0,0]=3 3694 B13R0.751 CCOC(=O)[C@H](CC)NC(CC)CO 78f8302b3f046971a01eaf16394ad1ad [0,2,0,0,0,0|1,0,0]=3 3695 B13R0.751 CCOC(=O)[C@H](CC)NC(CO)CO 28b5fe4511a039b1dff5ea37373b329e [0,2,0,0,0,0|2,0,0]=4 3696 B13R0.751 CCOC(=O)[C@H](CC)OC(C=O)CC 0eed8cc8660ed0f2d4c00ad7636496a4 [0,2,0,0,0,0|1,0,0]=3 3697 B13R0.751 CCOC(=O)[C@H](CC)OC(CC)CC 4d6dde4dd6e92986356ea8408bfb6513 [0,2,0,0,0,0|1,0,0]=3 3698 B13R0.751 CCOC(=O)[C@H](CC)OC(CO)CO 2769e3aa105990a704fdf32a1b928689 [0,2,0,0,0,0|2,0,0]=4 3699 B13R0.840 C=C(CC)C(=O)N(CC)CC(O)CC 1e4bdad113a90e34c82085c7e680367a [0,2,0,0,0,0|2,0,0]=4 3700 B13R0.840 CCC(=O)C(=O)N(CC)CC(O)CC 47833d97543691477ad504f01d737fa2 [0,2,0,0,0,0|2,0,0]=4 3701 B13R0.840 CCC(O)CN(CC)C(=O)C(O)CC a030bcae6d3b8acec421a7debc301c57 [0,2,0,0,0,0|2,0,0]=4 3702 B13R0.840 CCC(O)CN(CC)C(=O)[C@@H](O)CC 8296d4faec3c11a9864025bdebb7a290 [0,2,0,0,0,0|2,0,0]=4 3703 B13R0.840 CCC(O)CN(CC)C(=O)[C@@H](S)CC 4eaccbca0724b13da71585be7b1d766a [0,2,0,0,0,0|2,0,0]=4 3704 B13R0.840 CCC(O)CN(CC)C(=O)[C@H](O)CC 4cf6f877ec2115715637299b82f5b95e [0,2,0,0,0,0|2,0,0]=4 3705 B13R0.845 CCC(C)NC(CC)C(=O)NC(C)C 53c8c14712f86536910a205e7d25c9bd [0,2,0,0,0,0|2,0,0]=4 3706 B13R0.845 CCC(C)OC(CC)C(=O)NC(C)C 1489c6ddf39936ba2288edc1c1d122d7 [0,2,0,0,0,0|2,0,0]=4 3707 B13R0.845 CCC(N[C@@H](C)CC)C(=O)NC(C)C 9da11a56022362ef746e99f8990a67c7 [0,2,0,0,0,0|2,0,0]=4 3708 B13R0.845 CCC(N[C@H](C)CC)C(=O)NC(C)C 77aa5713bec4891cf6b13d9df9cf7863 [0,2,0,0,0,0|2,0,0]=4 3709 B13R0.845 CCC(O)CN(CC)C(=O)CC(C)C ec032af584a0af6a28509ccbf4128aa3 [0,2,0,0,0,0|2,0,0]=4 3710 B13R0.845 CCC(O)CN(CC)C(=O)CC(C)O ccb360844894ba77864bcb16c23c8814 [0,2,0,0,0,0|2,0,0]=4 3711 B13R0.845 CCC(O)CN(CC)C(=O)C[C@@H](C)O 0fa67b0d0dbcfa4a7cba7f6d7f59df04 [0,2,0,0,0,0|2,0,0]=4 3712 B13R0.845 CCC(O)CN(CC)C(=O)C[C@H](C)O 5085cb58aeb839365009625751337494 [0,2,0,0,0,0|2,0,0]=4 3713 B13R0.845 CCC(O[C@@H](C)CC)C(=O)NC(C)C dc5a78c1c8f315513096a6a5ad21527a [0,2,0,0,0,0|2,0,0]=4 3714 B13R0.845 CCC(O[C@H](C)CC)C(=O)NC(C)C 164cadfdd299aa4cc2bce303807f557d [0,2,0,0,0,0|2,0,0]=4 3715 B13R0.1126 CCOC(=O)C(CC)NC(C)(C)CC 0ee955208db628291abc1d908303ed0f [0,2,0,0,0,0|1,0,0]=3 3716 B13R0.1126 CCOC(=O)C(CC)NC(C)(C)CF 0b11483a22e684a5d78dd66aa4de3b9f [0,2,0,0,0,0|2,0,0]=4 3717 B13R0.1126 CCOC(=O)C(CC)NC(C)(C)CO d1ff9cfb692f692f6e0f63f79bb4b5eb [0,2,0,0,0,0|2,0,0]=4 3718 B13R0.299 C#CC(OC(C)C)C(CC)CCCC 0c9169f2b7c3c0a3e90bd21d89de7451 [0,2,0,0,0,0|1,0,1]=4 3719 B13R0.302 CCCCN(CC)C(=O)C(=O)C(C)C b716c9beb69d8a2ae53f33f0230e50bb [0,2,0,0,0,0|2,0,0]=4 3720 B13R0.302 CCCCN(CC)C(=O)C(F)C(C)C 913d7f7854ebff3db2d9aef5bd3b84ad [0,2,0,0,0,0|2,0,0]=4 3721 B13R0.302 CCCCN(CC)C(=O)C(O)C(C)C d043bf3f787ec3de313d28090c702831 [0,2,0,0,0,0|2,0,0]=4 3722 B13R0.302 CCCCN(CC)C(=O)[C@@H](O)C(C)C 07aeefd148052b9f083fdb4eac4bfdf7 [0,2,0,0,0,0|2,0,0]=4 3723 B13R0.302 CCCCN(CC)C(=O)[C@@H](O)[C@@H](C)O e86b2fc33cac470963a3dfdd41252924 [0,2,0,0,0,0|2,0,0]=4 3724 B13R0.302 CCCCN(CC)C(=O)[C@H](O)C(C)C 5f51946cd22c71cf5cb45858d409e0b6 [0,2,0,0,0,0|2,0,0]=4 3725 B13R0.376 C#CC(C)NC(=O)N(CC)CCCC 18675051498328a52c16b7d51931c8cc [0,2,0,0,0,0|2,0,0]=4 3726 B13R0.376 C#C[C@@H](C)NC(=O)N(CC)CCCC 40642e223ec34f19c27a127f9602c75b [0,2,0,0,0,0|2,0,0]=4 3727 B13R0.376 C#C[C@H](C)NC(=O)N(CC)CCCC 6af8d7cb150a704361d31ca3d7bf5a82 [0,2,0,0,0,0|2,0,0]=4 3728 B13R0.376 C=CC(C)CC(=O)N(CC)CCCC 2b119badec149a0852cfa53e37e955ad [0,2,0,0,0,0|2,0,0]=4 3729 B13R0.376 C=CC(C)NC(=O)N(CC)CCCC 40e105f68d02b23ad929657cddc45362 [0,2,0,0,0,0|2,0,0]=4 3730 B13R0.376 CCCCN(CC)C(=O)/C=C(/C)\CC 9a5d8ad1e1c562b5d8fc57b2428f5cee [0,2,0,0,0,0|2,0,0]=4 3731 B13R0.376 CCCCN(CC)C(=O)/C=C(\C)/CC 2f79ea4324100b0daf016532f45605ae [0,2,0,0,0,0|2,0,0]=4 3732 B13R0.376 CCCCN(CC)C(=O)CC(C)C#N 7fa2218ec388db0da75f5afed2133fd6 [0,2,0,0,0,0|2,0,0]=4 3733 B13R0.376 CCCCN(CC)C(=O)CC(C)CC ed87023678ce790906a77f4b426b5f55 [0,2,0,0,0,0|2,0,0]=4 3734 B13R0.376 CCCCN(CC)C(=O)CC(C)OC bc3fc01cfd7e9a56f7c86c07423c40ae [0,2,0,0,0,0|2,0,0]=4 3735 B13R0.376 CCCCN(CC)C(=O)CC(O)CC 21464ab5c84ba6464a700ef9fac4a450 [0,2,0,0,0,0|2,0,0]=4 3736 B13R0.376 CCCCN(CC)C(=O)CN(C)CC 907794aa0136d3f98a8d6fada0c98c22 [0,2,0,0,0,0|2,0,0]=4 3737 B13R0.376 CCCCN(CC)C(=O)C[C@@H](C)CC 9decb02a392efdcf98da950c093a98fe [0,2,0,0,0,0|2,0,0]=4 3738 B13R0.376 CCCCN(CC)C(=O)C[C@@H](O)CC 9a5f9907d04fd415c197422ba1ea35c5 [0,2,0,0,0,0|2,0,0]=4 3739 B13R0.376 CCCCN(CC)C(=O)C[C@H](C)CC aa4c3e37186ebb87418be08fd0115752 [0,2,0,0,0,0|2,0,0]=4 3740 B13R0.376 CCCCN(CC)C(=O)C[C@H](O)CC 8b5cbe805cf0d88fa00228de46641f24 [0,2,0,0,0,0|2,0,0]=4 3741 B13R0.376 CCCCN(CC)C(=O)NC(C)C#N d06a4d27e13fa334ce8c80f7ab5ee791 [0,2,0,0,0,0|2,0,0]=4 3742 B13R0.376 CCCCN(CC)C(=O)NC(C)CC e5c516626f0dc689bfbd1034e49605bf [0,2,0,0,0,0|2,0,0]=4 3743 B13R0.376 CCCCN(CC)C(=O)NC(C)CO aed078a80f352c0ef8f608a2a4b7c747 [0,2,0,0,0,0|2,0,0]=4 3744 B13R0.376 CCCCN(CC)C(=O)N[C@@H](C)CC c1aa176379dd3814cc0d56b645398777 [0,2,0,0,0,0|2,0,0]=4 3745 B13R0.376 CCCCN(CC)C(=O)N[C@@H](C)CO d6d3411777ff9b5500204a52918fdd16 [0,2,0,0,0,0|2,0,0]=4 3746 B13R0.376 CCCCN(CC)C(=O)N[C@H](C)CC ba00ee84787e8223521ca4bd0115391b [0,2,0,0,0,0|2,0,0]=4 3747 B13R0.376 CCCCN(CC)C(=O)N[C@H](C)CO d268c8f56fd73f9c59438863101a69d3 [0,2,0,0,0,0|2,0,0]=4 3748 B13R0.379 CCC(NCCBr)C(=O)OC(C)(C)C b18966d0f5677eee29b2eac7e8717d9f [0,2,0,0,0,0|2,0,0]=4 3749 B13R0.379 CCC(NCCF)C(=O)OC(C)(C)C 1977089f87e4fe618bbdd673608ba08b [0,2,0,0,0,0|2,0,0]=4 3750 B13R0.379 CCC(NCCI)C(=O)OC(C)(C)C 126232f5391c23a8bde50b0ce6979d73 [0,2,0,0,0,0|2,0,0]=4 3751 B13R0.379 CCC(NCCO)C(=O)OC(C)(C)C 818fc7b3c021e52bcd812ee9d21974d5 [0,2,0,0,0,0|2,0,0]=4 3752 B13R0.379 CCC(NCCS)C(=O)OC(C)(C)C c636608a4d84761921cd1189f04de3ab [0,2,0,0,0,0|2,0,0]=4 3753 B13R0.379 CCC(NCOC)C(=O)OC(C)(C)C c524e4e23f6c829c9464fdaf1dc41dff [0,2,0,0,0,0|2,0,0]=4 3754 B13R0.379 CCC(NCSC)C(=O)OC(C)(C)C d0e58072ff623adf9a25482fc4535ea0 [0,2,0,0,0,0|2,0,0]=4 3755 B13R0.379 CCC(OCCF)C(=O)OC(C)(C)C 842791f9233fd19884cb0faa65689515 [0,2,0,0,0,0|2,0,0]=4 3756 B13R0.379 CCC(OCCS)C(=O)OC(C)(C)C 5d46650877ae4ca96d4fe9f8b7d63d42 [0,2,0,0,0,0|2,0,0]=4 3757 B13R0.379 CCC(OCOC)C(=O)OC(C)(C)C 73081c928e101c1d45671fd6e8453f8e [0,2,0,0,0,0|2,0,0]=4 3758 B13R0.379 CCCCN(CC)C(=O)CC(C)(C)Br 0afccca08f9446e616cce3edccc58cd6 [0,2,0,0,0,0|2,0,0]=4 3759 B13R0.379 CCCCN(CC)C(=O)CC(C)(C)C 64a26c0ecec281884a2cd2d3fa04b00b [0,2,0,0,0,0|2,0,0]=4 3760 B13R0.379 CCCCN(CC)C(=O)CC(C)(C)Cl ce8bb631a7e60dff670efe60a035fc46 [0,2,0,0,0,0|2,0,0]=4 3761 B13R0.379 CCCCN(CC)C(=O)CC(C)(C)O 0ca338bddebbe84a7144e49bc0c958f3 [0,2,0,0,0,0|2,0,0]=4 3762 B13R0.379 CCCCN(CC)C(=O)CC(C)(F)F 704c2cc4f767f5f973a898d78e378f26 [0,2,0,0,0,0|2,0,0]=4 3763 B13R0.379 CCCCN(CC)C(=O)NC(C)(C)C 38afece9036ed84d470709fc3a9d1ac8 [0,2,0,0,0,0|2,0,0]=4 3764 B13R0.379 CCCNC(CC)C(=O)NC(C)(C)C 6d80bbf5daad21b033c937783dbd5780 [0,2,0,0,0,0|2,0,0]=4 3765 B13R0.379 CCCNC(CC)C(=O)OC(C)(C)C 4bd48ae4b67b4217ebafa18936c7ea1f [0,2,0,0,0,0|1,0,0]=3 3766 B13R0.379 CCCN[C@@H](CC)C(=O)OC(C)(C)C c646d2ee1f7fd6e13fdb020563e936ef [0,2,0,0,0,0|1,0,0]=3 3767 B13R0.379 CCCN[C@H](CC)C(=O)OC(C)(C)C 6718856fae0df6126f6429fccaa4037e [0,2,0,0,0,0|1,0,0]=3 3768 B13R0.379 CCCN[C@H](CO)C(=O)OC(C)(C)C f0fc19b72fbe60b023a7e603f7ad81d4 [0,2,0,0,0,0|2,0,0]=4 3769 B13R0.379 CCCOC(CC)C(=O)NC(C)(C)C 652261ed07ad58776267483c46e06b32 [0,2,0,0,0,0|2,0,0]=4 3770 B13R0.379 CCCOC(CC)C(=O)OC(C)(C)C 1d54e94bade239b56c9932cd2fe3627c [0,2,0,0,0,0|1,0,0]=3 3771 B13R0.379 CCCO[C@@H](CC)C(=O)OC(C)(C)C a5c16d60ee643dad93835836fcfccd07 [0,2,0,0,0,0|1,0,0]=3 3772 B13R0.379 CCCO[C@H](CC)C(=O)OC(C)(C)C d742a191717fead7777e66c906d5d0b7 [0,2,0,0,0,0|1,0,0]=3 3773 B13R0.379 CC[C@@H](NCCF)C(=O)OC(C)(C)C f802fc6f76bbaecaf0ca1a8fc631e203 [0,2,0,0,0,0|2,0,0]=4 3774 B13R0.379 CC[C@@H](NCCO)C(=O)OC(C)(C)C b58263bea895af6cf546cf2555817694 [0,2,0,0,0,0|2,0,0]=4 3775 B13R0.379 CC[C@@H](NCCS)C(=O)OC(C)(C)C 9f2bb822c86d6af48d9b53980d1d7473 [0,2,0,0,0,0|2,0,0]=4 3776 B13R0.379 CC[C@@H](NCOC)C(=O)OC(C)(C)C 38ba7c8cb8aa92bfc13a44ca04f5a6cb [0,2,0,0,0,0|2,0,0]=4 3777 B13R0.379 CC[C@@H](NCSC)C(=O)OC(C)(C)C 8d0da46eea896fccbc7af1150b18f87f [0,2,0,0,0,0|2,0,0]=4 3778 B13R0.379 CC[C@@H](OCCF)C(=O)OC(C)(C)C 36cdcd2038ed3c68a4a4b59e196d3e86 [0,2,0,0,0,0|2,0,0]=4 3779 B13R0.379 CC[C@@H](OCCS)C(=O)OC(C)(C)C fb2fc618e1315a438ee42541b82da0fd [0,2,0,0,0,0|2,0,0]=4 3780 B13R0.379 CC[C@@H](OCOC)C(=O)OC(C)(C)C d3d54b7d005d7cfa1082f932e9d06f67 [0,2,0,0,0,0|2,0,0]=4 3781 B13R0.379 CC[C@@H](OCSC)C(=O)OC(C)(C)C 0e36ea1253685dc6518adc72af6df800 [0,2,0,0,0,0|2,0,0]=4 3782 B13R0.379 CC[C@H](NCCF)C(=O)OC(C)(C)C 9f903188ceaf4238da253c41a545aef9 [0,2,0,0,0,0|2,0,0]=4 3783 B13R0.379 CC[C@H](NCCO)C(=O)OC(C)(C)C 5639df5ef20f2e402a3c3551a9aabaf8 [0,2,0,0,0,0|2,0,0]=4 3784 B13R0.379 CC[C@H](NCCS)C(=O)OC(C)(C)C 520a3ae0804c26413d2091603e71b5d9 [0,2,0,0,0,0|2,0,0]=4 3785 B13R0.379 CC[C@H](NCOC)C(=O)OC(C)(C)C fee5d9550ba407a7134cdb2c048f6b1b [0,2,0,0,0,0|2,0,0]=4 3786 B13R0.379 CC[C@H](NCSC)C(=O)OC(C)(C)C 07b69c9055cd316e4b5e7c8f01d6b6ad [0,2,0,0,0,0|2,0,0]=4 3787 B13R0.379 CC[C@H](OCCF)C(=O)OC(C)(C)C cc57cd87c491f491fed9a6bb8592c159 [0,2,0,0,0,0|2,0,0]=4 3788 B13R0.379 CC[C@H](OCCS)C(=O)OC(C)(C)C fd98ef1ad1bc4201aab1eec700cc07f7 [0,2,0,0,0,0|2,0,0]=4 3789 B13R0.379 CC[C@H](OCOC)C(=O)OC(C)(C)C 845172e4e82afa32db2db35c3af2f002 [0,2,0,0,0,0|2,0,0]=4 3790 B13R0.379 CC[C@H](OCSC)C(=O)OC(C)(C)C ab5bac482e690b333c00470dccc2be0a [0,2,0,0,0,0|2,0,0]=4 3791 B13R0.472 CCC(NCCCCl)C(=O)NC(C)C e33d5ad591fb1ef716e13e043d3be8a7 [0,2,0,0,0,0|2,0,0]=4 3792 B13R0.472 CCC(NCCCO)C(=O)NC(C)C f349ce17a7c093ff776591e9b36b091a [0,2,0,0,0,0|2,0,0]=4 3793 B13R0.472 CCC(NCCOC)C(=O)NC(C)C 8b21721a1a8da5bcbc3d9f7627da5b46 [0,2,0,0,0,0|2,0,0]=4 3794 B13R0.472 CCC(NCCSC)C(=O)NC(C)C 36381a93c83bdbbcde097c0240cd2ace [0,2,0,0,0,0|2,0,0]=4 3795 B13R0.472 CCC(OCCCF)C(=O)NC(C)C 18f45aff822adbeeb2d8408a13a057bd [0,2,0,0,0,0|2,0,0]=4 3796 B13R0.472 CCC(OCCCS)C(=O)NC(C)C 4e367a537f600fa5a383a3eb1b88867f [0,2,0,0,0,0|2,0,0]=4 3797 B13R0.472 CCC(OCCOC)C(=O)NC(C)C b086f4f737e0a9962e7523ed944f8ca7 [0,2,0,0,0,0|2,0,0]=4 3798 B13R0.472 CCC(OCCSC)C(=O)NC(C)C 260427aac1d1aa69d116b3a8d8e222d8 [0,2,0,0,0,0|2,0,0]=4 3799 B13R0.472 CCCCNC(CC)C(=O)NC(C)C 90d66f34b14df9a7ec81b2c198ffe1cc [0,2,0,0,0,0|1,0,0]=3 3800 B13R0.472 CCCCOC(CC)C(=O)NC(C)C 509cacffc13c286780aedcd1aef0fcc1 [0,2,0,0,0,0|1,0,0]=3 3801 B13R0.472 CCN(CCCCO)C(=O)CC(C)C 0193a4c2aa8a606f7808342e10a268e5 [0,2,0,0,0,0|2,0,0]=4 3802 B13R0.472 CCN(CCCCO)C(=O)CC(C)O 83d14dafe082aca37dee98d10196544e [0,2,0,0,0,0|2,0,0]=4 3803 B13R0.472 CCN(CCCCO)C(=O)C[C@@H](C)O 3ae697214dab43791b4a0da34969b2c6 [0,2,0,0,0,0|2,0,0]=4 3804 B13R0.472 CCN(CCCCO)C(=O)C[C@H](C)O 1af7dd15623c473e593f7f60468c17f4 [0,2,0,0,0,0|2,0,0]=4 3805 B13R0.472 CCN(CCCOC)C(=O)CC(C)C b6ee7734c4ff9c7594db898d2d6fcccc [0,2,0,0,0,0|2,0,0]=4 3806 B13R0.472 CCN(CCCOC)C(=O)CC(C)O fd2d08d41228ac925106b8748f12684c [0,2,0,0,0,0|2,0,0]=4 3807 B13R0.472 CCN(CCCOC)C(=O)C[C@@H](C)O f0c944105ba22fea2c72b36c7207000f [0,2,0,0,0,0|2,0,0]=4 3808 B13R0.472 CCN(CCCOC)C(=O)C[C@H](C)O d1a512db31e66d08b258dcdff44960f9 [0,2,0,0,0,0|2,0,0]=4 3809 B13R0.472 CCOCCN(CC)C(=O)CC(C)C 7a05bf325302357563a2fff09d41384d [0,2,0,0,0,0|2,0,0]=4 3810 B13R0.472 CCOCCN(CC)C(=O)CC(C)O c7712b151913d65c5a822dea4851f0a5 [0,2,0,0,0,0|2,0,0]=4 3811 B13R0.472 CCOCCN(CC)C(=O)C[C@@H](C)O 399e9687de2e96a7561245c63911d905 [0,2,0,0,0,0|2,0,0]=4 3812 B13R0.472 CCOCCN(CC)C(=O)C[C@H](C)O 3c00d643c52c77687dd42a07ded46b32 [0,2,0,0,0,0|2,0,0]=4 3813 B13R0.1310 CCCCN(C(=O)CC(C)C)C(C)C dc293b4afeaf7e0e966e02ee902ab920 [0,2,0,0,0,0|2,0,0]=4 3814 B13R0.1310 CCCCN(C(=O)CC(C)O)C(C)C 1e0a3af9b2dee8f79f6243300f4e0384 [0,2,0,0,0,0|2,0,0]=4 3815 B13R0.1310 CCCCN(C(=O)C[C@@H](C)O)C(C)C 861d08dd015c2f35b1483fdefaa349c2 [0,2,0,0,0,0|2,0,0]=4 3816 B13R0.1310 CCCCN(C(=O)C[C@H](C)O)C(C)C 5fbce9d6684b1d6d376cddc88b56c285 [0,2,0,0,0,0|2,0,0]=4 3817 B13R0.1310 CCCNC(C(=O)C)C(=O)OC(C)C 15d5e6e761f3868fffcfc85c68f40c63 [0,2,0,0,0,0|1,0,1]=4 3818 B13R0.1310 CCCN[C@H](C(=O)NC(C)C)C(C)C 4894062a28712b28a9818c7384e9bf98 [0,2,0,0,0,0|2,0,0]=4 3819 B13R0.1310 CCCOC(C(=O)C)C(=O)OC(C)C 4dcfbe85769f6a167f5c9fb77f6895ae [0,2,0,0,0,0|1,0,1]=4 3820 B13R0.1185 C#CC(OCCC)C(CC)CCCC 8494099743b45997505594a8151ad34e [0,2,0,0,0,0|1,0,1]=4 3821 B13R0.1185 C#CC(OCCF)C(CC)CCCC 11d3ed9ee35b0431017e28ae636a42a6 [0,2,0,0,0,0|1,0,1]=4 3822 B13R0.1185 C#CC(OCCS)C(CC)CCCC 9b0b769eda5fe3c20df289c793e19190 [0,2,0,0,0,0|1,0,1]=4 3823 B13R0.1185 C#CC(OCOC)C(CC)CCCC c9b9d565f5b91b3d4af9edae4b5b388c [0,2,0,0,0,0|1,0,1]=4 3824 B13R0.1185 C#CC(OCSC)C(CC)CCCC 02bd1af5e6182bd97355e43c00788d36 [0,2,0,0,0,0|1,0,1]=4 3825 B13R0.477 C=C(CC)C(=O)N(CCCC)C(C)C 9b8c11ad3535e8ca57718c8acbd182cf [0,2,0,0,0,0|2,0,0]=4 3826 B13R0.477 CCCCN(C(=O)C(=O)CC)C(C)C bc55b9166cf9cc26357ef488def6d8e9 [0,2,0,0,0,0|2,0,0]=4 3827 B13R0.477 CCCCN(C(=O)C(O)CC)C(C)C 955f346851c462ce2e64ba9bf17f9058 [0,2,0,0,0,0|2,0,0]=4 3828 B13R0.477 CCCCN(C(=O)[C@@H](O)CC)C(C)C 4dcb9733fcaeed5b06396431091b1042 [0,2,0,0,0,0|2,0,0]=4 3829 B13R0.477 CCCCN(C(=O)[C@@H](S)CC)C(C)C f0b0d7c95fe16a4c479dda7c20db5ae0 [0,2,0,0,0,0|2,0,0]=4 3830 B13R0.477 CCCCN(C(=O)[C@H](O)CC)C(C)C 9a3946550b177778589ff411bb69486e [0,2,0,0,0,0|2,0,0]=4 3831 B13R0.512 C=C(CC)C(=O)N(CC)CCCCO 36be1f43fee696807b646d1b2f926b4f [0,2,0,0,0,0|2,0,0]=4 3832 B13R0.512 C=C(CC)C(=O)N(CC)CCCOC 01fd1eea953830004f7adf028e4d07bc [0,2,0,0,0,0|2,0,0]=4 3833 B13R0.512 C=C(CC)C(=O)N(CC)CCOCC 4f155a099d6a014cba709ebaa42edf92 [0,2,0,0,0,0|2,0,0]=4 3834 B13R0.512 CCC(=O)C(=O)N(CC)CCCCO 88728a087f4f8a94473fbdc5914e1776 [0,2,0,0,0,0|2,0,0]=4 3835 B13R0.512 CCC(=O)C(=O)N(CC)CCCOC 05af77ffd15b0d8a94d022f54ab789a3 [0,2,0,0,0,0|2,0,0]=4 3836 B13R0.512 CCC(O)C(=O)N(CC)CCCCO 6e1a7f6fd8c920043499ae6f5f1691b3 [0,2,0,0,0,0|2,0,0]=4 3837 B13R0.512 CCC(O)C(=O)N(CC)CCCOC c3c99254746eb128d7c055bb04fc811b [0,2,0,0,0,0|2,0,0]=4 3838 B13R0.512 CCOCCN(CC)C(=O)C(=O)CC 5f893820c3195cc17572e3f4711de606 [0,2,0,0,0,0|2,0,0]=4 3839 B13R0.512 CCOCCN(CC)C(=O)C(O)CC 9e38c807bdff6ffb951bf2b7c7dc2c18 [0,2,0,0,0,0|2,0,0]=4 3840 B13R0.512 CCOCCN(CC)C(=O)[C@@H](O)CC 1441fc56b4e828b51f2113f0407cdb50 [0,2,0,0,0,0|2,0,0]=4 3841 B13R0.512 CCOCCN(CC)C(=O)[C@@H](S)CC 4e333f1007089d10ad25db99af8f6120 [0,2,0,0,0,0|2,0,0]=4 3842 B13R0.512 CCOCCN(CC)C(=O)[C@H](O)CC 8ee15377f88afc87af702acd09ef2cfb [0,2,0,0,0,0|2,0,0]=4 3843 B13R0.512 CC[C@@H](O)C(=O)N(CC)CCCCO b07ee5046163c56b9830c3908bc0a221 [0,2,0,0,0,0|2,0,0]=4 3844 B13R0.512 CC[C@@H](O)C(=O)N(CC)CCCOC b1c6c6a96fc0eb85b6f178946c9aad0c [0,2,0,0,0,0|2,0,0]=4 3845 B13R0.512 CC[C@H](O)C(=O)N(CC)CCCCO 6c83dc2e8ababfcf9f90919bb7af62fd [0,2,0,0,0,0|2,0,0]=4 3846 B13R0.512 CC[C@H](O)C(=O)N(CC)CCCOC b2ffb4a5f84aaba2e5737e8e31775d3f [0,2,0,0,0,0|2,0,0]=4 3847 B13R0.512 CC[C@H](S)C(=O)N(CC)CCCCO e3497db69e2aa22c3c89b031a1149b3b [0,2,0,0,0,0|2,0,0]=4 3848 B13R0.512 CC[C@H](S)C(=O)N(CC)CCCOC ca8fc8056cdac08040ee4822e3ac0f0f [0,2,0,0,0,0|2,0,0]=4 3849 B13R0.648 CCCCN(CC)C(=O)C(F)(F)CC 40a71e3e104f4b05b0197e0a0b5ce697 [0,2,0,0,0,0|2,0,0]=4 3850 B13R0.1191 C/C=C(/CC)\C(=O)N(CC)CCCC f24056e31ecd0c9de066eb01c98f4d8e [0,2,0,0,0,0|2,0,0]=4 3851 B13R0.1191 C/C=C(\CC)/C(=O)N(CC)CCCC 6f20829f8f0ca4d4ba8007232d405be0 [0,2,0,0,0,0|2,0,0]=4 3852 B13R0.1191 CC=C(CC)C(=O)N(CC)CCCC 1c62435d2fe2aec0521b0d2a6b60ff00 [0,2,0,0,0,0|2,0,0]=4 3853 B13R0.1191 CCCCN(CC)C(=O)C(CC)OC 405a64424acd13cf557b693826246ffa [0,2,0,0,0,0|2,0,0]=4 3854 B13R0.1191 CCCNC(CC)C(=O)N(CC)CC d1e1989e1c466f439ca7eec7c8ecb07b [0,2,0,0,0,0|2,0,0]=4 3855 B13R0.1191 CCCOC(CC)C(=O)N(CC)CC 0c70f98436842f041b0ca34719c0d272 [0,2,0,0,0,0|2,0,0]=4 3856 B13R0.498 CC/C=C/C(=O)N(CCCC)C(C)C f843fa18c2c14aa8bf706576a1c02118 [0,2,0,0,0,0|2,0,0]=4 3857 B13R0.498 CC/C=C\C(=O)N(CCCC)C(C)C 8aa71f8de0131b341946c9acb37527c4 [0,2,0,0,0,0|2,0,0]=4 3858 B13R0.498 CCC#CC(=O)N(CCCC)C(C)C 6df31a3390a7652a996b3a4cf02e06d1 [0,2,0,0,0,0|2,0,0]=4 3859 B13R0.498 CCC=CC(=O)N(CCCC)C(C)C 950e2c4217654170100cfb20cfa5d603 [0,2,0,0,0,0|2,0,0]=4 3860 B13R0.498 CCCCC(=O)N(CCCC)C(C)C 3e726304571465eecf6e02f1233058e7 [0,2,0,0,0,0|2,0,0]=4 3861 B13R0.498 CCCCN(C(=O)CCCF)C(C)C 147ec81cfb4b810c71a1aa9c7edca363 [0,2,0,0,0,0|2,0,0]=4 3862 B13R0.498 CCCCN(C(=O)CCOC)C(C)C 91c3d0b1c346fad0a4656e60d45e7007 [0,2,0,0,0,0|2,0,0]=4 3863 B13R0.498 CCCCN(C(=O)CCSC)C(C)C 99ec80f68e632500b47a43dadabc8a4f [0,2,0,0,0,0|2,0,0]=4 3864 B13R0.498 CCCCN(C(=O)COCC)C(C)C 56abd4231695c5f3167691c11a339345 [0,2,0,0,0,0|1,0,0]=3 3865 B13R0.498 CCCCN(C(=O)CSCC)C(C)C 5bc3ba383e0af71e6521cf44ac4807c0 [0,2,0,0,0,0|1,1,0]=4 3866 B13R0.498 CCCCN(C(=O)NCCC)C(C)C 20a70896858ae56870b567bd8d941b50 [0,2,0,0,0,0|2,0,0]=4 3867 B13R0.498 CCCCN(C(=O)NCCF)C(C)C dd1868e3e90df3d535a7772cb25d5541 [0,2,0,0,0,0|2,0,0]=4 3868 B13R0.498 CCCCN(C(=O)NCCN)C(C)C b3ded0aa19e1fd8e0cbec51724722f93 [0,2,0,0,0,0|2,0,0]=4 3869 B13R0.498 CCCCN(C(=O)NCCO)C(C)C eaaf868c56178142b3905ffb3947f9ff [0,2,0,0,0,0|2,0,0]=4 3870 B13R0.498 CCCCN(C(=O)NCCS)C(C)C bd79142cb07dddd389ebfc5b07fcce62 [0,2,0,0,0,0|2,0,0]=4 3871 B13R0.498 CCOCC(=O)N(CCCO)C(C)C c14ee6e6d248e20e6955ec45ffb2da78 [0,2,0,0,0,0|2,0,0]=4 3872 B13R0.498 CCOCC(=O)N(CCOC)C(C)C 00d14bf590fe9893168f8be263b3a2e9 [0,2,0,0,0,0|2,0,0]=4 3873 B13R0.710 CCCNC(C(=O)OCC)C(F)(F)F f680c82258f712ca61f6157aee3f7616 [0,2,0,0,0,0|2,0,0]=4 3874 B13R0.710 CCCN[C@H](C(=O)OCC)C(C)(C)C 6290c63797540a732f9b73e2c9207459 [0,2,0,0,0,0|1,0,0]=3 3875 B13R0.710 CCCOC(C(=O)OCC)C(C)(F)F 1c3c45b1a895fa235893d7954d70bb74 [0,2,0,0,0,0|1,0,0]=3 3876 B13R0.710 CCCOC(C(=O)OCC)C(F)(F)F 1803b5b670a7fa0016566685d2698573 [0,2,0,0,0,0|2,0,0]=4 3877 B13R0.710 CCOC(=O)C(OCCF)C(C)(F)F 6466df9999f98b99bec3675da441cc22 [0,2,0,0,0,0|2,0,0]=4 3878 B13R0.710 CCOC(=O)C(OCCS)C(C)(F)F e2192ccc4f6f3246ace584e80d9d9451 [0,2,0,0,0,0|2,0,0]=4 3879 B13R0.710 CCOC(=O)C(OCOC)C(C)(F)F 670cf8536f95ecca70e8fc8fefe71f6f [0,2,0,0,0,0|2,0,0]=4 3880 B13R0.710 CCOC(=O)C(OCSC)C(C)(F)F 5c9367926b8097e4ca9690df6e9a1a14 [0,2,0,0,0,0|2,0,0]=4 3881 B13R0.710 CCOC(=O)[C@@H](NCCF)C(C)(C)C d41183669bdab171edb6dcddec87b4e2 [0,2,0,0,0,0|2,0,0]=4 3882 B13R0.710 CCOC(=O)[C@@H](NCCO)C(C)(C)C 9e0e004a4107924fa50a4a3c9bbb326e [0,2,0,0,0,0|2,0,0]=4 3883 B13R0.710 CCOC(=O)[C@@H](NCCS)C(C)(C)C 3aa8e116324c8dafa525ad6f2dd4e0dd [0,2,0,0,0,0|2,0,0]=4 3884 B13R0.710 CCOC(=O)[C@@H](NCOC)C(C)(C)C a840097231097069fe1c0506574fd5ea [0,2,0,0,0,0|2,0,0]=4 3885 B13R0.710 CCOC(=O)[C@@H](NCSC)C(C)(C)C bc300add768a1bd464cf6f09eaeef8a7 [0,2,0,0,0,0|2,0,0]=4 3886 B13R0.1271 C#CCCNC(C(=O)OCC)C(C)C e600743891645eb04e3901855ea9fc4a [0,2,0,0,0,0|0,0,2]=4 3887 B13R0.1271 C#CCCN[C@@H](C(=O)OCC)C(C)C 0e9c74a1eab1bdd09621cb8ef3a848fd [0,2,0,0,0,0|0,0,2]=4 3888 B13R0.1271 C#CCCN[C@H](C(=O)OCC)C(C)C 29caa26d80bfe15777498610ac8c78e4 [0,2,0,0,0,0|0,0,2]=4 3889 B13R0.1271 C#CCCOC(C(=O)OCC)C(C)C f657b551062a73f0e5e4ff65fc31d0b6 [0,2,0,0,0,0|0,0,2]=4 3890 B13R0.1271 C#CCCO[C@@H](C(=O)OCC)C(C)C 15a369a98f743f6cb6c45c6395295a91 [0,2,0,0,0,0|0,0,2]=4 3891 B13R0.1271 C/C=C/CNC(C(=O)OCC)C(C)C d935eed585a817636665a90c3c30c8f4 [0,2,0,0,0,0|0,0,2]=4 3892 B13R0.1271 C/C=C/CN[C@@H](C(=O)OCC)C(C)C 0b6f9b836db08d71542f13092884945a [0,2,0,0,0,0|0,0,2]=4 3893 B13R0.1271 C/C=C/CN[C@H](C(=O)OCC)C(C)C 4518035c5a652aef1268b7f2537ef4f2 [0,2,0,0,0,0|0,0,2]=4 3894 B13R0.1271 C/C=C/COC(C(=O)OCC)C(C)C 7744da7de48e3287260d8f6ed88cb986 [0,2,0,0,0,0|0,0,2]=4 3895 B13R0.1271 C/C=C/CO[C@@H](C(=O)OCC)C(C)C 0b707400524154d27bca4cc6bf9b9d49 [0,2,0,0,0,0|0,0,2]=4 3896 B13R0.1271 C/C=C\CNC(C(=O)OCC)C(C)C 7f8dc00dd7c1dc2ed77e968565824868 [0,2,0,0,0,0|0,0,2]=4 3897 B13R0.1271 C/C=C\CN[C@@H](C(=O)OCC)C(C)C b0a6b1d58afc7f528d23cd601281a740 [0,2,0,0,0,0|0,0,2]=4 3898 B13R0.1271 C/C=C\CN[C@H](C(=O)OCC)C(C)C 9936f1e17f12438da3940b3772b98117 [0,2,0,0,0,0|0,0,2]=4 3899 B13R0.1271 C/C=C\COC(C(=O)OCC)C(C)C df69ab718cf415b40a90d3d3a3021126 [0,2,0,0,0,0|0,0,2]=4 3900 B13R0.1271 C/C=C\CO[C@@H](C(=O)OCC)C(C)C e33e431b372e9e2b22ac0fb01be9d452 [0,2,0,0,0,0|0,0,2]=4 3901 B13R0.1271 C=CCCNC(C(=O)OCC)C(C)C aaf6cb8387a7a55ed6a23225cf3e26ff [0,2,0,0,0,0|0,0,2]=4 3902 B13R0.1271 C=CCCN[C@@H](C(=O)OCC)C(C)C 5d421f73195cc50db1196861ec34e8b7 [0,2,0,0,0,0|0,0,2]=4 3903 B13R0.1271 C=CCCN[C@H](C(=O)OCC)C(C)C bac0bf39ad5dd587ed237d62d262d8ab [0,2,0,0,0,0|0,0,2]=4 3904 B13R0.1271 C=CCCOC(C(=O)OCC)C(C)C f2f52992df50968701d18471f9c46d38 [0,2,0,0,0,0|0,0,2]=4 3905 B13R0.1271 C=CCCO[C@@H](C(=O)OCC)C(C)C 2ff599a53a5042ffda1e081ae9b9e442 [0,2,0,0,0,0|0,0,2]=4 3906 B13R0.1271 CC#CCNC(C(=O)OCC)C(C)C 3448befb3a663045760ff4d786955772 [0,2,0,0,0,0|0,0,2]=4 3907 B13R0.1271 CC#CCN[C@@H](C(=O)OCC)C(C)C aaedcf2de4718d89182c5bac056a72eb [0,2,0,0,0,0|0,0,2]=4 3908 B13R0.1271 CC#CCOC(C(=O)OCC)C(C)C 19f5ede18eb275a549aa961c80a2c41c [0,2,0,0,0,0|0,0,2]=4 3909 B13R0.1271 CC#CCO[C@@H](C(=O)OCC)C(C)C ba75e89de11b5e9d7a6d3423aeb945ab [0,2,0,0,0,0|0,0,2]=4 3910 B13R0.1271 CC=CCNC(C(=O)OCC)C(C)C 5c1003b9dafdcf52762f116f7e28c5a9 [0,2,0,0,0,0|0,0,2]=4 3911 B13R0.1271 CC=CCN[C@@H](C(=O)OCC)C(C)C 56008a06e0fee427b8c25b397867aead [0,2,0,0,0,0|0,0,2]=4 3912 B13R0.1271 CC=CCOC(C(=O)OCC)C(C)C 18ab2f36468baab5beaf07bde8faaee1 [0,2,0,0,0,0|0,0,2]=4 3913 B13R0.1271 CC=CCO[C@@H](C(=O)OCC)C(C)C 4299a6a6e98b94d78f6a132dbb8b76bb [0,2,0,0,0,0|0,0,2]=4 3914 B13R0.1271 CCCC(=O)N(CCCCO)C(C)C 6926e0bbdd2088280ce6e869db97dd62 [0,2,0,0,0,0|2,0,0]=4 3915 B13R0.1271 CCCC(=O)N(CCCOC)C(C)C cccc5208320bb67f63dcb4907f659f22 [0,2,0,0,0,0|2,0,0]=4 3916 B13R0.1271 CCCCCN(C(=O)CCC)C(C)C c65ea2276d8fe3a8c32a0fc4ed4f6994 [0,2,0,0,0,0|2,0,0]=4 3917 B13R0.1271 CCCCNC(C(=O)C)C(=O)OCC 5736969697e5a35b46bd042b60919fa2 [0,2,0,0,0,0|0,0,1]=3 3918 B13R0.1271 CCCCNC(C(=O)OCC)C(C)C 22526f707b6116d1f94710b3c5637a76 [0,2,0,0,0,0|0,0,0]=2 3919 B13R0.1271 CCCCN[C@@H](C(=O)OCC)C(C)C c12f719adb5649882668b374f038b2b5 [0,2,0,0,0,0|0,0,0]=2 3920 B13R0.1271 CCCCN[C@H](C(=O)OCC)C(C)C f37d174efe10ed61f4df1a36e5982fac [0,2,0,0,0,0|0,0,0]=2 3921 B13R0.1271 CCCCOC(C(=O)C)C(=O)OCC 12f1c07381ba4783f3a4cbedb3cdb8de [0,2,0,0,0,0|0,0,1]=3 3922 B13R0.1271 CCCCOC(C(=O)OCC)C(C)C 6fa3a94fbf134e32ee29aba1e6f99795 [0,2,0,0,0,0|0,0,0]=2 3923 B13R0.1271 CCCCO[C@@H](C(=O)OCC)C(C)C 38231e75c2498b1c03306086ff9140f3 [0,2,0,0,0,0|0,0,0]=2 3924 B13R0.1271 CCOC(=O)C(NCCC#N)C(C)C 8515b421f7aba300ca52e05e2ce25156 [0,2,0,0,0,0|1,0,1]=4 3925 B13R0.1271 CCOC(=O)C(NCCC=O)C(C)C 15e744d1cb028340b00771a99a3b3026 [0,2,0,0,0,0|1,0,1]=4 3926 B13R0.1271 CCOC(=O)C(NCCCCl)C(=O)C 298ffe571ef6d42644c7fe4e3c7809a0 [0,2,0,0,0,0|1,0,1]=4 3927 B13R0.1271 CCOC(=O)C(NCCCCl)C(C)C 641155a161b0fa9c7d719352e855b179 [0,2,0,0,0,0|1,0,0]=3 3928 B13R0.1271 CCOC(=O)C(NCCCF)C(C)C 83d360dcf9456867455bb2a0e1a873cd [0,2,0,0,0,0|1,0,0]=3 3929 B13R0.1271 CCOC(=O)C(NCCCO)C(=O)C 72378906776db9b69694700ff77747c7 [0,2,0,0,0,0|1,0,1]=4 3930 B13R0.1271 CCOC(=O)C(NCCCO)C(C)C 967c80f98f25d286186dbfeb3a6b52ee [0,2,0,0,0,0|1,0,0]=3 3931 B13R0.1271 CCOC(=O)C(NCCCS)C(C)C 003641672746dfd0d3addc92414ec5d8 [0,2,0,0,0,0|1,0,0]=3 3932 B13R0.1271 CCOC(=O)C(NCCOC)C(=O)C ad74d1afb25e33532a5585316e711277 [0,2,0,0,0,0|1,0,1]=4 3933 B13R0.1271 CCOC(=O)C(NCCOC)C(C)C dac455328cbfb275270eb6180a3ace5c [0,2,0,0,0,0|1,0,0]=3 3934 B13R0.1271 CCOC(=O)C(NCCON)C(C)C f02da3e5a91e1bfd7f516081a2060443 [0,2,0,0,0,0|2,0,0]=4 3935 B13R0.1271 CCOC(=O)C(NCCSC)C(=O)C 4938ac4c2fac1198950ae8419b3bba64 [0,2,0,0,0,0|1,0,1]=4 3936 B13R0.1271 CCOC(=O)C(NCCSC)C(C)C 79fdd4678a131fd1f9df76793422cb84 [0,2,0,0,0,0|1,0,0]=3 3937 B13R0.1271 CCOC(=O)C(OCCC#N)C(C)C f7daaf55446e4710960c6eb81ba81eda [0,2,0,0,0,0|1,0,1]=4 3938 B13R0.1271 CCOC(=O)C(OCCC=O)C(C)C 1a712c8b4d65a376e9b74624c1784d47 [0,2,0,0,0,0|1,0,1]=4 3939 B13R0.1271 CCOC(=O)C(OCCCF)C(=O)C c1d030e9602a973ae3a8fa1a5f63bc02 [0,2,0,0,0,0|1,0,1]=4 3940 B13R0.1271 CCOC(=O)C(OCCCF)C(C)C fdd88ee575d8a4607331d685964b77c7 [0,2,0,0,0,0|1,0,0]=3 3941 B13R0.1271 CCOC(=O)C(OCCCS)C(=O)C 3cd9f8eb86255abc337d1ef8f0008f3f [0,2,0,0,0,0|1,0,1]=4 3942 B13R0.1271 CCOC(=O)C(OCCCS)C(C)C fc0a681521469ab0343420d57033d597 [0,2,0,0,0,0|1,0,0]=3 3943 B13R0.1271 CCOC(=O)C(OCCOC)C(=O)C bfbd7f4e624377c081b57d1c24f913f2 [0,2,0,0,0,0|1,0,1]=4 3944 B13R0.1271 CCOC(=O)C(OCCOC)C(C)C 8db854a3bea037d11dff385f0123a53e [0,2,0,0,0,0|1,0,0]=3 3945 B13R0.1271 CCOC(=O)C(OCCSC)C(=O)C 5d453abd2c827ddfdf6b873bdb21c38f [0,2,0,0,0,0|1,0,1]=4 3946 B13R0.1271 CCOC(=O)C(OCCSC)C(C)C 55a2e2fd55b455de5d72c2886764868c [0,2,0,0,0,0|1,0,0]=3 3947 B13R0.1271 CCOC(=O)[C@@H](NCCC#N)C(C)C 78cbcd0ddf2236fb369cd0c5599e22f0 [0,2,0,0,0,0|1,0,1]=4 3948 B13R0.1271 CCOC(=O)[C@@H](NCCC=O)C(C)C 9ad5a90d575a4b37b93c11f28a46031e [0,2,0,0,0,0|1,0,1]=4 3949 B13R0.1271 CCOC(=O)[C@@H](NCCCF)C(C)C fd85afab7b6b39bb6daee3e2f6a48ef2 [0,2,0,0,0,0|1,0,0]=3 3950 B13R0.1271 CCOC(=O)[C@@H](NCCCO)C(C)C 5aee6dcbcd557a279f64b2ad036c037f [0,2,0,0,0,0|1,0,0]=3 3951 B13R0.1271 CCOC(=O)[C@@H](NCCCS)C(C)C 1a8a6e97c8359a9852f5c97acd510cbf [0,2,0,0,0,0|1,0,0]=3 3952 B13R0.1271 CCOC(=O)[C@@H](NCCOC)C(C)C 08be7d50df11581b6d5f0c10b1b0a886 [0,2,0,0,0,0|1,0,0]=3 3953 B13R0.1271 CCOC(=O)[C@@H](NCCSC)C(C)C cf32d2a601a3310afe1f12e7b32ce23d [0,2,0,0,0,0|1,0,0]=3 3954 B13R0.1271 CCOC(=O)[C@H](NCCC#N)C(C)C 28dea217e69de5734fdafc29b91ab6ab [0,2,0,0,0,0|1,0,1]=4 3955 B13R0.1271 CCOC(=O)[C@H](NCCC=O)C(C)C f10a363fc4e21354bf2413463f9afd6d [0,2,0,0,0,0|1,0,1]=4 3956 B13R0.1271 CCOC(=O)[C@H](NCCCCl)C(C)C b803de0467675fee591ca60ba45f607b [0,2,0,0,0,0|1,0,0]=3 3957 B13R0.1271 CCOC(=O)[C@H](NCCCF)C(C)C 5e0e188c01633da42ab9540bf5e60f9c [0,2,0,0,0,0|1,0,0]=3 3958 B13R0.1271 CCOC(=O)[C@H](NCCCO)C(C)C 7fb683716fc485bd3cbda13fde37e545 [0,2,0,0,0,0|1,0,0]=3 3959 B13R0.1271 CCOC(=O)[C@H](NCCCS)C(C)C f04eb26db3c5486de2a2fb8ac60072e4 [0,2,0,0,0,0|1,0,0]=3 3960 B13R0.1271 CCOC(=O)[C@H](NCCOC)C(C)C 8678225a8c9db9bb6be85375253d9862 [0,2,0,0,0,0|1,0,0]=3 3961 B13R0.1271 CCOC(=O)[C@H](NCCON)C(C)C ae15906bbbd5685ce35e277de37bfa38 [0,2,0,0,0,0|2,0,0]=4 3962 B13R0.1271 CCOC(=O)[C@H](NCCSC)C(C)C 1705263c6b0baea4391b8069717c18ff [0,2,0,0,0,0|1,0,0]=3 3963 B13R0.1271 CCOC(=O)[C@H](OCCC#N)C(C)C 206ba2763e7657665e7575a0051a718d [0,2,0,0,0,0|1,0,1]=4 3964 B13R0.1271 CCOC(=O)[C@H](OCCC=O)C(C)C 76b181178281c966ab03c9d2e5063982 [0,2,0,0,0,0|1,0,1]=4 3965 B13R0.1271 CCOC(=O)[C@H](OCCCF)C(C)C 4d620bdbdeada362523ab5ac652830f9 [0,2,0,0,0,0|1,0,0]=3 3966 B13R0.1271 CCOC(=O)[C@H](OCCCS)C(C)C 6a4aee9ad0dd2280e6e0e93d89a153de [0,2,0,0,0,0|1,0,0]=3 3967 B13R0.1271 CCOC(=O)[C@H](OCCOC)C(C)C b852e8282946e20226201e400c51de55 [0,2,0,0,0,0|1,0,0]=3 3968 B13R0.1271 CCOC(=O)[C@H](OCCSC)C(C)C 2065b964cdb335d7dca646d0bf3007d4 [0,2,0,0,0,0|1,0,0]=3 3969 B13R0.1271 CCOCNC(C(=O)OCC)C(C)C 6a13bf0c8a642294c1acf786c64c7ba7 [0,2,0,0,0,0|1,0,0]=3 3970 B13R0.1271 CCOCN[C@@H](C(=O)OCC)C(C)C 4855aa27a4ca1e369ab0eca15ac9a3f7 [0,2,0,0,0,0|1,0,0]=3 3971 B13R0.1271 CCOCN[C@H](C(=O)OCC)C(C)C 4758e329bf595df92d02abc668652577 [0,2,0,0,0,0|1,0,0]=3 3972 B13R0.1271 CCOCO[C@@H](C(=O)OCC)C(C)C 38d4af9663e4ce23b571c9484e1c6abc [0,2,0,0,0,0|1,0,0]=3 3973 B13R0.1664 CCCNC(C)(C(=O)OCC)C(C)C 13a1425cca886d1877f53d7ffad69ce1 [0,2,0,0,0,0|1,0,0]=3 3974 B13R0.1664 CCOC(=O)C(C)(NCCF)C(C)C 3d22ff1032340afe18b420fee56ff0ac [0,2,0,0,0,0|2,0,0]=4 3975 B13R0.1664 CCOC(=O)C(C)(NCCO)C(C)C e32503f29becba2edc77f52714be3289 [0,2,0,0,0,0|2,0,0]=4 3976 B13R0.1664 CCOC(=O)C(C)(NCCS)C(C)C b45db611f74ab4e2e7dfeea6557e809b [0,2,0,0,0,0|2,0,0]=4 3977 B13R0.1664 CCOC(=O)C(C)(NCOC)C(C)C 2ca440c55d54e6c91f8eff682764a220 [0,2,0,0,0,0|2,0,0]=4 3978 B13R0.1664 CCOC(=O)C(C)(NCSC)C(C)C 3e85c4c27321b251cf3beebbf2c2639d [0,2,0,0,0,0|2,0,0]=4 3979 B13R0.378 C=C(C)CCC(=O)N(CC)CCCC 6df3044bf4b18a21111778e747409414 [0,2,0,0,0,0|2,0,0]=4 3980 B13R0.378 C=C(C)CNC(=O)N(CC)CCCC a281058a882bb963679660b73bd49666 [0,2,0,0,0,0|2,0,0]=4 3981 B13R0.378 CCCCN(CC)C(=O)/C=C/C(C)C c07e463461444d50b97612364ff2168d [0,2,0,0,0,0|2,0,0]=4 3982 B13R0.378 CCCCN(CC)C(=O)CCC(=O)C 3e6bdbdc9a3d809bc9eacbc18117373e [0,2,0,0,0,0|2,0,0]=4 3983 B13R0.378 CCCCN(CC)C(=O)CCC(C)C 9f9da45f1dcaa09d25eca9e699d0133a [0,2,0,0,0,0|2,0,0]=4 3984 B13R0.378 CCCCN(CC)C(=O)CCC(C)O ce7435d0da40ed0fb557c33faac7fd14 [0,2,0,0,0,0|2,0,0]=4 3985 B13R0.378 CCCCN(CC)C(=O)CCC(C)S 661311f47c45eae196af35bd93ffdcec [0,2,0,0,0,0|2,0,0]=4 3986 B13R0.378 CCCCN(CC)C(=O)CCC(F)F b0b543c8c11304ebd9be8cdebbc8db68 [0,2,0,0,0,0|2,0,0]=4 3987 B13R0.378 CCCCN(CC)C(=O)CCN(C)C f29b29474cd184303800caa7d91525c0 [0,2,0,0,0,0|2,0,0]=4 3988 B13R0.378 CCCCN(CC)C(=O)CCS(=O)C d654cccee25db9abe8cfb89bf4579bfa [0,2,0,0,0,0|2,0,0]=4 3989 B13R0.378 CCCCN(CC)C(=O)CC[C@H](C)S 6fe698bbdbd5957bd47d545e5ea7435c [0,2,0,0,0,0|2,0,0]=4 3990 B13R0.378 CCCCN(CC)C(=O)COC(=O)C 91f750ceb9a79f49e37e22dc03c5557d [0,2,0,0,0,0|1,0,1]=4 3991 B13R0.378 CCCCN(CC)C(=O)COC(C)C f073f03d2c03ab1bb556b7a31ba45ddc [0,2,0,0,0,0|1,0,0]=3 3992 B13R0.378 CCCCN(CC)C(=O)COC(F)F e357302223c6f25da84abacc4b00f93e [0,2,0,0,0,0|2,0,0]=4 3993 B13R0.378 CCCCN(CC)C(=O)NCC(=O)C a9245d5031604778e256069541ef2413 [0,2,0,0,0,0|2,0,0]=4 3994 B13R0.378 CCCCN(CC)C(=O)NCC(C)C 872c434f0828da40d506d0bd869e88a5 [0,2,0,0,0,0|2,0,0]=4 3995 B13R0.378 CCCCN(CC)C(=O)NCC(C)O 9113a3f53500ed1b45c1cf9aaaf55225 [0,2,0,0,0,0|2,0,0]=4 3996 B13R0.378 CCCCN(CC)C(=O)NCC(F)F 75adff1fb0e1fe4b397176d21b094b37 [0,2,0,0,0,0|2,0,0]=4 3997 B13R0.378 CCCCN(CC)C(=O)NC[C@@H](C)O cae7f5b8870b495d5161b7f81501d05d [0,2,0,0,0,0|2,0,0]=4 3998 B13R0.378 CCCCN(CC)C(=O)NC[C@H](C)O 5016f895ec1664160b4e802e4e43d2f0 [0,2,0,0,0,0|2,0,0]=4 3999 B13R0.378 CCN(CCCO)C(=O)COC(C)C 2dab3805adafa02a34bc92d4c4f163b7 [0,2,0,0,0,0|2,0,0]=4 4000 B13R0.378 CCN(CCOC)C(=O)COC(C)C e173365543527e62b4c73da668c1d949 [0,2,0,0,0,0|2,0,0]=4 4001 B13R0.1053 CC/C=C/C(=O)N(CC)CCCCO 0f9742f7a8aefcb92b7d402d1d02e237 [0,2,0,0,0,0|2,0,0]=4 4002 B13R0.1053 CC/C=C/C(=O)N(CC)CCCOC a1772a25af6c642d37f787847f4649a9 [0,2,0,0,0,0|2,0,0]=4 4003 B13R0.1053 CC/C=C/C(=O)N(CC)CCOCC 6cf6f1df4b28684e241331ec6a0b68da [0,2,0,0,0,0|2,0,0]=4 4004 B13R0.1053 CC/C=C\C(=O)N(CC)CCCCO 29ea7fecb714b471506b1263ac30b94b [0,2,0,0,0,0|2,0,0]=4 4005 B13R0.1053 CC/C=C\C(=O)N(CC)CCCOC b9793f8b424c1e8ec10ceac801380d25 [0,2,0,0,0,0|2,0,0]=4 4006 B13R0.1053 CC/C=C\C(=O)N(CC)CCOCC 77182e102f103f1f8870a2091b0d1840 [0,2,0,0,0,0|2,0,0]=4 4007 B13R0.1053 CCC#CC(=O)N(CC)CCCCO d927d20f99bb7483e912ec7326048c2a [0,2,0,0,0,0|2,0,0]=4 4008 B13R0.1053 CCC#CC(=O)N(CC)CCCOC d82365415c1722ee6960cd222756b9b6 [0,2,0,0,0,0|2,0,0]=4 4009 B13R0.1053 CCC#CC(=O)N(CC)CCOCC 0c7f2da1a498a38615ed468797de6f15 [0,2,0,0,0,0|2,0,0]=4 4010 B13R0.1053 CCC=CC(=O)N(CC)CCCCO 0ca9ce214ef7f4380744801d838ee3b7 [0,2,0,0,0,0|2,0,0]=4 4011 B13R0.1053 CCC=CC(=O)N(CC)CCCOC b4854148821d45484291f6a9b74619e4 [0,2,0,0,0,0|2,0,0]=4 4012 B13R0.1053 CCC=CC(=O)N(CC)CCOCC 4aa00b0a6b0a0dae39cc147f0de758b4 [0,2,0,0,0,0|2,0,0]=4 4013 B13R0.1053 CCCCC(=O)N(CC)CCCCO eedf57ec79f10c826863a5cc0b08e9fe [0,2,0,0,0,0|2,0,0]=4 4014 B13R0.1053 CCCCC(=O)N(CC)CCCOC 6fce1403a5334e9f19addb622132dfe5 [0,2,0,0,0,0|2,0,0]=4 4015 B13R0.1053 CCCCC(=O)N(CC)CCOCC 084dcd0157317215bf031c5fc5e05ff2 [0,2,0,0,0,0|2,0,0]=4 4016 B13R0.1053 CCCCNC(CC)C(=O)NCCC 9ee8d3c6bb91c3bca5220c7de95f98d0 [0,2,0,0,0,0|1,0,0]=3 4017 B13R0.1053 CCCCN[C@@H](CC)C(=O)NCCC aecbb25c169cb86345a5bed7c4ffb082 [0,2,0,0,0,0|1,0,0]=3 4018 B13R0.1053 CCCCOC(CC)C(=O)NCCC 45d41c01265490ed8771000e25d7865e [0,2,0,0,0,0|1,0,0]=3 4019 B13R0.1053 CCCNC(=O)C(CC)NCCCCl c0a3f3ee5e3ca40044105f9dfd58f328 [0,2,0,0,0,0|2,0,0]=4 4020 B13R0.1053 CCCNC(=O)C(CC)NCCCO 57a9e67c85ed5db8af6482407ffdf744 [0,2,0,0,0,0|2,0,0]=4 4021 B13R0.1053 CCCNC(=O)C(CC)NCCOC 6dc6c0a375259c3914e4d602087197a0 [0,2,0,0,0,0|2,0,0]=4 4022 B13R0.1053 CCCNC(=O)C(CC)NCCSC bb538435ac1305c95f7c280342f299d4 [0,2,0,0,0,0|2,0,0]=4 4023 B13R0.1053 CCCNC(=O)C(CC)OCCCF 35ba49de8cec45b7ca16f3345d9c2d5e [0,2,0,0,0,0|2,0,0]=4 4024 B13R0.1053 CCCNC(=O)C(CC)OCCCS 38b459337747a9819173191d838e0aae [0,2,0,0,0,0|2,0,0]=4 4025 B13R0.1053 CCCNC(=O)C(CC)OCCOC 737f1e66f302ece6b008e23a40d0989d [0,2,0,0,0,0|2,0,0]=4 4026 B13R0.1053 CCCNC(=O)C(CC)OCCSC 1a51c2556d996b85c6eada19b3065aa3 [0,2,0,0,0,0|2,0,0]=4 4027 B13R0.1053 CCCNC(=O)N(CC)CCCCO dc160004c37a659ad0799d347c614c13 [0,2,0,0,0,0|2,0,0]=4 4028 B13R0.1053 CCCNC(=O)N(CC)CCCOC 6e062c019569318eb7da2e67634857b3 [0,2,0,0,0,0|2,0,0]=4 4029 B13R0.1053 CCCNC(=O)N(CC)CCNCC f9877f6148671c548802761f1bfff0f2 [0,2,0,0,0,0|2,0,0]=4 4030 B13R0.1053 CCCNC(=O)N(CC)CCOCC a8aded19b119a6764a5a42fa5a49795f [0,2,0,0,0,0|2,0,0]=4 4031 B13R0.1053 CCCNC(=O)[C@H](CC)NCCCF f24dda1e6cabd0c8f62695d4c5eecfcc [0,2,0,0,0,0|2,0,0]=4 4032 B13R0.1053 CCCNC(=O)[C@H](CC)NCCCO b50832038b2e75dcf9c391a0bbec648b [0,2,0,0,0,0|2,0,0]=4 4033 B13R0.1053 CCCNC(=O)[C@H](CC)NCCCS 47ed219ee77787ae1ead401dc71f6ccc [0,2,0,0,0,0|2,0,0]=4 4034 B13R0.1053 CCCNC(=O)[C@H](CC)NCCOC d62341b82af2167fa4e935926128066b [0,2,0,0,0,0|2,0,0]=4 4035 B13R0.1053 CCCNC(=O)[C@H](CC)NCCSC 6c57ce8ac0f782b0f3a73ecb1cca012f [0,2,0,0,0,0|2,0,0]=4 4036 B13R0.1053 CCCNC(=O)[C@H](CC)NCOCC 8f5a0a3eef449ce970cb99864f8d0902 [0,2,0,0,0,0|2,0,0]=4 4037 B13R0.1053 CCN(CCCCO)C(=O)CCCF 82323f21b40694a679d413515d62b309 [0,2,0,0,0,0|2,0,0]=4 4038 B13R0.1053 CCN(CCCCO)C(=O)CCCS 6fa4ba10382a2abe091c115e2bc4021b [0,2,0,0,0,0|2,0,0]=4 4039 B13R0.1053 CCN(CCCCO)C(=O)CCOC e78944ab7484de536ea9185c99fa75c3 [0,2,0,0,0,0|2,0,0]=4 4040 B13R0.1053 CCN(CCCCO)C(=O)CCSC a391f27eb11bd38533c5046f7a3a0ee9 [0,2,0,0,0,0|2,0,0]=4 4041 B13R0.1053 CCN(CCCCO)C(=O)NCCF 9f1b7bec03bfe800ee9532af384d5e68 [0,2,0,0,0,0|2,0,0]=4 4042 B13R0.1053 CCN(CCCCO)C(=O)NCCN c870bf87bc7df3f70a22bb37ebd0fbdb [0,2,0,0,0,0|2,0,0]=4 4043 B13R0.1053 CCN(CCCCO)C(=O)NCCO 945894dd7da0657dbabf553907e15df7 [0,2,0,0,0,0|2,0,0]=4 4044 B13R0.1053 CCN(CCCCO)C(=O)NCCS 006972ee056e6d9f83301f348a23ab8a [0,2,0,0,0,0|2,0,0]=4 4045 B13R0.1053 CCN(CCCOC)C(=O)CCCF ed7b925bc19d4fc6d4590d22b80b4f6b [0,2,0,0,0,0|2,0,0]=4 4046 B13R0.1053 CCN(CCCOC)C(=O)CCCS e0b1dec1d1f5537fbc750c71b03f7524 [0,2,0,0,0,0|2,0,0]=4 4047 B13R0.1053 CCN(CCCOC)C(=O)CCOC d0aee1d34319bd34fb9b68387bb50ffb [0,2,0,0,0,0|2,0,0]=4 4048 B13R0.1053 CCN(CCCOC)C(=O)CCSC 6d5cbb26b9c45e8c47141d51c50a50a2 [0,2,0,0,0,0|2,0,0]=4 4049 B13R0.1053 CCN(CCCOC)C(=O)NCCF 786111edf5843b9d0cc0587b39d63b53 [0,2,0,0,0,0|2,0,0]=4 4050 B13R0.1053 CCN(CCCOC)C(=O)NCCN 2d1d1ee97e15a97b06f9af1f6aa8d24f [0,2,0,0,0,0|2,0,0]=4 4051 B13R0.1053 CCN(CCCOC)C(=O)NCCO c4807d4f265c56ede723894eb9535b04 [0,2,0,0,0,0|2,0,0]=4 4052 B13R0.1053 CCN(CCCOC)C(=O)NCCS 1b6b0326b112e3e2e9eb6dc29097d747 [0,2,0,0,0,0|2,0,0]=4 4053 B13R0.1053 CCNCCN(CC)C(=O)NCCF 02f4ce04282559f4906c0509a922b86e [0,2,0,0,0,0|2,0,0]=4 4054 B13R0.1053 CCNCCN(CC)C(=O)NCCN 617a164460be708a1eb912f987c6fe87 [0,2,0,0,0,0|2,0,0]=4 4055 B13R0.1053 CCNCCN(CC)C(=O)NCCO 9507d8a1a6db9de0381ad0c17159bc38 [0,2,0,0,0,0|2,0,0]=4 4056 B13R0.1053 CCNCCN(CC)C(=O)NCCS f0fe0aa58763014fe96c6fa1ffb1e143 [0,2,0,0,0,0|2,0,0]=4 4057 B13R0.1053 CCOCC(=O)N(CC)CCCCO 5fe99440d21f5a980eec03a85d8cf81d [0,2,0,0,0,0|1,0,0]=3 4058 B13R0.1053 CCOCC(=O)N(CC)CCCOC c79b75c4f07afc3a5ce895505ed6c1ca [0,2,0,0,0,0|1,0,0]=3 4059 B13R0.1053 CCOCCN(CC)C(=O)CCCF d66f403a5e8026e1f31fba2b04446a56 [0,2,0,0,0,0|2,0,0]=4 4060 B13R0.1053 CCOCCN(CC)C(=O)CCCS e962090f9c8aebfca21dc09d14943baf [0,2,0,0,0,0|2,0,0]=4 4061 B13R0.1053 CCOCCN(CC)C(=O)CCOC b5bfbd159ad3fc1dec96128b2af069a1 [0,2,0,0,0,0|2,0,0]=4 4062 B13R0.1053 CCOCCN(CC)C(=O)CCSC 9172edac04de45add79178f3e4c52431 [0,2,0,0,0,0|2,0,0]=4 4063 B13R0.1053 CCOCCN(CC)C(=O)COCC 9d096e1f7378af196993a0048cf3f33f [0,2,0,0,0,0|1,0,0]=3 4064 B13R0.1053 CCOCCN(CC)C(=O)CSCC 210a29613e4d7c3c8641fa822cabb522 [0,2,0,0,0,0|1,1,0]=4 4065 B13R0.1053 CCOCCN(CC)C(=O)NCCF 9b07347f5258fe52434e5ae06f27c5c3 [0,2,0,0,0,0|2,0,0]=4 4066 B13R0.1053 CCOCCN(CC)C(=O)NCCN f68b7be9d95094e41778a073fd183783 [0,2,0,0,0,0|2,0,0]=4 4067 B13R0.1053 CCOCCN(CC)C(=O)NCCO 0d96a2a87ce2051f7a36bc340b1838c8 [0,2,0,0,0,0|2,0,0]=4 4068 B13R0.1053 CCOCCN(CC)C(=O)NCCS f91de7421377b31246af5977eb778a09 [0,2,0,0,0,0|2,0,0]=4 4069 B13R0.1053 CCSCC(=O)N(CC)CCCCO 7a8dd4a7ad539d1c74f2a63657a0e870 [0,2,0,0,0,0|1,1,0]=4 4070 B13R0.1053 CCSCC(=O)N(CC)CCCOC 61d73c61b0333b8ca9ab80281710f5db [0,2,0,0,0,0|1,1,0]=4 4071 B13R0.1281 C#CCCCC(=O)N(CC)CCCC cc07e33a819b5954df7066c2cca29449 [0,2,0,0,0,0|2,0,0]=4 4072 B13R0.1281 C#CCCNC(=O)N(CC)CCCC 14aeae7337e2b7d77f85ffa483524e40 [0,2,0,0,0,0|2,0,0]=4 4073 B13R0.1281 C#CCOCC(=O)N(CC)CCCC 60cfbdf3b7723ffbdc165155adecf1d7 [0,2,0,0,0,0|1,0,1]=4 4074 B13R0.1281 C=CCCCC(=O)N(CC)CCCC 0f3c2f2e4489978ffc782b4d45d25c15 [0,2,0,0,0,0|2,0,0]=4 4075 B13R0.1281 C=CCCNC(=O)N(CC)CCCC d7d0245a2ffa55c669a19f2ac5fa06ed [0,2,0,0,0,0|2,0,0]=4 4076 B13R0.1281 C=CCOCC(=O)N(CC)CCCC c3e34cf6983539222e8df447bd1e84c8 [0,2,0,0,0,0|1,0,1]=4 4077 B13R0.1281 CC#CCCC(=O)N(CC)CCCC 73c246be9eee61198a5121583dc70106 [0,2,0,0,0,0|2,0,0]=4 4078 B13R0.1281 CC#CCNC(=O)N(CC)CCCC 0b1ccb19ef54a7791aae70815e3f3b40 [0,2,0,0,0,0|2,0,0]=4 4079 B13R0.1281 CC/C=C/CC(=O)N(CC)CCCC 5f0f55b8fce34b71d7185dfcf327fa62 [0,2,0,0,0,0|2,0,0]=4 4080 B13R0.1281 CC/C=C\CC(=O)N(CC)CCCC abea398fe8bfe884824259cb7f6410ca [0,2,0,0,0,0|2,0,0]=4 4081 B13R0.1281 CC=CCCC(=O)N(CC)CCCC f5ae64159baf3eba24625ff25809ec8f [0,2,0,0,0,0|2,0,0]=4 4082 B13R0.1281 CC=CCNC(=O)N(CC)CCCC 8d62552c78b002357fe5a88a7014ce35 [0,2,0,0,0,0|2,0,0]=4 4083 B13R0.1281 CCC/C=C/C(=O)N(CC)CCCC 77ddab1ef3b9b0825fae9c7c0972f34c [0,2,0,0,0,0|2,0,0]=4 4084 B13R0.1281 CCC=CCC(=O)N(CC)CCCC 2a73263367b90b2da9bccaf59c94ab39 [0,2,0,0,0,0|2,0,0]=4 4085 B13R0.1281 CCCC#CC(=O)N(CC)CCCC 5526baafebeca90227c04cb76a0427fd [0,2,0,0,0,0|2,0,0]=4 4086 B13R0.1281 CCCC=CC(=O)N(CC)CCCC 8b562e34652607ec9ba5a1752d446cc5 [0,2,0,0,0,0|2,0,0]=4 4087 B13R0.1281 CCCCC(CC)N(C)CCOCC a9802e6ed9357337c7970cda113c2557 [0,2,0,0,0,0|2,0,0]=4 4088 B13R0.1281 CCCCCC(=O)N(CC)CCCC 3c0bb724bdbfa6b5965f772aad6d1914 [0,2,0,0,0,0|2,0,0]=4 4089 B13R0.1281 CCCCN(CC)C(=O)/C=C/COC a76f0757fd92259d7749197cb04bd4f5 [0,2,0,0,0,0|2,0,0]=4 4090 B13R0.1281 CCCCN(CC)C(=O)/C=C/OCC 90e4f1cd10b61dbe3b290132b7fc43ef [0,2,0,0,0,0|1,0,0]=3 4091 B13R0.1281 CCCCN(CC)C(=O)C#CCCO 3edba42da9853f1f9f79d1f95b943aad [0,2,0,0,0,0|2,0,0]=4 4092 B13R0.1281 CCCCN(CC)C(=O)C#CCOC d69937b0802ca4a44a9565f4935b859c [0,2,0,0,0,0|2,0,0]=4 4093 B13R0.1281 CCCCN(CC)C(=O)C=CCOC 7744486412c1e98880afc966919e0614 [0,2,0,0,0,0|2,0,0]=4 4094 B13R0.1281 CCCCN(CC)C(=O)C=COCC 4e0dd79dc3b794684b0d60819198408a [0,2,0,0,0,0|1,0,0]=3 4095 B13R0.1281 CCCCN(CC)C(=O)CCCC#N 00a057b3a7bd26442fe275d78713545c [0,2,0,0,0,0|2,0,0]=4 4096 B13R0.1281 CCCCN(CC)C(=O)CCCC=O 3f69400fd96e467a7c1a0a6c0379feca [0,2,0,0,0,0|2,0,0]=4 4097 B13R0.1281 CCCCN(CC)C(=O)CCCCF 3bd4f13be7c6d18422aeb93d85a29147 [0,2,0,0,0,0|2,0,0]=4 4098 B13R0.1281 CCCCN(CC)C(=O)CCCCO 38c4c65c380e2512cdaccf47900f84df [0,2,0,0,0,0|2,0,0]=4 4099 B13R0.1281 CCCCN(CC)C(=O)CCCCS 8c599054a4b1dff6abcd33941393c5e8 [0,2,0,0,0,0|2,0,0]=4 4100 B13R0.1281 CCCCN(CC)C(=O)CCCOC 1c81ad616f30ee65d9b10e8acd582e3f [0,2,0,0,0,0|2,0,0]=4 4101 B13R0.1281 CCCCN(CC)C(=O)CCCSC b1fe4785e26bbe091f26fe893728d495 [0,2,0,0,0,0|2,0,0]=4 4102 B13R0.1281 CCCCN(CC)C(=O)CCOCC 3c20c74c81608bf2b8deb9711dab2611 [0,2,0,0,0,0|1,0,0]=3 4103 B13R0.1281 CCCCN(CC)C(=O)CCSCC e207700166d12d5d18d51a0e07c40612 [0,2,0,0,0,0|1,1,0]=4 4104 B13R0.1281 CCCCN(CC)C(=O)CCSSC 2e1b31017bc66a7696155d8aff2129a5 [0,2,0,0,0,0|2,0,0]=4 4105 B13R0.1281 CCCCN(CC)C(=O)COCCC 97a2f9b4757b3bcc3a0932e5ab8b6a52 [0,2,0,0,0,0|1,0,0]=3 4106 B13R0.1281 CCCCN(CC)C(=O)COCCO cc1c86e4528149f9ea4fcc1a661d5e1b [0,2,0,0,0,0|1,0,0]=3 4107 B13R0.1281 CCCCN(CC)C(=O)COCCS a2911b41a57c085889b1aa24c2589f05 [0,2,0,0,0,0|1,0,0]=3 4108 B13R0.1281 CCCCN(CC)C(=O)CSCCC 7e931e125927451720dc6d344d83c92c [0,2,0,0,0,0|1,1,0]=4 4109 B13R0.1281 CCCCN(CC)C(=O)NCCC#N 0a721b467ae4b1fd8ab605f660f10456 [0,2,0,0,0,0|2,0,0]=4 4110 B13R0.1281 CCCCN(CC)C(=O)NCCCN 4c57bc37f0be3e96d3557722b7d8256b [0,2,0,0,0,0|2,0,0]=4 4111 B13R0.1281 CCCCN(CC)C(=O)NCCCO b067717f70f6e01bb920c64efc09522e [0,2,0,0,0,0|2,0,0]=4 4112 B13R0.1281 CCCCN(CC)C(=O)NCCOC 107f240c5265fb85d76ad81dac2accab [0,2,0,0,0,0|2,0,0]=4 4113 B13R0.1281 CCCCN(CC)C(=O)NCCON 6271de3faf1f9951d525c043a91fc06c [0,2,0,0,0,0|2,0,0]=4 4114 B13R0.1281 CCCCN(CC)C(=O)NCCSC bf85dc1e7387734102879fc3dcb5b2b5 [0,2,0,0,0,0|2,0,0]=4 4115 B13R0.1281 CCCCNC(=O)C(CC)NCCC afa34373b77251f6746aae9c160cc8a4 [0,2,0,0,0,0|2,0,0]=4 4116 B13R0.1281 CCCCNC(=O)C(CC)OCCC 77e841f418152c0665e4c190586275f1 [0,2,0,0,0,0|2,0,0]=4 4117 B13R0.1281 CCCCNC(=O)N(CC)CCCC e4fc11661e96b71327953df781962336 [0,2,0,0,0,0|2,0,0]=4 4118 B13R0.1281 CCCCOC(=O)[C@H](CC)OCCC 41141f8ab575fee649ddc8308503a568 [0,2,0,0,0,0|1,0,0]=3 4119 B13R0.1281 CCCCOC(=O)[C@H](CC)OCCF c910a82d3319a003680b35b3b811a25e [0,2,0,0,0,0|2,0,0]=4 4120 B13R0.1281 CCCCOC(=O)[C@H](CC)OCCS 4d65ca89952ef26e6886cbf80b4f7689 [0,2,0,0,0,0|2,0,0]=4 4121 B13R0.1281 CCCCOC(=O)[C@H](CC)OCOC b5c91876502fd1e30d6c47c951423f58 [0,2,0,0,0,0|2,0,0]=4 4122 B13R0.1281 CCCCOC(=O)[C@H](CC)OCSC 0eedecf8d1cc8fd189f3897334973bd7 [0,2,0,0,0,0|2,0,0]=4 4123 B13R0.1281 CCCNC(CC)C(=O)NCCOC 60d64ff4bedc9e862b3290e46a1bc828 [0,2,0,0,0,0|2,0,0]=4 4124 B13R0.1281 CCCOC(CC)C(=O)NCCOC 01c288fd096f8ceb36508a66f6cfc618 [0,2,0,0,0,0|2,0,0]=4 4125 B13R0.1281 CCCOCC(=O)N(CC)CCCO 037d7d50c3fadb5241e630f3f9f0e6df [0,2,0,0,0,0|2,0,0]=4 4126 B13R0.1281 CCCOCC(=O)N(CC)CCOC 11893556208e619171a05e82fdfccf00 [0,2,0,0,0,0|2,0,0]=4 4127 B13R0.1281 CCN(CCCO)C(=O)COCCO 93f5b02382f6c20ee53766a7f1551d3f [0,2,0,0,0,0|2,0,0]=4 4128 B13R0.1281 CCN(CCCO)C(=O)COCCS 8a6ed69fc2ce802efed84335e4b61196 [0,2,0,0,0,0|2,0,0]=4 4129 B13R0.1281 CCN(CCOC)C(=O)COCCO 4560b0d2c7b1ad899bc4f3c72de5c0f6 [0,2,0,0,0,0|2,0,0]=4 4130 B13R0.1281 CCN(CCOC)C(=O)COCCS baa295468ab0d2c69e0fe5ee1d3678dd [0,2,0,0,0,0|2,0,0]=4 4131 B13R0.1281 CCO/C=C/C(=O)N(CC)CCCO 70e4dca14c0a3499420dc5ce324de00d [0,2,0,0,0,0|2,0,0]=4 4132 B13R0.1281 CCO/C=C/C(=O)N(CC)CCOC f1887f9e0b155a42db0923de35469dbc [0,2,0,0,0,0|2,0,0]=4 4133 B13R0.1281 CCOC=CC(=O)N(CC)CCCO f0ea23f43c764fcb3da504e843cf3088 [0,2,0,0,0,0|2,0,0]=4 4134 B13R0.1281 CCOC=CC(=O)N(CC)CCOC 602332ce44eb2bdb7f590dbff00a6046 [0,2,0,0,0,0|2,0,0]=4 4135 B13R0.1281 CCOCCC(=O)N(CC)CCCO 40802dad8a7f421f5ec713c74748ebfc [0,2,0,0,0,0|2,0,0]=4 4136 B13R0.1281 CCOCCC(=O)N(CC)CCOC 89414cebe3c7b5f5d222bf0240f54a61 [0,2,0,0,0,0|2,0,0]=4 4137 B13R0.59 C#CC(OCCCCC)C(=O)OCC a04b43b508f46f58f9fc7e943da564c3 [0,2,0,0,0,0|0,0,2]=4 4138 B13R0.59 C#CC(OCCCCF)C(=O)OCC 2a170eb662febb5034fb9006a86eef52 [0,2,0,0,0,0|0,0,2]=4 4139 B13R0.59 C#CC(OCCCOC)C(=O)OCC 197749ea1d8c08458dab348e552b2738 [0,2,0,0,0,0|0,0,2]=4 4140 B13R0.59 C#CC(OCCCSC)C(=O)OCC c2ebb57089cbba6f011446b3d7dce76d [0,2,0,0,0,0|0,0,2]=4 4141 B13R0.59 C#CC(OCCOCC)C(=O)OCC 93aa0944efa0402826b72fc39dea3af1 [0,2,0,0,0,0|0,0,2]=4 4142 B13R0.59 C#CC(OCCSCC)C(=O)OCC 315feb39af9f49d834f5ec8c8d307aec [0,2,0,0,0,0|0,0,2]=4 4143 B13R0.59 C#CCCCNC(CC)C(=O)CCC 58849e524e200b26a80d0278a7baf0bb [0,2,0,0,0,0|1,0,1]=4 4144 B13R0.59 C#CCCCNC(CC)C(=O)NCC 08188387607810281d3db39082568c79 [0,2,0,0,0,0|1,0,1]=4 4145 B13R0.59 C#CCCCNC(CC)C(=O)OCC 7015d08d86ad7fd2be28b460f8e78575 [0,2,0,0,0,0|0,0,1]=3 4146 B13R0.59 C#CCCCNC(CO)C(=O)OCC 7044a1360a1836f3676a580d0fd66d71 [0,2,0,0,0,0|1,0,1]=4 4147 B13R0.59 C#CCCCNC(SC)C(=O)OCC d563f7464d4c5cf8b03fd10bc43c023c [0,2,0,0,0,0|1,0,1]=4 4148 B13R0.59 C#CCCCN[C@@H](CC)C(=O)OCC 9c0d4d1e169d299e95467bf25c4f52bd [0,2,0,0,0,0|0,0,1]=3 4149 B13R0.59 C#CCCCN[C@H](CC)C(=O)OCC 428fa7db1228773eed707b4231edf6ec [0,2,0,0,0,0|0,0,1]=3 4150 B13R0.59 C#CCCCOC(CC)C(=O)OCC d25b27c36dd633263abb753dda2f948b [0,2,0,0,0,0|0,0,1]=3 4151 B13R0.59 C#CCCCO[C@@H](CC)C(=O)OCC 440b341d534ef984846b4e5a8fa777c6 [0,2,0,0,0,0|0,0,1]=3 4152 B13R0.59 C#CCCCO[C@H](CC)C(=O)OCC 3d3f83efd7e35abd22680e1c14a6fab8 [0,2,0,0,0,0|0,0,1]=3 4153 B13R0.59 C/C=C/CCOC(CC)C(=O)CCC 2025b3759f8d5eceb22571306800a472 [0,2,0,0,0,0|1,0,1]=4 4154 B13R0.59 C/C=C/CCOC(CC)C(=O)OCC 1dfdd2f31e91224b727fe1ffc99e870e [0,2,0,0,0,0|0,0,1]=3 4155 B13R0.59 C=C=CCCOC(CC)C(=O)OCC 06cb721ebba4cb04e78043332ea0805e [0,2,0,0,0,0|0,0,2]=4 4156 B13R0.59 C=CCCCNC(CC)C(=O)CCC d0ffc9234243c66bf9b7b76056d30692 [0,2,0,0,0,0|1,0,1]=4 4157 B13R0.59 C=CCCCNC(CC)C(=O)NCC 7983b8ffe70bce66ce09537a0892f697 [0,2,0,0,0,0|1,0,1]=4 4158 B13R0.59 C=CCCCNC(CC)C(=O)OCC b439ef4519c0f6d62e153f49da65ba16 [0,2,0,0,0,0|0,0,1]=3 4159 B13R0.59 C=CCCCNC(CO)C(=O)OCC 6e5c4a6c4277a7c91a0fcc681c37362b [0,2,0,0,0,0|1,0,1]=4 4160 B13R0.59 C=CCCCNC(SC)C(=O)OCC 171b51228f8e31c463d97c9cf03984f1 [0,2,0,0,0,0|1,0,1]=4 4161 B13R0.59 C=CCCCN[C@@H](CC)C(=O)OCC f1429b941d6902d2077c028112cc854b [0,2,0,0,0,0|0,0,1]=3 4162 B13R0.59 C=CCCCN[C@H](CC)C(=O)OCC 21dea438c0f7dd5d9f99ab41736f51f4 [0,2,0,0,0,0|0,0,1]=3 4163 B13R0.59 C=CCCCOC(CC)C(=O)CCC 4e13e7c234d096829cb7a8cf7eac68bf [0,2,0,0,0,0|1,0,1]=4 4164 B13R0.59 C=CCCCOC(CC)C(=O)OCC ea5c768ce89e5269151f7276a4bee27b [0,2,0,0,0,0|0,0,1]=3 4165 B13R0.59 C=CCCCOC(SC)C(=O)OCC c062e2b2612bfa5ffdd6d14e63ab434e [0,2,0,0,0,0|1,0,1]=4 4166 B13R0.59 C=CCCCO[C@@H](CC)C(=O)OCC fc7d4b5a8451618dff8a8434e8e44045 [0,2,0,0,0,0|0,0,1]=3 4167 B13R0.59 C=CCCCO[C@H](CC)C(=O)OCC c9f972dc1bc98721a3cb74cc67c66aa0 [0,2,0,0,0,0|0,0,1]=3 4168 B13R0.59 C=COCCNC(CC)C(=O)OCC b4033e9b375f81508bd2d0fed6eb18ec [0,2,0,0,0,0|0,0,2]=4 4169 B13R0.59 C=COCCOC(CC)C(=O)OCC 1e95e06a961009771f327202b7ac732c [0,2,0,0,0,0|0,0,2]=4 4170 B13R0.59 CC#CCCOC(CC)C(=O)CCC a89111c8983bb15b3f87f00865e21aa2 [0,2,0,0,0,0|1,0,1]=4 4171 B13R0.59 CC#CCCOC(CC)C(=O)OCC 475634adb2e49101ae45345aceb8076e [0,2,0,0,0,0|0,0,1]=3 4172 B13R0.59 CC#CCCOC(SC)C(=O)OCC bb4eade4b9c07462485270c498ebb35b [0,2,0,0,0,0|1,0,1]=4 4173 B13R0.59 CC/C=C/CNC(CC)C(=O)NCC 2435bf89fe57df903c8a5b87e0049394 [0,2,0,0,0,0|1,0,1]=4 4174 B13R0.59 CC/C=C/CNC(CC)C(=O)OCC baeffdaf72a12addfdcd1df5c3dd48ac [0,2,0,0,0,0|0,0,1]=3 4175 B13R0.59 CC/C=C/CN[C@@H](CC)C(=O)OCC a0f959ab30b2cca86c56b571ef3dff6f [0,2,0,0,0,0|0,0,1]=3 4176 B13R0.59 CC/C=C/CN[C@H](CC)C(=O)OCC 27ad4223606fa0cc15be924f44b91964 [0,2,0,0,0,0|0,0,1]=3 4177 B13R0.59 CC/C=C/COC(CC)C(=O)OCC 8b3b49e2a66624006872a350996bf572 [0,2,0,0,0,0|0,0,1]=3 4178 B13R0.59 CC/C=C/CO[C@@H](CC)C(=O)OCC e09e1f49e677cedfa0ee796f3d2ca0ba [0,2,0,0,0,0|0,0,1]=3 4179 B13R0.59 CC/C=C/CO[C@H](CC)C(=O)OCC 1181619b5c20a5ef30d27d471dedd6f2 [0,2,0,0,0,0|0,0,1]=3 4180 B13R0.59 CC/C=C\COC(CC)C(=O)OCC 6c426816b654cf0d529c80adf256a4a8 [0,2,0,0,0,0|0,0,1]=3 4181 B13R0.59 CCCC(=O)C(CC)NCCCC#N 6e2ab684967695f9a86c4c1271fc3d0a [0,2,0,0,0,0|1,0,1]=4 4182 B13R0.59 CCCC(=O)C(CC)NCCCCCl 87aeca4a5e86109fb1f460c2b502e857 [0,2,0,0,0,0|1,0,0]=3 4183 B13R0.59 CCCC(=O)C(CC)NCCCCO bd9cd8701c2b98e87b05f552cbf06905 [0,2,0,0,0,0|1,0,0]=3 4184 B13R0.59 CCCC(=O)C(CC)NCCCCS a8861027f0fc2dd7dc5af1455dc9d5c5 [0,2,0,0,0,0|1,0,0]=3 4185 B13R0.59 CCCC(=O)C(CC)NCCCOC 5497a543dacf901eb15d9ed6e8882bb0 [0,2,0,0,0,0|1,0,0]=3 4186 B13R0.59 CCCC(=O)C(CC)NCCCSC 6c9dba0a77145c9804e76a15fdda192a [0,2,0,0,0,0|1,0,0]=3 4187 B13R0.59 CCCC(=O)C(CC)NCCOCC 8f86a713a90a636404a18780f3fdd7a6 [0,2,0,0,0,0|1,0,0]=3 4188 B13R0.59 CCCC(=O)C(CC)NCCSCC 39aaf859ce7b86a4b0cf5e1e2c75cced [0,2,0,0,0,0|1,0,0]=3 4189 B13R0.59 CCCC(=O)C(CC)OCCCC#N 69379f198a959ac898c90c6e258f64c5 [0,2,0,0,0,0|1,0,1]=4 4190 B13R0.59 CCCC(=O)C(CC)OCCCC=O dfdbf94a37d3fce0b51572430f58fa7b [0,2,0,0,0,0|1,0,1]=4 4191 B13R0.59 CCCC(=O)C(CC)OCCCCF fc307c53bebb5dd973c11784d4e347e5 [0,2,0,0,0,0|1,0,0]=3 4192 B13R0.59 CCCC(=O)C(CC)OCCCOC b84f21c16a4a99d5d07a68c33a701808 [0,2,0,0,0,0|1,0,0]=3 4193 B13R0.59 CCCC(=O)C(CC)OCCCSC 32731b216b2cf79580087a592392cdd4 [0,2,0,0,0,0|1,0,0]=3 4194 B13R0.59 CCCC(=O)C(CC)OCCOCC c1af7c6323ce4a9518f882d98f0d163a [0,2,0,0,0,0|1,0,0]=3 4195 B13R0.59 CCCC(=O)C(CC)OCCSCC ce6587baf0914d2685db2804b567ef6b [0,2,0,0,0,0|1,0,0]=3 4196 B13R0.59 CCCCCNC(C#N)C(=O)OCC 9d139f10d36962f670cc76630a8de7b0 [0,2,0,0,0,0|1,0,1]=4 4197 B13R0.59 CCCCCNC(C=O)C(=O)OCC e6ce1326c638246689c7fa4883b81e91 [0,2,0,0,0,0|1,0,1]=4 4198 B13R0.59 CCCCCNC(CC)C(=O)CCC 74133841a82f8cce30f430b08b38dbbc [0,2,0,0,0,0|1,0,0]=3 4199 B13R0.59 CCCCCNC(CC)C(=O)NCC 6184503d9db66f99da1c988dfbbd8e3c [0,2,0,0,0,0|1,0,0]=3 4200 B13R0.59 CCCCCNC(CC)C(=O)OCC ecd089062f15ec7ead7680b9ff7d4381 [0,2,0,0,0,0|0,0,0]=2 4201 B13R0.59 CCCCCNC(CO)C(=O)OCC c171a4311baaf39ade1c4dcf3fad8554 [0,2,0,0,0,0|1,0,0]=3 4202 B13R0.59 CCCCCN[C@@H](CC)C(=O)OCC e9aae2c1165f2043d1a9131d8f3df6c0 [0,2,0,0,0,0|0,0,0]=2 4203 B13R0.59 CCCCCN[C@H](CC)C(=O)OCC 8164e77cd7e27a5298efe2a86994fba7 [0,2,0,0,0,0|0,0,0]=2 4204 B13R0.59 CCCCCOC(C=O)C(=O)OCC 7ea9764de62fe84decc8bf1c3f6ff8f1 [0,2,0,0,0,0|1,0,1]=4 4205 B13R0.59 CCCCCOC(CC)C(=O)OCC af982e3a58df1b5b8e2ee5897bb6d8fc [0,2,0,0,0,0|0,0,0]=2 4206 B13R0.59 CCCCCO[C@@H](CC)C(=O)OCC 102fe38b5786e3e12a8527cb8d04ba89 [0,2,0,0,0,0|0,0,0]=2 4207 B13R0.59 CCCCCO[C@H](CC)C(=O)OCC a4d62fd89cff1b03c2f8d05c8edb7571 [0,2,0,0,0,0|0,0,0]=2 4208 B13R0.59 CCNC(=O)C(CC)NCCCC#N 3dec4fecb1e98b579c14d0b956f93d71 [0,2,0,0,0,0|1,0,1]=4 4209 B13R0.59 CCNC(=O)C(CC)NCCCC=O 844036b55686bb92895b2f9395d8c154 [0,2,0,0,0,0|1,0,1]=4 4210 B13R0.59 CCNC(=O)C(CC)NCCCCF cf155e2e97593c40f2c9b01e76edee13 [0,2,0,0,0,0|1,0,0]=3 4211 B13R0.59 CCNC(=O)C(CC)NCCCCO 793880081d0749f03e990783adc2943e [0,2,0,0,0,0|1,0,0]=3 4212 B13R0.59 CCNC(=O)C(CC)NCCCOC baea82a4fad439e0c0c01219d878b3ea [0,2,0,0,0,0|1,0,0]=3 4213 B13R0.59 CCNC(=O)C(CC)NCCCSC 2b1dd8bbede709221b529b02c9fbc3dc [0,2,0,0,0,0|1,0,0]=3 4214 B13R0.59 CCNC(=O)C(CC)NCCOCC 5e90961da59b54ab931867ebc26a0b40 [0,2,0,0,0,0|1,0,0]=3 4215 B13R0.59 CCNC(=O)C(CC)NCCSCC c294b3fb63c0c9cdf215d04c2c15408d [0,2,0,0,0,0|1,0,0]=3 4216 B13R0.59 CCOC(=O)C(C#N)NCCCCF ba131d86960a3422f0bf6c0e5a08ae2b [0,2,0,0,0,0|1,0,1]=4 4217 B13R0.59 CCOC(=O)C(C#N)NCCCCO 14dfb5e561b25c84cc9b37b21aae20b5 [0,2,0,0,0,0|1,0,1]=4 4218 B13R0.59 CCOC(=O)C(C#N)NCCCOC 52270ddedff0038414559eb48d5e5d3d [0,2,0,0,0,0|1,0,1]=4 4219 B13R0.59 CCOC(=O)C(C#N)NCCCSC 798f1198d431bfc4cf7ca3e7625bd355 [0,2,0,0,0,0|1,0,1]=4 4220 B13R0.59 CCOC(=O)C(C#N)NCCSCC f119f4133c9c071c2149318f5cb33f88 [0,2,0,0,0,0|1,0,1]=4 4221 B13R0.59 CCOC(=O)C(C=O)NCCCCCl d39ece0e225c72a2da97765a197a3933 [0,2,0,0,0,0|1,0,1]=4 4222 B13R0.59 CCOC(=O)C(C=O)NCCCCO 145c86d63b7a9c001ec07e1b87cbd827 [0,2,0,0,0,0|1,0,1]=4 4223 B13R0.59 CCOC(=O)C(C=O)NCCCCS 45ca8ddf85e5b66fcc54abdf840816c0 [0,2,0,0,0,0|1,0,1]=4 4224 B13R0.59 CCOC(=O)C(C=O)NCCCOC 1558dda3e2be02df6208550bb632d2e6 [0,2,0,0,0,0|1,0,1]=4 4225 B13R0.59 CCOC(=O)C(C=O)NCCCSC 5dd4607847900998b290eb730c8d6eb5 [0,2,0,0,0,0|1,0,1]=4 4226 B13R0.59 CCOC(=O)C(C=O)NCCSCC 0462fb2d8e183a30c091656a6b1fb7d2 [0,2,0,0,0,0|1,0,1]=4 4227 B13R0.59 CCOC(=O)C(C=O)OCCCCF 4f02cb226bbf0b8e9555607cb5477782 [0,2,0,0,0,0|1,0,1]=4 4228 B13R0.59 CCOC(=O)C(C=O)OCCCCS 1cf157c62d01dc7643141b7652af335a [0,2,0,0,0,0|1,0,1]=4 4229 B13R0.59 CCOC(=O)C(C=O)OCCCOC a22ce9d7d83194ac290bcda4a760c65f [0,2,0,0,0,0|1,0,1]=4 4230 B13R0.59 CCOC(=O)C(C=O)OCCCSC 174c9918aeacde25e3cf49aeb4f6dc5c [0,2,0,0,0,0|1,0,1]=4 4231 B13R0.59 CCOC(=O)C(C=O)OCCSCC 2792c190f004d0da724dbf86baca1eb6 [0,2,0,0,0,0|1,0,1]=4 4232 B13R0.59 CCOC(=O)C(CC)NCC#CCO a63c8890ceab95ae2a5fb96d47ce20ed [0,2,0,0,0,0|0,0,2]=4 4233 B13R0.59 CCOC(=O)C(CC)NCCCC#N 41598b754ecd19f5e0164923699ac5bc [0,2,0,0,0,0|0,0,1]=3 4234 B13R0.59 CCOC(=O)C(CC)NCCCC=O 80e94ea27edb14e506b7c46e0a60548a [0,2,0,0,0,0|0,0,1]=3 4235 B13R0.59 CCOC(=O)C(CC)NCCCCCl 0bfa98f62caa3fdf62666d10b1fbe123 [0,2,0,0,0,0|0,0,0]=2 4236 B13R0.59 CCOC(=O)C(CC)NCCCCF 3f379bdec1e4918e14398b7e5b81f0d2 [0,2,0,0,0,0|0,0,0]=2 4237 B13R0.59 CCOC(=O)C(CC)NCCCCO cb63c720502f097beec38792462f2785 [0,2,0,0,0,0|0,0,0]=2 4238 B13R0.59 CCOC(=O)C(CC)NCCCCS 8950ac04acac79108c2786f3ec4546cb [0,2,0,0,0,0|0,0,0]=2 4239 B13R0.59 CCOC(=O)C(CC)NCCCOC f73491d02c61735df51a1acfacb4c5ee [0,2,0,0,0,0|0,0,0]=2 4240 B13R0.59 CCOC(=O)C(CC)NCCCSC 3e6790f99335f09e582491fd2c44f24e [0,2,0,0,0,0|0,0,0]=2 4241 B13R0.59 CCOC(=O)C(CC)NCCSCC 439a6d8127ddc9011e2976a3b0f4f5d4 [0,2,0,0,0,0|0,0,0]=2 4242 B13R0.59 CCOC(=O)C(CC)OCCCC#N 32a51ab0652ab0eaf0f6db024597664a [0,2,0,0,0,0|0,0,1]=3 4243 B13R0.59 CCOC(=O)C(CC)OCCCC=O 93992b9a880dc1617d3531647789f43a [0,2,0,0,0,0|0,0,1]=3 4244 B13R0.59 CCOC(=O)C(CC)OCCCCF 715dd5e348dcc7db221b9501fb06b845 [0,2,0,0,0,0|0,0,0]=2 4245 B13R0.59 CCOC(=O)C(CC)OCCCCS c62ac37323aecfcfaac1e9172cc4b2df [0,2,0,0,0,0|0,0,0]=2 4246 B13R0.59 CCOC(=O)C(CC)OCCCOC 9d618c30f288b19cb3406c5603a5ffd9 [0,2,0,0,0,0|0,0,0]=2 4247 B13R0.59 CCOC(=O)C(CC)OCCCSC 988a0431d7d4a0fd98e3fdeb5a0ed6ee [0,2,0,0,0,0|0,0,0]=2 4248 B13R0.59 CCOC(=O)C(CC)OCCOC=O 5c3ae27a5d9cc50d4ff29cd1df48d205 [0,2,0,0,0,0|1,0,1]=4 4249 B13R0.59 CCOC(=O)C(CC)OCCSCC 8384ddaca69ea33dbd19f8bb0e25a7ea [0,2,0,0,0,0|0,0,0]=2 4250 B13R0.59 CCOC(=O)C(CO)NCCCC#N 8bef3cd2ddc6c00ce055415d92211bc6 [0,2,0,0,0,0|1,0,1]=4 4251 B13R0.59 CCOC(=O)C(CO)NCCCCCl ee609d3da597f6d60e73390b04f69983 [0,2,0,0,0,0|1,0,0]=3 4252 B13R0.59 CCOC(=O)C(CO)NCCCCO 6e6b21c48d22916bc87880c4cc7ec5e6 [0,2,0,0,0,0|1,0,0]=3 4253 B13R0.59 CCOC(=O)C(CO)NCCCCS 16abbdfc9954774a89e6c630cc0f886b [0,2,0,0,0,0|1,0,0]=3 4254 B13R0.59 CCOC(=O)C(CO)NCCCOC e9b72c2ef8bfd66abe14cd7297a5e2d7 [0,2,0,0,0,0|1,0,0]=3 4255 B13R0.59 CCOC(=O)C(CO)NCCCSC fa7acc2496913e01269ff9938d409f29 [0,2,0,0,0,0|1,0,0]=3 4256 B13R0.59 CCOC(=O)C(CO)NCCSCC f32b00eae307729523f25d40d3e6e978 [0,2,0,0,0,0|1,0,0]=3 4257 B13R0.59 CCOC(=O)C(NCCCCCl)SC 9156658cfdf55059b4357a08ea83d9b6 [0,2,0,0,0,0|1,0,0]=3 4258 B13R0.59 CCOC(=O)C(OCCCC=O)SC a3a4756bb6b1c7bec29adb9c2fa10832 [0,2,0,0,0,0|1,0,1]=4 4259 B13R0.59 CCOC(=O)C(OCCCCF)SC f46fd2c2ff7837b29cdc1ea55b31cd1e [0,2,0,0,0,0|1,0,0]=3 4260 B13R0.59 CCOC(=O)[C@@H](CC)NCCCC#N 64c6050be743b2c286a70e7b3473b1cf [0,2,0,0,0,0|0,0,1]=3 4261 B13R0.59 CCOC(=O)[C@@H](CC)NCCCC=O 382296afddc11dde60cf25fb0858f546 [0,2,0,0,0,0|0,0,1]=3 4262 B13R0.59 CCOC(=O)[C@@H](CC)NCCCCF 4e867b86fe80d5c7417543db8f5bda25 [0,2,0,0,0,0|0,0,0]=2 4263 B13R0.59 CCOC(=O)[C@@H](CC)NCCCCO 344a37abdfe202e382f6e826b1d0c43f [0,2,0,0,0,0|0,0,0]=2 4264 B13R0.59 CCOC(=O)[C@@H](CC)NCCCOC b048ee435821ae5795bf21b9c185f51e [0,2,0,0,0,0|0,0,0]=2 4265 B13R0.59 CCOC(=O)[C@@H](CC)NCCCSC 344afc3d52baf9cf2554f516458907f3 [0,2,0,0,0,0|0,0,0]=2 4266 B13R0.59 CCOC(=O)[C@@H](CC)NCCSCC e8e7c6ae62ef9b0ee11c69fbaa036919 [0,2,0,0,0,0|0,0,0]=2 4267 B13R0.59 CCOC(=O)[C@@H](CC)OCCCC#N 84bafb4d0dbf3a304b8087adcd1c5a5d [0,2,0,0,0,0|0,0,1]=3 4268 B13R0.59 CCOC(=O)[C@@H](CC)OCCCC=O 5d9f89fd1b41519579532a5b9d1b567c [0,2,0,0,0,0|0,0,1]=3 4269 B13R0.59 CCOC(=O)[C@@H](CC)OCCCCF cd1f838492f00e8cf5bb368e45be464f [0,2,0,0,0,0|0,0,0]=2 4270 B13R0.59 CCOC(=O)[C@@H](CC)OCCCOC ff18deff6372238e9dfc34099f0902b5 [0,2,0,0,0,0|0,0,0]=2 4271 B13R0.59 CCOC(=O)[C@@H](CC)OCCCSC 939f473b86fc6af22ba00ab567f9a318 [0,2,0,0,0,0|0,0,0]=2 4272 B13R0.59 CCOC(=O)[C@@H](CC)OCCSCC 629bd32b81a1a858f3d329c583f161af [0,2,0,0,0,0|0,0,0]=2 4273 B13R0.59 CCOC(=O)[C@H](CC)NCCCC#N 6a5222cd877089c9f6d462a6f49ca5a1 [0,2,0,0,0,0|0,0,1]=3 4274 B13R0.59 CCOC(=O)[C@H](CC)NCCCC=O 735fc071925f9eb6e0019020eb03993c [0,2,0,0,0,0|0,0,1]=3 4275 B13R0.59 CCOC(=O)[C@H](CC)NCCCCF 23da5abef595b5413525ddc2354ce6bd [0,2,0,0,0,0|0,0,0]=2 4276 B13R0.59 CCOC(=O)[C@H](CC)NCCCCO 91e5531a6a621b341dcaad0c34e7a47e [0,2,0,0,0,0|0,0,0]=2 4277 B13R0.59 CCOC(=O)[C@H](CC)NCCCOC 07cd29a22a0e82c5a8ec5c697b8884f9 [0,2,0,0,0,0|0,0,0]=2 4278 B13R0.59 CCOC(=O)[C@H](CC)NCCCSC 6aff2bdc27290954831c473941970b7a [0,2,0,0,0,0|0,0,0]=2 4279 B13R0.59 CCOC(=O)[C@H](CC)NCCSCC 51b42162117bdbcd813fb9c2557bc475 [0,2,0,0,0,0|0,0,0]=2 4280 B13R0.59 CCOC(=O)[C@H](CC)OCCCC#N df0f93207a76d8fd1883bfa5abee3872 [0,2,0,0,0,0|0,0,1]=3 4281 B13R0.59 CCOC(=O)[C@H](CC)OCCCC=O 5e4092415d640dd46cc408d49ac5d279 [0,2,0,0,0,0|0,0,1]=3 4282 B13R0.59 CCOC(=O)[C@H](CC)OCCCCF a4d6ce1042afd9cfb70ab32818a59ba1 [0,2,0,0,0,0|0,0,0]=2 4283 B13R0.59 CCOC(=O)[C@H](CC)OCCCOC 80c40d549213c1a8cd37b6d913042da8 [0,2,0,0,0,0|0,0,0]=2 4284 B13R0.59 CCOC(=O)[C@H](CC)OCCCSC e1d166ef8d266fce987f38abd551b4de [0,2,0,0,0,0|0,0,0]=2 4285 B13R0.59 CCOC(=O)[C@H](CC)OCCSCC 796ec3b41795db345d168786183db858 [0,2,0,0,0,0|0,0,0]=2 4286 B13R0.59 CCOCCNC(C#N)C(=O)OCC f3e150eabeaf9827e93545b3c65826c1 [0,2,0,0,0,0|1,0,1]=4 4287 B13R0.59 CCOCCNC(C=O)C(=O)OCC c1612479ec91740d9dffa153ec78a510 [0,2,0,0,0,0|1,0,1]=4 4288 B13R0.59 CCOCCNC(CC)C(=O)OCC 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CCOC(=O)[C@@H](CC)NCCC(=O)N 41510bf6097d3651d1e8a7049744f008 [0,2,0,0,0,0|1,0,1]=4 4385 B13R0.94 CCOC(=O)[C@@H](CC)NCCC(=O)O c4f22ec9ba3319f1c16e1c179e5d38b8 [0,2,0,0,0,0|1,0,1]=4 4386 B13R0.94 CCOC(=O)[C@@H](CC)NCCC(C)C 412422cc8a6b9e993d00990f5c754b99 [0,2,0,0,0,0|0,0,0]=2 4387 B13R0.94 CCOC(=O)[C@@H](CC)NCCC(C)O f73c907717abdf11be5706decf3226f8 [0,2,0,0,0,0|0,0,0]=2 4388 B13R0.94 CCOC(=O)[C@@H](CC)NCCN(C)C 7482d45de5ea2c439e4f6684685966f9 [0,2,0,0,0,0|1,0,0]=3 4389 B13R0.94 CCOC(=O)[C@@H](CC)NCCS(=O)C f1ea1a7b02f350aaf15ec65759fad843 [0,2,0,0,0,0|1,0,0]=3 4390 B13R0.94 CCOC(=O)[C@@H](CC)NCOC(=O)C 3711758cc1ae3aa95b161a18b52cc06d [0,2,0,0,0,0|1,0,1]=4 4391 B13R0.94 CCOC(=O)[C@@H](CC)NCOC(C)C bafa9f7ca73150be970ce70cf87584d1 [0,2,0,0,0,0|1,0,0]=3 4392 B13R0.94 CCOC(=O)[C@@H](CC)OC/C=C(/C)\I fffa2ed9abc1ddffef8dd15de1c0be86 [0,2,0,0,0,0|0,0,2]=4 4393 B13R0.94 CCOC(=O)[C@@H](CC)OC/C=C(\C)/Cl a0720abf24b4494ee905283e59426687 [0,2,0,0,0,0|0,0,2]=4 4394 B13R0.94 CCOC(=O)[C@@H](CC)OCC=C(C)C 82be7c21e0a23f978f67f250b555d77c [0,2,0,0,0,0|0,0,2]=4 4395 B13R0.94 CCOC(=O)[C@@H](CC)OCC=C(C)Cl 4b15f676db2aa3993c17d65b2e9832e1 [0,2,0,0,0,0|0,0,2]=4 4396 B13R0.94 CCOC(=O)[C@@H](CC)OCC=C(C)I 35a6c601f163a8bea46cb839cfa913a0 [0,2,0,0,0,0|0,0,2]=4 4397 B13R0.94 CCOC(=O)[C@@H](CC)OCCC(=O)C 5312fa91fe5451b69176827644a1a730 [0,2,0,0,0,0|0,0,1]=3 4398 B13R0.94 CCOC(=O)[C@@H](CC)OCCC(=O)N 40fdddfb3906c4fbc02894d550ee6316 [0,2,0,0,0,0|1,0,1]=4 4399 B13R0.94 CCOC(=O)[C@@H](CC)OCCC(C)C 7569ccf91152fde778598c1ccb02e656 [0,2,0,0,0,0|0,0,0]=2 4400 B13R0.94 CCOC(=O)[C@@H](CC)OCCN(C)C 355de79cf7aea761197d2b7110f8cba4 [0,2,0,0,0,0|1,0,0]=3 4401 B13R0.94 CCOC(=O)[C@@H](CC)OCCS(=O)C 9ddbabe8fa594a9a1c28fa37f61967ae [0,2,0,0,0,0|1,0,0]=3 4402 B13R0.94 CCOC(=O)[C@@H](CC)OCOC(=O)C f0a14d3fb84191ec436e8ee2d01e331c [0,2,0,0,0,0|1,0,1]=4 4403 B13R0.94 CCOC(=O)[C@@H](CC)OCOC(C)C 5b5454ce9a2c4c20e411b5bfdae1d670 [0,2,0,0,0,0|1,0,0]=3 4404 B13R0.94 CCOC(=O)[C@H](CC)NC/C=C(/C)\I 1f1b258c7e7e8be607a0832f6607bcc0 [0,2,0,0,0,0|0,0,2]=4 4405 B13R0.94 CCOC(=O)[C@H](CC)NC/C=C(\C)/Cl 319c3d4965a72e8b4935dbf3ccae60d2 [0,2,0,0,0,0|0,0,2]=4 4406 B13R0.94 CCOC(=O)[C@H](CC)NCC=C(C)C f0a58449f10bb248e1f14c3f04accab3 [0,2,0,0,0,0|0,0,2]=4 4407 B13R0.94 CCOC(=O)[C@H](CC)NCC=C(C)Cl e7efd987224d4715667bb84f8ed27761 [0,2,0,0,0,0|0,0,2]=4 4408 B13R0.94 CCOC(=O)[C@H](CC)NCC=C(C)I 04c520c60279e197a77ca20372324fd7 [0,2,0,0,0,0|0,0,2]=4 4409 B13R0.94 CCOC(=O)[C@H](CC)NCCC(=O)C a9f4d5061a89b420be9a5b2b90eae537 [0,2,0,0,0,0|0,0,1]=3 4410 B13R0.94 CCOC(=O)[C@H](CC)NCCC(=O)N 8f28df845e6612cc2baa154715a20489 [0,2,0,0,0,0|1,0,1]=4 4411 B13R0.94 CCOC(=O)[C@H](CC)NCCC(=O)O 02e1f53392cbf9bd11204bb8d012c028 [0,2,0,0,0,0|1,0,1]=4 4412 B13R0.94 CCOC(=O)[C@H](CC)NCCC(C)C 35157912085afe81d83fb5cb72d31c99 [0,2,0,0,0,0|0,0,0]=2 4413 B13R0.94 CCOC(=O)[C@H](CC)NCCC(C)O 40695f9e3331c044ade65205ed9e3c29 [0,2,0,0,0,0|0,0,0]=2 4414 B13R0.94 CCOC(=O)[C@H](CC)NCCN(C)C 65714fc084bcc59064de609bcb09d613 [0,2,0,0,0,0|1,0,0]=3 4415 B13R0.94 CCOC(=O)[C@H](CC)NCCS(=O)C fe68b3fd0e92b5805142badfecea6e91 [0,2,0,0,0,0|1,0,0]=3 4416 B13R0.94 CCOC(=O)[C@H](CC)NCOC(=O)C 4e15bad178c6aea9a74638e83097c9f9 [0,2,0,0,0,0|1,0,1]=4 4417 B13R0.94 CCOC(=O)[C@H](CC)NCOC(C)C fffd31618764b86fdcc94470b6dcfc9f [0,2,0,0,0,0|1,0,0]=3 4418 B13R0.94 CCOC(=O)[C@H](CC)OC/C=C(/C)\I 2de4d1a1c220fda4b0661fa46387be97 [0,2,0,0,0,0|0,0,2]=4 4419 B13R0.94 CCOC(=O)[C@H](CC)OC/C=C(\C)/Cl ba5241d24a12230ce7a5a35686ad72bd [0,2,0,0,0,0|0,0,2]=4 4420 B13R0.94 CCOC(=O)[C@H](CC)OCC=C(C)C 0811ee05fd921faf08da13c68265d29f [0,2,0,0,0,0|0,0,2]=4 4421 B13R0.94 CCOC(=O)[C@H](CC)OCC=C(C)Cl 2243de148f8c1ea8593a6e569d7052c7 [0,2,0,0,0,0|0,0,2]=4 4422 B13R0.94 CCOC(=O)[C@H](CC)OCC=C(C)I 7874b2fe0af1cec751fc5cbc085fcf5d [0,2,0,0,0,0|0,0,2]=4 4423 B13R0.94 CCOC(=O)[C@H](CC)OCCC(=O)C d5ed974026f73cbf84cd92a96a7c6945 [0,2,0,0,0,0|0,0,1]=3 4424 B13R0.94 CCOC(=O)[C@H](CC)OCCC(=O)N 4c9e9ffa44872e1eb056de33bcc2a287 [0,2,0,0,0,0|1,0,1]=4 4425 B13R0.94 CCOC(=O)[C@H](CC)OCCC(C)C 15cc38284a1ec79a756fa4290b1e01a6 [0,2,0,0,0,0|0,0,0]=2 4426 B13R0.94 CCOC(=O)[C@H](CC)OCCN(C)C 9d2e89fd4ccfd0033ad053fff413ac2f [0,2,0,0,0,0|1,0,0]=3 4427 B13R0.94 CCOC(=O)[C@H](CC)OCCS(=O)C 02bdeb9d938e7282e9e5b1ff42836fc9 [0,2,0,0,0,0|1,0,0]=3 4428 B13R0.94 CCOC(=O)[C@H](CC)OCOC(=O)C d7b7737c08c6854c67c9604173b5a7de [0,2,0,0,0,0|1,0,1]=4 4429 B13R0.94 CCOC(=O)[C@H](CC)OCOC(C)C 4aac0133621a3028e9dd6be0e0b14aea [0,2,0,0,0,0|1,0,0]=3 4430 B11R1.1 CC1CCC(CC1)COCF af51a2e75cf06678cf86a00ac53db214 [1,0,0,1,0,0|1,0,1]=4 4431 B11R1.1 CCCNC1CCC(CC1)C a3b7455b84039578dbc0450a76dec347 [1,0,0,1,0,0|2,0,0]=4 4432 B11R1.1 CCCN[C@H]1CC[C@@H](CC1)C 9715ab2a580769652f6323e774ce9623 [1,0,0,1,0,0|2,0,0]=4 4433 B11R1.1 CCCN[C@H]1CC[C@H](CC1)C 05ba719679c5a48397bbf527dc23c55c [1,0,0,1,0,0|2,0,0]=4 4434 B11R1.1 CCCOC1CCC(CC1)C 7a9689dd98aa4f92d8f5043f1b15a983 [1,0,0,1,0,0|2,0,0]=4 4435 B11R1.1 CCCO[C@H]1CC[C@@H](CC1)C 63f78b25b14708866f991f61dafeaa8d [1,0,0,1,0,0|2,0,0]=4 4436 B11R1.1 CCCO[C@H]1CC[C@H](CC1)C effb30eda82162f702b9f3fc5c106b18 [1,0,0,1,0,0|2,0,0]=4 4437 B11R1.1 CCNCC1CCC(CC1)C f7ed57a3ae2a1a5c8de5aaf4b1a475f2 [1,0,0,1,0,0|1,0,1]=4 4438 B11R1.1 CCOCC1CCC(CC1)C c51abc060b6548b39618627130923e28 [1,0,0,1,0,0|0,0,1]=3 4439 B11R1.1 CCOCC1CCN(CC1)C ea70823a134d803d55e336f4cd225bad [1,0,0,1,0,0|1,0,1]=4 4440 B11R1.1 CCOCN1CCC(CC1)C bb0c07ab719c9214187e62875c24c42d [1,0,0,1,0,0|1,0,1]=4 4441 B11R1.1 CCOC[C@H]1CC[C@@H](CC1)C 447d65990e933e27973675b6f4d63d93 [1,0,0,1,0,0|0,0,1]=3 4442 B11R1.1 CCOC[C@H]1CC[C@H](CC1)C dca432ad3524dc848cfaf2383ff946e5 [1,0,0,1,0,0|0,0,1]=3 4443 B11R1.1 C[C@H]1CC[C@@H](CC1)COCF 1156b04e4643bcc353f9b60940a0a0a8 [1,0,0,1,0,0|1,0,1]=4 4444 B11R1.1 C[C@H]1CC[C@H](CC1)COCF 17c17b2e444aa81eff9a33b7bedf3390 [1,0,0,1,0,0|1,0,1]=4 4445 B11R1.17 CCCNC1CCCCC1C bdb9b023308419a6bdd339eb4623faf7 [1,0,0,1,0,0|2,0,0]=4 4446 B11R1.17 CCCN[C@@H]1CCCC[C@@H]1C 1317a9b9d1647bfa509f7e2a68369b53 [1,0,0,1,0,0|2,0,0]=4 4447 B11R1.17 CCCN[C@@H]1CCCC[C@H]1C fdeaf4479440c414ae221687ebf74d86 [1,0,0,1,0,0|2,0,0]=4 4448 B11R1.17 CCCN[C@H]1CCCC[C@@H]1C a75070aed8e0fbb0e1d31ce9811b7104 [1,0,0,1,0,0|2,0,0]=4 4449 B11R1.17 CCCN[C@H]1CCCC[C@H]1C 93523405ad8f6e38114baf82438de76c [1,0,0,1,0,0|2,0,0]=4 4450 B11R1.17 CCCOC1CCCCC1C 4d0cd2cc86879eaea764a5e506032648 [1,0,0,1,0,0|2,0,0]=4 4451 B11R1.17 CCCO[C@@H]1CCCC[C@@H]1C e7057264cfbad8629f9a4688e6a83d4f [1,0,0,1,0,0|2,0,0]=4 4452 B11R1.17 CCCO[C@H]1CCCC[C@@H]1C 6243eb875afc5a9f4ff394ac6f43dee3 [1,0,0,1,0,0|2,0,0]=4 4453 B11R1.17 CCCO[C@H]1CCCC[C@H]1C 81c2b2c6a4f88908629c095bb85377dd [1,0,0,1,0,0|2,0,0]=4 4454 B11R1.17 CCNCC1CCCCC1C 3db2897bc02580041d74323dfcee9c77 [1,0,0,1,0,0|1,0,1]=4 4455 B11R1.17 CCOCC1CCCCN1C 8e8a56bfae80eacb06ce70cbd2978572 [1,0,0,1,0,0|1,0,1]=4 4456 B11R1.17 CCOCN1CCCCC1C 2a71a64337fff5a0e9115ec13f84cfda [1,0,0,1,0,0|1,0,1]=4 4457 B11R1.17 CCOCN1CCCC[C@@H]1C d200dca18d6cd57545248364d6503b5e [1,0,0,1,0,0|1,0,1]=4 4458 B11R1.17 CCOCN1CCCC[C@H]1C bd992d68022a5d86ce95cae6a61027b3 [1,0,0,1,0,0|1,0,1]=4 4459 B11R1.17 CCOC[C@@H]1CCCCN1C cff92034da3e0c43ee3ae40113b0373d [1,0,0,1,0,0|1,0,1]=4 4460 B11R1.17 CCOC[C@H]1CCCCN1C 81e8c9544a472aa4c574ca8fad79de10 [1,0,0,1,0,0|1,0,1]=4 4461 B11R1.41 CCC1CCCCC1OCF 1cd08105dd638695cc6af1465a6af2c4 [1,0,0,1,0,0|1,0,1]=4 4462 B11R1.41 CCCN1CCCCC1CC f2435757f1fd18c21601dd2b31d08991 [1,0,0,1,0,0|2,0,0]=4 4463 B11R1.41 CCCN1CCCC[C@@H]1CC a1da9c4facc05a83af6dbc4dddc1c007 [1,0,0,1,0,0|2,0,0]=4 4464 B11R1.41 CCCN1CCCC[C@H]1CC 211bfe4f63afdabf8e93ac5b64213f46 [1,0,0,1,0,0|2,0,0]=4 4465 B11R1.41 CCCN1CCOCC1CC 976c9f74976ccbb85c65835b77253721 [1,0,0,1,0,0|1,0,1]=4 4466 B11R1.41 CCCN1CCOC[C@@H]1CC 51af9da65d34ccb85f92a8e8e609687b [1,0,0,1,0,0|1,0,1]=4 4467 B11R1.41 CCCN1CCOC[C@H]1CC 742ea737b16f28dca9357fd1b74dd02e [1,0,0,1,0,0|1,0,1]=4 4468 B11R1.41 CCNC1CCOCC1CC a0788cf5023e9650f9f81209af942bae [1,0,0,1,0,0|1,0,1]=4 4469 B11R1.41 CCOC1CCCCC1CC 810042b55fdd81b47fd5fb695851c34e [1,0,0,1,0,0|0,0,1]=3 4470 B11R1.41 CCOC1CCCCC1OC b532451a5bdbf718fe078517509cf76d [1,0,0,1,0,0|1,0,1]=4 4471 B11R1.41 CCO[C@@H]1CCCC[C@H]1SC 2993473c789d05460b7803f356cbcc00 [1,0,0,1,0,0|1,0,1]=4 4472 B11R1.203 CCCNC1CCCCCC1 be3afd6091ac207b6cf40b281273c757 [1,0,0,1,0,0|2,0,0]=4 4473 B11R1.203 CCCOC1CCCCCC1 a0d3b974b653d57eb78c12eb297baa1e [1,0,0,1,0,0|2,0,0]=4 4474 B11R1.203 CCNCC1CCCCCC1 1aa480dec958b76c9e0d1e012a7b0c7e [1,0,0,1,0,0|1,0,1]=4 4475 B11R1.203 CCOCC1CCCCCC1 01b51887c2e87b16f92024e3ab52aa12 [1,0,0,1,0,0|0,0,1]=3 4476 B11R1.203 CCOCN1CCCCCC1 77048636f84233a3974266d958aff3ff [1,0,0,1,0,0|1,0,1]=4 4477 B11R1.203 FCOCC1CCCCCC1 180d24b69547b24cf74154898667164f [1,0,0,1,0,0|1,0,1]=4 4478 B11R1.214 CCOCC1CCN(C1)CC 0c29b017064220b6d807a2d790fafebe [1,0,0,1,0,0|1,0,1]=4 4479 B11R1.214 CCOCN1CCC(C1)CC 79fd6df4f07a457ad387ef55e5fb251c [1,0,0,1,0,0|1,0,1]=4 4480 B11R1.214 CCOC[C@@H]1CCN(C1)CC 71b4d8337022b4720c6cc8e892c85c5d [1,0,0,1,0,0|1,0,1]=4 4481 B11R1.214 CCOC[C@H]1CCN(C1)CC 459f6f7586363b7c4cb1fac5a9a6384c [1,0,0,1,0,0|1,0,1]=4 4482 B11R1.280 CCC1CCC(N(C1)CC)C ea1915439aa39a4615a48f2f8451c453 [1,0,0,1,0,0|1,0,1]=4 4483 B11R1.317 CCCCC(CC)N1CCC1 a85318baa8212e851fbcf92f6dba72d2 [1,0,0,1,0,0|2,0,0]=4 4484 B11R1.317 CCOCN(CC)C1CCC1 cca954b583f7a36d1f113a1940238117 [1,0,0,1,0,0|1,0,1]=4 4485 B11R1.319 CCCCC(CC)NC1CC1 43e701c951cbbce95d376c566352fbfc [1,0,0,1,0,0|2,0,0]=4 4486 B11R1.319 CCCCC(CC)OC1CC1 41a9c047bb17b12c116d3341c1ed8c3c [1,0,0,1,0,0|2,0,0]=4 4487 B11R1.319 CCOCN(CC)CC1CC1 5e6fd4e20b632773c02dda8c7a3575ac [1,0,0,1,0,0|1,0,1]=4 4488 B11R1.13 CCCN1CCNC(=O)C1C e2000285665816158bad39a600919fdf [1,0,0,1,0,0|2,0,0]=4 4489 B11R1.13 CCCN1CCNC(=O)[C@@H]1C 5f00d6742afd6e2977c386756da7cab8 [1,0,0,1,0,0|2,0,0]=4 4490 B11R1.13 CCCN1CCNC(=O)[C@H]1C 5612e150fb5409c8a4be11e1d3c4784d [1,0,0,1,0,0|2,0,0]=4 4491 B11R1.15 CCCC(=O)N1CCC(C1)C 08648b218ef50b96e9b556d775fff5e5 [1,0,0,1,0,0|2,0,0]=4 4492 B11R1.16 CCOC(C)C1CCCCC1 37be17fa0db3d275abb0f9a6c52c9161 [1,0,0,1,0,0|1,0,1]=4 4493 B11R1.16 CCO[C@@H](C)C1CCCCC1 df439a6e4e17aa6ad53b1ef6ed12fa04 [1,0,0,1,0,0|1,0,1]=4 4494 B11R1.16 CCO[C@H](C)C1CCCCC1 cf6c9a4c5bb690790b693154b5b07a7d [1,0,0,1,0,0|1,0,1]=4 4495 B11R1.182 CCOC1CC(CCC1C)C 33ca5bb47c81f1fcde925eecbfed1877 [1,0,0,1,0,0|1,0,1]=4 4496 B11R1.230 CC1CC(C(=O)O1)NCCBr 04ade738492c50bf7f707108a01838ad [1,0,0,1,0,0|2,0,0]=4 4497 B11R1.230 CC1CC(C(=O)O1)NCCF 5d4e96def386455a2b695f6bacd0f0a9 [1,0,0,1,0,0|2,0,0]=4 4498 B11R1.230 CC1CC(C(=O)O1)NCCI 4c60beccd3babdd2777a1eb5b1847c5a [1,0,0,1,0,0|2,0,0]=4 4499 B11R1.230 CC1CC(C(=O)O1)NCCO 2a7f81767f4e45359be36cc673ed4bce [1,0,0,1,0,0|2,0,0]=4 4500 B11R1.230 CC1CC(C(=O)O1)NCCS cbf6b654c9cd63d40a1a4c73122bb4d6 [1,0,0,1,0,0|2,0,0]=4 4501 B11R1.230 CC1CC(C(=O)O1)OCCF 9fb52e5b497829b0c77116345efd3b05 [1,0,0,1,0,0|2,0,0]=4 4502 B11R1.230 CC1CC(C(=O)O1)OCCS 3b08dd579b7c53ce435447e10b9029a2 [1,0,0,1,0,0|2,0,0]=4 4503 B11R1.230 CCCNC1CC(OC1=O)C f4af22d6ae9871f61d8d94be3052aa15 [1,0,0,1,0,0|1,0,0]=3 4504 B11R1.230 CCCOC1CC(OC1=O)C ac43bc77e6d33437408bb02628b93fb2 [1,0,0,1,0,0|1,0,0]=3 4505 B11R1.230 CCCO[C@@H]1C[C@@H](NC1=O)C 0ff45f3b02bf67b3784044e9f0bf73df [1,0,0,1,0,0|2,0,0]=4 4506 B11R1.230 COCOC1CC(OC1=O)C ab8bfea20b46dd20f3958f974956a7a5 [1,0,0,1,0,0|2,0,0]=4 4507 B11R1.349 CCCC(=O)N(C)C1CCC1 17097cc5cbe153ec94a3076290626d83 [1,0,0,1,0,0|2,0,0]=4 4508 B11R1.349 CCNC(=O)C(C)N1CCC1 e62d0532516b4b48521d5721f669a359 [1,0,0,1,0,0|2,0,0]=4 4509 B11R1.349 CCOC(=O)C(C)N1CCC1 247ee4a17d2bfb87e1670dab3d954041 [1,0,0,1,0,0|1,0,0]=3 4510 B11R1.349 CCOC(=O)[C@@H](C)N1CCC1 2cd9ca7d4721bc3b2884b4ccacd824bc [1,0,0,1,0,0|1,0,0]=3 4511 B11R1.349 CCOC(=O)[C@H](C)N1CCC1 d882433857c9e1040d9dd6f8e3a9092c [1,0,0,1,0,0|1,0,0]=3 4512 B11R1.351 CCCC(=O)N(C)CC1CC1 964844a1f3c6f366101a2a1a4a1bbbec [1,0,0,1,0,0|2,0,0]=4 4513 B11R1.351 CCNC(=O)C(C)NC1CC1 a54cfcfaea5ed3bc5913f57289334063 [1,0,0,1,0,0|2,0,0]=4 4514 B11R1.351 CCNC(=O)C(C)OC1CC1 e82cbb1c52b9d89e8e52f936547ae553 [1,0,0,1,0,0|2,0,0]=4 4515 B11R1.351 CCNC(=O)[C@H](C)NC1CC1 21671a91bbd1924ab9d56ede8fc12cc0 [1,0,0,1,0,0|2,0,0]=4 4516 B11R1.351 CCOC(=O)C(C)NC1CC1 43ce8bcdab426f856215f2e367552879 [1,0,0,1,0,0|1,0,0]=3 4517 B11R1.351 CCOC(=O)C(C)OC1CC1 8f121fffbdfb8c69513adfb78a817ffc [1,0,0,1,0,0|1,0,0]=3 4518 B11R1.351 CCOC(=O)C(F)NC1CC1 fa37f1b1454b693ebcdf38d4c3d08391 [1,0,0,1,0,0|2,0,0]=4 4519 B11R1.351 CCOC(=O)C(F)OC1CC1 58d9658187bf71f8329602ec5c0360bb [1,0,0,1,0,0|2,0,0]=4 4520 B11R1.351 CCOC(=O)[C@@H](C)NC1CC1 d24ba8255323dca9068953998197edce [1,0,0,1,0,0|1,0,0]=3 4521 B11R1.351 CCOC(=O)[C@@H](C)OC1CC1 18027b222fc21d0e5e733a667340d225 [1,0,0,1,0,0|1,0,0]=3 4522 B11R1.351 CCOC(=O)[C@H](C)NC1CC1 c537d0e48f10cc217b7428cea78a8e56 [1,0,0,1,0,0|1,0,0]=3 4523 B11R1.351 CCOC(=O)[C@H](C)OC1CC1 b074a7bbe46b310f2c22bfd4057f2fda [1,0,0,1,0,0|1,0,0]=3 4524 B11R1.526 CCCNC(C)C(=O)C1CC1 ba8dfc9c4583db43c2e84addf714d1c9 [1,0,0,1,0,0|2,0,0]=4 4525 B11R1.526 CCCOC(C)C(=O)C1CC1 04c732ab126cfbe1a077b9b030ba44fa [1,0,0,1,0,0|2,0,0]=4 4526 B11R1.822 CCCC(=O)N1CC(C1)CC 4c7cacde79ba3d40bfdcef476953df4d [1,0,0,1,0,0|2,0,0]=4 4527 B11R1.822 CCOC(=O)C1CN(C1)CC cc9fe1cef8a05b1a9f32cc496a32efbe [1,0,0,1,0,0|1,0,0]=3 4528 B11R1.822 CCOC(=O)C1CN(C1)CF 6b5969aa2ad39662c35a1c87861397a2 [1,0,0,1,0,0|2,0,0]=4 4529 B11R1.822 CCOC(=O)C1CN(C1)CO 014fd3a7f7cd039472f04f9009f6bd3f [1,0,0,1,0,0|2,0,0]=4 4530 B11R1.1133 CCCNC1(CCNC1=O)C 6ab89bcee2411162f104beec50d287cc [1,0,0,1,0,0|2,0,0]=4 4531 B11R1.1133 CCOCC1(CCCC1=O)C 2e74a5d10a171662593a700ef34abd27 [1,0,0,1,0,0|2,0,0]=4 4532 B11R1.1133 CCOCC1(CCNC1=O)C 3705a76597def5bc5b0666aaacdf3e87 [1,0,0,1,0,0|2,0,0]=4 4533 B11R1.199 CCCC(=O)N1CCCC1C 8c24dc4b9058c88c58f6be94f5bfa8dc [1,0,0,1,0,0|2,0,0]=4 4534 B11R1.199 CCCC(=O)N1CCC[C@@H]1C 87bbbddbc09dd6f86d6c8e25df54a80d [1,0,0,1,0,0|2,0,0]=4 4535 B11R1.199 CCCC(=O)N1CCC[C@H]1C 1bc4022f596909465ba443478f45a3f5 [1,0,0,1,0,0|2,0,0]=4 4536 B11R1.200 CCCC(=O)N1CCC1CC 1463a3076dd4a4f8cdaa143f1b5367da [1,0,0,1,0,0|2,0,0]=4 4537 B11R1.265 CCC1C(=O)NCCN1CC 20cad01c24a6fd6c6dca4bb23ec63051 [1,0,0,1,0,0|2,0,0]=4 4538 B11R1.823 CCCC(=O)N(CC)C1CC1 e0af19378bfc5433494d42ff7e51002b [1,0,0,1,0,0|2,0,0]=4 4539 B11R1.838 CCCC1(CC1)C(C)OCC 94441e29c1261089e2e4ac638767e48e [1,0,0,1,0,0|1,0,1]=4 4540 B11R1.838 CCNC1(CC1)C(=O)OCC bd1656521aa0dfa2707d9a3bf848fc3b [1,0,0,1,0,0|1,0,0]=3 4541 B11R1.838 CCOC(=O)C1(CC1)NCF 96674e3933b0cd9621de0d2974e645bf [1,0,0,1,0,0|2,0,0]=4 4542 B11R1.838 CCOC(=O)C1(CC1)NCO 710d291f1109addc072e4d0502370de0 [1,0,0,1,0,0|2,0,0]=4 4543 B11R1.18 CCCCC1CCCN1CC 6c3b253cd7b75c3fe3c15ee12418cb92 [1,0,0,1,0,0|2,0,0]=4 4544 B11R1.22 CC1CCN(CC1)C(=O)CF 1ee8cd5e8233a14fc7ef9592669e1e27 [1,0,0,1,0,0|2,0,0]=4 4545 B11R1.22 CC1CCN(CC1)C(=O)CO 0dc849a3316f225da3907b220b492896 [1,0,0,1,0,0|2,0,0]=4 4546 B11R1.22 CC1CCN(CC1)C(=O)CS 64067df21a57cc0aaef406d06f73ce84 [1,0,0,1,0,0|2,0,0]=4 4547 B11R1.22 CCC(=O)N1CCC(CC1)C c81613b6655c997eca709dfa4094755b [1,0,0,1,0,0|1,0,0]=3 4548 B11R1.22 CCC(=O)N1CCC(CC1)Cl 69399477677d06e23814d2eb73d1e76d [1,0,0,1,0,0|2,0,0]=4 4549 B11R1.22 CCC(=O)N1CCC(CC1)F 9a0f1d78e5746cad44a6465147e83a4f [1,0,0,1,0,0|2,0,0]=4 4550 B11R1.22 CCC(=O)N1CCC(CC1)I 88f486c55380121dbf1ac32d011274be [1,0,0,1,0,0|2,0,0]=4 4551 B11R1.22 CCC(=O)N1CCC(CC1)O 89d8799ed899e8f033da26c1bde26127 [1,0,0,1,0,0|2,0,0]=4 4552 B11R1.22 CCC(=O)N1CCN(CC1)C 054441d860ca0929b72bdc09168eb7e7 [1,0,0,1,0,0|2,0,0]=4 4553 B11R1.22 CCN(C)C1CCC(CC1)C ebfe8deeaff65f22fc90ec9921b4367c [1,0,0,1,0,0|2,0,0]=4 4554 B11R1.22 CCN(C)[C@H]1CC[C@@H](CC1)C 9f1d1328ac8f1e57a6d39f8486ba3b75 [1,0,0,1,0,0|2,0,0]=4 4555 B11R1.44 CCC(=O)N1CCC(C1)CC 9c942fe148046ddf3325c6b967f2244f [1,0,0,1,0,0|1,0,0]=3 4556 B11R1.44 CCC(=O)N1CCC(C1)CO 791e06acdd4f299d9e5b4cd1eb740b12 [1,0,0,1,0,0|2,0,0]=4 4557 B11R1.44 CCC(=O)N1CCC(C1)OC 2f17bb79caa74cf87be6008ac6d034ae [1,0,0,1,0,0|2,0,0]=4 4558 B11R1.44 CCC(=O)N1CC[C@@H](C1)CO 36e5e594020e7aa5c1edf95a2efbc852 [1,0,0,1,0,0|2,0,0]=4 4559 B11R1.44 CCC(=O)N1CC[C@@H](C1)OC ec580c6d1933e6006530bac61136e134 [1,0,0,1,0,0|2,0,0]=4 4560 B11R1.44 CCC(=O)N1CC[C@H](C1)CO b1cd0b8a063914019aca343f6de73008 [1,0,0,1,0,0|2,0,0]=4 4561 B11R1.44 CCC(=O)N1CC[C@H](C1)OC 5bfeec9ebab9fbb88580ab3bd1bdae72 [1,0,0,1,0,0|2,0,0]=4 4562 B11R1.44 CCC1CCN(C1)C(=O)CF 4a4c7e48575a0e3e3e8229c84832bdbb [1,0,0,1,0,0|2,0,0]=4 4563 B11R1.44 CCC1CCN(C1)C(=O)CO a3cadcd7f70020828af095122464617e [1,0,0,1,0,0|2,0,0]=4 4564 B11R1.44 CCC1CCN(C1)C(=O)CS cbd431b34ad7890dec08b2180f04164a [1,0,0,1,0,0|2,0,0]=4 4565 B11R1.44 CCN1CCC(C1)C(=O)NC 75a3a1a0424c28bdf31032a3a6dd9382 [1,0,0,1,0,0|2,0,0]=4 4566 B11R1.44 CCN1CCC(C1)C(=O)OC 1e302227f7cd3ebd4032ffb883ffe322 [1,0,0,1,0,0|1,0,0]=3 4567 B11R1.44 CCN1CC[C@@H](C1)C(=O)OC 14caec3a25d478de0124fbbe12f334d9 [1,0,0,1,0,0|1,0,0]=3 4568 B11R1.44 CCN1CC[C@H](C1)C(=O)OC 7c02d05cc29379c4da0c22a30aacd16c [1,0,0,1,0,0|1,0,0]=3 4569 B11R1.44 COC(=O)C1CCN(C1)CF beac0d1d5452231ee5981e04dbe0268a [1,0,0,1,0,0|2,0,0]=4 4570 B11R1.44 COC(=O)C1CCN(C1)CO 04b31db22699d0ed11c1d3bbfb56a570 [1,0,0,1,0,0|2,0,0]=4 4571 B11R1.44 COC(=O)[C@@H]1CCN(C1)CF 686443a5c36207345825f273c4af2395 [1,0,0,1,0,0|2,0,0]=4 4572 B11R1.44 COC(=O)[C@@H]1CCN(C1)CO 4ff1cba63dd605b00ce13765a03d1c08 [1,0,0,1,0,0|2,0,0]=4 4573 B11R1.44 COC(=O)[C@H]1CCN(C1)CF 26296f7bcc4551dc7517b1f1851c8393 [1,0,0,1,0,0|2,0,0]=4 4574 B11R1.44 COC(=O)[C@H]1CCN(C1)CO 1fa5a03b05f643b6ac84153a5241b26b [1,0,0,1,0,0|2,0,0]=4 4575 B11R1.115 CCC(=O)N1CCC1CCO eddb6c4f0d5bb86f1b69a9d0a98c855f [1,0,0,1,0,0|2,0,0]=4 4576 B11R1.115 CCC(=O)N1CCC1COC db3d0b5d118dcddc156574aa13753f9d [1,0,0,1,0,0|2,0,0]=4 4577 B11R1.115 CCC(=O)N1CC[C@@H]1COC 577aea14e80ad29d1cb7c127eea306dc [1,0,0,1,0,0|2,0,0]=4 4578 B11R1.115 CCC(=O)N1CC[C@H]1COC 45ac63ef9836610feb682a191373f53a [1,0,0,1,0,0|2,0,0]=4 4579 B11R1.115 CCCN1CC[C@@H]1C(=O)OC c4d0d2b7afd55bcbcd4477409e2cf1ae [1,0,0,1,0,0|1,0,0]=3 4580 B11R1.115 COC(=O)[C@H]1CCN1CCF 83b9dc8bd55ebae718bf72d2411bc315 [1,0,0,1,0,0|2,0,0]=4 4581 B11R1.115 COC(=O)[C@H]1CCN1CCO d92491e1291b13814a1d77666d4faeb6 [1,0,0,1,0,0|2,0,0]=4 4582 B11R1.115 COC(=O)[C@H]1CCN1CCS 6bcd8f37dfcac90acec6d95a0b2b5ea1 [1,0,0,1,0,0|2,0,0]=4 4583 B11R1.115 COC(=O)[C@H]1CCN1CSC a130c08d2a2b5a05b78a6921cf7aeee5 [1,0,0,1,0,0|2,0,0]=4 4584 B11R1.115 COCN1CC[C@@H]1C(=O)OC b54dea898c40f5027e4abf3e62330f0e [1,0,0,1,0,0|2,0,0]=4 4585 B11R1.222 CC1CCCCN1C(=O)CF 2a20aad245cc4e1b1043d68e67a10cc7 [1,0,0,1,0,0|2,0,0]=4 4586 B11R1.222 CC1CCCCN1C(=O)CO f2377579275bd5ba13851bbc93dd16bd [1,0,0,1,0,0|2,0,0]=4 4587 B11R1.222 CC1CCCCN1C(=O)CS 68a733d59a5683e65b805d00c889dec6 [1,0,0,1,0,0|2,0,0]=4 4588 B11R1.222 CCC(=O)N1CCCCC1C 9f8997a43a0135743998f58647508ffc [1,0,0,1,0,0|1,0,0]=3 4589 B11R1.222 CCC(=O)N1CCCC[C@@H]1C b83df98c72b4c39c4638f2400442f81a [1,0,0,1,0,0|1,0,0]=3 4590 B11R1.222 CCC(=O)N1CCCC[C@H]1C ea345c17f894328087f191f4cea87dc5 [1,0,0,1,0,0|1,0,0]=3 4591 B11R1.222 CCC(=O)N1CCOCC1C c62b05094ec92ad8bfadc072896fcd99 [1,0,0,1,0,0|2,0,0]=4 4592 B11R1.222 CCC(=O)N1CCOC[C@@H]1C fa6d883d02ea18be62391aed8ef72573 [1,0,0,1,0,0|2,0,0]=4 4593 B11R1.222 CCC(=O)N1CCOC[C@H]1C 2ec268205e61d451ea1e7cf81e8e23f4 [1,0,0,1,0,0|2,0,0]=4 4594 B11R1.222 CCN(C)[C@H]1CCCC[C@H]1C 9fc1959d4e688a82e1c1057fafa8f084 [1,0,0,1,0,0|2,0,0]=4 4595 B11R1.222 C[C@@H]1CCCCN1C(=O)CF 0e104784bf225e33e8089450924912a4 [1,0,0,1,0,0|2,0,0]=4 4596 B11R1.222 C[C@@H]1CCCCN1C(=O)CO d453731bdb038659b97a613a0b95de07 [1,0,0,1,0,0|2,0,0]=4 4597 B11R1.222 C[C@@H]1CCCCN1C(=O)CS 483f96e82fc51ff9e9c2d6b4ca146ee9 [1,0,0,1,0,0|2,0,0]=4 4598 B11R1.222 C[C@H]1CCCCN1C(=O)CF e6b6a07302c373d4a21429fef19bffdc [1,0,0,1,0,0|2,0,0]=4 4599 B11R1.222 C[C@H]1CCCCN1C(=O)CO 754de7529e354e1000f4a6e493fc95f0 [1,0,0,1,0,0|2,0,0]=4 4600 B11R1.222 C[C@H]1CCCCN1C(=O)CS e939555a2b85d077dd09c59319c1bc1a [1,0,0,1,0,0|2,0,0]=4 4601 B11R1.852 CCC(=O)N1CCCCCC1 ad10cabe38a2ba06b9fbc202cc4d0017 [1,0,0,1,0,0|1,0,0]=3 4602 B11R1.852 CCC(=O)N1CCCOCC1 73461dfd41208a3bd9e9ede4249daf39 [1,0,0,1,0,0|2,0,0]=4 4603 B11R1.852 CCN(C)C1CCCCCC1 066069867938ad225737044af6360627 [1,0,0,1,0,0|2,0,0]=4 4604 B11R1.852 O=C(CF)N1CCCCCC1 1c95e42af8af133957704485dc4da987 [1,0,0,1,0,0|2,0,0]=4 4605 B11R1.852 O=C(CO)N1CCCCCC1 d1c31dd67819daac890df5180aa87f09 [1,0,0,1,0,0|2,0,0]=4 4606 B11R1.852 O=C(CS)N1CCCCCC1 14f03e05a0fe91a27efd6a0d4c9ca632 [1,0,0,1,0,0|2,0,0]=4 4607 B11R1.860 CCC(=O)N(CC)C1CCC1 7f4a3e1c30528fa86642a0dcb97dddc9 [1,0,0,1,0,0|1,0,0]=3 4608 B11R1.860 CCC(=O)N(CC)C1COC1 965be85119ed44d0fa0ec9ec870ca9ea [1,0,0,1,0,0|2,0,0]=4 4609 B11R1.860 CCC(=O)N(CC)C1CSC1 00bf0a65e8f78a76c83bf6a63e4065a4 [1,0,0,1,0,0|2,0,0]=4 4610 B11R1.860 CCC(C(=O)OC)N1CCC1 c571d7de90c95a74db69e3f5572e8513 [1,0,0,1,0,0|1,0,0]=3 4611 B11R1.860 CCN(C(=O)CF)C1CCC1 1be75aaa6db6a7bc64b7cfddfc47cdaa [1,0,0,1,0,0|2,0,0]=4 4612 B11R1.860 CCN(C(=O)CO)C1CCC1 011a44577558f6533e0ec9b696ad2c76 [1,0,0,1,0,0|2,0,0]=4 4613 B11R1.860 CCN(C(=O)CS)C1CCC1 97891cf0c55d24a1bc84b72e14f00b67 [1,0,0,1,0,0|2,0,0]=4 4614 B11R1.860 CC[C@H](C(=O)OC)N1CCC1 722709f4c6bbc5c34810956bc3eac4fa [1,0,0,1,0,0|1,0,0]=3 4615 B11R1.860 COC(=O)C(CO)N1CCC1 26d428119afb3a549a2de3cbeaacb842 [1,0,0,1,0,0|2,0,0]=4 4616 B11R1.860 COC(=O)[C@@H](CO)N1CCC1 a38f9dbfaec2334bd6a35b9bbf3430ee [1,0,0,1,0,0|2,0,0]=4 4617 B11R1.860 COC(=O)[C@H](CO)N1CCC1 c672f2b67b677ca3c20b59623bfe5407 [1,0,0,1,0,0|2,0,0]=4 4618 B11R1.862 CCC(=O)C(CC)OC1CC1 44418cfa1dbd1e269d0bd4ac622cd23f [1,0,0,1,0,0|1,0,0]=3 4619 B11R1.862 CCC(=O)N(CC)CC1CC1 79a7eb93738027ac18c9abb08f9e0eb5 [1,0,0,1,0,0|1,0,0]=3 4620 B11R1.862 CCC(NC1CC1)C(=O)NC e549d2c821d4df00d72cc5dc0f295ef6 [1,0,0,1,0,0|2,0,0]=4 4621 B11R1.862 CCC(NC1CC1)C(=O)OC 6b4b3fd53c3eeca43c4b2e1045c35f19 [1,0,0,1,0,0|1,0,0]=3 4622 B11R1.862 CCC(OC1CC1)C(=O)OC dc6fb4c1de351cb8306e4b3c810cf486 [1,0,0,1,0,0|1,0,0]=3 4623 B11R1.862 CCN(CC1CC1)C(=O)CF 91c64df1afe89249577df61f562c1c81 [1,0,0,1,0,0|2,0,0]=4 4624 B11R1.862 CCN(CC1CC1)C(=O)CO 44711410f170103c125cb61fe9bd6dbf [1,0,0,1,0,0|2,0,0]=4 4625 B11R1.862 CCN(CC1CC1)C(=O)CS 123eff3724ae171f05e36dc8a0d0d257 [1,0,0,1,0,0|2,0,0]=4 4626 B11R1.862 CC[C@@H](NC1CC1)C(=O)OC 94cf6ff84ed42985ba583d964ccb0bb4 [1,0,0,1,0,0|1,0,0]=3 4627 B11R1.862 CC[C@@H](OC1CC1)C(=O)OC 4f31043b88a8dcc4b3e0d9bd94381983 [1,0,0,1,0,0|1,0,0]=3 4628 B11R1.862 CC[C@H](NC1CC1)C(=O)OC 679587717e0d82e1f35924a412e22db3 [1,0,0,1,0,0|1,0,0]=3 4629 B11R1.862 COC(=O)C(CO)NC1CC1 8c8023ab31d2e45ab72f2dea196f2b3e [1,0,0,1,0,0|2,0,0]=4 4630 B11R1.862 COC(=O)C(OC)OC1CC1 594020a30af2758b42e900424ce35f88 [1,0,0,1,0,0|2,0,0]=4 4631 B11R1.862 COC(=O)[C@@H](CO)NC1CC1 56f13b323ad6ea9da28831c7db51dfcf [1,0,0,1,0,0|2,0,0]=4 4632 B11R1.862 COC(=O)[C@H](CO)NC1CC1 0fa3afcf358f6e90d6b15142e8b7a0cb [1,0,0,1,0,0|2,0,0]=4 4633 B11R1.865 CCC(=O)N1CCC(C1C)O 88e0a685479f890a5bf245baeb4d7e03 [1,0,0,1,0,0|2,0,0]=4 4634 B11R1.865 CCC(=O)N1CC[C@@H]([C@@H]1C)O 271b87533ebe4536be35829b757e1960 [1,0,0,1,0,0|2,0,0]=4 4635 B11R1.865 CCC(=O)N1CC[C@H]([C@H]1C)O a139b656180ab9b6c4f6a30b0cecc006 [1,0,0,1,0,0|2,0,0]=4 4636 B11R1.915 CCCNC1(CC1)C(=O)NC e1ee5a92094b3896bf752fd8fcc8e355 [1,0,0,1,0,0|2,0,0]=4 4637 B11R1.915 CCOCC1(CC1)C(=O)NC 3b863533107ebf5492007b32ae0ef064 [1,0,0,1,0,0|2,0,0]=4 4638 B11R1.915 CCOCC1(CC1)C(=O)OC 9682f749db7c78ba89cf4d5f09cb8e5f [1,0,0,1,0,0|1,0,0]=3 4639 B11R1.915 COC(=O)C1(CC1)COCF 0fe78382dcc33957914d08c7e13adc0b [1,0,0,1,0,0|2,0,0]=4 4640 B11R1.915 COC(=O)C1(CC1)NCCO 70364d4884718702677f549dadea27fb [1,0,0,1,0,0|2,0,0]=4 4641 B11R1.915 COC(=O)C1(CC1)NCCS 8ad0ebb1d6d2c76657079a6cf4743329 [1,0,0,1,0,0|2,0,0]=4 4642 B13R1.19 C/C=C/C(=O)NC1CCC(CC1)C ea2a7c2d1882e8ae1f7401bcfd4e0f82 [0,0,0,1,0,1|1,0,1]=4 4643 B13R1.19 C/C=C/C(=O)N[C@H]1CC[C@@H](CC1)C c1a35e720a6d67feb87ea4650414e598 [0,0,0,1,0,1|1,0,1]=4 4644 B13R1.19 C/C=C/C(=O)N[C@H]1CC[C@H](CC1)C 514f85a0ab5cfd792f1c66a0bcc0ca68 [0,0,0,1,0,1|1,0,1]=4 4645 B13R1.19 CC#CC(=O)NC1CCC(CC1)C 47891bc0bd000254d41e774476468ad9 [0,0,0,1,0,1|1,0,1]=4 4646 B13R1.19 CC#CC(=O)N[C@H]1CC[C@@H](CC1)C 8c96154bf9e23ebca5d5fb5f09249ba5 [0,0,0,1,0,1|1,0,1]=4 4647 B13R1.19 CC#CC(=O)N[C@H]1CC[C@H](CC1)C e89cb9b94f216e2e70bb4e0df4d90aba [0,0,0,1,0,1|1,0,1]=4 4648 B13R1.19 CC1CCC(CC1)NC(=O)CCF 8f82bb9e03120ae605b211993f9eeadd [0,0,0,1,0,1|2,0,0]=4 4649 B13R1.19 CCCC(=O)CN1CCC(CC1)C 609c4daf17a8446afdf900be9e95a610 [0,0,0,1,0,1|2,0,0]=4 4650 B13R1.19 CCCC(=O)NC1CCC(CC1)C 41ee3bc9e5b335c3ffa3cbb1ad1fd967 [0,0,0,1,0,1|1,0,0]=3 4651 B13R1.19 CCCC(=O)NC1CCC(CC1)Cl db5bd85fc552eebfc50fa232207f0335 [0,0,0,1,0,1|2,0,0]=4 4652 B13R1.19 CCCC(=O)NC1CCC(CC1)O 72a820f4fa79c8cb8bc03ce487b4c6d8 [0,0,0,1,0,1|2,0,0]=4 4653 B13R1.19 CCCC(=O)NC1CCN(CC1)C 080c1d2c0c597cb4e49e6e05bcdfdf06 [0,0,0,1,0,1|2,0,0]=4 4654 B13R1.19 CCCC(=O)N[C@H]1CC[C@@H](CC1)C 9a1e3dfdf501b3efa1e3e82de159627c [0,0,0,1,0,1|1,0,0]=3 4655 B13R1.19 CCCC(=O)N[C@H]1CC[C@@H](CC1)Cl 5f8d267917b3a9147716745f6f5f0c64 [0,0,0,1,0,1|2,0,0]=4 4656 B13R1.19 CCCC(=O)N[C@H]1CC[C@@H](CC1)O 1549e4b7a8721faca10c08dc0bcb1d74 [0,0,0,1,0,1|2,0,0]=4 4657 B13R1.19 CCCC(=O)N[C@H]1CC[C@H](CC1)C dfd5ca058ec3e0a5bdfb05be70c04265 [0,0,0,1,0,1|1,0,0]=3 4658 B13R1.19 CCCC(=O)N[C@H]1CC[C@H](CC1)Cl 015694f798bab55fcb639fe03eb5b7d2 [0,0,0,1,0,1|2,0,0]=4 4659 B13R1.19 CCCC(=O)N[C@H]1CC[C@H](CC1)O 353754747d2bd59d779ba2f976aae7a4 [0,0,0,1,0,1|2,0,0]=4 4660 B13R1.19 CCCC(=S)OC1CCC(CC1)C 2713b455a003cb2833662e04570fa363 [0,0,0,1,0,1|1,1,0]=4 4661 B13R1.19 CCNC(=O)CN1CCC(CC1)C 262d593ef0d8dd4960948465e536ae7e [0,0,0,1,0,1|2,0,0]=4 4662 B13R1.19 CCOC(=O)CN1CCC(CC1)C f2e427e28e783ceb3b96aad86d83057f [0,0,0,1,0,1|1,0,0]=3 4663 B13R1.19 CCOC(=O)CN1CCC(CC1)Cl 493099c4b30f30af333d8f2af4d7d5cc [0,0,0,1,0,1|2,0,0]=4 4664 B13R1.19 CCOC(=O)CN1CCC(CC1)F 87ed2d21032052ac97dd92b01bd4c195 [0,0,0,1,0,1|2,0,0]=4 4665 B13R1.19 CCOC(=O)CN1CCC(CC1)I 69fc4cd9c4bef5e2575029cfd123b51a [0,0,0,1,0,1|2,0,0]=4 4666 B13R1.19 CCOC(=O)CN1CCC(CC1)O f6bd235eae4374b28bb8434f0cf229f3 [0,0,0,1,0,1|2,0,0]=4 4667 B13R1.19 CCOC(=O)CN1CCN(CC1)C 6bc4e4bcff3419bc79ed1c10a9eab658 [0,0,0,1,0,1|2,0,0]=4 4668 B13R1.19 COCC(=O)NC1CCC(CC1)C 66a8e308353c28c35d31036416197e55 [0,0,0,1,0,1|2,0,0]=4 4669 B13R1.19 COCC(=O)N[C@H]1CC[C@@H](CC1)C 6a977669e97d66308ad278f21254d32a [0,0,0,1,0,1|2,0,0]=4 4670 B13R1.19 COCC(=O)N[C@H]1CC[C@H](CC1)C 48adcb4fb7536dd70d14194acb74c075 [0,0,0,1,0,1|2,0,0]=4 4671 B13R1.19 CSCC(=O)NC1CCC(CC1)C 2da6a0e954e7c79cd7e2f26e32219190 [0,0,0,1,0,1|2,0,0]=4 4672 B13R1.19 CSCC(=O)N[C@H]1CC[C@@H](CC1)C b4a56fad9fdfcde023eaf20795f92080 [0,0,0,1,0,1|2,0,0]=4 4673 B13R1.19 CSCC(=O)N[C@H]1CC[C@H](CC1)C e6a0e2cc7396994e7a07a3ac9581af7a [0,0,0,1,0,1|2,0,0]=4 4674 B13R1.19 C[C@H]1CC[C@@H](CC1)NC(=O)CCF f0a80f8ab81a526490460d5b727b74e7 [0,0,0,1,0,1|2,0,0]=4 4675 B13R1.19 C[C@H]1CC[C@H](CC1)NC(=O)CCF ba20322fb0ec22bddf3dca6b157e4d27 [0,0,0,1,0,1|2,0,0]=4 4676 B13R1.223 CCOC(=O)CN1CCC1CCO 664c16ec92f7c364d271da59b3b19503 [0,0,0,1,0,1|2,0,0]=4 4677 B13R1.223 CCOC(=O)CN1CCC1COC f323a0c9c0f597dee027fb5a22966a86 [0,0,0,1,0,1|2,0,0]=4 4678 B13R1.223 CCOC(=O)CN1CC[C@@H]1COC 1e61542058a86a1d64edfef19da244a9 [0,0,0,1,0,1|2,0,0]=4 4679 B13R1.223 CCOC(=O)CN1CC[C@H]1COC bf16ca26334bd8409fd50839c1576ff1 [0,0,0,1,0,1|2,0,0]=4 4680 B13R1.372 CCCCC(CC)OC1CCCO1 1a5d17cd81a933cd0ca9b8b09c8588e4 [0,0,0,1,0,1|1,0,1]=4 4681 B13R1.464 C/C=C/C(=O)N1CCCCC1CC d03f57a4de82f18e932c82619b6c9574 [0,0,0,1,0,1|1,0,1]=4 4682 B13R1.464 C/C=C/C(=O)N1CCCC[C@@H]1CC ebdd11c4e61e02873344039731746533 [0,0,0,1,0,1|1,0,1]=4 4683 B13R1.464 C/C=C/C(=O)N1CCCC[C@H]1CC f4ccfff817d160bf0bf3b8787939b04e [0,0,0,1,0,1|1,0,1]=4 4684 B13R1.464 CC#CC(=O)N1CCCCC1CC 8f3b1900f84a5877d5a1c4e99aa1e5f3 [0,0,0,1,0,1|1,0,1]=4 4685 B13R1.464 CC#CC(=O)N1CCCC[C@@H]1CC 7f9215cbac8cc920a392754e0c81f597 [0,0,0,1,0,1|1,0,1]=4 4686 B13R1.464 CC#CC(=O)N1CCCC[C@H]1CC e5446acc04c5cad79afe997492fd9ba9 [0,0,0,1,0,1|1,0,1]=4 4687 B13R1.464 CCC1CCCCN1C(=O)CCF 2381c0a01468320b2d772ad941065255 [0,0,0,1,0,1|2,0,0]=4 4688 B13R1.464 CCC1CCCCN1C(=O)CCO 012128402af08d9ff5bae91266969651 [0,0,0,1,0,1|2,0,0]=4 4689 B13R1.464 CCC1CCCCN1C(=O)CCS 5faeec06554f8a440c6444d8e535cc2e [0,0,0,1,0,1|2,0,0]=4 4690 B13R1.464 CCC1CCCCN1C(=O)COC e0126eb77124f30d8e8a677af2f2c811 [0,0,0,1,0,1|2,0,0]=4 4691 B13R1.464 CCC1CCCCN1C(=O)CSC b779d855ed4cc78626f95e1017515d97 [0,0,0,1,0,1|2,0,0]=4 4692 B13R1.464 CCCC(=O)N1CCCCC1CC c8095af7f69837102d67b265ff76d42b [0,0,0,1,0,1|1,0,0]=3 4693 B13R1.464 CCCC(=O)N1CCCCC1CO d4323c1c7c9cdbc46dbc45d2dc8e51b5 [0,0,0,1,0,1|2,0,0]=4 4694 B13R1.464 CCCC(=O)N1CCCC[C@@H]1CC c5a5c956adc2d1c648a4baf0b3daa045 [0,0,0,1,0,1|1,0,0]=3 4695 B13R1.464 CCCC(=O)N1CCCC[C@@H]1CO 92a2793e75ada6a3a778c761be1c014c [0,0,0,1,0,1|2,0,0]=4 4696 B13R1.464 CCCC(=O)N1CCCC[C@H]1CC a1b1c2bf3cd8dc6bfdc24fe9f52b8cb5 [0,0,0,1,0,1|1,0,0]=3 4697 B13R1.464 CCCC(=O)N1CCCC[C@H]1CO c1b45a6d0bb8d0f31a5becce0f8e2826 [0,0,0,1,0,1|2,0,0]=4 4698 B13R1.464 CCCC(=O)N1CCOCC1CC 73b0822699d4acb57ca7a7ab8639898f [0,0,0,1,0,1|2,0,0]=4 4699 B13R1.464 CCCC(=O)N1CCOC[C@@H]1CC 0a83f90f6f48c95ff630f00a0c87d175 [0,0,0,1,0,1|2,0,0]=4 4700 B13R1.464 CCCC(=O)N1CCOC[C@H]1CC 2f40074efb224bbc836b2d7609169d8b [0,0,0,1,0,1|2,0,0]=4 4701 B13R1.464 CCOC(=O)C1CCCCN1CC 2ec2db69c223b3b40c8791450e08567b [0,0,0,1,0,1|1,0,0]=3 4702 B13R1.464 CCOC(=O)C1CCCCN1CF e321a738a95ceb181563530331cafa4b [0,0,0,1,0,1|2,0,0]=4 4703 B13R1.464 CCOC(=O)C1CCCCN1CO bfea3379a5b106378e65b7ea8d98a8c1 [0,0,0,1,0,1|2,0,0]=4 4704 B13R1.464 CCOC(=O)C1COCCN1CC f1f6d47ba216bef8cc88ce540f65d628 [0,0,0,1,0,1|2,0,0]=4 4705 B13R1.464 CCOC(=O)C1CSCCN1CC f07ad93b4dde2894d77ef2ac1555ad1a [0,0,0,1,0,1|2,0,0]=4 4706 B13R1.464 CCOC(=O)[C@@H]1CCCCN1CC dd3817f72e0c8772e76af26e818c433b [0,0,0,1,0,1|1,0,0]=3 4707 B13R1.464 CCOC(=O)[C@@H]1CCCCN1CF 935a0249dbe12cd22df40929d0502bcc [0,0,0,1,0,1|2,0,0]=4 4708 B13R1.464 CCOC(=O)[C@@H]1CCCCN1CO f9a7dec8c03f2d1a6384db5fb98e4f86 [0,0,0,1,0,1|2,0,0]=4 4709 B13R1.464 CCOC(=O)[C@H]1CCCCN1CC 105d459dbbf4bc4850a4b5e84896cb04 [0,0,0,1,0,1|1,0,0]=3 4710 B13R1.464 CCOC(=O)[C@H]1CCCCN1CF 2c96b5c3db377abb87cf2c0222f07526 [0,0,0,1,0,1|2,0,0]=4 4711 B13R1.464 CCOC(=O)[C@H]1CCCCN1CO 649de0d8697378ad985e5c26b971c05d [0,0,0,1,0,1|2,0,0]=4 4712 B13R1.464 CC[C@@H]1CCCCN1C(=O)CCF 0421041409c7ed62ff86fb859413e8d8 [0,0,0,1,0,1|2,0,0]=4 4713 B13R1.464 CC[C@@H]1CCCCN1C(=O)CCO 20a03c4784c652faa7c24496e1e5025b [0,0,0,1,0,1|2,0,0]=4 4714 B13R1.464 CC[C@@H]1CCCCN1C(=O)CCS 3d6571d98ea235f3e120b8b5ebae450b [0,0,0,1,0,1|2,0,0]=4 4715 B13R1.464 CC[C@@H]1CCCCN1C(=O)COC 2a1d2534f48ec68d8a04288a0e85d2ed [0,0,0,1,0,1|2,0,0]=4 4716 B13R1.464 CC[C@@H]1CCCCN1C(=O)CSC 0aefce00793de80062947d89fcde73e2 [0,0,0,1,0,1|2,0,0]=4 4717 B13R1.464 CC[C@H]1CCCCN1C(=O)CCF 2834ce14616084a584860bdad0fddfa0 [0,0,0,1,0,1|2,0,0]=4 4718 B13R1.464 CC[C@H]1CCCCN1C(=O)CCO a511d29b5e44016ed89ff647112ea820 [0,0,0,1,0,1|2,0,0]=4 4719 B13R1.464 CC[C@H]1CCCCN1C(=O)CCS 8cf9181c152831136a1996f57d4cdaaf [0,0,0,1,0,1|2,0,0]=4 4720 B13R1.464 CC[C@H]1CCCCN1C(=O)COC 4110ccfd01856759b3a8c89e5bacf7b3 [0,0,0,1,0,1|2,0,0]=4 4721 B13R1.464 CC[C@H]1CCCCN1C(=O)CSC 9d8865f31a57c335503fb5fb80bfc876 [0,0,0,1,0,1|2,0,0]=4 4722 B13R1.470 C/C=C/C(=O)NC1CCCCC1C f2f0c4f9b31d9b6b4249d6479105eb9e [0,0,0,1,0,1|1,0,1]=4 4723 B13R1.470 C/C=C/C(=O)N[C@@H]1CCCC[C@@H]1C 5d09a210bd2abb8ac37ffcf0da75e1bd [0,0,0,1,0,1|1,0,1]=4 4724 B13R1.470 C/C=C/C(=O)N[C@@H]1CCCC[C@H]1C d649627e7b7bfefa9208f7741a276a87 [0,0,0,1,0,1|1,0,1]=4 4725 B13R1.470 C/C=C/C(=O)N[C@H]1CCCC[C@@H]1C 5aee518891ef963b7d4808231a7e5510 [0,0,0,1,0,1|1,0,1]=4 4726 B13R1.470 C/C=C/C(=O)N[C@H]1CCCC[C@H]1C cd3a6b6b42818ae2bd74b9a19cf08bb3 [0,0,0,1,0,1|1,0,1]=4 4727 B13R1.470 CC#CC(=O)NC1CCCCC1C db0f12b1e558ba14a0081eef3f82acc8 [0,0,0,1,0,1|1,0,1]=4 4728 B13R1.470 CC#CC(=O)N[C@@H]1CCCC[C@@H]1C 34e1a4b77e50eba9d492727db5832dfe [0,0,0,1,0,1|1,0,1]=4 4729 B13R1.470 CC#CC(=O)N[C@@H]1CCCC[C@H]1C 1dfcb3cee85a44874977ce04f9e5eec2 [0,0,0,1,0,1|1,0,1]=4 4730 B13R1.470 CC#CC(=O)N[C@H]1CCCC[C@@H]1C 4b47c58784646500881e63a56f32be08 [0,0,0,1,0,1|1,0,1]=4 4731 B13R1.470 CC#CC(=O)N[C@H]1CCCC[C@H]1C 025ac04fe4d57d57b2bc52a087f5b999 [0,0,0,1,0,1|1,0,1]=4 4732 B13R1.470 CC1CCCCC1NC(=O)CCF 9bb87c1dae86bf0d4f16daed04a7a0c9 [0,0,0,1,0,1|2,0,0]=4 4733 B13R1.470 CC1CCCCC1NC(=O)CCO 57d0f2e8930cfa4088024a28deabe665 [0,0,0,1,0,1|2,0,0]=4 4734 B13R1.470 CC1CCCCC1NC(=O)CCS f33039107bce9e1ad225de09e97efc75 [0,0,0,1,0,1|2,0,0]=4 4735 B13R1.470 CCCC(=O)CN1CCCCC1C b9a8d74e33dc7b8c8c73e697e9039d48 [0,0,0,1,0,1|2,0,0]=4 4736 B13R1.470 CCCC(=O)CN1CCCC[C@@H]1C b18e70cc08ac0325c82dce8c082f07bc [0,0,0,1,0,1|2,0,0]=4 4737 B13R1.470 CCCC(=O)CN1CCCC[C@H]1C ac0927280f9fa1b79d18bcc043df5bcf [0,0,0,1,0,1|2,0,0]=4 4738 B13R1.470 CCCC(=O)NC1CCCCC1C 75e1be7d3457d70892956679947f57d6 [0,0,0,1,0,1|1,0,0]=3 4739 B13R1.470 CCCC(=O)NC1CCCCC1O 5ffe078a5054493102c0809db25e2b9f [0,0,0,1,0,1|2,0,0]=4 4740 B13R1.470 CCCC(=O)NC1CCOCC1C 52cd2baa69f0cd08a12500a646b67833 [0,0,0,1,0,1|2,0,0]=4 4741 B13R1.470 CCCC(=O)N[C@@H]1CCCC[C@@H]1C e38ca304ac9d9d9f703d03d2aba7d6c9 [0,0,0,1,0,1|1,0,0]=3 4742 B13R1.470 CCCC(=O)N[C@@H]1CCCC[C@H]1C 52467d92ca1cdf87154f20dc7302becc [0,0,0,1,0,1|1,0,0]=3 4743 B13R1.470 CCCC(=O)N[C@@H]1CCCC[C@H]1O c5bd626190766d14ab869b2ee563d0ef [0,0,0,1,0,1|2,0,0]=4 4744 B13R1.470 CCCC(=O)N[C@@H]1CCOC[C@@H]1C f1b956b8bbd7255c191b84fa8df9ef9b [0,0,0,1,0,1|2,0,0]=4 4745 B13R1.470 CCCC(=O)N[C@H]1CCCC[C@@H]1C ce41091f97c26e5133f7e1bc5c5ece67 [0,0,0,1,0,1|1,0,0]=3 4746 B13R1.470 CCCC(=O)N[C@H]1CCCC[C@@H]1O 2dbffd7d1e3badb38af7ae39ddbbdb35 [0,0,0,1,0,1|2,0,0]=4 4747 B13R1.470 CCCC(=O)N[C@H]1CCCC[C@H]1C b0c193bae776d308ad683a1200ba6743 [0,0,0,1,0,1|1,0,0]=3 4748 B13R1.470 CCCC(=O)N[C@H]1CCCC[C@H]1O 140914f1687d37ab9601824a1977e84d [0,0,0,1,0,1|2,0,0]=4 4749 B13R1.470 CCCC(=O)N[C@H]1CCOC[C@H]1C ba5619ae8b8ff00088316cfb598be509 [0,0,0,1,0,1|2,0,0]=4 4750 B13R1.470 CCCC(=S)O[C@H]1CCCC[C@H]1C 53b538cd138b9b6beb148d83c1d7c679 [0,0,0,1,0,1|1,1,0]=4 4751 B13R1.470 CCNC(=O)CN1CCCCC1C e969d9646a5184d57a31f832aced2588 [0,0,0,1,0,1|2,0,0]=4 4752 B13R1.470 CCNC(=O)CN1CCCC[C@@H]1C 22d3320eb4de1ba7bf162a222dfc86d4 [0,0,0,1,0,1|2,0,0]=4 4753 B13R1.470 CCNC(=O)CN1CCCC[C@H]1C 9f31e957cac510e282f7353833987179 [0,0,0,1,0,1|2,0,0]=4 4754 B13R1.470 CCOC(=O)CN1CCCCC1C 535378c9a650a897fb5b24f9be86001d [0,0,0,1,0,1|1,0,0]=3 4755 B13R1.470 CCOC(=O)CN1CCCC[C@@H]1C 794146e07a985f98a6ecbb558c59bd06 [0,0,0,1,0,1|1,0,0]=3 4756 B13R1.470 CCOC(=O)CN1CCCC[C@H]1C f59669138b1c36292c0b545ca7447685 [0,0,0,1,0,1|1,0,0]=3 4757 B13R1.470 CCOC(=O)CN1CCOCC1C 30cda2310850d299d9b76c9c61cc40b4 [0,0,0,1,0,1|2,0,0]=4 4758 B13R1.470 CCOC(=O)CN1CCOC[C@@H]1C e43127bccc947fb770d301efb199ef11 [0,0,0,1,0,1|2,0,0]=4 4759 B13R1.470 CCOC(=O)CN1CCOC[C@H]1C b16ba979bbe6f3a9dd38a766e43f9519 [0,0,0,1,0,1|2,0,0]=4 4760 B13R1.470 COCC(=O)NC1CCCCC1C 867eb86430ccbcb6b70f742f9fa9f2fc [0,0,0,1,0,1|2,0,0]=4 4761 B13R1.470 COCC(=O)N[C@@H]1CCCC[C@@H]1C 0b212432f9fac7873f94375f61e80f50 [0,0,0,1,0,1|2,0,0]=4 4762 B13R1.470 COCC(=O)N[C@@H]1CCCC[C@H]1C f35f71b2dbfeee215603a953b9ffb07c [0,0,0,1,0,1|2,0,0]=4 4763 B13R1.470 COCC(=O)N[C@H]1CCCC[C@@H]1C 6f75fd1c35ddd502065c761d2911104d [0,0,0,1,0,1|2,0,0]=4 4764 B13R1.470 COCC(=O)N[C@H]1CCCC[C@H]1C 1e2d96580c0cf7b4f4b9de34de1c372b [0,0,0,1,0,1|2,0,0]=4 4765 B13R1.470 CSCC(=O)NC1CCCCC1C 75f33422192adfc08d76e470087f2476 [0,0,0,1,0,1|2,0,0]=4 4766 B13R1.470 CSCC(=O)N[C@@H]1CCCC[C@@H]1C e8dfb8dcbbba70a6f1d5084479284978 [0,0,0,1,0,1|2,0,0]=4 4767 B13R1.470 CSCC(=O)N[C@@H]1CCCC[C@H]1C 52049c6b4d8fad1ddd9d780c112cf023 [0,0,0,1,0,1|2,0,0]=4 4768 B13R1.470 CSCC(=O)N[C@H]1CCCC[C@@H]1C b46d12dc356b38b229d92e61472ed0e1 [0,0,0,1,0,1|2,0,0]=4 4769 B13R1.470 CSCC(=O)N[C@H]1CCCC[C@H]1C a6f26edc8637ff8c2302c935351ec3d3 [0,0,0,1,0,1|2,0,0]=4 4770 B13R1.470 C[C@@H]1CCCC[C@@H]1NC(=O)CCF a003309840df926fdf4020426ca122bd [0,0,0,1,0,1|2,0,0]=4 4771 B13R1.470 C[C@@H]1CCCC[C@@H]1NC(=O)CCO 73ae97845e0d668bbd70b6ca52f057b5 [0,0,0,1,0,1|2,0,0]=4 4772 B13R1.470 C[C@@H]1CCCC[C@@H]1NC(=O)CCS 5958a4b44ee68faec61eb8e76edde0de [0,0,0,1,0,1|2,0,0]=4 4773 B13R1.470 C[C@@H]1CCCC[C@H]1NC(=O)CCF e0451627415fa1f3cf98579153667d80 [0,0,0,1,0,1|2,0,0]=4 4774 B13R1.470 C[C@@H]1CCCC[C@H]1NC(=O)CCO 6ee02beaa99603f0f86a39b1a3d194ba [0,0,0,1,0,1|2,0,0]=4 4775 B13R1.470 C[C@@H]1CCCC[C@H]1NC(=O)CCS 1e5629c74eec6638c03e99a9f342c2c9 [0,0,0,1,0,1|2,0,0]=4 4776 B13R1.470 C[C@H]1CCCC[C@@H]1NC(=O)CCF 3996316c4a94dd3c1de9e3a314096281 [0,0,0,1,0,1|2,0,0]=4 4777 B13R1.470 C[C@H]1CCCC[C@@H]1NC(=O)CCO c1ca7941d814b489cd2f9c7d81539235 [0,0,0,1,0,1|2,0,0]=4 4778 B13R1.470 C[C@H]1CCCC[C@@H]1NC(=O)CCS f7290f286339fdeeff6ffc0e36b743cf [0,0,0,1,0,1|2,0,0]=4 4779 B13R1.470 C[C@H]1CCCC[C@H]1NC(=O)CCF 45ebe3e0d6014fbad2b490da87d64aad [0,0,0,1,0,1|2,0,0]=4 4780 B13R1.470 C[C@H]1CCCC[C@H]1NC(=O)CCO 95dfe46562189bd70dcb2533dd637411 [0,0,0,1,0,1|2,0,0]=4 4781 B13R1.470 C[C@H]1CCCC[C@H]1NC(=O)CCS 56bdc8cd2953a7e819fab56ea5b44718 [0,0,0,1,0,1|2,0,0]=4 4782 B13R1.577 CCCCN1CCN(C(=O)C1)CC 7d81a866c817eb5844d9c2a8691c39d5 [0,0,0,1,0,1|2,0,0]=4 4783 B13R1.689 CCCC(=O)CN1CCC(C1)CC be4d888976dd152645e9aa040281b404 [0,0,0,1,0,1|2,0,0]=4 4784 B13R1.689 CCCC(=O)NC1CCC(C1)CO 1126e2f932437f8c74f2697e5d503e0e [0,0,0,1,0,1|2,0,0]=4 4785 B13R1.689 CCCC(=O)NC1CCN(C1)CC 302f37f373e3fb0a0af4007124f071bf [0,0,0,1,0,1|2,0,0]=4 4786 B13R1.689 CCCC(=O)N[C@@H]1CCN(C1)CC fedf03a1a4a77b41b68689792fdc7856 [0,0,0,1,0,1|2,0,0]=4 4787 B13R1.689 CCCC(=O)N[C@@H]1CC[C@@H](C1)CO 10b90fc15b33f72acf8c813ac3657703 [0,0,0,1,0,1|2,0,0]=4 4788 B13R1.689 CCCC(=O)N[C@@H]1CC[C@@H](C1)OC 76c0b459ef60a58b9d4f4a16cc64e6a3 [0,0,0,1,0,1|2,0,0]=4 4789 B13R1.689 CCCC(=O)N[C@@H]1CC[C@H](C1)CO 929b652790c3bf58dd77977c9e8f5fdb [0,0,0,1,0,1|2,0,0]=4 4790 B13R1.689 CCCC(=O)N[C@H]1CCN(C1)CC 5764caa3c9c0ef235b7222ba4ac2e7bb [0,0,0,1,0,1|2,0,0]=4 4791 B13R1.689 CCCC(=O)N[C@H]1CC[C@@H](C1)CO 016c53bf749af56b13584aa33e8e2dbc [0,0,0,1,0,1|2,0,0]=4 4792 B13R1.689 CCCC(=O)N[C@H]1CC[C@H](C1)CO bcaeeb94dde6332991589aae771c2f6b [0,0,0,1,0,1|2,0,0]=4 4793 B13R1.689 CCNC(=O)CN1CCC(C1)CC 5b4d00d4bbe273ffa37646423db87861 [0,0,0,1,0,1|2,0,0]=4 4794 B13R1.689 CCOC(=O)CN1CCC(C1)CC 5e9058ef37df3b82e44f8ccb030351a2 [0,0,0,1,0,1|1,0,0]=3 4795 B13R1.689 CCOC(=O)CN1CCC(C1)CO 318ddfa68cb47a8771a79e5e1b73d1a8 [0,0,0,1,0,1|2,0,0]=4 4796 B13R1.689 CCOC(=O)CN1CCC(C1)OC bf7840bb82f1b36e258bc19eaa273299 [0,0,0,1,0,1|2,0,0]=4 4797 B13R1.689 CCOC(=O)CN1CC[C@@H](C1)CO bf6c34d1d7ca9936cf27e35cbba8bc37 [0,0,0,1,0,1|2,0,0]=4 4798 B13R1.689 CCOC(=O)CN1CC[C@@H](C1)OC ffe16ee3e2df899045e5b7a0bb5ad981 [0,0,0,1,0,1|2,0,0]=4 4799 B13R1.689 CCOC(=O)CN1CC[C@H](C1)CO 5c0567f959b8c17ff4c2ef68cce00cd0 [0,0,0,1,0,1|2,0,0]=4 4800 B13R1.689 CCOC(=O)CN1CC[C@H](C1)OC 9ea84439af0cf25de0fdb0554d56dec1 [0,0,0,1,0,1|2,0,0]=4 4801 B13R1.1478 CCOC(=O)CN1CCC(C1C)O 5830c5d875e21456938e35196787f21c [0,0,0,1,0,1|2,0,0]=4 4802 B13R1.1478 CCOC(=O)CN1CC[C@@H]([C@@H]1C)O cc3457ed7007094483c8884e4e43d027 [0,0,0,1,0,1|2,0,0]=4 4803 B13R1.1478 CCOC(=O)CN1CC[C@H]([C@H]1C)O d5b7b540c78955bc1ebbefc4c91bdb51 [0,0,0,1,0,1|2,0,0]=4 4804 B13R1.1575 C/C=C/C(=O)NC1CCCCCC1 d6a4c5b382759bebe199f99533e115fa [0,0,0,1,0,1|1,0,1]=4 4805 B13R1.1575 CC#CC(=O)NC1CCCCCC1 870e2e6fed9f3d877da3a9130dd91877 [0,0,0,1,0,1|1,0,1]=4 4806 B13R1.1575 CCCC(=O)CN1CCCCCC1 e4a419eb8832044e2c302134e73a7ec5 [0,0,0,1,0,1|2,0,0]=4 4807 B13R1.1575 CCCC(=O)NC1CCCCCC1 59b41ffbcc81977f72aef1a283e24fa7 [0,0,0,1,0,1|1,0,0]=3 4808 B13R1.1575 CCCC(=O)NC1CCCOCC1 d1a1775927043ebc5dfc6b4f12a7f61a [0,0,0,1,0,1|2,0,0]=4 4809 B13R1.1575 CCCC(=S)OC1CCCCCC1 444c0c5ab66e41f8427869b7cc4ee9e6 [0,0,0,1,0,1|1,1,0]=4 4810 B13R1.1575 CCNC(=O)CN1CCCCCC1 58ce88ab541fa02d3d80cd3e85510d6f [0,0,0,1,0,1|2,0,0]=4 4811 B13R1.1575 CCOC(=O)CN1CCCCCC1 b66a5de06402119d233a4472db419f7c [0,0,0,1,0,1|1,0,0]=3 4812 B13R1.1575 CCOC(=O)CN1CCCOCC1 5b0363bb54b7a87391893d7019a949ad [0,0,0,1,0,1|2,0,0]=4 4813 B13R1.1575 COCC(=O)NC1CCCCCC1 71ad0e73b8a4ce53c03e5b2220822219 [0,0,0,1,0,1|2,0,0]=4 4814 B13R1.1575 CSCC(=O)NC1CCCCCC1 3e5c21c2a131528a9300416e71c6a6f6 [0,0,0,1,0,1|2,0,0]=4 4815 B13R1.1575 O=C(CCF)NC1CCCCCC1 370726543b245045fc6778c53cb61cbb [0,0,0,1,0,1|2,0,0]=4 4816 B13R1.1575 O=C(CCO)NC1CCCCCC1 69e35ab6eb75f9593de3551f71b33c54 [0,0,0,1,0,1|2,0,0]=4 4817 B13R1.1575 O=C(CCS)NC1CCCCCC1 18e4d684ab7fa92d9e403064e61ca65d [0,0,0,1,0,1|2,0,0]=4 4818 B13R1.1896 CCCCN(CC)CC(=O)C1CC1 c9c42f7e67f4e8c8067cf9d1089f84d2 [0,0,0,1,0,1|2,0,0]=4 4819 B13R1.2555 CCCC(=O)CN(CC)C1CCC1 d49b4e8d66b9103e03b3fd0f2bc2f9ff [0,0,0,1,0,1|2,0,0]=4 4820 B13R1.2555 CCCC(=O)NC(CC)C1COC1 c490a450fa531975f2c56f6d67e0bc06 [0,0,0,1,0,1|2,0,0]=4 4821 B13R1.2555 CCCC(=O)N[C@H](CO)C1CCC1 5e263ad9180a877c8853b283b17dba5d [0,0,0,1,0,1|2,0,0]=4 4822 B13R1.2555 CCNC(=O)CN(CC)C1CCC1 964d4b1c0d535ed38a1d1ef609c459ca [0,0,0,1,0,1|2,0,0]=4 4823 B13R1.2555 CCOC(=O)CN(CC)C1CCC1 4e0adb9a496c1670bdcfdd0dda1a9345 [0,0,0,1,0,1|1,0,0]=3 4824 B13R1.2555 CCOC(=O)CN(CC)C1COC1 f8809d021e83662fbbd43fe374260f39 [0,0,0,1,0,1|2,0,0]=4 4825 B13R1.2555 CCOC(=O)CN(CC)C1CSC1 1b2800ac999f8360f58cbe0f27de238e [0,0,0,1,0,1|2,0,0]=4 4826 B13R1.2557 CCCC(=O)CN(CC)CC1CC1 b969e82b1a5147195baadab186f4d267 [0,0,0,1,0,1|2,0,0]=4 4827 B13R1.2557 CCNC(=O)CN(CC)CC1CC1 493c8ac2d1c06306852dc4a0ed6a773d [0,0,0,1,0,1|2,0,0]=4 4828 B13R1.2557 CCOC(=O)CC(CC)OC1CC1 477cb2f17ea921cacf9df926539126d5 [0,0,0,1,0,1|1,0,0]=3 4829 B13R1.2557 CCOC(=O)CN(CC)CC1CC1 c79bc86c6333e6a0a685fbea4eb0f156 [0,0,0,1,0,1|1,0,0]=3 4830 B13R1.3507 CCCNC1CCC1C(=O)OCC 6ddce0495fe9f5bd5f8e9402d3641df6 [0,0,0,1,0,1|1,0,0]=3 4831 B13R1.3507 CCCOC1CCC1C(=O)OCC 6ab1763bfc54f5fbed1ddc6a59b34535 [0,0,0,1,0,1|1,0,0]=3 4832 B13R1.3507 CCOC(=O)C1CCC1NCCBr 4e61fd3dc3660b83ae90ac8a622d18a4 [0,0,0,1,0,1|2,0,0]=4 4833 B13R1.3507 CCOC(=O)C1CCC1NCCF e6352b86b1d33f7fc73f8b245062a47a [0,0,0,1,0,1|2,0,0]=4 4834 B13R1.3507 CCOC(=O)C1CCC1NCCI fb6c8c01ca357cfd7bb46af93a7565ca [0,0,0,1,0,1|2,0,0]=4 4835 B13R1.3507 CCOC(=O)C1CCC1NCCO cdde4ea38a4535b39759c816b8bb824b [0,0,0,1,0,1|2,0,0]=4 4836 B13R1.3507 CCOC(=O)C1CCC1NCCS a1a70b129c5f2008e09116f7a704689c [0,0,0,1,0,1|2,0,0]=4 4837 B13R1.3507 CCOC(=O)C1CCC1OCCF 2417819e5768d16d5b9f0e1ba0a3fa55 [0,0,0,1,0,1|2,0,0]=4 4838 B13R1.3507 CCOC(=O)C1CCC1OCCS 08852a82aeb4ceae24056b38751cee78 [0,0,0,1,0,1|2,0,0]=4 4839 B13R1.3507 CCOC(=O)C1CCC1OCOC 04a06738231cbeafb5f15d8c174c1c83 [0,0,0,1,0,1|2,0,0]=4 4840 B13R1.4565 CCCC(=O)NC1(CCCC1)CO 87b42567234ee8026b0c5dbe590697ca [0,0,0,1,0,1|2,0,0]=4 4841 B13R1.5103 CCCNC1(CC1)CC(=O)OCC 3ccfd33cc358fa80e797724604cef504 [0,0,0,1,0,1|1,0,0]=3 4842 B13R1.5103 CCOC(=O)CC1(CC1)NCCF e2975139373010e42ecb1f36c0e45ade [0,0,0,1,0,1|2,0,0]=4 4843 B13R1.5103 CCOC(=O)CC1(CC1)NCCO 9f27ad4bfb65d76b8027c38102ec67b5 [0,0,0,1,0,1|2,0,0]=4 4844 B13R1.5103 CCOC(=O)CC1(CC1)NCCS 7b3e69cf31f869b6d5285f97cb5e75ed [0,0,0,1,0,1|2,0,0]=4 4845 B13R1.5103 CCOC(=O)CC1(CC1)NCOC d162a8e025eb3a418fd05ede0815d48c [0,0,0,1,0,1|2,0,0]=4 4846 B13R1.5103 CCOC(=O)CC1(CC1)NCSC 0f5fe9429e672f7d1c8f6157beba9d4e [0,0,0,1,0,1|2,0,0]=4 4847 B13R1.208 CCCC(=O)N1CCSC1CCC 4343d829a00adfdbedd2aca5641f3367 [0,1,0,1,0,0|2,0,0]=4 4848 B13R1.208 CCCN1CCCC1C(=O)NCC 4d95021f9604b7c59426e941a2303160 [0,1,0,1,0,0|2,0,0]=4 4849 B13R1.208 CCCN1CCCC1C(=O)OCC bbc0a4973c452391a5a665eba7b84e2d [0,1,0,1,0,0|1,0,0]=3 4850 B13R1.208 CCCN1CCC[C@@H]1C(=O)OCC 324462b53f94ba9d074b8788f9cd6844 [0,1,0,1,0,0|1,0,0]=3 4851 B13R1.208 CCCN1CSCC1C(=O)OCC 55a756aa706633b676b90f1eecb7ebe5 [0,1,0,1,0,0|1,0,0]=3 4852 B13R1.208 CCN[C@@H]1CCC[C@@H]1C(=O)OCC 4f005a456d77cddc7d783fd0892149b7 [0,1,0,1,0,0|1,0,0]=3 4853 B13R1.208 CCN[C@@H]1CCC[C@H]1C(=O)OCC 4f0b43e7538bcd8f48c054930cffc92d [0,1,0,1,0,0|1,0,0]=3 4854 B13R1.208 CCN[C@H]1CCC[C@@H]1C(=O)OCC 4305c87297496a2db0b7ca51d7f28682 [0,1,0,1,0,0|1,0,0]=3 4855 B13R1.208 CCN[C@H]1CCC[C@H]1C(=O)OCC 3f12f49bf96e305747f743aed2739b5c [0,1,0,1,0,0|1,0,0]=3 4856 B13R1.208 CCOC(=O)C1CCCC1OCC 14f0f437d34f58f7b7a3d48cfd39bcd9 [0,1,0,1,0,0|1,0,0]=3 4857 B13R1.208 CCOC(=O)C1CCCC1OCF ed062147ed7421d1cbebb7f44de34aa8 [0,1,0,1,0,0|2,0,0]=4 4858 B13R1.208 CCOC(=O)C1CCCN1CCF fe9b699bac8ba9b7e63a8322a5467f1f [0,1,0,1,0,0|2,0,0]=4 4859 B13R1.208 CCOC(=O)C1CCCN1CCO 5c5905168dcf1ae90bf3fe3d08cb5e0e [0,1,0,1,0,0|2,0,0]=4 4860 B13R1.208 CCOC(=O)C1CCCN1CCS f47ec6e95e1caa4ddd4124e3eef7e2b8 [0,1,0,1,0,0|2,0,0]=4 4861 B13R1.208 CCOC(=O)C1CCCN1COC edb031595ac06944b32e6901388106a9 [0,1,0,1,0,0|2,0,0]=4 4862 B13R1.208 CCOC(=O)C1CCCN1CSC 9313b9d9a64902ec2c31d18f476cd237 [0,1,0,1,0,0|2,0,0]=4 4863 B13R1.208 CCOC(=O)C1CSCN1CCF e583a599d5980a1f7c69a095596f0b51 [0,1,0,1,0,0|2,0,0]=4 4864 B13R1.208 CCOC(=O)C1CSCN1CCO 17fc514d1ac34f49988e72cc4f84dc4f [0,1,0,1,0,0|2,0,0]=4 4865 B13R1.208 CCOC(=O)C1CSCN1CCS ef3e7a22fa0b39854b8768d10968a15b [0,1,0,1,0,0|2,0,0]=4 4866 B13R1.208 CCOC(=O)C1CSCN1COC 14bbc42cb34e23f81a49212eab299d8e [0,1,0,1,0,0|2,0,0]=4 4867 B13R1.208 CCOC(=O)C1CSCN1CSC de9bca91b79d1eee469d0d17f1b5b117 [0,1,0,1,0,0|2,0,0]=4 4868 B13R1.208 CCOC(=O)[C@@H]1CCC[C@@H]1NCF 04740e831dc181ee7212af3d0a6cdef6 [0,1,0,1,0,0|2,0,0]=4 4869 B13R1.208 CCOC(=O)[C@@H]1CCC[C@@H]1NCO 067840323975bb9636428725cb954a9d [0,1,0,1,0,0|2,0,0]=4 4870 B13R1.208 CCOC(=O)[C@@H]1CCC[C@@H]1OCC ed420d367434354c758b3b4033b50ba3 [0,1,0,1,0,0|1,0,0]=3 4871 B13R1.208 CCOC(=O)[C@@H]1CCC[C@@H]1OCF 64661cda0ebb1efb9a5890197db28f32 [0,1,0,1,0,0|2,0,0]=4 4872 B13R1.208 CCOC(=O)[C@@H]1CCC[C@H]1NCF 0e4ac8de6e51b0c805fc8651e2388405 [0,1,0,1,0,0|2,0,0]=4 4873 B13R1.208 CCOC(=O)[C@@H]1CCC[C@H]1NCO 33d50659dae56930902dcfdc4d6eb10d [0,1,0,1,0,0|2,0,0]=4 4874 B13R1.208 CCOC(=O)[C@@H]1CCC[C@H]1OCC f4876bc59ddf5c9a7a338ebddbfde43c [0,1,0,1,0,0|1,0,0]=3 4875 B13R1.208 CCOC(=O)[C@@H]1CCC[C@H]1OCF 1bd353f00e11ba1056a6cdcd8e8c3227 [0,1,0,1,0,0|2,0,0]=4 4876 B13R1.208 CCOC(=O)[C@H]1CCCN1CCF 71911867da8e4c06a419385a3d3faef0 [0,1,0,1,0,0|2,0,0]=4 4877 B13R1.208 CCOC(=O)[C@H]1CCCN1CCO 0963309b7a8530af48e79e934e91be07 [0,1,0,1,0,0|2,0,0]=4 4878 B13R1.208 CCOC(=O)[C@H]1CCCN1CCS 2f945d6d78f815ee9fd8c1348a48c818 [0,1,0,1,0,0|2,0,0]=4 4879 B13R1.208 CCOC(=O)[C@H]1CCCN1COC 3f712e584875453db6562aff08899ea4 [0,1,0,1,0,0|2,0,0]=4 4880 B13R1.208 CCOC(=O)[C@H]1CCCN1CSC 773b189d039ad8a98fcccd7c92296144 [0,1,0,1,0,0|2,0,0]=4 4881 B13R1.208 CCOC(=O)[C@H]1CCC[C@@H]1NCF 08c0f9377c995ca732d981ab5f2161e2 [0,1,0,1,0,0|2,0,0]=4 4882 B13R1.208 CCOC(=O)[C@H]1CCC[C@@H]1NCO 8d1b4a35da0a2432f4650a185d9652d7 [0,1,0,1,0,0|2,0,0]=4 4883 B13R1.208 CCOC(=O)[C@H]1CCC[C@H]1NCF 7a0763496134b6a1cd561c95436814fd [0,1,0,1,0,0|2,0,0]=4 4884 B13R1.208 CCOC(=O)[C@H]1CCC[C@H]1NCO 66715eb55dd9c6e0dac6d3b8e2e620b5 [0,1,0,1,0,0|2,0,0]=4 4885 B13R1.449 CCCC(=O)C(CC)N1CCSC1 99b3e9fd2565c256fbff4ecf4073a6d0 [0,1,0,1,0,0|2,0,0]=4 4886 B13R1.449 CCCC(=O)N(CC)C1CCCC1 e6f05f464be26126002183af897ebc07 [0,1,0,1,0,0|2,0,0]=4 4887 B13R1.449 CCCC(=O)N(CC)C1CCOC1 2d3fa8a90b1de9b3141e749cc1efb6aa [0,1,0,1,0,0|2,0,0]=4 4888 B13R1.449 CCOC(=O)C(CC)N1CC=CC1 01478916d7744be7c951fa3de82c3172 [0,1,0,1,0,0|0,0,2]=4 4889 B13R1.449 CCOC(=O)C(CC)N1CCSC1 1e63e07dadd38e5a64ef3689a63f9771 [0,1,0,1,0,0|1,0,0]=3 4890 B13R1.449 CCOC(=O)C(CO)N1CCSC1 e5c64beb6b9d31f4b2f795aa36b0e39f [0,1,0,1,0,0|2,0,0]=4 4891 B13R1.449 CCOC(=O)C(SC)N1CCSC1 954e6db4c2b7584d5ff880a7936026d4 [0,1,0,1,0,0|2,0,0]=4 4892 B13R1.463 CCCC(=O)N1CCCCCC1C e7849529dc4ac19be32f1e42d7b16a88 [0,1,0,1,0,0|2,0,0]=4 4893 B13R1.463 CCCC(=O)N1CCCOCC1C ca0ac8ca3afb3c3ee6e3597da4b457c0 [0,1,0,1,0,0|2,0,0]=4 4894 B13R1.463 CCCC(=O)N1CCOCCC1C 83ec2c3cece2ade7e623547b13c2f03c [0,1,0,1,0,0|2,0,0]=4 4895 B13R1.463 CCCC(=O)N1CCSCCC1C 8b2eb387230bfa98cbf9610e4d9333f3 [0,1,0,1,0,0|2,0,0]=4 4896 B13R1.1492 CCCC(=O)C(CC)N1CC(C1)F a626abb9216e7b72f820ccadee2ff8ac [0,1,0,1,0,0|2,0,0]=4 4897 B13R1.1492 CCCC(=O)C(CC)N1CC(C1)O 71dd789396103607b70a4a8e2dd79198 [0,1,0,1,0,0|2,0,0]=4 4898 B13R1.1492 CCOC(=O)C(CC)N1CC(C1)F 7056aca1197ba02c5338c9cdc3830cce [0,1,0,1,0,0|1,0,0]=3 4899 B13R1.1492 CCOC(=O)C(CC)N1CC(C1)O 04f6dbc68710275f4bf7f0a75d73a24a [0,1,0,1,0,0|1,0,0]=3 4900 B13R1.1492 CCOC(=O)C(CO)N1CC(C1)F 296c344ebb9076f6fe2457f1d4871795 [0,1,0,1,0,0|2,0,0]=4 4901 B13R1.1492 CCOC(=O)C(SC)N1CC(C1)F 3553cd22012c569bdd9f426a3a674521 [0,1,0,1,0,0|2,0,0]=4 4902 B13R1.1492 CCOC(=O)C(SC)N1CC(C1)O b25bf14137c4d83fd0ee897d438a912a [0,1,0,1,0,0|2,0,0]=4 4903 B13R1.1504 CCCC(=O)C(CC)N(C)C1CC1 babf6a50d7c7aab95d8b6708bb548a7d [0,1,0,1,0,0|2,0,0]=4 4904 B13R1.1504 CCCC(=O)N(CC)C(C)C1CC1 d219d65ccfb7a688647e1472132320d9 [0,1,0,1,0,0|2,0,0]=4 4905 B13R1.1504 CCOC(=O)C(CC)N(C)C1CC1 ab7ea281d31f1c3800d5232838c90a09 [0,1,0,1,0,0|1,0,0]=3 4906 B13R1.1504 CCOC(=O)C(CO)N(C)C1CC1 ffbb588d71f104ade11d8fed965051f6 [0,1,0,1,0,0|2,0,0]=4 4907 B13R1.1504 CCOC(=O)C(SC)N(C)C1CC1 4726972ed75d8ca1af65613ca74b20d6 [0,1,0,1,0,0|2,0,0]=4 4908 B13R1.1509 CCCC(=O)N1CCC(C1C)CO b9e3626c86edb8c154b81e24559d833f [0,1,0,1,0,0|2,0,0]=4 4909 B13R1.1509 CCCC(=O)N1CC[C@@H]([C@@H]1C)CO c4e90158bf194fbd3d587ca8fa0474a3 [0,1,0,1,0,0|2,0,0]=4 4910 B13R1.1509 CCCC(=O)N1CC[C@H]([C@@H]1C)CO 95806a8debe4d56d52460ad0f191f97b [0,1,0,1,0,0|2,0,0]=4 4911 B13R1.1509 CCOC(=O)[C@H]1CCN([C@@H]1C)C=O 078e70b735c7c21a039d936f1d8b4378 [0,1,0,1,0,0|1,0,1]=4 4912 B13R1.1509 CCOC(=O)[C@H]1CCN([C@@H]1C)CC 86e354f59b6aee12cedd275b62ae328f [0,1,0,1,0,0|0,0,0]=2 4913 B13R1.1509 CCOC(=O)[C@H]1CCN([C@@H]1C)CF 1266a881c81b49c9617a6cacd3de7c01 [0,1,0,1,0,0|1,0,0]=3 4914 B13R1.1509 CCOC(=O)[C@H]1CCN([C@@H]1C)CO 178d3f4dba994f9262ab7f8126d22581 [0,1,0,1,0,0|1,0,0]=3 4915 B13R1.1509 CCOC(=O)[C@H]1CCN([C@H]1C)C=O 15019cb20b252233db12768c003ff159 [0,1,0,1,0,0|1,0,1]=4 4916 B13R1.1509 CCOC(=O)[C@H]1CCN([C@H]1C)CC b243e4ea81c3fc80075d0658059ac5b7 [0,1,0,1,0,0|0,0,0]=2 4917 B13R1.1509 CCOC(=O)[C@H]1CCN([C@H]1C)CF 9ae6602699c0f2a7b4d504edc646fcf8 [0,1,0,1,0,0|1,0,0]=3 4918 B13R1.1509 CCOC(=O)[C@H]1CCN([C@H]1C)CO 24beeda2d7b5f2589b257ea3253e0230 [0,1,0,1,0,0|1,0,0]=3 4919 B13R1.1511 CCCC(=O)N1CCC(CC1C)C 80d9997566a8d77408a3e22c77a93426 [0,1,0,1,0,0|2,0,0]=4 4920 B13R1.1511 CCCC(=O)N1CCC(CC1C)O 9248b350519813a8d20c3cdc47150884 [0,1,0,1,0,0|2,0,0]=4 4921 B13R1.1511 CCCC(=O)N1CC[C@@H](C[C@@H]1C)C d2c563c7cc7d9da69fed7c22abf6a012 [0,1,0,1,0,0|2,0,0]=4 4922 B13R1.1511 CCCC(=O)N1CC[C@@H](C[C@H]1C)O dfa609e1f50ac5572b36b659c8084dba [0,1,0,1,0,0|2,0,0]=4 4923 B13R1.1511 CCCC(=O)N1CC[C@H](C[C@H]1C)C 7c6119eef7a535acfd1c4539bb352478 [0,1,0,1,0,0|2,0,0]=4 4924 B13R1.1511 CCCC(=O)N1CC[C@H](C[C@H]1C)O e6a54129a97f511f2fd91183793e9cba [0,1,0,1,0,0|2,0,0]=4 4925 B13R1.4453 CCCC(=O)N1C(CCCC1C)C 73c621d9354c94a6b5d53e360d298cad [0,1,0,1,0,0|2,0,0]=4 4926 B13R1.4453 CCCC(=O)N1[C@@H](CCC[C@@H]1C)C dea820493ab89976e7857997d5d0f950 [0,1,0,1,0,0|2,0,0]=4 4927 B13R1.4453 CCCC(=O)N1[C@@H](CCC[C@H]1C)C 8bd35e3ff5d4cdd71686693204804123 [0,1,0,1,0,0|2,0,0]=4 4928 B13R1.4453 CCCC(=O)N1[C@H](CCC[C@@H]1C)C 23b1ad5b19d1f7347fcd432e6c310cb0 [0,1,0,1,0,0|2,0,0]=4 4929 B13R1.154 CCCNC1CCCCCNC1=O 062444f7600a893192834abecfd827f5 [0,1,0,1,0,0|2,0,0]=4 4930 B13R1.460 CCCC(=O)N1CCCC(C1)CC d926d7a7d9f35d8d2a68a781af3cd6f5 [0,1,0,1,0,0|2,0,0]=4 4931 B13R1.460 CCCC(=O)N1CCOC(C1)CC 96e685a3af94668d05d1b8a6e7903eea [0,1,0,1,0,0|2,0,0]=4 4932 B13R1.460 CCCC(=O)N1CCO[C@@H](C1)CC dbcc37ba1e7589ed9baf1852edad54e6 [0,1,0,1,0,0|2,0,0]=4 4933 B13R1.460 CCCC(=O)N1CCO[C@H](C1)CC e86e9d8a6ca2d0d5ce5bcf57213af34b [0,1,0,1,0,0|2,0,0]=4 4934 B13R1.460 CCNC(=O)C1CCCN(C1)CC 07aced86f92f6d6d878d36b3f4664377 [0,1,0,1,0,0|2,0,0]=4 4935 B13R1.460 CCOC(=O)C1CCCN(C1)CC c37bd8917db353e4f4c023a9f5ed6b56 [0,1,0,1,0,0|1,0,0]=3 4936 B13R1.460 CCOC(=O)C1CCCN(C1)CF d1696e200bc15e35949239e9a6a29338 [0,1,0,1,0,0|2,0,0]=4 4937 B13R1.460 CCOC(=O)C1CCCN(C1)CO a727eba3d4c1f2a7673ed3a2460cfe8a [0,1,0,1,0,0|2,0,0]=4 4938 B13R1.460 CCOC(=O)C1CN(CCO1)CC 483b0e9047e5a8df44d0be91eef12dbf [0,1,0,1,0,0|1,0,0]=3 4939 B13R1.460 CCOC(=O)C1CN(CCO1)CF 88a6181e81456bad21ce50a59bc41aa9 [0,1,0,1,0,0|2,0,0]=4 4940 B13R1.460 CCOC(=O)C1CN(CCO1)CO 688ad279f6489e8b6ff794b6634cd740 [0,1,0,1,0,0|2,0,0]=4 4941 B13R1.460 CCOC(=O)C1CN(CCS1)CC ea69e2efb16eef0490fde79031dad87d [0,1,0,1,0,0|1,0,0]=3 4942 B13R1.460 CCOC(=O)[C@@H]1CCCN(C1)CC aee2109a4759b40e93c2c0e4b0fb59c5 [0,1,0,1,0,0|1,0,0]=3 4943 B13R1.460 CCOC(=O)[C@@H]1CCCN(C1)CF 1b46da07dc00ee620e7a99366a303dbd [0,1,0,1,0,0|2,0,0]=4 4944 B13R1.460 CCOC(=O)[C@@H]1CCCN(C1)CO a9ff17edfca24f365f31acaa4944fc11 [0,1,0,1,0,0|2,0,0]=4 4945 B13R1.460 CCOC(=O)[C@@H]1CN(CCO1)CC fa8e84f90fc39a2733ae37b25da3ed16 [0,1,0,1,0,0|1,0,0]=3 4946 B13R1.460 CCOC(=O)[C@@H]1CN(CCO1)CF 1d01d73b39cb822a0d31f28ad4f46816 [0,1,0,1,0,0|2,0,0]=4 4947 B13R1.460 CCOC(=O)[C@@H]1CN(CCO1)CO 47744cd311bb7926c0833794b08c0f84 [0,1,0,1,0,0|2,0,0]=4 4948 B13R1.460 CCOC(=O)[C@H]1CCCN(C1)CC 4b78310d644de28d835395a6f6e61d5d [0,1,0,1,0,0|1,0,0]=3 4949 B13R1.460 CCOC(=O)[C@H]1CCCN(C1)CF bdd0e9a28b107af3a6526c209c279a6f [0,1,0,1,0,0|2,0,0]=4 4950 B13R1.460 CCOC(=O)[C@H]1CCCN(C1)CO 11b2e96bc6e1322b60f70dab744b7fab [0,1,0,1,0,0|2,0,0]=4 4951 B13R1.460 CCOC(=O)[C@H]1CN(CCO1)CC 416f2a78ea8e3de1428446150af89a8a [0,1,0,1,0,0|1,0,0]=3 4952 B13R1.460 CCOC(=O)[C@H]1CN(CCO1)CF 2c798e95962a9d5066c2b631a4de28d6 [0,1,0,1,0,0|2,0,0]=4 4953 B13R1.460 CCOC(=O)[C@H]1CN(CCO1)CO f4dbf7461df55bb1f2311341003bc886 [0,1,0,1,0,0|2,0,0]=4 4954 B13R1.466 CCCC(=O)N1CCC(C(C1)O)C a2f9f5040670313c2ab676f2f03b52a6 [0,1,0,1,0,0|2,0,0]=4 4955 B13R1.466 CCCC(=O)N1CC[C@@H]([C@@H](C1)O)C 2ca69ab4b55e001dca43f9ee7f802909 [0,1,0,1,0,0|2,0,0]=4 4956 B13R1.466 CCCC(=O)N1CC[C@@H]([C@H](C1)O)C 420d330c008e1b1e2f79262f10b44a6e [0,1,0,1,0,0|2,0,0]=4 4957 B13R1.466 CCCC(=O)N1CC[C@H]([C@@H](C1)O)C 36cfebeb7060e116e46f1ab3c3e7c4e5 [0,1,0,1,0,0|2,0,0]=4 4958 B13R1.466 CCCC(=O)N1CC[C@H]([C@H](C1)O)C 04c024a81cad3f8856d131a8edb58b64 [0,1,0,1,0,0|2,0,0]=4 4959 B13R1.569 CCCNC1CCCN(C1=O)CC 53f32eea3dc2dc4234d0ebc6d5609453 [0,1,0,1,0,0|2,0,0]=4 4960 B13R1.1221 CCN1CCCC[C@@H](C1=O)NCF 7abe88e1e3c362b1bab7b7a2839ae80f [0,1,0,1,0,0|2,0,0]=4 4961 B13R1.1221 CCN1CCCC[C@@H](C1=O)NCO d9c3af72cf66ee331c145de49f353cea [0,1,0,1,0,0|2,0,0]=4 4962 B13R1.1221 CCN[C@H]1CCCCN(C1=O)CC c610662a157e270b20ca8cbaa2402943 [0,1,0,1,0,0|1,0,0]=3 4963 B13R1.1462 CCCC(=O)N1CCCCC(C1)O 8f95193a2839753918175da7181af72e [0,1,0,1,0,0|2,0,0]=4 4964 B13R1.1462 CCCC(=O)N1CCCC[C@H](C1)O f61088bfc69520e2e7a5dc68cd416c62 [0,1,0,1,0,0|2,0,0]=4 4965 B13R1.1463 CCCC(=O)N1CCCC(CC1)C 1d75ac9a1f74046fc4fdca3c81e96839 [0,1,0,1,0,0|2,0,0]=4 4966 B13R1.1463 CCCC(=O)N1CCCC(CC1)F 4df0113ee5af506a3778e55f5d23c40a [0,1,0,1,0,0|2,0,0]=4 4967 B13R1.1463 CCCC(=O)N1CCCC(CC1)O 3d6ce9e0cc1b289212e05047e5c3c2e6 [0,1,0,1,0,0|2,0,0]=4 4968 B13R1.1463 CCCC(=O)N1CCCN(CC1)C 1f23bb61d32e3f8995b39057d12469cd [0,1,0,1,0,0|2,0,0]=4 4969 B13R1.1463 CCCC(=O)N1CCC[C@@H](CC1)O 8dd6e0eba5d6c3d9bbd8846425bf7642 [0,1,0,1,0,0|2,0,0]=4 4970 B13R1.1463 CCCC(=O)N1CCC[C@H](CC1)O 072edb7856c396a9bb601dba9c69cb93 [0,1,0,1,0,0|2,0,0]=4 4971 B13R1.1464 CCCC(=O)N1CCCCCCC1 fe7989dec2485133f1674d6ddc2545c7 [0,1,0,1,0,0|2,0,0]=4 4972 B13R1.1508 CCOC(=O)[C@@H]1CC[C@@H](N1C=O)C fbae0b3b6828768bb26d0f9067be2eff [0,1,0,1,0,0|1,0,1]=4 4973 B13R1.1508 CCOC(=O)[C@@H]1CC[C@@H](N1CC)C 02f75d19d93b8a56c46813a3db9e796c [0,1,0,1,0,0|0,0,0]=2 4974 B13R1.1508 CCOC(=O)[C@@H]1CC[C@@H](N1CF)C 7c77d3438c780ce664086e163b68a1b0 [0,1,0,1,0,0|1,0,0]=3 4975 B13R1.1508 CCOC(=O)[C@@H]1CC[C@@H](N1CO)C d6f397cf513b78efb8b77ebdb02ddfc7 [0,1,0,1,0,0|1,0,0]=3 4976 B13R1.1570 C=CCC(OC1CC1)C(=O)OCC 81897e8fe440b27c544f1c231359593b [0,1,0,1,0,0|1,0,1]=4 4977 B13R1.1570 CCCC(=O)C(CCC)OC1CC1 6aac1cbd7ee3df8376cd01c6f7a427f2 [0,1,0,1,0,0|2,0,0]=4 4978 B13R1.1570 CCCC(=O)N(CCC)CC1CC1 dfda3c5d6ddc1314e783adbc06bcab30 [0,1,0,1,0,0|2,0,0]=4 4979 B13R1.1570 CCCC(=O)N(CCO)CC1CC1 c138567ba461f254bca20c9223c198e4 [0,1,0,1,0,0|2,0,0]=4 4980 B13R1.1570 CCCC(NC1CC1)C(=O)OCC 9b98750b2043af311f0bccbf336697e3 [0,1,0,1,0,0|1,0,0]=3 4981 B13R1.1570 CCCC(OC1CC1)C(=O)OCC 383b9a94cda852aefb1edf2b4e315d2e [0,1,0,1,0,0|1,0,0]=3 4982 B13R1.1570 CCOC(=O)C(CC1CC1)OCC b52a1bb3fa91c877ab77ac8d2cca7970 [0,1,0,1,0,0|0,0,0]=2 4983 B13R1.1570 CCOC(=O)C(CC1CC1)OCF 929530e7a0b10588144611d6eb8e556c [0,1,0,1,0,0|1,0,0]=3 4984 B13R1.1570 CCOC(=O)C(NC1CC1)OCC 2e6d5afcb3001799cee70acef760abac [0,1,0,1,0,0|1,0,0]=3 4985 B13R1.1570 CCOC(=O)C(OCC)OC1CC1 c9243067d80a819458a9b88ced7ca924 [0,1,0,1,0,0|1,0,0]=3 4986 B13R1.1911 CCCNC(C(=O)OCC)C1CC1 e7d0488c304e307582fa25ded050b40d [0,1,0,1,0,0|1,0,0]=3 4987 B13R1.1911 CCCOC(C(=O)OCC)C1CC1 c57b314284d37122f132288100c2b799 [0,1,0,1,0,0|1,0,0]=3 4988 B13R1.1911 CCOC(=O)C(NCCBr)C1CC1 f24fe6bcc8ae326cb6e0f4a99fe6e7a8 [0,1,0,1,0,0|2,0,0]=4 4989 B13R1.1911 CCOC(=O)C(NCCF)C1CC1 89dcf6c9cde392029fc10f43733706e4 [0,1,0,1,0,0|2,0,0]=4 4990 B13R1.1911 CCOC(=O)C(NCCI)C1CC1 01a522010236000afda994f30bf12d7c [0,1,0,1,0,0|2,0,0]=4 4991 B13R1.1911 CCOC(=O)C(NCCO)C1CC1 dbce0cc8e47f944a7db0b7abbb816b12 [0,1,0,1,0,0|2,0,0]=4 4992 B13R1.1911 CCOC(=O)C(NCCS)C1CC1 600f5eb5c27fecb19c0131e002ba07b0 [0,1,0,1,0,0|2,0,0]=4 4993 B13R1.1911 CCOC(=O)C(OCCF)C1CC1 b827c066e74e7744db9ac69f7cf60fc9 [0,1,0,1,0,0|2,0,0]=4 4994 B13R1.1911 CCOC(=O)C(OCCS)C1CC1 d65bed8886859c7398b794023e4c2839 [0,1,0,1,0,0|2,0,0]=4 4995 B13R1.1911 CCOC(=O)C(OCOC)C1CC1 5b3ae299fb6dcc88b894ca1541148e1d [0,1,0,1,0,0|2,0,0]=4 4996 B13R1.1911 CCOC(=O)C(OCSC)C1CC1 f5569f51ec04c71f122ce45c6922209d [0,1,0,1,0,0|2,0,0]=4 4997 B13R1.3910 CCCN1CCNC(=O)C1CCO 4ec41fa9141ac878ded5c9d928dd7e18 [0,1,0,1,0,0|2,0,0]=4 4998 B13R1.4445 C=C[C@@H]1C[C@]1(NCC)C(=O)OCC 6e13767acab6aa25e4949664bb9600c4 [0,1,0,1,0,0|0,0,2]=4 4999 B13R1.4461 CCNC1(CCCC1)C(=O)OCC a63e41c08701ca14da5777b024d7849c [0,1,0,1,0,0|0,0,0]=2 5000 B13R1.4461 CCOC(=O)C1(CCCC1)NC=O d1e26a202341f16d938d759306425491 [0,1,0,1,0,0|1,0,1]=4 5001 B13R1.4461 CCOC(=O)C1(CCCC1)NCF d8c55de80092b4cdc8c6c44fb80f7288 [0,1,0,1,0,0|1,0,0]=3 5002 B13R1.4461 CCOC(=O)C1(CCCC1)NCO 2e299c630b378104b07268d81816efc5 [0,1,0,1,0,0|1,0,0]=3 5003 B13R1.6410 CCCNC1(COC1)C(=O)OCC e02785de96b75d9c17f4459f90f061ad [0,1,0,1,0,0|1,0,0]=3 5004 B13R1.6410 CCNCC1(CCC1)C(=O)OCC 5d2cedd6f9a5e1b6421ae833afbc36b7 [0,1,0,1,0,0|1,0,0]=3 5005 B13R1.6410 CCOC(=O)C1(CCC1)CNCF fd2da4a76cfce3fc2c2bc5c7c5cc1af6 [0,1,0,1,0,0|2,0,0]=4 5006 B13R1.6410 CCOC(=O)C1(CCC1)CNCO 72edcb743989385eb895fb414be00201 [0,1,0,1,0,0|2,0,0]=4 5007 B13R1.6410 CCOC(=O)C1(CCC1)COCF a212337012d91cf0b66159b212ed8db1 [0,1,0,1,0,0|2,0,0]=4 5008 B13R1.6410 CCOC(=O)C1(COC1)NCCF c5f18567e5c50f3092ff132678ee169c [0,1,0,1,0,0|2,0,0]=4 5009 B13R1.6410 CCOC(=O)C1(COC1)NCCO 3ecd4cd032a75e727f2494068657ce98 [0,1,0,1,0,0|2,0,0]=4 5010 B13R1.6410 CCOC(=O)C1(COC1)NCCS 49335cda8f9cc6f4253d5ccd9a06530e [0,1,0,1,0,0|2,0,0]=4 5011 B13R1.6410 CCOC(=O)C1(COC1)NCSC e5c762d1354256298d941dcb6c5e4c8e [0,1,0,1,0,0|2,0,0]=4 5012 B13R1.6410 CCOCC1(CCC1)C(=O)OCC a91dc1f46ac9ddc7432e1cde9a4c79ed [0,1,0,1,0,0|1,0,0]=3 5013 B13R1.6469 CCCC(=O)N(CCO)C1CCC1 4eb40f57c045cd7ed26b9d05298ea494 [0,1,0,1,0,0|2,0,0]=4 5014 B13R1.6469 CCCC(C(=O)OCC)N1CCC1 ef98b3074aa188f2ea78e6d21cd7b7b4 [0,1,0,1,0,0|1,0,0]=3 5015 B13R1.6469 CCNC(C(=O)OCC)C1CCC1 c5498c2b70c293fe7ba0a89227867cbc [0,1,0,1,0,0|0,0,0]=2 5016 B13R1.6469 CCOC(=O)C(NC#N)C1CCC1 2f7b99a14bff3f1bf1b7b8774e761213 [0,1,0,1,0,0|1,0,1]=4 5017 B13R1.6469 CCOC(=O)C(NC=O)C1CCC1 6d93d2cb0e9bdddba107b352292e2f5d [0,1,0,1,0,0|1,0,1]=4 5018 B13R1.6469 CCOC(=O)C(NCF)C1CCC1 15333045ffebb35c4a6516f7b11a29c1 [0,1,0,1,0,0|1,0,0]=3 5019 B13R1.6469 CCOC(=O)C(NCO)C1CCC1 0ff563b6adda620dcc43bc0a39329eca [0,1,0,1,0,0|1,0,0]=3 5020 B13R1.6469 CCOC(=O)C(OCC)C1COC1 eed837409a4529ec5fbc0f63625160b3 [0,1,0,1,0,0|1,0,0]=3 5021 B13R1.6469 CCOC(=O)C(OCF)C1COC1 0559bc5b9d77ff988380dcd7abc0e7b3 [0,1,0,1,0,0|2,0,0]=4 5022 B13R1.115 CCC1C(=O)NCCN1CC(C)C 7a5d79a94e08ebc86f0d20b29dfcae32 [0,1,0,1,0,0|2,0,0]=4 5023 B13R1.115 CCC1C(=O)NCCN1CC(C)O e6ef32a2b2297116d47911c21c8ae6f4 [0,1,0,1,0,0|2,0,0]=4 5024 B13R1.115 CCC1C(=O)NCCN1C[C@@H](C)O b55659af7e1b2bb298e2acf82850dec9 [0,1,0,1,0,0|2,0,0]=4 5025 B13R1.115 CCC1C(=O)NCCN1C[C@H](C)O 15f6eb8e22df058159195faa59b8ac6c [0,1,0,1,0,0|2,0,0]=4 5026 B13R1.280 CC(C)CNC1CCCCCC1=O 0cd0cb06a6c1b3d6004d088358a1ea20 [0,1,0,1,0,0|2,0,0]=4 5027 B13R1.280 CC(C)CNC1CCCCNC1=O 5c0b2a360dcf68b5e5d6f0a5a665d140 [0,1,0,1,0,0|2,0,0]=4 5028 B13R1.280 CC(C)CN[C@@H]1CCCCNC1=O 6c6f08678cbdda05504b6da3e6fe515e [0,1,0,1,0,0|2,0,0]=4 5029 B13R1.280 CC(C)CN[C@H]1CCCCNC1=O 212353050e5e04c6636e1fabcd943a53 [0,1,0,1,0,0|2,0,0]=4 5030 B13R1.280 CC(C)COC1CCCCCC1=O 3d9e013c4112293cf1ff72844ced969e [0,1,0,1,0,0|2,0,0]=4 5031 B13R1.280 CC(O)CNC1CCCCCC1=O 69aa6c5dd51c52e0ce46573259ff958d [0,1,0,1,0,0|2,0,0]=4 5032 B13R1.280 CC(O)CNC1CCCCNC1=O de2f2954c1b0011781cab9276ef68bbb [0,1,0,1,0,0|2,0,0]=4 5033 B13R1.280 CC(O)CN[C@@H]1CCCCNC1=O b1c8e5efc5e1d59f7f5f0f8f8f2a276f [0,1,0,1,0,0|2,0,0]=4 5034 B13R1.280 CC(O)CN[C@H]1CCCCNC1=O 189f5ab4027d1831bdfc6ec7de48eb9e [0,1,0,1,0,0|2,0,0]=4 5035 B13R1.280 C[C@@H](O)CNC1CCCCCC1=O 28177f7c168b947cd0c204e13ae55ee1 [0,1,0,1,0,0|2,0,0]=4 5036 B13R1.280 C[C@@H](O)CNC1CCCCNC1=O f07c916ee64e3088c24a08a6b5e7a954 [0,1,0,1,0,0|2,0,0]=4 5037 B13R1.280 C[C@@H](O)CN[C@@H]1CCCCNC1=O bff961e918a8ea5e3bab6bab53711767 [0,1,0,1,0,0|2,0,0]=4 5038 B13R1.280 C[C@@H](O)CN[C@H]1CCCCNC1=O 1dce20b4afb32c42b2088eb9b8e84d5d [0,1,0,1,0,0|2,0,0]=4 5039 B13R1.280 C[C@H](O)CNC1CCCCCC1=O 4b24d35c5d06c4c88820474ce9ed420e [0,1,0,1,0,0|2,0,0]=4 5040 B13R1.280 C[C@H](O)CNC1CCCCNC1=O 66d1ac1e5b6ad9daf991405f3a9e70e2 [0,1,0,1,0,0|2,0,0]=4 5041 B13R1.280 C[C@H](O)CN[C@@H]1CCCCNC1=O 3949a725726a5d5fc1cc0cc924146c24 [0,1,0,1,0,0|2,0,0]=4 5042 B13R1.280 C[C@H](O)CN[C@H]1CCCCNC1=O 567e511fd4dca9231c1a96b884b3d938 [0,1,0,1,0,0|2,0,0]=4 5043 B13R1.451 CCNC(=O)C1CCN(C1)C(C)C 56db3894ce01afd347f2d9bd3fbe63b4 [0,1,0,1,0,0|2,0,0]=4 5044 B13R1.451 CCOC(=O)C1CCN(C1)C(=O)C ff48d8b56869ee63e1048c8af9df318e [0,1,0,1,0,0|1,0,1]=4 5045 B13R1.451 CCOC(=O)C1CCN(C1)C(C)C 92c2f496362efd1e548d5afcd49badf8 [0,1,0,1,0,0|1,0,0]=3 5046 B13R1.451 CCOC(=O)[C@H]1CCN(C1)C(=O)C 93059fc35f0383f771a122546416bffc [0,1,0,1,0,0|1,0,1]=4 5047 B13R1.451 CCOC(=O)[C@H]1CCN(C1)C(C)C 7fe2d0679c62b9c5939f72668713456b [0,1,0,1,0,0|1,0,0]=3 5048 B13R1.1488 CCCC(=O)C(CC)NC1CC1C 09d63c45bef48c35142f717c44c3a3c8 [0,1,0,1,0,0|1,0,0]=3 5049 B13R1.1488 CCCC(=O)C(CC)N[C@@H]1C[C@H]1F 3d2f5bf41f28c7f3ea11f3c19939324a [0,1,0,1,0,0|2,0,0]=4 5050 B13R1.1488 CCCC(=O)C(CC)N[C@H]1C[C@@H]1F b5cdfdae63d0af3ad131dd29e268b8e2 [0,1,0,1,0,0|2,0,0]=4 5051 B13R1.1488 CCCC(=O)C(CC)N[C@H]1C[C@H]1F 99602de400ec33c0c826782cc1143f1b [0,1,0,1,0,0|2,0,0]=4 5052 B13R1.1488 CCOC(=O)C(C=O)NC1CC1C dfa06dff80c575b35efd308232465317 [0,1,0,1,0,0|1,0,1]=4 5053 B13R1.1488 CCOC(=O)C(CC)NC1CC1C efb8ed2f2e8695799cfbedb54af68da4 [0,1,0,1,0,0|0,0,0]=2 5054 B13R1.1488 CCOC(=O)C(CC)N[C@@H]1C[C@H]1F 6b939ff42ec19090612ba9f92566a76e [0,1,0,1,0,0|1,0,0]=3 5055 B13R1.1488 CCOC(=O)C(CC)N[C@H]1C[C@@H]1F c8880360fc8e14736e24503412c794a2 [0,1,0,1,0,0|1,0,0]=3 5056 B13R1.1488 CCOC(=O)C(CC)N[C@H]1C[C@H]1F 0fbb48603ae61491798cf38dff97e9eb [0,1,0,1,0,0|1,0,0]=3 5057 B13R1.1488 CCOC(=O)C(CO)NC1CC1C 6c641864ba5d187833f414f0b688ef7b [0,1,0,1,0,0|1,0,0]=3 5058 B13R1.1488 CCOC(=O)C(CO)N[C@@H]1C[C@H]1F d187804307ea627ff93abcb63b597310 [0,1,0,1,0,0|2,0,0]=4 5059 B13R1.1488 CCOC(=O)C(CO)N[C@H]1C[C@@H]1F 39eb184286d5428db35e103a8baa90ab [0,1,0,1,0,0|2,0,0]=4 5060 B13R1.1488 CCOC(=O)C(CO)N[C@H]1C[C@H]1F 429605af83e511dcaeea4a11606f7bea [0,1,0,1,0,0|2,0,0]=4 5061 B13R1.1488 CCOC(=O)C(NC1CC1C)SC dc8854e1f8f4fa43ea2322886cf6bbfc [0,1,0,1,0,0|1,0,0]=3 5062 B13R1.1488 CCOC(=O)C(N[C@@H]1C[C@H]1F)SC 0aaec97a7a11df78ddfc36e5df6dd44a [0,1,0,1,0,0|2,0,0]=4 5063 B13R1.1488 CCOC(=O)C(N[C@H]1C[C@@H]1F)SC 3d05d38d8c8a4e891624db52fef61672 [0,1,0,1,0,0|2,0,0]=4 5064 B13R1.1488 CCOC(=O)C(N[C@H]1C[C@H]1F)SC 68e02a149fb00f5b22a23634e4e59e8d [0,1,0,1,0,0|2,0,0]=4 5065 B13R1.1490 C#CC(OCC1CC1)C(=O)OCC a4ef4ace34fc6d203dc3922190423d23 [0,1,0,1,0,0|0,0,2]=4 5066 B13R1.1490 CCCC(=O)C(CC)NCC1CC1 240d2ff31bd946bad8a6986ef8693345 [0,1,0,1,0,0|1,0,0]=3 5067 B13R1.1490 CCCC(=O)C(CC)OCC1CC1 955c6e8b028025fa1f3abeef11ef825d [0,1,0,1,0,0|1,0,0]=3 5068 B13R1.1490 CCNC(=O)C(CC)NCC1CC1 63bee8ed138fa907f784fcfd639e9eb3 [0,1,0,1,0,0|1,0,0]=3 5069 B13R1.1490 CCOC(=O)C(C#N)NCC1CC1 1851ef6b736fdcaba008b3ba9affc4cb [0,1,0,1,0,0|1,0,1]=4 5070 B13R1.1490 CCOC(=O)C(C=O)NCC1CC1 13c623e900d38d21c19ec79d95ec128b [0,1,0,1,0,0|1,0,1]=4 5071 B13R1.1490 CCOC(=O)C(CC)NCC1CC1 9d20c023279990c19a64db1573278e59 [0,1,0,1,0,0|0,0,0]=2 5072 B13R1.1490 CCOC(=O)C(CC)OCC1CC1 95b6ada6fe870eadeb88e0d1c28eea3c [0,1,0,1,0,0|0,0,0]=2 5073 B13R1.1490 CCOC(=O)C(CO)NCC1CC1 4f7d749001e92ed3463b23b710116857 [0,1,0,1,0,0|1,0,0]=3 5074 B13R1.1490 CCOC(=O)C(NCC1CC1)SC 38e68a029812b0720f089e6916c15c05 [0,1,0,1,0,0|1,0,0]=3 5075 B13R1.1490 CCOC(=O)[C@@H](CC)NCC1CC1 12d031980b4cab349c514a5db5f63ee1 [0,1,0,1,0,0|0,0,0]=2 5076 B13R1.1490 CCOC(=O)[C@@H](CC)OCC1CC1 6c4548b3afd6900e9275e0238206eaa4 [0,1,0,1,0,0|0,0,0]=2 5077 B13R1.1490 CCOC(=O)[C@H](CC)NCC1CC1 510754843544a8a7833894c58ad23fbc [0,1,0,1,0,0|0,0,0]=2 5078 B13R1.1490 CCOC(=O)[C@H](CC)OCC1CC1 73382b210da84b4b2bcd8975199eec66 [0,1,0,1,0,0|0,0,0]=2 5079 B13R1.1501 CCCC(=O)N1CCC(C1C)(C)C cca7d73502243273d75edaf45588656e [0,1,0,1,0,0|2,0,0]=4 5080 B13R1.1512 CCCC(=O)N1CCC(CC1)(C)C 6205b29e9d7769616b1601042eb15193 [0,1,0,1,0,0|2,0,0]=4 5081 B13R1.1512 CCCC(=O)N1CCC(CC1)(C)O 52eee5db59aae0b36d6b949d89ac50af [0,1,0,1,0,0|2,0,0]=4 5082 B13R1.1518 CCOC(=O)C1CCC1OC(C)C ebec4aa6c18fc8cc261c3b64110c75db [0,1,0,1,0,0|1,0,0]=3 5083 B13R1.1565 C=C(C)CNC1(CC1)C(=O)OCC e6b062a1d689330277cc5a06a86b97bb [0,1,0,1,0,0|1,0,1]=4 5084 B13R1.1565 CCOC(=O)C1(CC1)CNC(=O)C 8fbda5d7be0d71b1e4da6098616c92fe [0,1,0,1,0,0|1,0,1]=4 5085 B13R1.1565 CCOC(=O)C1(CC1)CNC(C)C f325b4c8e58c14f5175d4c3115fafae1 [0,1,0,1,0,0|1,0,0]=3 5086 B13R1.1565 CCOC(=O)C1(CC1)COC(C)C bd6dbc5101fcdc33d34f34e3cbc35464 [0,1,0,1,0,0|1,0,0]=3 5087 B13R1.1565 CCOC(=O)C1(CC1)NCC(C)C a349c26b30eeb6c25b1872c872c8d918 [0,1,0,1,0,0|1,0,0]=3 5088 B13R1.1565 CCOC(=O)C1(CC1)NCC(C)O 478905799af2d5760d55110f041ed1bb [0,1,0,1,0,0|1,0,0]=3 5089 B13R1.1565 CCOC(=O)C1(CC1)NCC(F)F fb4103639d9c5c4964f35cf97266a035 [0,1,0,1,0,0|2,0,0]=4 5090 B13R1.1565 CCOC(=O)C1(CC1)NCN(C)C 7bda1c65b30500c4820b22a070de7447 [0,1,0,1,0,0|2,0,0]=4 5091 B13R1.1565 CCOC(=O)C1(CC1)NC[C@@H](C)O c3561eba4602996cf9dff21308e50e81 [0,1,0,1,0,0|1,0,0]=3 5092 B13R1.1565 CCOC(=O)C1(CC1)NC[C@H](C)O 09de5d232802b31209070c770a5f5b38 [0,1,0,1,0,0|1,0,0]=3 5093 B13R1.4489 CCCC(=O)C(CC)N1CC1(C)C d4bdd0673ed9800f2e772cca0a138149 [0,1,0,1,0,0|2,0,0]=4 5094 B13R1.4489 CCOC(=O)C(CC)N1CC1(C)C 76ddb57ff99e61af7ac4785bf30f69b0 [0,1,0,1,0,0|1,0,0]=3 5095 B13R1.4489 CCOC(=O)C(CO)N1CC1(C)C 1b1692a1d51e670dc1250be68d076a28 [0,1,0,1,0,0|2,0,0]=4 5096 B13R1.4489 CCOC(=O)C(SC)N1CC1(C)C 26878c98ce1b0d5f87d0c08356d149a3 [0,1,0,1,0,0|2,0,0]=4 5097 B13R1.107 CCC(C)N1CCNC(=O)C1CC 5a626a2b8c5a633b4d6f68128c5ff6c9 [0,1,0,1,0,0|2,0,0]=4 5098 B13R1.446 CCCC(=O)N1CC(CCC1C)O 9fe598ac22271ff6e52270fd6466856b [0,1,0,1,0,0|2,0,0]=4 5099 B13R1.446 CCCC(=O)N1C[C@@H](CC[C@H]1C)O c5bcdd8db76189c216738fc18f14e4ed [0,1,0,1,0,0|2,0,0]=4 5100 B13R1.456 CCOC(=O)[C@@H]1CN(C[C@H]1C)CC 428aecdbeef443349a413ba10c89e316 [0,1,0,1,0,0|1,0,0]=3 5101 B13R1.456 CCOC(=O)[C@@H]1CN(C[C@H]1C)CF 904019c871ad2cae37e977d38d80c46f [0,1,0,1,0,0|2,0,0]=4 5102 B13R1.456 CCOC(=O)[C@@H]1CN(C[C@H]1C)CO cfb11f9a891018d732656e386ca3b348 [0,1,0,1,0,0|2,0,0]=4 5103 B13R1.456 CCOC(=O)[C@@H]1CN(C[C@H]1O)CC c36d68b22bebb94b739e54fbf87ef2a5 [0,1,0,1,0,0|1,0,0]=3 5104 B13R1.456 CCOC(=O)[C@@H]1CN(C[C@H]1O)CF f17f118e5053b674efb1dfdba9574d20 [0,1,0,1,0,0|2,0,0]=4 5105 B13R1.456 CCOC(=O)[C@@H]1CN(C[C@H]1O)CO fce075c000763974315ff81782f67d2b [0,1,0,1,0,0|2,0,0]=4 5106 B13R1.456 CCOC(=O)[C@H]1CN(C[C@@H]1C)CC 8fc068b8077b66de6579b2ed9399d56c [0,1,0,1,0,0|1,0,0]=3 5107 B13R1.456 CCOC(=O)[C@H]1CN(C[C@@H]1C)CF 06a0e3004ea874d23ef0daa27eda5ea7 [0,1,0,1,0,0|2,0,0]=4 5108 B13R1.456 CCOC(=O)[C@H]1CN(C[C@@H]1C)CO c2a94958c4ec9bdef25a95082622889b [0,1,0,1,0,0|2,0,0]=4 5109 B13R1.527 CCC(C)NC1CCCCCC1=O f36fbcfc8112200930994b28a0466112 [0,1,0,1,0,0|2,0,0]=4 5110 B13R1.527 CCC(C)NC1CCCCNC1=O 8bb90aa44fa264330afe33b9b4cdda33 [0,1,0,1,0,0|2,0,0]=4 5111 B13R1.527 CCC(C)N[C@@H]1CCCCNC1=O bc47d170ff3f0a5f6acee2326c4b6637 [0,1,0,1,0,0|2,0,0]=4 5112 B13R1.527 CCC(C)N[C@H]1CCCCNC1=O 3aa117311cb14a83d24b2d8c97cabee4 [0,1,0,1,0,0|2,0,0]=4 5113 B13R1.527 CCC(C)OC1CCCCCC1=O 39ad2612567c4a53fb681310b0384d45 [0,1,0,1,0,0|2,0,0]=4 5114 B13R1.527 CC[C@@H](C)NC1CCCCCC1=O 5b6e175f855c7c66d7db92c6adcd0751 [0,1,0,1,0,0|2,0,0]=4 5115 B13R1.527 CC[C@@H](C)NC1CCCCNC1=O 5730bbcbdfc3a4742fc413ad79f7c80d [0,1,0,1,0,0|2,0,0]=4 5116 B13R1.527 CC[C@H](C)NC1CCCCCC1=O 75961387b08c23708abb7c96aa7e0030 [0,1,0,1,0,0|2,0,0]=4 5117 B13R1.527 CC[C@H](C)NC1CCCCNC1=O 064397b4b8f6c3aabddb143bd927d8b3 [0,1,0,1,0,0|2,0,0]=4 5118 B13R1.1376 CCCC(=O)C(CC)NC1(CC1)C b33b73c7efbbc5d50590c4032d4fcaf9 [0,1,0,1,0,0|2,0,0]=4 5119 B13R1.1376 CCOC(=O)C(CC)NC1(CC1)C d861b94d17d855611f4b9459fc9f591f [0,1,0,1,0,0|1,0,0]=3 5120 B13R1.1376 CCOC(=O)C(CO)NC1(CC1)C 367f687105a7f61f3ee49f8830f4acfe [0,1,0,1,0,0|2,0,0]=4 5121 B13R1.1376 CCOC(=O)C(NC1(CC1)C)SC 1feca6a496b05579474c4fe5338fb5b0 [0,1,0,1,0,0|2,0,0]=4 5122 B13R1.1489 C#CC(OC1CCC1)C(=O)OCC d165f5bb464c61c61c419bba74937cad [0,1,0,1,0,0|0,0,2]=4 5123 B13R1.1489 CCCC(=O)C(CC)NC1CCC1 37888ecccc8e454f06b17354331f4144 [0,1,0,1,0,0|1,0,0]=3 5124 B13R1.1489 CCCC(=O)C(CC)NC1COC1 4ec753392ac754861e47cdc4132b0644 [0,1,0,1,0,0|2,0,0]=4 5125 B13R1.1489 CCCC(=O)C(CC)OC1CCC1 f14fc75733671edbf5906b6b04773508 [0,1,0,1,0,0|1,0,0]=3 5126 B13R1.1489 CCCC(=O)C(CC)OC1COC1 46cc3be2137be9b4dd5eeb09173480ae [0,1,0,1,0,0|2,0,0]=4 5127 B13R1.1489 CCCC(=O)C(CC)OC1CSC1 69166d2de57130c41d85e42cfdbbaf56 [0,1,0,1,0,0|2,0,0]=4 5128 B13R1.1489 CCNC(=O)C(CC)NC1CCC1 9f9e1d693d47c607fa77a1f6cec4ddeb [0,1,0,1,0,0|1,0,0]=3 5129 B13R1.1489 CCNC(=O)C(CC)NC1COC1 9a3f317a00462e320b86f5e1ed5cbfcd [0,1,0,1,0,0|2,0,0]=4 5130 B13R1.1489 CCOC(=O)C(C#N)NC1CCC1 3a0605508c91c7e140bc44eb0a2353cf [0,1,0,1,0,0|1,0,1]=4 5131 B13R1.1489 CCOC(=O)C(C=O)NC1CCC1 180161a01b257f35dc5d6fe4b84d3a04 [0,1,0,1,0,0|1,0,1]=4 5132 B13R1.1489 CCOC(=O)C(C=O)OC1CCC1 7dc58817e27437bb05d5bceb096abca0 [0,1,0,1,0,0|1,0,1]=4 5133 B13R1.1489 CCOC(=O)C(CC)NC1CCC1 b3b8b59f68ee86838e8e530ee050fd14 [0,1,0,1,0,0|0,0,0]=2 5134 B13R1.1489 CCOC(=O)C(CC)NC1COC1 f92a3d54a6001ddc105314b65c393cc1 [0,1,0,1,0,0|1,0,0]=3 5135 B13R1.1489 CCOC(=O)C(CC)OC1CCC1 4c5d02e0e7f20c2f60b2c50b3d3baf16 [0,1,0,1,0,0|0,0,0]=2 5136 B13R1.1489 CCOC(=O)C(CC)OC1COC1 e99e802049ab5892da56191616a2e8ce [0,1,0,1,0,0|1,0,0]=3 5137 B13R1.1489 CCOC(=O)C(CC)OC1CSC1 401515b631ab4389d7a7daa4f3d56323 [0,1,0,1,0,0|1,0,0]=3 5138 B13R1.1489 CCOC(=O)C(CO)NC1CCC1 544b677eb78bdf7d4fc988bbdf6594e3 [0,1,0,1,0,0|1,0,0]=3 5139 B13R1.1489 CCOC(=O)C(CO)NC1COC1 b0ff6786005ef770c9469e047b7c60af [0,1,0,1,0,0|2,0,0]=4 5140 B13R1.1489 CCOC(=O)C(NC1CCC1)SC eb2ceb138ecf022c3c1991b020416cb8 [0,1,0,1,0,0|1,0,0]=3 5141 B13R1.1489 CCOC(=O)C(NC1COC1)SC 89d30c03d4510dc444944edeb3926d5e [0,1,0,1,0,0|2,0,0]=4 5142 B13R1.1489 CCOC(=O)[C@@H](CC)NC1CCC1 f6495a2d1724ad7aba750e6246718656 [0,1,0,1,0,0|0,0,0]=2 5143 B13R1.1489 CCOC(=O)[C@@H](CC)NC1COC1 eb9e86c2bb764c6bd2d59de2503dec1a [0,1,0,1,0,0|1,0,0]=3 5144 B13R1.1489 CCOC(=O)[C@@H](CC)OC1CCC1 c7572180e073b882ecf004e060e4670f [0,1,0,1,0,0|0,0,0]=2 5145 B13R1.1489 CCOC(=O)[C@@H](CC)OC1COC1 e6822ae3f5a5ea304dc8cd5f499ee9fd [0,1,0,1,0,0|1,0,0]=3 5146 B13R1.1489 CCOC(=O)[C@H](CC)NC1CCC1 3502042d198c19c9a3861d4262c56cf4 [0,1,0,1,0,0|0,0,0]=2 5147 B13R1.1489 CCOC(=O)[C@H](CC)NC1COC1 6a14ff98618a91913857a095ac406e05 [0,1,0,1,0,0|1,0,0]=3 5148 B13R1.1489 CCOC(=O)[C@H](CC)OC1CCC1 9c78f2b9a8ec5e33c7662941ff5a93f9 [0,1,0,1,0,0|0,0,0]=2 5149 B13R1.1489 CCOC(=O)[C@H](CC)OC1COC1 431afd2c47b06a1ed07d39f37ac9bf57 [0,1,0,1,0,0|1,0,0]=3 5150 B13R1.1520 CCOC(=O)C1CCC1N(C)CC 3eb2d0a6d016e219f4584bc103c86753 [0,1,0,1,0,0|1,0,0]=3 5151 B13R1.1548 CCOC(=O)C1(CC1)NC(=O)CC b4b4911c7452d00d8f8d9264a7b0b904 [0,1,0,1,0,0|1,0,1]=4 5152 B13R1.1548 CCOC(=O)C1(CC1)NC(C)CO 844615703d9b401da3c85cd70a6db788 [0,1,0,1,0,0|2,0,0]=4 5153 B13R1.1548 CCOC(=O)C1(CC1)N[C@@H](C)CO 9f61302bbd9a6e85fc45741cb3a8f56a [0,1,0,1,0,0|2,0,0]=4 5154 B13R1.1548 CCOC(=O)C1(CC1)N[C@H](C)CO e0389c5062d846497237195c89af74ae [0,1,0,1,0,0|2,0,0]=4 5155 B13R1.4506 CCCC(=O)N1CCC(C1)(C)CC 63c76fd74d1fd5822f05534fa9539d51 [0,1,0,1,0,0|2,0,0]=4 5156 B13R1.4506 CCCC(=O)N1CCC(C1)(F)CC bcb7a4e2d78a640207a848f926753e99 [0,1,0,1,0,0|2,0,0]=4 5157 B13R1.58 CCC1CCN(C1)C(=O)CC(C)C b1b6f97f7c625ae48e4ab8b487217cbf [0,1,0,1,0,0|2,0,0]=4 5158 B13R1.58 CCC1CCN(C1)C(=O)CC(C)O bcc09c2936cc1f592603e9ed0dffcb59 [0,1,0,1,0,0|2,0,0]=4 5159 B13R1.58 CCC1CCN(C1)C(=O)C[C@@H](C)O 94bcba6ae3a92da8e3efb95fefa4e3e1 [0,1,0,1,0,0|2,0,0]=4 5160 B13R1.58 CCC1CCN(C1)C(=O)C[C@H](C)O 9abe73b96c5562c02656210311ef61e5 [0,1,0,1,0,0|2,0,0]=4 5161 B13R1.132 CC(C)CC(=O)N1CCC(CC1)C 883f5f13bd35aaafeb44fac2259c937c [0,1,0,1,0,0|2,0,0]=4 5162 B13R1.132 CC(O)CC(=O)N1CCC(CC1)C 9f72c682d57b4ad563b85012b75478b4 [0,1,0,1,0,0|2,0,0]=4 5163 B13R1.132 CC1CCN(CC1)C(=O)C[C@@H](C)O 05656aa45b37b38eb2215646310767e2 [0,1,0,1,0,0|2,0,0]=4 5164 B13R1.132 CC1CCN(CC1)C(=O)C[C@H](C)O e24b8db748007a48c39d69296fc6db15 [0,1,0,1,0,0|2,0,0]=4 5165 B13R1.201 CC(C)CC(=O)N1CCCCC1C 478a6b27560797d7c9e65e9a1d116a78 [0,1,0,1,0,0|2,0,0]=4 5166 B13R1.201 CC(C)CC(=O)N1CCCC[C@@H]1C adef7853d40c39c7d38ca4c3e6971377 [0,1,0,1,0,0|2,0,0]=4 5167 B13R1.201 CC(C)CC(=O)N1CCCC[C@H]1C 750951563baeaebf4de5265cd030fc44 [0,1,0,1,0,0|2,0,0]=4 5168 B13R1.201 CC(O)CC(=O)N1CCCCC1C e429ad2c493cd131347302c94b5609b5 [0,1,0,1,0,0|2,0,0]=4 5169 B13R1.201 CC(O)CC(=O)N1CCCC[C@@H]1C 9d1f1044abab06f5bd5b4ffd15a8d114 [0,1,0,1,0,0|2,0,0]=4 5170 B13R1.201 CC(O)CC(=O)N1CCCC[C@H]1C 4f31988c874ee90aaebfd2ea71bb8937 [0,1,0,1,0,0|2,0,0]=4 5171 B13R1.201 CC1CCCCN1C(=O)C[C@@H](C)O 535c00199b2a08e3de659ab34d694b43 [0,1,0,1,0,0|2,0,0]=4 5172 B13R1.201 CC1CCCCN1C(=O)C[C@H](C)O a461732f73ead4c2c1ae8ecc036dc38a [0,1,0,1,0,0|2,0,0]=4 5173 B13R1.201 C[C@@H](O)CC(=O)N1CCCC[C@@H]1C ed0e0dcae5ffad8a6f9e4a5ae88f02fc [0,1,0,1,0,0|2,0,0]=4 5174 B13R1.201 C[C@@H]1CCCCN1C(=O)C[C@@H](C)O 781c6e290b90f6ad98691c32a4f5a7dc [0,1,0,1,0,0|2,0,0]=4 5175 B13R1.201 C[C@H](O)CC(=O)N1CCCC[C@@H]1C 929b929fadc98571c5057a48131ff7bd [0,1,0,1,0,0|2,0,0]=4 5176 B13R1.201 C[C@H](O)CC(=O)N1CCCC[C@H]1C f160878db849ed0a943754f4fad07d2a [0,1,0,1,0,0|2,0,0]=4 5177 B13R1.1924 CCCCN(CC)C(=O)CC1CC1 7eb8b7ced5c648dcd394ffe8a770e9f5 [0,1,0,1,0,0|2,0,0]=4 5178 B13R1.1924 CCCCN(CC)C(=O)NC1CC1 f280499c15c19e7da2e32d220b65a7e4 [0,1,0,1,0,0|2,0,0]=4 5179 B13R1.1947 CC(C)OC(=O)C1(CC1)NCCS 6410cabc23fca41bca990bc05fd09373 [0,1,0,1,0,0|2,0,0]=4 5180 B13R1.2687 CCC(NC1CC1)C(=O)NC(C)C 926b9f7fe28b3da2a0620602ea8ed77f [0,1,0,1,0,0|2,0,0]=4 5181 B13R1.2687 CCC(OC1CC1)C(=O)NC(C)C 2295b9bd15cf877b766bc522d3f450af [0,1,0,1,0,0|2,0,0]=4 5182 B13R1.2687 CCN(CC1CC1)C(=O)CC(C)C 938c851afd820ffe51c538e1be4ec1e9 [0,1,0,1,0,0|2,0,0]=4 5183 B13R1.2687 CCN(CC1CC1)C(=O)CC(C)O 67f4f29d7d64d8c0c1ad34bddd566143 [0,1,0,1,0,0|2,0,0]=4 5184 B13R1.2687 CCN(CC1CC1)C(=O)C[C@@H](C)O ef3d7a0da503881eee1c18ce57d8b486 [0,1,0,1,0,0|2,0,0]=4 5185 B13R1.2687 CCN(CC1CC1)C(=O)C[C@H](C)O 806c7e4a47128e1d9ed13e3d7d2494fd [0,1,0,1,0,0|2,0,0]=4 5186 B13R1.2732 CCC(C(=O)NC(C)C)N1CCC1 6edf778919b3b7c52c4c05f983afec73 [0,1,0,1,0,0|2,0,0]=4 5187 B13R1.2732 CCN(C(=O)CC(C)C)C1CCC1 bf78095e2fb119e74e68f56e6b1548c3 [0,1,0,1,0,0|2,0,0]=4 5188 B13R1.2732 CCN(C(=O)CC(C)O)C1CCC1 99016b5d73a1223c3616e47d3fe8d90b [0,1,0,1,0,0|2,0,0]=4 5189 B13R1.2732 CCN(C(=O)C[C@@H](C)O)C1CCC1 ec77f3d3abae6842d5242d19b74302fe [0,1,0,1,0,0|2,0,0]=4 5190 B13R1.2732 CCN(C(=O)C[C@H](C)O)C1CCC1 e3fd62b6d425a4ff99d1203fef113df3 [0,1,0,1,0,0|2,0,0]=4 5191 B13R1.7456 CC(C)CC(=O)N1CCCCCC1 16a8d62d337282ef1f4e6dd5cb69e201 [0,1,0,1,0,0|2,0,0]=4 5192 B13R1.7456 CC(O)CC(=O)N1CCCCCC1 c2486f9b821b8a326589232c2086eeb5 [0,1,0,1,0,0|2,0,0]=4 5193 B13R1.7456 C[C@@H](O)CC(=O)N1CCCCCC1 b55433298a6ec56d6746702e9a55defe [0,1,0,1,0,0|2,0,0]=4 5194 B13R1.7456 C[C@H](O)CC(=O)N1CCCCCC1 d515ef1c2413e8bc7ed8f40618cb3f9e [0,1,0,1,0,0|2,0,0]=4 5195 B13R1.26 CCCCC(CC)N1CCCOC1 bd5cd95d70291679b93d3936c4d48e41 [0,1,0,1,0,0|2,0,0]=4 5196 B13R1.21 C=C(CC)C(=O)N1CCC(CC1)C 4be8b2f07faefe722dcc760977e6ed18 [0,1,0,1,0,0|2,0,0]=4 5197 B13R1.21 CCC(=O)C(=O)N1CCC(CC1)C 481c27e4817287a0fee1cc3eeeef48a0 [0,1,0,1,0,0|2,0,0]=4 5198 B13R1.21 CCC(O)C(=O)N1CCC(CC1)C 12aea35bb7a66379f38c105252e23504 [0,1,0,1,0,0|2,0,0]=4 5199 B13R1.21 CC[C@@H](O)C(=O)N1CCC(CC1)C e937775cce242c83c7fcc4382a911e67 [0,1,0,1,0,0|2,0,0]=4 5200 B13R1.21 CC[C@H](O)C(=O)N1CCC(CC1)C b16519f92f5eeee4c70a21940ded0c8a [0,1,0,1,0,0|2,0,0]=4 5201 B13R1.21 CC[C@H](S)C(=O)N1CCC(CC1)C c55b5ffa87a0aef808fbdbe69c8f1090 [0,1,0,1,0,0|2,0,0]=4 5202 B13R1.63 C=C(CC)C(=O)N1CCC(C1)CC 6e5d68d58420cb660df39b76211ac7f2 [0,1,0,1,0,0|2,0,0]=4 5203 B13R1.63 CCC(=O)C(=O)N1CCC(C1)CC 300c9f1be362a13dd8871257652ab373 [0,1,0,1,0,0|2,0,0]=4 5204 B13R1.63 CCC1CCN(C1)C(=O)C(O)CC 366dffa1db17304135f4e0e7e1b439d3 [0,1,0,1,0,0|2,0,0]=4 5205 B13R1.63 CCC1CCN(C1)C(=O)[C@@H](O)CC 0d4b522e60ede25861b7056d5102c409 [0,1,0,1,0,0|2,0,0]=4 5206 B13R1.63 CCC1CCN(C1)C(=O)[C@@H](S)CC f47480b042e9a279034fbe7d126008f8 [0,1,0,1,0,0|2,0,0]=4 5207 B13R1.63 CCC1CCN(C1)C(=O)[C@H](O)CC ec6934095a0f03f4fb532c1a78178f55 [0,1,0,1,0,0|2,0,0]=4 5208 B13R1.217 CCCN1CC[C@H]1C(=O)N(C)CC f64fd546cf476e4b48dc713d45eaf4d0 [0,1,0,1,0,0|2,0,0]=4 5209 B13R1.696 C=C(CC)C(=O)N1CCCCC1C 12ab1af76d4830988a5c39792d6b9b0f [0,1,0,1,0,0|2,0,0]=4 5210 B13R1.696 C=C(CC)C(=O)N1CCCC[C@@H]1C 30a21484da4490fd71fea6df06cdab9a [0,1,0,1,0,0|2,0,0]=4 5211 B13R1.696 C=C(CC)C(=O)N1CCCC[C@H]1C 4d49dff7d03a99caf91c37d243faecc2 [0,1,0,1,0,0|2,0,0]=4 5212 B13R1.696 CCC(=O)C(=O)N1CCCCC1C 3888e204a2b373aeb9f4a7671a7a466a [0,1,0,1,0,0|2,0,0]=4 5213 B13R1.696 CCC(=O)C(=O)N1CCCC[C@@H]1C 3729dd4350fed49feb41cdd26893f075 [0,1,0,1,0,0|2,0,0]=4 5214 B13R1.696 CCC(=O)C(=O)N1CCCC[C@H]1C 0e179d2558b625e45e9281a1c8a54c27 [0,1,0,1,0,0|2,0,0]=4 5215 B13R1.696 CCC(O)C(=O)N1CCCCC1C 7092e643d74be9f8080f8c68d0fdf1c0 [0,1,0,1,0,0|2,0,0]=4 5216 B13R1.696 CCC(O)C(=O)N1CCCC[C@@H]1C 2c1c85137f2a7c2b72e41478a766825e [0,1,0,1,0,0|2,0,0]=4 5217 B13R1.696 CCC(O)C(=O)N1CCCC[C@H]1C bb10076c8815f5076b6d984a819bbafd [0,1,0,1,0,0|2,0,0]=4 5218 B13R1.696 CCN(C)C(=O)C1CCCCN1C d578d912a219fb744e18770f682e9413 [0,1,0,1,0,0|2,0,0]=4 5219 B13R1.696 CCN(C)C(=O)[C@@H]1CCCCN1C b74f4bdd9b842eb438b77c46bb8cad08 [0,1,0,1,0,0|2,0,0]=4 5220 B13R1.696 CCN(C)C(=O)[C@H]1CCCCN1C d932f82b7d6cfaea9c379641ef9e2616 [0,1,0,1,0,0|2,0,0]=4 5221 B13R1.696 CC[C@@H](O)C(=O)N1CCCCC1C 819ac6ff96217959df5467e90e2019e7 [0,1,0,1,0,0|2,0,0]=4 5222 B13R1.696 CC[C@@H](O)C(=O)N1CCCC[C@@H]1C c16a4d062fe6bb06c574c6b08a23f806 [0,1,0,1,0,0|2,0,0]=4 5223 B13R1.696 CC[C@@H](O)C(=O)N1CCCC[C@H]1C 07d9c82247d84a3d1195869abe387e6f [0,1,0,1,0,0|2,0,0]=4 5224 B13R1.696 CC[C@H](O)C(=O)N1CCCCC1C d7ec23f4eca9098a050b33234c8b208e [0,1,0,1,0,0|2,0,0]=4 5225 B13R1.696 CC[C@H](O)C(=O)N1CCCC[C@@H]1C 209c4762335b8d5e36b13f633c2ce768 [0,1,0,1,0,0|2,0,0]=4 5226 B13R1.696 CC[C@H](O)C(=O)N1CCCC[C@H]1C b062275428d9fefecbdd38e371ca70e5 [0,1,0,1,0,0|2,0,0]=4 5227 B13R1.696 CC[C@H](S)C(=O)N1CCCCC1C b014b5f34e4ed876daecb10f9aa2339e [0,1,0,1,0,0|2,0,0]=4 5228 B13R1.696 CC[C@H](S)C(=O)N1CCCC[C@@H]1C 7e188e25a2aa3c0e21542794ba989779 [0,1,0,1,0,0|2,0,0]=4 5229 B13R1.696 CC[C@H](S)C(=O)N1CCCC[C@H]1C 531fd9774be8148f9aa00854a5c6b7ad [0,1,0,1,0,0|2,0,0]=4 5230 B13R1.1253 CCCN1CCN(C(=O)C1CC)C 6027af67c8335c693753a58b42eac7d1 [0,1,0,1,0,0|2,0,0]=4 5231 B13R1.1917 CCCNC1CCCCN(C1=O)C a99bca2eb363b9279a41fe38a8d860eb [0,1,0,1,0,0|2,0,0]=4 5232 B13R1.1917 CCCN[C@H]1CCCCN(C1=O)C 31d27c6e8a692480a2b469702c1a87cf [0,1,0,1,0,0|2,0,0]=4 5233 B13R1.1922 CCCCN(CC)C(=O)C1=CCC1 092c72032158b3b13b0fab1f20443689 [0,1,0,1,0,0|2,0,0]=4 5234 B13R1.1922 CCCCN(CC)C(=O)C1CCO1 fc5d7b6d376680ffaea34840045d4388 [0,1,0,1,0,0|1,0,0]=3 5235 B13R1.1922 CCCCN(CC)C(=O)[C@@H]1CCO1 6bd8c209af6209e60010f7a83df8b0b1 [0,1,0,1,0,0|1,0,0]=3 5236 B13R1.1922 CCCCN(CC)C(=O)[C@H]1CCO1 0c26111e434e205b3d0ad2735061d845 [0,1,0,1,0,0|1,0,0]=3 5237 B13R1.1922 CCN(CCCO)C(=O)C1CCO1 bb26fa1f8dfab5d61322dd49665ea521 [0,1,0,1,0,0|2,0,0]=4 5238 B13R1.1922 CCN(CCCO)C(=O)[C@@H]1CCO1 553f7963a3681ee03e3928eed64bff31 [0,1,0,1,0,0|2,0,0]=4 5239 B13R1.1922 CCN(CCCO)C(=O)[C@H]1CCO1 04f25b2e18450caf5c6cf707f01a1d36 [0,1,0,1,0,0|2,0,0]=4 5240 B13R1.1922 CCN(CCOC)C(=O)C1CCO1 cf0cf88af74410d7e6e20a5fec5eff47 [0,1,0,1,0,0|2,0,0]=4 5241 B13R1.1922 CCN(CCOC)C(=O)[C@@H]1CCO1 79450d1694a1b9dcca2d7c83aa762e3c [0,1,0,1,0,0|2,0,0]=4 5242 B13R1.1922 CCN(CCOC)C(=O)[C@H]1CCO1 b4a97d52aabe4d88bb8c622be41138c2 [0,1,0,1,0,0|2,0,0]=4 5243 B13R1.2620 C=C(CC)C(=O)N1CCCCCC1 a494bd3ffa2eef86e8622fef7df98929 [0,1,0,1,0,0|2,0,0]=4 5244 B13R1.2620 CCC(=O)C(=O)N1CCCCCC1 64fba9945f9ddaf389ae94f8b814919e [0,1,0,1,0,0|2,0,0]=4 5245 B13R1.2620 CCC(O)C(=O)N1CCCCCC1 3644bbcfb1393b628d57505385e47fff [0,1,0,1,0,0|2,0,0]=4 5246 B13R1.2620 CC[C@@H](O)C(=O)N1CCCCCC1 97ca0d3744811a53940daa2ab598f97a [0,1,0,1,0,0|2,0,0]=4 5247 B13R1.2620 CC[C@H](O)C(=O)N1CCCCCC1 e1cb939f798d09b070175bcd4693d2b9 [0,1,0,1,0,0|2,0,0]=4 5248 B13R1.2620 CC[C@H](S)C(=O)N1CCCCCC1 d967566792b1da8a07cc1ac29ccf74fa [0,1,0,1,0,0|2,0,0]=4 5249 B13R1.2632 C=C(CC)C(=O)N(CC)C1CCC1 0b278daf6b92ddb538c6078b68f0147a [0,1,0,1,0,0|2,0,0]=4 5250 B13R1.2632 CCC(=O)C(=O)N(CC)C1CCC1 b460a8683f15dfb738cae4b3b9b9c117 [0,1,0,1,0,0|2,0,0]=4 5251 B13R1.2632 CCC(O)C(=O)N(CC)C1CCC1 d9d57eb16b73da0a0ec56bb46ff401eb [0,1,0,1,0,0|2,0,0]=4 5252 B13R1.2632 CC[C@@H](O)C(=O)N(CC)C1CCC1 0f79f8cc2e5b89ca357a16dba3237927 [0,1,0,1,0,0|2,0,0]=4 5253 B13R1.2632 CC[C@H](O)C(=O)N(CC)C1CCC1 47b7dccc4b8df9450a8f32443914682e [0,1,0,1,0,0|2,0,0]=4 5254 B13R1.2632 CC[C@H](S)C(=O)N(CC)C1CCC1 aaa35eca381be03b2fd7486c0181ceb5 [0,1,0,1,0,0|2,0,0]=4 5255 B13R1.2634 C=C(CC)C(=O)N(CC)CC1CC1 b6ac5bdcde7071b91410f8adac45ee3b [0,1,0,1,0,0|2,0,0]=4 5256 B13R1.2634 CCC(=O)C(=O)N(CC)CC1CC1 53ef1c8ff6e33b761322b87a7deaa237 [0,1,0,1,0,0|2,0,0]=4 5257 B13R1.2634 CCC(O)C(=O)N(CC)CC1CC1 863f34deac55b83d04d1529a26180714 [0,1,0,1,0,0|2,0,0]=4 5258 B13R1.2634 CC[C@@H](O)C(=O)N(CC)CC1CC1 a490fd8089e23b9a01846f44679f2a84 [0,1,0,1,0,0|2,0,0]=4 5259 B13R1.2634 CC[C@H](O)C(=O)N(CC)CC1CC1 0d45cfd39448fb21c8667cc575bcc16c [0,1,0,1,0,0|2,0,0]=4 5260 B13R1.2634 CC[C@H](S)C(=O)N(CC)CC1CC1 c8d1966dc1e1da8a2485c4ee12a76bba [0,1,0,1,0,0|2,0,0]=4 5261 B13R1.356 CCOC1CC(CCC1C(C)C)C ecb0f618cab246aa17f733d54a6347aa [0,1,0,1,0,0|1,0,1]=4 5262 B13R1.356 CCO[C@@H]1C[C@@H](CC[C@@H]1C(C)C)C b94938aeb3889c97244e51a1e98af8c1 [0,1,0,1,0,0|1,0,1]=4 5263 B13R1.356 CCO[C@@H]1C[C@@H](CC[C@H]1C(C)C)C 6be64ae419c73c6cd94d79986bb709ad [0,1,0,1,0,0|1,0,1]=4 5264 B13R1.356 CCO[C@H]1C[C@@H](CC[C@@H]1C(C)C)C 5f259e01e4d90af0bd35d224bbba8d4b [0,1,0,1,0,0|1,0,1]=4 5265 B13R1.356 CCO[C@H]1C[C@@H](CC[C@H]1C(C)C)C 98849c958990c845c7384253eba7601d [0,1,0,1,0,0|1,0,1]=4 5266 B13R1.356 CCO[C@H]1C[C@H](CC[C@@H]1C(C)C)C 94b870f75bc0421a92aaac9d78ee86db [0,1,0,1,0,0|1,0,1]=4 5267 B13R1.465 CCCC(=O)N1CCCCC1(C)C 8059044b7389f1597a02dd1ed93b63bb [0,1,0,1,0,0|2,0,0]=4 5268 B13R1.1497 CCOC(=O)C(C(=O)C)N1CCC1 29a2ff335b2dc68bce8a23dab8b6aa69 [0,1,0,1,0,0|1,0,1]=4 5269 B13R1.1497 CCOC(=O)C(C(C)C)N1CCC1 abad11fd186238ce5c9820b9fe2981ae [0,1,0,1,0,0|1,0,0]=3 5270 B13R1.1497 CCOC(=O)[C@@H](C(C)C)N1CCC1 65ba2ae046bd6f5175218bcdb1e44005 [0,1,0,1,0,0|1,0,0]=3 5271 B13R1.1510 CCCC(=O)N1CCC(C1(C)C)C 55590486092c50d22e6b982aca78db12 [0,1,0,1,0,0|2,0,0]=4 5272 B13R1.2897 CCCN1CCNC(=O)C1C(C)C 0e8699c4ea76a09e8cfe0aba8a6cde60 [0,1,0,1,0,0|2,0,0]=4 5273 B13R1.4441 CCOC(=O)C(NC1CC1)C(=O)C d8afecdd86cbed5362665e99f913c7de [0,1,0,1,0,0|1,0,1]=4 5274 B13R1.4441 CCOC(=O)C(NC1CC1)C(C)C 8c5e224c34c48238d990e545300c304c [0,1,0,1,0,0|1,0,0]=3 5275 B13R1.4441 CCOC(=O)C(OC1CC1)C(=O)C 0dde6337d47032db05f712fc5e3c91c6 [0,1,0,1,0,0|1,0,1]=4 5276 B13R1.4441 CCOC(=O)C(OC1CC1)C(C)C c93751d07063465a7fdba0d18f54eebd [0,1,0,1,0,0|1,0,0]=3 5277 B13R1.4441 CCOC(=O)[C@@H](NC1CC1)C(C)C be607ffaa5d30faa8f935ba4fce98648 [0,1,0,1,0,0|1,0,0]=3 5278 B13R1.4441 CCOC(=O)[C@H](NC1CC1)C(C)C 3d783133a3bfc48a605af885fb47c878 [0,1,0,1,0,0|1,0,0]=3 5279 B13R1.4441 CCOC(=O)[C@H](OC1CC1)C(C)C c2a158678947337adae56ac96ee42a7f [0,1,0,1,0,0|1,0,0]=3 5280 B13R1.8134 CCCN1C(C1(C)C)C(=O)OCC 4988fb1eae09fa43e004285930bc6947 [0,1,0,1,0,0|1,0,0]=3 5281 B13R1.8134 CCOC(=O)C1N(C1(C)C)CCF a4c063c216fb594d0188aefab2e48783 [0,1,0,1,0,0|2,0,0]=4 5282 B13R1.8134 CCOC(=O)C1N(C1(C)C)CCO 42b85de3c73eedca0acca355e6d3507a [0,1,0,1,0,0|2,0,0]=4 5283 B13R1.8134 CCOC(=O)C1N(C1(C)C)CCS df0e7912de3860e66a7d1b7d6d966c3f [0,1,0,1,0,0|2,0,0]=4 5284 B13R1.8134 CCOC(=O)C1N(C1(C)C)COC dccd22564273dbca9e103c7047cf6745 [0,1,0,1,0,0|2,0,0]=4 5285 B13R1.8134 CCOC(=O)C1N(C1(C)C)CSC 131c3d01523446b4b3fd248b08bb153f [0,1,0,1,0,0|2,0,0]=4 5286 B13R1.17 CC/C=C/C(=O)N1CCC(CC1)C 6b0af652efbd71ccef3efc958531350a [0,1,0,1,0,0|2,0,0]=4 5287 B13R1.17 CC/C=C\C(=O)N1CCC(CC1)C 2f48d300c4aa4b340abb5b175e372ebc [0,1,0,1,0,0|2,0,0]=4 5288 B13R1.17 CC1CCN(CC1)C(=O)CCCF 7b82b7cbeefc9ab68667389a8d24de33 [0,1,0,1,0,0|2,0,0]=4 5289 B13R1.17 CC1CCN(CC1)C(=O)CCCS 9cb7132a41ba75b298de97e06d46d171 [0,1,0,1,0,0|2,0,0]=4 5290 B13R1.17 CC1CCN(CC1)C(=O)NCCF 0ca3559ae9908f304027212873861871 [0,1,0,1,0,0|2,0,0]=4 5291 B13R1.17 CC1CCN(CC1)C(=O)NCCN 21ca14b7958b304b7da307cd4ee6c5ed [0,1,0,1,0,0|2,0,0]=4 5292 B13R1.17 CC1CCN(CC1)C(=O)NCCO a78f428f2d70115d45535b8b13d3b4fb [0,1,0,1,0,0|2,0,0]=4 5293 B13R1.17 CC1CCN(CC1)C(=O)NCCS 40cdd4317b76b3647a8f8755f6846f32 [0,1,0,1,0,0|2,0,0]=4 5294 B13R1.17 CCC#CC(=O)N1CCC(CC1)C a23bf801f2f6e7eb23b1292f8ad9e717 [0,1,0,1,0,0|2,0,0]=4 5295 B13R1.17 CCC=CC(=O)N1CCC(CC1)C 08dd9a9a897979a882103aabfc4ddd0c [0,1,0,1,0,0|2,0,0]=4 5296 B13R1.17 CCCCC(=O)N1CCC(CC1)C f6f379095edb25bf8e0fb55acbce48f8 [0,1,0,1,0,0|2,0,0]=4 5297 B13R1.17 CCCNC(=O)N1CCC(CC1)C 0f5dffd4497f5da57b479f0bcc9fc15f [0,1,0,1,0,0|2,0,0]=4 5298 B13R1.17 CCOCC(=O)N1CCC(CC1)C a1a9e7ce38dd34681e4214db47a62056 [0,1,0,1,0,0|1,0,0]=3 5299 B13R1.17 CCOCC(=O)N1CCC(CC1)Cl a9007a12ed551ddcf1bb052a654c73f2 [0,1,0,1,0,0|2,0,0]=4 5300 B13R1.17 CCOCC(=O)N1CCC(CC1)F a99ee256b72ab3e0260059e36e7ef90a [0,1,0,1,0,0|2,0,0]=4 5301 B13R1.17 CCOCC(=O)N1CCC(CC1)I b818c58b2a04cd882254ae6e0fae2635 [0,1,0,1,0,0|2,0,0]=4 5302 B13R1.17 CCOCC(=O)N1CCC(CC1)O 5374540b2ec0badd577864b5d99a973a [0,1,0,1,0,0|2,0,0]=4 5303 B13R1.17 CCOCC(=O)N1CCN(CC1)C 5b52aeb2c6f459845a904c825f1a916b [0,1,0,1,0,0|2,0,0]=4 5304 B13R1.17 CCOCN(C)C1CCC(CC1)C 3446a834755bcabefe64fb766b0fc193 [0,1,0,1,0,0|2,0,0]=4 5305 B13R1.17 CCOCN(C)[C@H]1CC[C@@H](CC1)C cf266037bdfaa8f080d1f4efc76d35b7 [0,1,0,1,0,0|2,0,0]=4 5306 B13R1.17 CCSCC(=O)N1CCC(CC1)C f908d77818af684e1936537df9c89732 [0,1,0,1,0,0|1,1,0]=4 5307 B13R1.17 COCCC(=O)N1CCC(CC1)C 636b91343e7c707bb91c6eb7b94cbcc9 [0,1,0,1,0,0|2,0,0]=4 5308 B13R1.17 CSCCC(=O)N1CCC(CC1)C b4e977c9e3054e02d70923ef7d2089d3 [0,1,0,1,0,0|2,0,0]=4 5309 B13R1.75 CCCCN1CCN(CC1=O)CC a4aebdf31d38f1dae45a79dc13efac93 [0,1,0,1,0,0|2,0,0]=4 5310 B13R1.579 CCCCC1CCCN1COCC 1fd69392e4577ff262161b1e681e4cb1 [0,1,0,1,0,0|2,0,0]=4 5311 B13R1.674 CC/C=C/C(=O)N1CCCCC1C a9286dabe12becedc7d0f2c65ddcc5dd [0,1,0,1,0,0|2,0,0]=4 5312 B13R1.674 CC/C=C/C(=O)N1CCCC[C@@H]1C 1163520cb34723cbd6460b358fd00ef5 [0,1,0,1,0,0|2,0,0]=4 5313 B13R1.674 CC/C=C/C(=O)N1CCCC[C@H]1C 2fed87d8bc6aa4315c6d8c8f7cad3a79 [0,1,0,1,0,0|2,0,0]=4 5314 B13R1.674 CC/C=C\C(=O)N1CCCCC1C 7e762c9957179d072a3e76fae5432c10 [0,1,0,1,0,0|2,0,0]=4 5315 B13R1.674 CC/C=C\C(=O)N1CCCC[C@@H]1C 23b5adb47981c9acd403b97fc95bc1b8 [0,1,0,1,0,0|2,0,0]=4 5316 B13R1.674 CC/C=C\C(=O)N1CCCC[C@H]1C a315812dcfe9490951f562b27aa8f6bb [0,1,0,1,0,0|2,0,0]=4 5317 B13R1.674 CC1CCCCN1C(=O)CCCF 16a06211cc0e9735899932ba9123737c [0,1,0,1,0,0|2,0,0]=4 5318 B13R1.674 CC1CCCCN1C(=O)CCCS 80fb293db9e37f9f6321ceb464859813 [0,1,0,1,0,0|2,0,0]=4 5319 B13R1.674 CC1CCCCN1C(=O)NCCF 4eaccccef36a07bbc412ec444c893734 [0,1,0,1,0,0|2,0,0]=4 5320 B13R1.674 CC1CCCCN1C(=O)NCCN a817eaed67bb8cf14e37d9967af5fb8b [0,1,0,1,0,0|2,0,0]=4 5321 B13R1.674 CC1CCCCN1C(=O)NCCO c6dbce04ccae4b325bfb7be1489c00a1 [0,1,0,1,0,0|2,0,0]=4 5322 B13R1.674 CC1CCCCN1C(=O)NCCS ab2249b64226c51b5b8faf1710d67e8e [0,1,0,1,0,0|2,0,0]=4 5323 B13R1.674 CCC#CC(=O)N1CCCCC1C 923d7e4f791a5ff1bd5171306d2c32ff [0,1,0,1,0,0|2,0,0]=4 5324 B13R1.674 CCC#CC(=O)N1CCCC[C@@H]1C a8bdcf2ff3f9ac7666fc558deb83a46a [0,1,0,1,0,0|2,0,0]=4 5325 B13R1.674 CCC#CC(=O)N1CCCC[C@H]1C 12065f4b22a16e4b79a7b10b3969582b [0,1,0,1,0,0|2,0,0]=4 5326 B13R1.674 CCC=CC(=O)N1CCCCC1C 824d1d9af2882ad21af5a093187c9ad5 [0,1,0,1,0,0|2,0,0]=4 5327 B13R1.674 CCC=CC(=O)N1CCCC[C@@H]1C 738e761e62339a6035c9d7188916d03d [0,1,0,1,0,0|2,0,0]=4 5328 B13R1.674 CCC=CC(=O)N1CCCC[C@H]1C 1d4b0a6aa1cce76e3826a1dc62d999a2 [0,1,0,1,0,0|2,0,0]=4 5329 B13R1.674 CCCCC(=O)N1CCCCC1C a325176eebb256885907840b75a8659d [0,1,0,1,0,0|2,0,0]=4 5330 B13R1.674 CCCCC(=O)N1CCCC[C@@H]1C 38d23c08f4304c33203524b1b610cfc7 [0,1,0,1,0,0|2,0,0]=4 5331 B13R1.674 CCCCC(=O)N1CCCC[C@H]1C ad3efbe83b544196a4329fd247369986 [0,1,0,1,0,0|2,0,0]=4 5332 B13R1.674 CCCNC(=O)C1CCCCN1C 8fc8cd291155bcb086a202a8c6a1d550 [0,1,0,1,0,0|2,0,0]=4 5333 B13R1.674 CCCNC(=O)N1CCCCC1C bb063613d01035053c61c3086dd5d013 [0,1,0,1,0,0|2,0,0]=4 5334 B13R1.674 CCCNC(=O)N1CCCC[C@@H]1C 66913cdece8216ee8f804a3dad5bf324 [0,1,0,1,0,0|2,0,0]=4 5335 B13R1.674 CCCNC(=O)N1CCCC[C@H]1C 2eb106c40f25fd915bea89a51e23330d [0,1,0,1,0,0|2,0,0]=4 5336 B13R1.674 CCCNC(=O)[C@@H]1CCCCN1C 403686423fddd3ff3662b0566fe91242 [0,1,0,1,0,0|2,0,0]=4 5337 B13R1.674 CCCNC(=O)[C@H]1CCCCN1C bb51983a6ee9a244e5df8affff13d637 [0,1,0,1,0,0|2,0,0]=4 5338 B13R1.674 CCOCC(=O)N1CCCCC1C 63db18efb523cd43f3fd6e6b00cdad87 [0,1,0,1,0,0|1,0,0]=3 5339 B13R1.674 CCOCC(=O)N1CCCC[C@@H]1C 09b7ade9bcb36425da60cd7cd4458f24 [0,1,0,1,0,0|1,0,0]=3 5340 B13R1.674 CCOCC(=O)N1CCCC[C@H]1C db6facb3cf84f4863517aff4e2566173 [0,1,0,1,0,0|1,0,0]=3 5341 B13R1.674 CCOCC(=O)N1CCOCC1C 1ef7eb5d0ffd7ad0107e7521c1897b39 [0,1,0,1,0,0|2,0,0]=4 5342 B13R1.674 CCOCC(=O)N1CCOC[C@@H]1C b48c4c4bb0d1457dfaa3aebfaaa24526 [0,1,0,1,0,0|2,0,0]=4 5343 B13R1.674 CCOCC(=O)N1CCOC[C@H]1C f66cbb2507bf24f031122fca4c32a89f [0,1,0,1,0,0|2,0,0]=4 5344 B13R1.674 CCSCC(=O)N1CCCCC1C f9a4255091a7286daddf8f8265a296f2 [0,1,0,1,0,0|1,1,0]=4 5345 B13R1.674 CCSCC(=O)N1CCCC[C@@H]1C 68988a55a146bca3aacb5283e9d9ae26 [0,1,0,1,0,0|1,1,0]=4 5346 B13R1.674 CCSCC(=O)N1CCCC[C@H]1C b9a7e6c8eb156ca54a6539eed5fd1ea9 [0,1,0,1,0,0|1,1,0]=4 5347 B13R1.674 CN1CCCCC1C(=O)NCCBr e72b6cbbec77493ac4b79bf3b80a655f [0,1,0,1,0,0|2,0,0]=4 5348 B13R1.674 CN1CCCCC1C(=O)NCCF fd6d5583c14f07445e3f011a9f199f60 [0,1,0,1,0,0|2,0,0]=4 5349 B13R1.674 CN1CCCCC1C(=O)NCCI e88a475314b4b1241e0cdbc7bf90f738 [0,1,0,1,0,0|2,0,0]=4 5350 B13R1.674 CN1CCCCC1C(=O)NCCO 14f45af5ee6d2720222493c78af6e5ac [0,1,0,1,0,0|2,0,0]=4 5351 B13R1.674 CN1CCCCC1C(=O)NCCS 222ce62ac4f654467d66b907b574d642 [0,1,0,1,0,0|2,0,0]=4 5352 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCBr 4eb7c041eb5173e00befe4e4a2a621d0 [0,1,0,1,0,0|2,0,0]=4 5353 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCF 7e592c9df586223abc4cc1057d1aed81 [0,1,0,1,0,0|2,0,0]=4 5354 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCI a1a18a627b33fd78e2061fcf1f162a80 [0,1,0,1,0,0|2,0,0]=4 5355 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCO 0fa0f69ad8083c5e5ee5219d06e6be81 [0,1,0,1,0,0|2,0,0]=4 5356 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCS 5942925f98ac387ce9be4003fd9fbc58 [0,1,0,1,0,0|2,0,0]=4 5357 B13R1.674 CN1CCCC[C@H]1C(=O)NCCBr 7a5bcb7b49379106f26b0e3610af4ac7 [0,1,0,1,0,0|2,0,0]=4 5358 B13R1.674 CN1CCCC[C@H]1C(=O)NCCF 284f220892e9737ec6dfec491a85df96 [0,1,0,1,0,0|2,0,0]=4 5359 B13R1.674 CN1CCCC[C@H]1C(=O)NCCI b0c8bb60655ac5afa3305b39feef4b9a [0,1,0,1,0,0|2,0,0]=4 5360 B13R1.674 CN1CCCC[C@H]1C(=O)NCCO c139a336063af37649e191deee94ee9a [0,1,0,1,0,0|2,0,0]=4 5361 B13R1.674 CN1CCCC[C@H]1C(=O)NCCS a066ad68297345022b727bd63c6b555e [0,1,0,1,0,0|2,0,0]=4 5362 B13R1.674 COCCC(=O)N1CCCCC1C 4e21b91d6718e2386c4cc656e26ac34c [0,1,0,1,0,0|2,0,0]=4 5363 B13R1.674 COCCC(=O)N1CCCC[C@@H]1C 23a9ba29a90bc233703c2ecb5518392e [0,1,0,1,0,0|2,0,0]=4 5364 B13R1.674 COCCC(=O)N1CCCC[C@H]1C d8966c368125e382a1401b52ffd04498 [0,1,0,1,0,0|2,0,0]=4 5365 B13R1.674 CSCCC(=O)N1CCCCC1C 3fe72c5fe3e28a84b6d54b44d74536b2 [0,1,0,1,0,0|2,0,0]=4 5366 B13R1.674 CSCCC(=O)N1CCCC[C@@H]1C e68f35141ad7c421b18be955c7260083 [0,1,0,1,0,0|2,0,0]=4 5367 B13R1.674 CSCCC(=O)N1CCCC[C@H]1C 29633eb3a772f795213721d262a48669 [0,1,0,1,0,0|2,0,0]=4 5368 B13R1.674 C[C@@H]1CCCCN1C(=O)CCCF daeaf3deafd8888901c10a33bb07fbc6 [0,1,0,1,0,0|2,0,0]=4 5369 B13R1.674 C[C@@H]1CCCCN1C(=O)CCCS d4639de5f937dd8d583c2035faf6ce74 [0,1,0,1,0,0|2,0,0]=4 5370 B13R1.674 C[C@@H]1CCCCN1C(=O)NCCF c563df967e645dfb5927b5d37893fabf [0,1,0,1,0,0|2,0,0]=4 5371 B13R1.674 C[C@@H]1CCCCN1C(=O)NCCN e733d80bccb94f944e3b98a47ca15285 [0,1,0,1,0,0|2,0,0]=4 5372 B13R1.674 C[C@@H]1CCCCN1C(=O)NCCO 1b135fe000ff43028671436367362933 [0,1,0,1,0,0|2,0,0]=4 5373 B13R1.674 C[C@@H]1CCCCN1C(=O)NCCS b36d5a7174cfc389a22d6d01c156c51b [0,1,0,1,0,0|2,0,0]=4 5374 B13R1.674 C[C@H]1CCCCN1C(=O)CCCF 2aa527e75b689ea4b06ba4d72fe6d351 [0,1,0,1,0,0|2,0,0]=4 5375 B13R1.674 C[C@H]1CCCCN1C(=O)CCCS fc29fc2611dbc684df97c6133afc7dbf [0,1,0,1,0,0|2,0,0]=4 5376 B13R1.674 C[C@H]1CCCCN1C(=O)NCCF f8dd055348abce46c8d11e4e18da9926 [0,1,0,1,0,0|2,0,0]=4 5377 B13R1.674 C[C@H]1CCCCN1C(=O)NCCN c5f657a6d1d4f262b65e8d64d25e5d50 [0,1,0,1,0,0|2,0,0]=4 5378 B13R1.674 C[C@H]1CCCCN1C(=O)NCCO 38f7efb5da1aaba3c981e95e656122cd [0,1,0,1,0,0|2,0,0]=4 5379 B13R1.674 C[C@H]1CCCCN1C(=O)NCCS 13d178af0d851a0a979cb1a910d4843e [0,1,0,1,0,0|2,0,0]=4 5380 B13R1.679 CC/C=C/C(=O)N1CCC(C1)CC b7c4d8e825e11a7ea4cc6bcee4ecc94d [0,1,0,1,0,0|2,0,0]=4 5381 B13R1.679 CC/C=C\C(=O)N1CCC(C1)CC 31fb6550a4fe591854d840d84a912c18 [0,1,0,1,0,0|2,0,0]=4 5382 B13R1.679 CCC#CC(=O)N1CCC(C1)CC d17b82cb2bf3a1bcce1c0157f7279822 [0,1,0,1,0,0|2,0,0]=4 5383 B13R1.679 CCC1CCN(C1)C(=O)CCCF e46d601df55b4c643d214f4612547f88 [0,1,0,1,0,0|2,0,0]=4 5384 B13R1.679 CCC1CCN(C1)C(=O)CCCS dcc808c86b4a7d5d96976386ad313606 [0,1,0,1,0,0|2,0,0]=4 5385 B13R1.679 CCC1CCN(C1)C(=O)CCOC 413a7d4e7ad6b87a168da2f0b2d73df7 [0,1,0,1,0,0|2,0,0]=4 5386 B13R1.679 CCC1CCN(C1)C(=O)CCSC 5865149e9e194d313dcd31db4252097f [0,1,0,1,0,0|2,0,0]=4 5387 B13R1.679 CCC1CCN(C1)C(=O)NCCF fa31775f91551aca373b298ab601ad8d [0,1,0,1,0,0|2,0,0]=4 5388 B13R1.679 CCC1CCN(C1)C(=O)NCCN e8676aeac91dd9923f9c7e68d84bbcba [0,1,0,1,0,0|2,0,0]=4 5389 B13R1.679 CCC1CCN(C1)C(=O)NCCO 557ad290c666f2e5f49299c51733d612 [0,1,0,1,0,0|2,0,0]=4 5390 B13R1.679 CCC1CCN(C1)C(=O)NCCS 575b99ad2bf87359b8e6fc216b4910a1 [0,1,0,1,0,0|2,0,0]=4 5391 B13R1.679 CCC=CC(=O)N1CCC(C1)CC c4ec0aec0e4a962f5b8d39005f5f7e83 [0,1,0,1,0,0|2,0,0]=4 5392 B13R1.679 CCCCC(=O)N1CCC(C1)CC 183400b2aa00e63667d0aeaca36df54e [0,1,0,1,0,0|2,0,0]=4 5393 B13R1.679 CCCNC(=O)N1CCC(C1)CC 13437fb1ddd924397ddd1633d6a7085d [0,1,0,1,0,0|2,0,0]=4 5394 B13R1.679 CCOCC(=O)N1CCC(C1)CC eb586a0c7cb2a1674ae4f03dad3fe00c [0,1,0,1,0,0|1,0,0]=3 5395 B13R1.679 CCOCC(=O)N1CCC(C1)CO 2aa1ea1cce45241f2fe27476656534fb [0,1,0,1,0,0|2,0,0]=4 5396 B13R1.679 CCOCC(=O)N1CCC(C1)OC 7d7e26123656ff3f6d0bfda19fad2cc5 [0,1,0,1,0,0|2,0,0]=4 5397 B13R1.679 CCOCC(=O)N1CC[C@@H](C1)CO 3cb59a48527af821e52e8db537ac48d2 [0,1,0,1,0,0|2,0,0]=4 5398 B13R1.679 CCOCC(=O)N1CC[C@@H](C1)OC abf3ee497fa5d4d21233c17607fcd2fb [0,1,0,1,0,0|2,0,0]=4 5399 B13R1.679 CCOCC(=O)N1CC[C@H](C1)CO d3f7190be822d1667a2aa44c15d31fcc [0,1,0,1,0,0|2,0,0]=4 5400 B13R1.679 CCOCC(=O)N1CC[C@H](C1)OC f8c989a10c7c4774eca9a6e4f6bb44f5 [0,1,0,1,0,0|2,0,0]=4 5401 B13R1.679 CCSCC(=O)N1CCC(C1)CC 2b5665c3cb6cae97be3c7f805e42463c [0,1,0,1,0,0|1,1,0]=4 5402 B13R1.682 CCCN1CC[C@H]1C(=O)NCCBr 47008ba8e2273dd5903a3c9e49d36ea9 [0,1,0,1,0,0|2,0,0]=4 5403 B13R1.682 CCCN1CC[C@H]1C(=O)NCCF 4b4e3bc79340abeb19afe1210d240781 [0,1,0,1,0,0|2,0,0]=4 5404 B13R1.682 CCCN1CC[C@H]1C(=O)NCCI cefe60220e60cb1f171667a0c9a03681 [0,1,0,1,0,0|2,0,0]=4 5405 B13R1.682 CCCN1CC[C@H]1C(=O)NCCO e349c894c9782a1cdf41f3566b4d5f97 [0,1,0,1,0,0|2,0,0]=4 5406 B13R1.682 CCCN1CC[C@H]1C(=O)NCCS 37255c1368930e39001b0f5a2d36c0eb [0,1,0,1,0,0|2,0,0]=4 5407 B13R1.682 CCCNC(=O)[C@@H]1CCN1CCC a0d387b09be586ef65f8f0ad0851a584 [0,1,0,1,0,0|2,0,0]=4 5408 B13R1.682 CCOCC(=O)N1CCC1CCO 8b92aa803d7e0a15af18b35b116ecad8 [0,1,0,1,0,0|2,0,0]=4 5409 B13R1.682 CCOCC(=O)N1CCC1COC 7ef7425171c17d1470916e37aed98bd4 [0,1,0,1,0,0|2,0,0]=4 5410 B13R1.682 CCOCC(=O)N1CC[C@@H]1COC 1b1d275801e0eeedc0d800c05edfd9e7 [0,1,0,1,0,0|2,0,0]=4 5411 B13R1.682 CCOCC(=O)N1CC[C@H]1COC b7d0f70ad91f21ffe9961205c4744935 [0,1,0,1,0,0|2,0,0]=4 5412 B13R1.2488 CC/C=C/C(=O)N1CCCCCC1 b71289f386caba564984a576188cb6cf [0,1,0,1,0,0|2,0,0]=4 5413 B13R1.2488 CC/C=C\C(=O)N1CCCCCC1 96f67e74bde8c4555176521c42ba707b [0,1,0,1,0,0|2,0,0]=4 5414 B13R1.2488 CCC#CC(=O)N1CCCCCC1 1bc0ab05f65b83dafa1ae6c5787b49ff [0,1,0,1,0,0|2,0,0]=4 5415 B13R1.2488 CCC=CC(=O)N1CCCCCC1 4fb077393a4986dbf0c62f222cd773ba [0,1,0,1,0,0|2,0,0]=4 5416 B13R1.2488 CCCCC(=O)N1CCCCCC1 b06f73644271bca508e353a95bb57c19 [0,1,0,1,0,0|2,0,0]=4 5417 B13R1.2488 CCCNC(=O)N1CCCCCC1 b240e9ee12220cc2ffed5fe5cafae2b6 [0,1,0,1,0,0|2,0,0]=4 5418 B13R1.2488 CCOCC(=O)N1CCCCCC1 c18765889ceff54ab28029a26711916d [0,1,0,1,0,0|1,0,0]=3 5419 B13R1.2488 CCOCC(=O)N1CCCOCC1 bcac01fde6760553e7f69241fe45cafd [0,1,0,1,0,0|2,0,0]=4 5420 B13R1.2488 CCOCN(C)C1CCCCCC1 1e0d253be08ab684105216ce77739749 [0,1,0,1,0,0|2,0,0]=4 5421 B13R1.2488 CCSCC(=O)N1CCCCCC1 2a599e8485c73ac0eeb3bef4d69a4714 [0,1,0,1,0,0|1,1,0]=4 5422 B13R1.2488 COCCC(=O)N1CCCCCC1 543027ef760d9da367790186064df478 [0,1,0,1,0,0|2,0,0]=4 5423 B13R1.2488 CSCCC(=O)N1CCCCCC1 64c3fe2a06ecadad69fe55ff2037ab98 [0,1,0,1,0,0|2,0,0]=4 5424 B13R1.2488 NCCNC(=O)N1CCCCCC1 0514a8b49a12498a61c04629045111ee [0,1,0,1,0,0|2,0,0]=4 5425 B13R1.2488 O=C(CCCF)N1CCCCCC1 734a131ec6fc037462236d0e0032cdc0 [0,1,0,1,0,0|2,0,0]=4 5426 B13R1.2488 O=C(CCCS)N1CCCCCC1 172fdb533b9489596f4f2f088bd4d7ef [0,1,0,1,0,0|2,0,0]=4 5427 B13R1.2488 O=C(NCCF)N1CCCCCC1 4b7ee46bdd47acde44651941f00beb41 [0,1,0,1,0,0|2,0,0]=4 5428 B13R1.2488 O=C(NCCO)N1CCCCCC1 c8ba0def8b3caef6acc5ef774b522eb7 [0,1,0,1,0,0|2,0,0]=4 5429 B13R1.2488 O=C(NCCS)N1CCCCCC1 9be1feda66f7e062ff350e9f9cb4c6f7 [0,1,0,1,0,0|2,0,0]=4 5430 B13R1.2500 CC/C=C/C(=O)N(CC)C1CCC1 3151242d7f17e4616be75f1914a60ba2 [0,1,0,1,0,0|2,0,0]=4 5431 B13R1.2500 CC/C=C\C(=O)N(CC)C1CCC1 4adace48a263dac671bfc50c1dfb0580 [0,1,0,1,0,0|2,0,0]=4 5432 B13R1.2500 CCC#CC(=O)N(CC)C1CCC1 95139760912342eedfff536d1d01321f [0,1,0,1,0,0|2,0,0]=4 5433 B13R1.2500 CCC=CC(=O)N(CC)C1CCC1 4e9c45c01a44ebf88ad9befdccb4d642 [0,1,0,1,0,0|2,0,0]=4 5434 B13R1.2500 CCCCC(=O)N(CC)C1CCC1 eafb30d2556061c1e868725b0ba9cb29 [0,1,0,1,0,0|2,0,0]=4 5435 B13R1.2500 CCCNC(=O)C(CC)N1CCC1 9071d319ce4f7e19eed3d287a3b1fec6 [0,1,0,1,0,0|2,0,0]=4 5436 B13R1.2500 CCCNC(=O)N(CC)C1CCC1 781f124f0bcb41ae84c1e5c82c1925b5 [0,1,0,1,0,0|2,0,0]=4 5437 B13R1.2500 CCN(C(=O)CCCF)C1CCC1 1c3c08e74bf3ead47c9ade72324870d5 [0,1,0,1,0,0|2,0,0]=4 5438 B13R1.2500 CCN(C(=O)CCCS)C1CCC1 632ed5870057e70a6ff9d29037568c1d [0,1,0,1,0,0|2,0,0]=4 5439 B13R1.2500 CCN(C(=O)CCOC)C1CCC1 282a4b16b3fb688e7026ccd25d143ac2 [0,1,0,1,0,0|2,0,0]=4 5440 B13R1.2500 CCN(C(=O)CCSC)C1CCC1 848b8b04e18dc1791e8ba49da0fdc00d [0,1,0,1,0,0|2,0,0]=4 5441 B13R1.2500 CCN(C(=O)NCCF)C1CCC1 fd3f8bb181dc2b51dc9da946f06127e6 [0,1,0,1,0,0|2,0,0]=4 5442 B13R1.2500 CCN(C(=O)NCCN)C1CCC1 6a507b1273115ba5f9a54d77f1129646 [0,1,0,1,0,0|2,0,0]=4 5443 B13R1.2500 CCN(C(=O)NCCO)C1CCC1 083652bfbef9282b4cb25b4e0e74be2a [0,1,0,1,0,0|2,0,0]=4 5444 B13R1.2500 CCN(C(=O)NCCS)C1CCC1 d1e08e4f27cf0b0ba320124612f85d0d [0,1,0,1,0,0|2,0,0]=4 5445 B13R1.2500 CCOCC(=O)N(CC)C1CCC1 fef6236a47e44bc3fc3abf60be29f690 [0,1,0,1,0,0|1,0,0]=3 5446 B13R1.2500 CCOCC(=O)N(CC)C1COC1 f120dbdcb152b74d3cc0b16afe0e96fb [0,1,0,1,0,0|2,0,0]=4 5447 B13R1.2500 CCOCC(=O)N(CC)C1CSC1 e1f14a722b2e331b8b5256861c30a89a [0,1,0,1,0,0|2,0,0]=4 5448 B13R1.2500 CCSCC(=O)N(CC)C1CCC1 26d6290e95f510bd1725cd90a6524047 [0,1,0,1,0,0|1,1,0]=4 5449 B13R1.2502 CC/C=C/C(=O)N(CC)CC1CC1 f9063df947ee8a677668718c2f75f565 [0,1,0,1,0,0|2,0,0]=4 5450 B13R1.2502 CC/C=C\C(=O)N(CC)CC1CC1 501715778076d2a2c904e76db45f195d [0,1,0,1,0,0|2,0,0]=4 5451 B13R1.2502 CCC#CC(=O)N(CC)CC1CC1 1585dcbe3ef271e9d6306739f6b27c99 [0,1,0,1,0,0|2,0,0]=4 5452 B13R1.2502 CCC=CC(=O)N(CC)CC1CC1 59c4930886104aad03d3ca588f4816e1 [0,1,0,1,0,0|2,0,0]=4 5453 B13R1.2502 CCCCC(=O)N(CC)CC1CC1 67403b3fbc82e5233f70eb49fb80cf12 [0,1,0,1,0,0|2,0,0]=4 5454 B13R1.2502 CCCNC(=O)C(CC)NC1CC1 cbd9ca9295ea2baebf1ff24cc3444fcf [0,1,0,1,0,0|2,0,0]=4 5455 B13R1.2502 CCCNC(=O)C(CC)OC1CC1 72a6bf39e3c295406b0dd4fc40cbf24f [0,1,0,1,0,0|2,0,0]=4 5456 B13R1.2502 CCCNC(=O)N(CC)CC1CC1 9ee6756d23021c7c203a9d5e30053c3f [0,1,0,1,0,0|2,0,0]=4 5457 B13R1.2502 CCCNC(=O)[C@H](CC)NC1CC1 de4153d72c7c5498d16d593841a316a2 [0,1,0,1,0,0|2,0,0]=4 5458 B13R1.2502 CCN(CC1CC1)C(=O)CCCF 022a70e57351ee18a61f2b29d362123e [0,1,0,1,0,0|2,0,0]=4 5459 B13R1.2502 CCN(CC1CC1)C(=O)CCCS 675d628977212041d5bf4fb438b14fba [0,1,0,1,0,0|2,0,0]=4 5460 B13R1.2502 CCN(CC1CC1)C(=O)CCOC 23195bff7b5400a50e53ec844f12eda7 [0,1,0,1,0,0|2,0,0]=4 5461 B13R1.2502 CCN(CC1CC1)C(=O)CCSC 33e98337bf6bf85c71b9b59e6e423238 [0,1,0,1,0,0|2,0,0]=4 5462 B13R1.2502 CCN(CC1CC1)C(=O)NCCF cce593c21ebea404b4750311ccdc2f35 [0,1,0,1,0,0|2,0,0]=4 5463 B13R1.2502 CCN(CC1CC1)C(=O)NCCN ae345596fb9cae36cc14f99afad45a48 [0,1,0,1,0,0|2,0,0]=4 5464 B13R1.2502 CCN(CC1CC1)C(=O)NCCO 75b735c4e38ddb1afee7348ac2a3c34d [0,1,0,1,0,0|2,0,0]=4 5465 B13R1.2502 CCN(CC1CC1)C(=O)NCCS 493fa1c1370d2b35bda0c923a6004975 [0,1,0,1,0,0|2,0,0]=4 5466 B13R1.2502 CCOCC(=O)N(CC)CC1CC1 9409344101d76b1775aa4ceb99823314 [0,1,0,1,0,0|1,0,0]=3 5467 B13R1.2502 CCSCC(=O)N(CC)CC1CC1 6bba8567c0a6a2da53a8e0df44761f07 [0,1,0,1,0,0|1,1,0]=4 5468 B13R1.2505 CCOCC(=O)N1CCC(C1C)O a75cd217441dd9ce2a2f894f52aad617 [0,1,0,1,0,0|2,0,0]=4 5469 B13R1.2505 CCOCC(=O)N1CC[C@@H]([C@@H]1C)O e20b264d95a26d10a01efd96aa044493 [0,1,0,1,0,0|2,0,0]=4 5470 B13R1.2505 CCOCC(=O)N1CC[C@H]([C@H]1C)O add8621afdcb127d7121bf38b5b7bb1a [0,1,0,1,0,0|2,0,0]=4 5471 B13R1.2542 CCCNC1(CC1)C(=O)OCCC 256d6642818be51718ee58745ba63035 [0,1,0,1,0,0|1,0,0]=3 5472 B13R1.2542 CCCOC(=O)C1(CC1)NCCF ebd8db0667b2c5c9789f6d45ffb4c018 [0,1,0,1,0,0|2,0,0]=4 5473 B13R1.2542 CCCOC(=O)C1(CC1)NCCO affada763d00f018142ac9bd10055bd7 [0,1,0,1,0,0|2,0,0]=4 5474 B13R1.2542 CCCOC(=O)C1(CC1)NCCS 846f7372666628d7c0ef6f27090bc686 [0,1,0,1,0,0|2,0,0]=4 5475 B13R1.2542 CCCOC(=O)C1(CC1)NCSC ac4245ca9859201d140ccc199251790a [0,1,0,1,0,0|2,0,0]=4 5476 B13R1.12 CCCC(=O)N1CCCC(C1C)O 363a41e404c3377fd384e854c84f790f [0,1,0,1,0,0|2,0,0]=4 5477 B13R1.12 CCCC(=O)N1CCC[C@@H]([C@H]1C)O 48f4de1d75dbdd78af530765a9a7f76b [0,1,0,1,0,0|2,0,0]=4 5478 B13R1.12 CCCC(=O)N1CCC[C@H]([C@@H]1C)O 7fc86726758c10dcdcbee3bae58e6e97 [0,1,0,1,0,0|2,0,0]=4 5479 B13R1.34 CCCCNC1CCCCCC1=O 2145299933c12c096ab66d9232e7568b [0,1,0,1,0,0|1,0,0]=3 5480 B13R1.34 CCCCNC1CCCCNC1=O 2b6a3345cdfc37104284621bc26ccbb2 [0,1,0,1,0,0|1,0,0]=3 5481 B13R1.34 CCCCN[C@@H]1CCCCNC1=O 13eb164b6dc2eadba6b397124e084826 [0,1,0,1,0,0|1,0,0]=3 5482 B13R1.34 CCCCN[C@H]1CCCCNC1=O eee58d5da4c4c5c3840c6571132bee52 [0,1,0,1,0,0|1,0,0]=3 5483 B13R1.34 CCCCOC1CCCCCC1=O af654d5db6fc498cb136338a6ce8c932 [0,1,0,1,0,0|1,0,0]=3 5484 B13R1.34 CCCCOC1CCCCNC1=O b296b2336cdbb14ec67a2ce6154888a9 [0,1,0,1,0,0|1,0,0]=3 5485 B13R1.34 CCCOCN1CCCCCC1=O 5c1c90b95901ccb1256b56e9b96e9883 [0,1,0,1,0,0|2,0,0]=4 5486 B13R1.34 CCOCNC1CCCCNC1=O ea2cfbe0e85ff722de41b7799ce50de1 [0,1,0,1,0,0|2,0,0]=4 5487 B13R1.34 CCOCN[C@@H]1CCCCNC1=O d3d39c0c5d5b54012ab5c93649b48890 [0,1,0,1,0,0|2,0,0]=4 5488 B13R1.34 CCOCN[C@H]1CCCCNC1=O 237f4783f194fd14833a380c8bd7781c [0,1,0,1,0,0|2,0,0]=4 5489 B13R1.34 COCCNC1CCCCCC1=O add9174f505e24770717933821e7feca [0,1,0,1,0,0|2,0,0]=4 5490 B13R1.34 COCCNC1CCCCNC1=O ed16db4099f0af746bdc2d860b6690e8 [0,1,0,1,0,0|2,0,0]=4 5491 B13R1.34 COCCN[C@@H]1CCCCNC1=O 5cdb73b8a4916ce7f81b6bf66e1005ae [0,1,0,1,0,0|2,0,0]=4 5492 B13R1.34 COCCN[C@H]1CCCCNC1=O 1c980d1d525f2319e8c14bf9a157fac4 [0,1,0,1,0,0|2,0,0]=4 5493 B13R1.34 COCCOC1CCCCCC1=O 8b3ba7c10b3e10055f8b4cca3f70ce18 [0,1,0,1,0,0|2,0,0]=4 5494 B13R1.34 COCCOC1CCCCNC1=O 15f8bfdc2de1a204c81adb548fe4cdbf [0,1,0,1,0,0|2,0,0]=4 5495 B13R1.34 CSCCNC1CCCCCC1=O 854a7fee9dc9722020c10362504bfafe [0,1,0,1,0,0|2,0,0]=4 5496 B13R1.34 CSCCNC1CCCCNC1=O 36c480d2d21393d313cabd02d413f115 [0,1,0,1,0,0|2,0,0]=4 5497 B13R1.34 CSCCN[C@@H]1CCCCNC1=O 6f966f62e0451804d24d3ae832414cf7 [0,1,0,1,0,0|2,0,0]=4 5498 B13R1.34 CSCCN[C@H]1CCCCNC1=O 09a8de1ce826bbb940bf860924d80767 [0,1,0,1,0,0|2,0,0]=4 5499 B13R1.34 CSCCOC1CCCCCC1=O 48ffc0b6a450100fa2ca9eb98ba713a2 [0,1,0,1,0,0|2,0,0]=4 5500 B13R1.34 CSCCOC1CCCCNC1=O 13a8384c088e6e8e2d8cb99a23f41852 [0,1,0,1,0,0|2,0,0]=4 5501 B13R1.34 O=C1CCCCCC1NCCCCl 655c9bd31cdcfc7fd33c34bb3c89721a [0,1,0,1,0,0|2,0,0]=4 5502 B13R1.34 O=C1CCCCCC1NCCCO ff0c2fc124b1204162cf85e3db9fc284 [0,1,0,1,0,0|2,0,0]=4 5503 B13R1.34 O=C1CCCCCC1OCCCF 033ea2c13cb527ff40ee15ec76ed312a [0,1,0,1,0,0|2,0,0]=4 5504 B13R1.34 O=C1CCCCCC1OCCCS 0c9340e86761819188b5eb5451eeb6e5 [0,1,0,1,0,0|2,0,0]=4 5505 B13R1.34 O=C1NCCCCC1NCCCCl 1edb1a0721483464f71e14c748d4a1e4 [0,1,0,1,0,0|2,0,0]=4 5506 B13R1.34 O=C1NCCCCC1NCCCF 5905d3256b352d80c9e42124d1b2ddb8 [0,1,0,1,0,0|2,0,0]=4 5507 B13R1.34 O=C1NCCCCC1NCCCO 57fec622e2cb1cdaeb65c311b3d7e534 [0,1,0,1,0,0|2,0,0]=4 5508 B13R1.34 O=C1NCCCCC1NCCCS 537931050b7fa99f08e93fc60c3f08fb [0,1,0,1,0,0|2,0,0]=4 5509 B13R1.34 O=C1NCCCCC1OCCCF 084c51d7a5575ee07c43ab0ed0ab5cb0 [0,1,0,1,0,0|2,0,0]=4 5510 B13R1.34 O=C1NCCCCC1OCCCS c5363fe8388d80b25a976878c307f6f4 [0,1,0,1,0,0|2,0,0]=4 5511 B13R1.34 O=C1NCCCC[C@@H]1NCCCF b7549bec2ede8a06b87c791d9be8c4d6 [0,1,0,1,0,0|2,0,0]=4 5512 B13R1.34 O=C1NCCCC[C@@H]1NCCCO 4593a0e7da54ccb4e7cbaa6a8c7b6752 [0,1,0,1,0,0|2,0,0]=4 5513 B13R1.34 O=C1NCCCC[C@@H]1NCCCS 6f7e707dcb924de84adfe499a7b8d8e6 [0,1,0,1,0,0|2,0,0]=4 5514 B13R1.34 O=C1NCCCC[C@H]1NCCCF 1a175cd610d13d9e6682fc6837b0e4a2 [0,1,0,1,0,0|2,0,0]=4 5515 B13R1.34 O=C1NCCCC[C@H]1NCCCO 42d84f14c1ca8fa42f6bd0c5d51cb6e2 [0,1,0,1,0,0|2,0,0]=4 5516 B13R1.34 O=C1NCCCC[C@H]1NCCCS 95942e410f8e5926a5785182710c6aaa [0,1,0,1,0,0|2,0,0]=4 5517 B13R1.361 C#CCN1CCC(C1)C(=O)OCC 494909e9f8e1bd88566bdafc1424dbc6 [0,1,0,1,0,0|0,0,2]=4 5518 B13R1.361 C#CCN1CC[C@@H](C1)C(=O)OCC 9097ef047866f721e1e368caf31f9e4f [0,1,0,1,0,0|0,0,2]=4 5519 B13R1.361 C=CCN1CCC(C1)C(=O)OCC 4b8daa78249b875cfe7354d446f6eef6 [0,1,0,1,0,0|0,0,2]=4 5520 B13R1.361 C=CCN1CC[C@@H](C1)C(=O)OCC 2a87a064fa1005d0d096a171334aaf35 [0,1,0,1,0,0|0,0,2]=4 5521 B13R1.361 CCCC(=O)N1CCC(C1)CCC 00df26384b8f2cf02a63d202c0b332ed [0,1,0,1,0,0|2,0,0]=4 5522 B13R1.361 CCCC(=O)N1CCC(C1)CCO a95faf0abeb8174e177ebee9253e678e [0,1,0,1,0,0|2,0,0]=4 5523 B13R1.361 CCCC(=O)N1CCC(C1)COC b06c23be58918f05c852a7a13d8b8c30 [0,1,0,1,0,0|2,0,0]=4 5524 B13R1.361 CCCC(=O)N1CC[C@@H](C1)COC 3c57c8e35cde494c1e4c4f226f637859 [0,1,0,1,0,0|2,0,0]=4 5525 B13R1.361 CCCC(=O)N1CC[C@@H](C1)OCC 4ab20818e7da17f01c35f719cc88a547 [0,1,0,1,0,0|2,0,0]=4 5526 B13R1.361 CCCC(=O)N1CC[C@H](C1)COC d0526550129b67eaeb108e7429ce2a24 [0,1,0,1,0,0|2,0,0]=4 5527 B13R1.361 CCCC(=O)N1CC[C@H](C1)OCC 5ace6cf3227bcb9cc5c362a18b20c9a2 [0,1,0,1,0,0|2,0,0]=4 5528 B13R1.361 CCCN1CCC(C1)C(=O)NCC 6875dcb98ae466137e7620ea7cac2c7f [0,1,0,1,0,0|1,0,0]=3 5529 B13R1.361 CCCN1CCC(C1)C(=O)OCC c321b37d62723188904cd509aef1d80e [0,1,0,1,0,0|0,0,0]=2 5530 B13R1.361 CCCN1CC[C@@H](C1)C(=O)OCC fa727ed4df1eb5929f7a2ae129b5f14e [0,1,0,1,0,0|0,0,0]=2 5531 B13R1.361 CCNC(=O)C1CCN(C1)CCF 4a67a9f8a710f0b290678120e6c49399 [0,1,0,1,0,0|2,0,0]=4 5532 B13R1.361 CCNC(=O)C1CCN(C1)CCO 397526d6d2cf4fa92ca5729f2ea5babb [0,1,0,1,0,0|2,0,0]=4 5533 B13R1.361 CCNC(=O)C1CCN(C1)CCS 689231193e2e8081d711fbf9d4f5f493 [0,1,0,1,0,0|2,0,0]=4 5534 B13R1.361 CCNC(=O)C1CCN(C1)COC 1e5ff21d31cf2e4bc56221ceb7912dab [0,1,0,1,0,0|2,0,0]=4 5535 B13R1.361 CCNC(=O)C1CCN(C1)CSC f66132af454a311376dbe4ce3ddd4dd4 [0,1,0,1,0,0|2,0,0]=4 5536 B13R1.361 CCNC1CCC(C1)C(=O)OCC 59c1085c581b61bd4bcea3877779fa94 [0,1,0,1,0,0|0,0,0]=2 5537 B13R1.361 CCOC(=O)C1CC(CO1)OCC 7016e15a022489df3801b417b278a878 [0,1,0,1,0,0|1,0,0]=3 5538 B13R1.361 CCOC(=O)C1CC(CO1)OCF 9d4498a1706ce953922e3d7c9caac265 [0,1,0,1,0,0|2,0,0]=4 5539 B13R1.361 CCOC(=O)C1CCC(C1)NC=O 9d02ca5a8d3de4cf82f572b785cf1d6f [0,1,0,1,0,0|1,0,1]=4 5540 B13R1.361 CCOC(=O)C1CCC(C1)NCF 6c9d445804e481e9f59ff90e0bc9af9e [0,1,0,1,0,0|1,0,0]=3 5541 B13R1.361 CCOC(=O)C1CCC(C1)NCO 8e70364683f2a4438b01e538422a6ed7 [0,1,0,1,0,0|1,0,0]=3 5542 B13R1.361 CCOC(=O)C1CCC(C1)OCC f0e9dfb5181b0adcef63bdf6896c6061 [0,1,0,1,0,0|0,0,0]=2 5543 B13R1.361 CCOC(=O)C1CCC(C1)OCF 2093fc180c3fab89c55e218266cd2595 [0,1,0,1,0,0|1,0,0]=3 5544 B13R1.361 CCOC(=O)C1CCN(C1)CC#N 0ad7d4b1ea3c0532544d32d765caeaaa [0,1,0,1,0,0|1,0,1]=4 5545 B13R1.361 CCOC(=O)C1CCN(C1)CC=O 691164873c6d6317dd34141e2411e90e [0,1,0,1,0,0|1,0,1]=4 5546 B13R1.361 CCOC(=O)C1CCN(C1)CCF 7e6ae8acca54b0625e5e6b4f9a0f1ea7 [0,1,0,1,0,0|1,0,0]=3 5547 B13R1.361 CCOC(=O)C1CCN(C1)CCO c9215fc06b55f3a6661099c2d1562623 [0,1,0,1,0,0|1,0,0]=3 5548 B13R1.361 CCOC(=O)C1CCN(C1)CCS 239201e58c4bf3681a4e0de8f463593a [0,1,0,1,0,0|1,0,0]=3 5549 B13R1.361 CCOC(=O)C1CCN(C1)COC 74c9a34574fb6c0ac46fed20c28eb8d9 [0,1,0,1,0,0|1,0,0]=3 5550 B13R1.361 CCOC(=O)C1CCN(C1)CSC 1ed2d94603f059b0815d68937b44f97d [0,1,0,1,0,0|1,0,0]=3 5551 B13R1.361 CCOC(=O)[C@H]1CCN(C1)CC#N 02e73359b257bb973bf7121e60dc701f [0,1,0,1,0,0|1,0,1]=4 5552 B13R1.361 CCOC(=O)[C@H]1CCN(C1)CC=O 6e3a2399fae8cd292bd8af367c5a0bac [0,1,0,1,0,0|1,0,1]=4 5553 B13R1.361 CCOC(=O)[C@H]1CCN(C1)CCF ed4f5d5cdb21e5553b2cc618ab8e4145 [0,1,0,1,0,0|1,0,0]=3 5554 B13R1.361 CCOC(=O)[C@H]1CCN(C1)CCO 65e88aa9d4bd1cbe656fadb27572c6dd [0,1,0,1,0,0|1,0,0]=3 5555 B13R1.361 CCOC(=O)[C@H]1CCN(C1)CCS ddcadd3fc2e5b7ab615079dba42022b2 [0,1,0,1,0,0|1,0,0]=3 5556 B13R1.361 CCOC(=O)[C@H]1CCN(C1)COC e1348655e97cd36dc257289bb2ddab00 [0,1,0,1,0,0|1,0,0]=3 5557 B13R1.361 CCOC(=O)[C@H]1CCN(C1)CSC c22680dc400c8a8f9872bbacf72dfe33 [0,1,0,1,0,0|1,0,0]=3 5558 B13R1.361 CCOC(=O)[C@H]1CC[C@@H](C1)OCC c0d09a35fd69cf34e1cccc9e05cabdd8 [0,1,0,1,0,0|0,0,0]=2 5559 B13R1.361 CCOC(=O)[C@H]1CC[C@@H](C1)OCF 20e46ad870d2a19bdfdd4b33f7e708f4 [0,1,0,1,0,0|1,0,0]=3 5560 B13R1.361 CCOC(=O)[C@H]1CC[C@H](C1)OCC 20b91931cc6388f9d0e0b665fcd855e4 [0,1,0,1,0,0|0,0,0]=2 5561 B13R1.361 CCOC(=O)[C@H]1CC[C@H](C1)OCF a18981912209158795c40fd4bc8b37ef [0,1,0,1,0,0|1,0,0]=3 5562 B13R1.452 CCCC(=O)C1CCN(CC1)CC ed4aa7ee86e08168aad334591fd4e4a9 [0,1,0,1,0,0|1,0,0]=3 5563 B13R1.452 CCCC(=O)C1CCN(CC1)CF 91d9585ea1c58bb783e453e59044b50f [0,1,0,1,0,0|2,0,0]=4 5564 B13R1.452 CCCC(=O)C1CCN(CC1)CO 2f69f4a3bd7608fb4aec535933f3df43 [0,1,0,1,0,0|2,0,0]=4 5565 B13R1.452 CCCC(=O)N1CCC(CC1)CC f47d5352901825d3e26c9e0e59de3459 [0,1,0,1,0,0|2,0,0]=4 5566 B13R1.452 CCCC(=O)N1CCC(CC1)CF da24ee3b46ba76ac00309688bd20cf2a [0,1,0,1,0,0|2,0,0]=4 5567 B13R1.452 CCCC(=O)N1CCC(CC1)CO 2b2861e61309f0a49c8c61460e95138c [0,1,0,1,0,0|2,0,0]=4 5568 B13R1.452 CCCC(=O)N1CCC(CC1)OC 49972e712a082a097997bd14fb1e5d50 [0,1,0,1,0,0|2,0,0]=4 5569 B13R1.452 CCCC(=O)N1CCC(CC1)SC fac4292c00a59f8c2e65ed40a4d30399 [0,1,0,1,0,0|2,0,0]=4 5570 B13R1.452 CCCC(=O)N1CCN(CC1)CC 5e38c48faa957c4c1847a5f7a43d49ca [0,1,0,1,0,0|2,0,0]=4 5571 B13R1.452 CCNC(=O)C1CCN(CC1)CC 1c1fa51358434e7bc24a67554d92f0b1 [0,1,0,1,0,0|1,0,0]=3 5572 B13R1.452 CCNC(=O)C1CCN(CC1)CF d5b5a31734e9c82398adb584537daebd [0,1,0,1,0,0|2,0,0]=4 5573 B13R1.452 CCNC(=O)C1CCN(CC1)CO 8df3b63aa84e16ad7de121a6115ce6b5 [0,1,0,1,0,0|2,0,0]=4 5574 B13R1.452 CCOC(=O)C1CCN(CC1)C=O 1e952477bdfb068ccd443fa85f22c87c [0,1,0,1,0,0|1,0,1]=4 5575 B13R1.452 CCOC(=O)C1CCN(CC1)CC 0b5eb8e35fe03db218d1d4780735216d [0,1,0,1,0,0|0,0,0]=2 5576 B13R1.452 CCOC(=O)C1CCN(CC1)CF cef36122cee8c1e0d1f4d2aa8173c21d [0,1,0,1,0,0|1,0,0]=3 5577 B13R1.452 CCOC(=O)C1CCN(CC1)CO 9b9c40264201383640bf69e0f921f05b [0,1,0,1,0,0|1,0,0]=3 5578 B13R1.671 CCCCCC1CCCC1OCC 048decd865e76fb181df7d2332d2c6dc [0,1,0,1,0,0|1,0,1]=4 5579 B13R1.2461 C#CCCNC1(CC1)C(=O)OCC b8e659e1cd663cf5034090ab75ebc548 [0,1,0,1,0,0|0,0,2]=4 5580 B13R1.2461 C#CCNCC1(CC1)C(=O)OCC 96d00a212f477cb5a90f665011ee704e [0,1,0,1,0,0|0,0,2]=4 5581 B13R1.2461 C#CCOCC1(CC1)C(=O)OCC a666f34af9f0ca60ba45f6948e463c7e [0,1,0,1,0,0|0,0,2]=4 5582 B13R1.2461 C/C=C/CNC1(CC1)C(=O)OCC 9da736ee75d834ef6ad12c1c820a6bb3 [0,1,0,1,0,0|0,0,2]=4 5583 B13R1.2461 C/C=C\CNC1(CC1)C(=O)OCC 5afcf939d141263250cd7c8e2c14868f [0,1,0,1,0,0|0,0,2]=4 5584 B13R1.2461 C=CCCNC1(CC1)C(=O)OCC 54988e555a3df91ffb9b6ea9ce631697 [0,1,0,1,0,0|0,0,2]=4 5585 B13R1.2461 C=CCNCC1(CC1)C(=O)OCC bca91f856c35148ad8681783331cc162 [0,1,0,1,0,0|0,0,2]=4 5586 B13R1.2461 C=CCOCC1(CC1)C(=O)OCC 7b094f2d626ff540cecaece5452d4aa6 [0,1,0,1,0,0|0,0,2]=4 5587 B13R1.2461 CCCCNC1(CC1)C(=O)OCC cb200ebfa9852c0e832349274465d030 [0,1,0,1,0,0|0,0,0]=2 5588 B13R1.2461 CCCNCC1(CC1)C(=O)OCC 8c90eb9cd7f49a449248e2a2d8744a95 [0,1,0,1,0,0|0,0,0]=2 5589 B13R1.2461 CCCOCC1(CC1)C(=O)OCC 1e6f43448b2d7965fb097a7cca57d6cb [0,1,0,1,0,0|0,0,0]=2 5590 B13R1.2461 CCOC(=O)C1(CC1)CNCC#N c2e079229149f0170b435cf1a0c6f985 [0,1,0,1,0,0|1,0,1]=4 5591 B13R1.2461 CCOC(=O)C1(CC1)CNCC=O 4228141881b154f783d30daf79f1942f [0,1,0,1,0,0|1,0,1]=4 5592 B13R1.2461 CCOC(=O)C1(CC1)CNCCF 6a9c7e89f17ec54d16ded223e95f333f [0,1,0,1,0,0|1,0,0]=3 5593 B13R1.2461 CCOC(=O)C1(CC1)CNCCI f9f564bc19060ec9d4df991ec84b99e6 [0,1,0,1,0,0|1,0,0]=3 5594 B13R1.2461 CCOC(=O)C1(CC1)CNCCO 2137ee68649fd82d28e5df01d2d18851 [0,1,0,1,0,0|1,0,0]=3 5595 B13R1.2461 CCOC(=O)C1(CC1)CNCCS 2bda77898f67d715ec5c98d22691bb82 [0,1,0,1,0,0|1,0,0]=3 5596 B13R1.2461 CCOC(=O)C1(CC1)CNCOC 9f4a083e9c37034d533d82d51c164262 [0,1,0,1,0,0|1,0,0]=3 5597 B13R1.2461 CCOC(=O)C1(CC1)CNCSC 7f15a01e05f408216d4e3e028c98b9e4 [0,1,0,1,0,0|1,0,0]=3 5598 B13R1.2461 CCOC(=O)C1(CC1)COCC#N ebb17d54a028d4aa74ca46a84b8bf106 [0,1,0,1,0,0|1,0,1]=4 5599 B13R1.2461 CCOC(=O)C1(CC1)COCC=O bb92da6a31b3711eb5f19793dc6d8ecf [0,1,0,1,0,0|1,0,1]=4 5600 B13R1.2461 CCOC(=O)C1(CC1)COCCF 27a6145419ee20cf7a30d8586e60230c [0,1,0,1,0,0|1,0,0]=3 5601 B13R1.2461 CCOC(=O)C1(CC1)COCCS 9e205ccf1a1a05b0a26074db325d163b [0,1,0,1,0,0|1,0,0]=3 5602 B13R1.2461 CCOC(=O)C1(CC1)COCOC 1c20a610ea8cb1a62e01f9cefabb15ef [0,1,0,1,0,0|1,0,0]=3 5603 B13R1.2461 CCOC(=O)C1(CC1)COCSC 082496f7eec68e043e910b7548b8f97a [0,1,0,1,0,0|1,0,0]=3 5604 B13R1.2461 CCOC(=O)C1(CC1)NCCC#N 0938f3f2be4b5f979c83b746224d0161 [0,1,0,1,0,0|1,0,1]=4 5605 B13R1.2461 CCOC(=O)C1(CC1)NCCC=O e921081c32c26913c40ca7580b84b85b [0,1,0,1,0,0|1,0,1]=4 5606 B13R1.2461 CCOC(=O)C1(CC1)NCCCF 62174a9aadc995542576a1097c71f56c [0,1,0,1,0,0|1,0,0]=3 5607 B13R1.2461 CCOC(=O)C1(CC1)NCCCO 9dbe467fd20f5aa9486f166a384b16d9 [0,1,0,1,0,0|1,0,0]=3 5608 B13R1.2461 CCOC(=O)C1(CC1)NCCCS 4340b935e31689727332b2461be38a99 [0,1,0,1,0,0|1,0,0]=3 5609 B13R1.2461 CCOC(=O)C1(CC1)NCCOC c8ac57d05403d2750c3ee39a1c21bd3a [0,1,0,1,0,0|1,0,0]=3 5610 B13R1.2461 CCOC(=O)C1(CC1)NCCSC bba9de22884e4a7dc3f1b75e6bb8a3ab [0,1,0,1,0,0|1,0,0]=3 5611 B13R1.3516 CCC1C(=O)NCCN1CCCF 7a107b3fc41849d93af1b97e3da07a4a [0,1,0,1,0,0|2,0,0]=4 5612 B13R1.3516 CCC1C(=O)NCCN1CCCO 6f8175112ea7ccb90311a957cc3a6af5 [0,1,0,1,0,0|2,0,0]=4 5613 B13R1.3516 CCC1C(=O)NCCN1CCCS f87dda7c15c6f272c51fb680b5d4ad36 [0,1,0,1,0,0|2,0,0]=4 5614 B13R1.3516 CCC1C(=O)NCCN1CCOC 96d8b857efb1347a424e00212e4b8d3b [0,1,0,1,0,0|2,0,0]=4 5615 B13R1.3516 CCC1C(=O)NCCN1CCSC a967e0c52cc42d29d08db6ea2ce5d1ae [0,1,0,1,0,0|2,0,0]=4 5616 B13R1.3516 CCCCN1CCNC(=O)C1CC d54750d79f24c6233fc95fe1ed00b3a2 [0,1,0,1,0,0|1,0,0]=3 5617 B13R1.3516 CCOCN1CCNC(=O)C1CC 430dd95b27b1b84ea467baa1d7578d7e [0,1,0,1,0,0|2,0,0]=4 5618 B13R1.6200 CCCCOC1=C(C(OC1=O)C)C 830893a13fc6d4166211d4609fadd245 [0,1,0,1,0,0|0,0,2]=4 5619 B13R1.1561 CCOC(=O)C1(CCN(C1)CC)C 91356ec3373fe63252370277194c263a [0,1,0,1,0,0|1,0,0]=3 5620 B13R1.1561 CCOC(=O)C1(CCN(C1)CF)C f8643c0ae5b972286d690082bb7ad55f [0,1,0,1,0,0|2,0,0]=4 5621 B13R1.1561 CCOC(=O)C1(CCN(C1)CO)C c944249db872eec3d4ed1257ad1bc8ed [0,1,0,1,0,0|2,0,0]=4 5622 B13R1.1561 CCOC(=O)[C@@]1(CCN(C1)CC)C 1bebf4aa8cacd0c2ff7c4a43f1e4a5a6 [0,1,0,1,0,0|1,0,0]=3 5623 B13R1.1561 CCOC(=O)[C@@]1(CCN(C1)CF)C 65806b00f2c1c75345f682ecf22efff2 [0,1,0,1,0,0|2,0,0]=4 5624 B13R1.1561 CCOC(=O)[C@@]1(CCN(C1)CO)C 85d069130ece8ee4864108c219fb2e54 [0,1,0,1,0,0|2,0,0]=4 5625 B13R1.4100 CCCN1CCNC(=O)C1(C)CC 7576c9bfb935c015da2fb729e955033a [0,1,0,1,0,0|2,0,0]=4 5626 B13R2.844 CCCC(=O)N1CCC2CC2C1 035d407688c0c4accdcb46454fe11ac6 [0,0,0,2,0,0|2,0,0]=4 5627 B13R2.3045 O=C1NCCCCC1NC2CC2 eb2f75a499a78c20a1f3d85b2a2f5bce [0,0,0,2,0,0|2,0,0]=4 5628 B13R2.3045 O=C1NCCCC[C@@H]1NC2CC2 9c9260faf5b7742ab1547276d4bef13a [0,0,0,2,0,0|2,0,0]=4 5629 B13R2.3045 O=C1NCCCC[C@H]1NC2CC2 24d9a7081259ca77c2cfe8f90fa26084 [0,0,0,2,0,0|2,0,0]=4 5630 B13R2.4045 CCCN1C2CCC1C(=O)NC2 d28339180a26bb7d8ae11b92c5a05ffd [0,0,0,2,0,0|2,0,0]=4 5631 B13R2.4045 CCCN1C2CC[C@H]1C(=O)NC2 0f5d98198d86f6e55414f8a6691e4fed [0,0,0,2,0,0|2,0,0]=4 5632 B13R2.4045 CCCN1[C@H]2CC[C@@H]1C(=O)NC2 ced08b90c6ddd6d6bc453af08fa129d9 [0,0,0,2,0,0|2,0,0]=4 5633 B13R2.4901 O=C1CCCCCC1N2CCC2 b00a81e1974a2125c80e292b7b0f2022 [0,0,0,2,0,0|2,0,0]=4 5634 B13R2.4901 O=C1NCCCCC1N2CCC2 45e609f3674ebc61fba979a0adb9de55 [0,0,0,2,0,0|2,0,0]=4 5635 B13R2.2452 CCCNC1C(=O)[C@H]2CC[C@@H]1C2 9e28b0bbffb6a44ebae464d6ac6caeef [0,0,0,2,0,0|2,0,0]=4 5636 B13R2.605 CCN1C[C@@H]2CC[C@H](C1)C(=O)N2 92a139c72032287ab82bed448f0b8774 [0,0,0,2,0,0|2,0,0]=4 5637 B13R2.856 CCCC(=O)N1CC2CCC1C2 c6983d50442d0565590b76cf094a075c [0,0,0,2,0,0|2,0,0]=4 5638 B13R2.856 CCCC(=O)N1C[C@@H]2CC[C@H]1C2 b25016f30e6e2c521d02d2a4e4768cde [0,0,0,2,0,0|2,0,0]=4 5639 B13R2.856 CCCC(=O)N1C[C@H]2CC[C@@H]1C2 57a65563c0663b58c3d3e9f128211804 [0,0,0,2,0,0|2,0,0]=4 5640 B13R2.9 CCN1CCC2C1CCNC2=O c0415ebd009b8ee17232f1fe7d5686e7 [0,0,0,2,0,0|2,0,0]=4 5641 B13R2.850 CCCC(=O)N1CC2CCC2C1 984613888e5973b350b28ecc30a199b2 [0,0,0,2,0,0|2,0,0]=4 5642 B13R2.2489 CCN1CCC2(C1)CCNC2=O 83b436e4642b8451731ba09afa8b10de [0,0,0,2,0,0|2,0,0]=4 5643 B13R2.2489 CCN1CCC2(C1)CCOC2=O c503b9a857076446cde20951ac8e5f59 [0,0,0,2,0,0|1,0,0]=3 5644 B13R2.2489 O=C1OCCC12CCN(C2)CF 341647ffcbfd3c83ae33827617d014ad [0,0,0,2,0,0|2,0,0]=4 5645 B13R2.2489 O=C1OCCC12CCN(C2)CO 2c166786e487e545160c0bf92196514c [0,0,0,2,0,0|2,0,0]=4 5646 B13R2.14853 CCCC(=O)N1CCC2(C1)CC2 81ee85fdef10be5cd9d5c06903ee1dcd [0,0,0,2,0,0|2,0,0]=4 5647 B13R2.797 CCCC(=O)N1CC2C1CCC2 d9a3dd65f47a47bbb8874a3a467de8b2 [0,0,0,2,0,0|2,0,0]=4 5648 B13R2.797 CCCC(=O)N1C[C@H]2[C@@H]1CCC2 855d942a40eba2183faab891a710a421 [0,0,0,2,0,0|2,0,0]=4 5649 B13R2.2615 CCC1C(=O)NCCN1C2CC2 d2c0b33ba8b8ed43fb844b0c591f8132 [0,0,0,2,0,0|2,0,0]=4 5650 B13R2.8049 CCCN1CCNC(=O)C12CC2 2dd5ad1d37cd2e9faa471da27e5c92d5 [0,0,0,2,0,0|2,0,0]=4 5651 B13R2.8049 CCCN1CCOC(=O)C12CC2 1d935418ca7afe0b1e5a6a91c2f227ba [0,0,0,2,0,0|1,0,0]=3 5652 B13R2.8049 COCN1CCOC(=O)C12CC2 c83a9fe06d67a248426f0169862a1ab9 [0,0,0,2,0,0|2,0,0]=4 5653 B13R2.8049 CSCN1CCOC(=O)C12CC2 8bd5f4cd893aa86f46f77b421b0360b8 [0,0,0,2,0,0|2,0,0]=4 5654 B13R2.8049 O=C1OCCN(C12CC2)CCF aa3bbe57dc70868073c765c3221ae9b3 [0,0,0,2,0,0|2,0,0]=4 5655 B13R2.8049 O=C1OCCN(C12CC2)CCO d75f9a83d4a17697343e0921f343d939 [0,0,0,2,0,0|2,0,0]=4 5656 B13R2.8049 O=C1OCCN(C12CC2)CCS 28383b279cb24eab2fd44b976518ac87 [0,0,0,2,0,0|2,0,0]=4 5657 B13R2.14823 CCCC(=O)N1C2C1CCCC2 3899f449c598f109baa1f9a039c0f911 [0,0,0,2,0,0|2,0,0]=4 5658 B11R0.5 C/C=C/C(=O)NC(C)CCCC d3adbe398831edd2c0c4888dbdb115c3 [1,0,0,0,0,1|1,0,1]=4 5659 B11R0.5 C/C=C/C(=O)N[C@H](C)CCCC 81ef273c58b85f845278c587e199fb0c [1,0,0,0,0,1|1,0,1]=4 5660 B11R0.5 CC#CC(=O)NC(C)CCCC 09802138b96802960d93efc261118bcb [1,0,0,0,0,1|1,0,1]=4 5661 B11R0.5 CC#CC(=O)N[C@H](C)CCCC b07019048f51f1681e0d8a6dbeedb8e9 [1,0,0,0,0,1|1,0,1]=4 5662 B11R0.5 CCCC(=O)NC(C)CCCO c653f3238dd5ed5ce22fbd0bf1f1e75f [1,0,0,0,0,1|2,0,0]=4 5663 B11R0.5 CCCC(=O)N[C@H](C)CCCO c022a4354d04fa63464693a3796bd84f [1,0,0,0,0,1|2,0,0]=4 5664 B11R0.5 CCCCC(C)NC(=O)CCC 43436934f24e745885dfbadec08128d1 [1,0,0,0,0,1|1,0,0]=3 5665 B11R0.5 CCCCC(C)NC(=O)CCF cda440c74a569fab8e1afa816d18d04a [1,0,0,0,0,1|2,0,0]=4 5666 B11R0.5 CCCCC(C)NC(=O)CCO 1b9d98a6035ede469114e581d81e339d [1,0,0,0,0,1|2,0,0]=4 5667 B11R0.5 CCCCC(C)NC(=O)CCS edc03cd7374c69f14e827a3a34772526 [1,0,0,0,0,1|2,0,0]=4 5668 B11R0.5 CCCCC(C)NC(=O)COC f7dde75e19c01301ddf951d10524cbeb [1,0,0,0,0,1|2,0,0]=4 5669 B11R0.5 CCCCC(C)NC(=O)CSC 79c76642976c4c66103a112bee688d8c [1,0,0,0,0,1|2,0,0]=4 5670 B11R0.5 CCCCC(C)OC(=S)CCC 0c4270cad6dfde75c78c81454c1eb24c [1,0,0,0,0,1|1,1,0]=4 5671 B11R0.5 CCCCN(C)CC(=O)CCC 2c9d1b447eaaf33a4021bbf9ae8724ad [1,0,0,0,0,1|2,0,0]=4 5672 B11R0.5 CCCCN(C)CC(=O)NCC 4e7624ee18d03d9dffcf9124edde8a28 [1,0,0,0,0,1|2,0,0]=4 5673 B11R0.5 CCCCN(C)CC(=O)OCC 66588873868685277f1e6323ca93ab3b [1,0,0,0,0,1|1,0,0]=3 5674 B11R0.5 CCCC[C@@H](C)NC(=O)CCC b900024a5ad230bdc04e528498061486 [1,0,0,0,0,1|1,0,0]=3 5675 B11R0.5 CCCC[C@@H](C)NC(=O)CCF 93c934f351e64ccf8e2d521aa9e42fe2 [1,0,0,0,0,1|2,0,0]=4 5676 B11R0.5 CCCC[C@@H](C)NC(=O)CCO 01d87af3b75d31c5fff556ee40effeba [1,0,0,0,0,1|2,0,0]=4 5677 B11R0.5 CCCC[C@@H](C)NC(=O)CCS fe705c5d8d60b5621a19a2d183083fe0 [1,0,0,0,0,1|2,0,0]=4 5678 B11R0.5 CCCC[C@@H](C)NC(=O)COC f016a4f80e22fff5992dc6293ea396fc [1,0,0,0,0,1|2,0,0]=4 5679 B11R0.5 CCCC[C@@H](C)NC(=O)CSC 360791f73cc423f58950b480a5db3482 [1,0,0,0,0,1|2,0,0]=4 5680 B11R0.5 CCCNC(C)CC(=O)OCC 4cd8834a858e3d0a1873cc056d8991da [1,0,0,0,0,1|1,0,0]=3 5681 B11R0.5 CCCNC(C)OC(=O)OCC 63c80613f8e796087da31e8ca1b05e75 [1,0,0,0,0,1|1,0,0]=3 5682 B11R0.5 CCCOC(C)CC(=O)OCC a9a559828e9beac6ca0cba22bdf2c0ed [1,0,0,0,0,1|1,0,0]=3 5683 B11R0.5 CCCOC(C)OC(=O)OCC 04395d9cacdeb76959acd261d30b7e51 [1,0,0,0,0,1|1,0,0]=3 5684 B11R0.5 CCCO[C@@H](C)CC(=O)OCC 99e55bc55c2f57c9f328e26219482cbd [1,0,0,0,0,1|1,0,0]=3 5685 B11R0.5 CCCO[C@H](C)CC(=O)OCC 50122b0db756fef3e2071464e7d8c83a [1,0,0,0,0,1|1,0,0]=3 5686 B11R0.5 CCOC(=O)CC(C)NCCBr 23386132c2fb40df07f9636e04e42c1e [1,0,0,0,0,1|2,0,0]=4 5687 B11R0.5 CCOC(=O)CC(C)NCCF 558100352fb65496ae4103cf7ed8efb4 [1,0,0,0,0,1|2,0,0]=4 5688 B11R0.5 CCOC(=O)CC(C)NCCI c7099127709895f04c1fef234e4880fe [1,0,0,0,0,1|2,0,0]=4 5689 B11R0.5 CCOC(=O)CC(C)NCCO 1453c991baad81c273a21311d74437b4 [1,0,0,0,0,1|2,0,0]=4 5690 B11R0.5 CCOC(=O)CC(C)NCCS bff70fab463d98607dba2b2828d03fd4 [1,0,0,0,0,1|2,0,0]=4 5691 B11R0.5 CCOC(=O)CC(C)NCOC 8595dbb9f364262768a8c4b29edb1a75 [1,0,0,0,0,1|2,0,0]=4 5692 B11R0.5 CCOC(=O)CC(C)NCSC 36bab76a8c452acd08a95d7e24f52884 [1,0,0,0,0,1|2,0,0]=4 5693 B11R0.5 CCOC(=O)CC(C)OCCF e99b133b6e84da7c9b49ce946a7ad8a4 [1,0,0,0,0,1|2,0,0]=4 5694 B11R0.5 CCOC(=O)CC(C)OCCS 6270366bcec9500188f593efcd5a7901 [1,0,0,0,0,1|2,0,0]=4 5695 B11R0.5 CCOC(=O)CC(C)OCSC 417e447c88161bcb128afd3256308862 [1,0,0,0,0,1|2,0,0]=4 5696 B11R0.5 CCOC(=O)CN(C)CCCO d79e74f78ebed6a566c4fc6e1162fd74 [1,0,0,0,0,1|2,0,0]=4 5697 B11R0.5 CCOC(=O)CN(C)CCOC dae3d3280e0387273ddf5fa2c631929d [1,0,0,0,0,1|2,0,0]=4 5698 B11R0.5 CCOC(=O)CN(C)CCSC 811918ba95a9855d07e23c73514762cc [1,0,0,0,0,1|2,0,0]=4 5699 B11R0.5 CCOC(=O)C[C@@H](C)OCCF 7ca6d53afc408279e83a5997e50714c2 [1,0,0,0,0,1|2,0,0]=4 5700 B11R0.5 CCOC(=O)C[C@@H](C)OCCS 2bb20a29aa9dd019acdd7dc012ee7f97 [1,0,0,0,0,1|2,0,0]=4 5701 B11R0.5 CCOC(=O)C[C@@H](C)OCSC 161f3906fa0dc692d9a3788f46152823 [1,0,0,0,0,1|2,0,0]=4 5702 B11R0.5 CCOC(=O)C[C@H](C)OCCF 60e98bc7e7a0c9330344f3f6797ea799 [1,0,0,0,0,1|2,0,0]=4 5703 B11R0.5 CCOC(=O)C[C@H](C)OCCS 9815cb7a149f02d77b3ed7d4728ea339 [1,0,0,0,0,1|2,0,0]=4 5704 B11R0.5 CCOC(=O)C[C@H](C)OCSC 906d6180c1a249e5a7e937bd75cbd91a [1,0,0,0,0,1|2,0,0]=4 5705 B11R0.5 CCOC(=O)OC(C)NCCBr 780d2a084cfdfbe63f7ea4c1c6e75056 [1,0,0,0,0,1|2,0,0]=4 5706 B11R0.5 CCOC(=O)OC(C)NCCF 12a9208359bdce1b7bd2382f4e829765 [1,0,0,0,0,1|2,0,0]=4 5707 B11R0.5 CCOC(=O)OC(C)NCCI 087a16277dbf724bb2931c84b3b2c95e [1,0,0,0,0,1|2,0,0]=4 5708 B11R0.5 CCOC(=O)OC(C)NCCO d0d09e4afb9906990efaa583d7a323fb [1,0,0,0,0,1|2,0,0]=4 5709 B11R0.5 CCOC(=O)OC(C)NCCS 6aa0b840cf0929bab3333635a6b4e603 [1,0,0,0,0,1|2,0,0]=4 5710 B11R0.5 CCOC(=O)OC(C)OCCS f3596f189ab14257e6ab294cded45960 [1,0,0,0,0,1|2,0,0]=4 5711 B11R0.5 CCOC(=O)OC(C)OCOC 0da8ee90a86ad1943b3e6683041ffb7d [1,0,0,0,0,1|2,0,0]=4 5712 B11R0.5 CCOC/C(=C/C(=O)OCC)/C e8d33d26df2be99b0c931d9173ff83e9 [1,0,0,0,0,1|1,0,1]=4 5713 B11R0.182 CCCC(=O)CN(CC)CCC 359d1610544da9de946f160474417401 [1,0,0,0,0,1|2,0,0]=4 5714 B11R0.182 CCCC(=O)NC(CC)COC b9e1e9657c13d00e37c6323673812dde [1,0,0,0,0,1|2,0,0]=4 5715 B11R0.182 CCCC(=O)NC(CO)CCC 8357a68ec7638717ad58912bc333cd7d [1,0,0,0,0,1|2,0,0]=4 5716 B11R0.182 CCCC(=O)N[C@@H](CO)CCC 5f7b0da7a556be11ff6a93652e317241 [1,0,0,0,0,1|2,0,0]=4 5717 B11R0.182 CCCC(=O)N[C@H](CO)CCC d216b26925f143b5dae6b39d9fc94f49 [1,0,0,0,0,1|2,0,0]=4 5718 B11R0.182 CCCC(=S)OC(CC)CCC 02056ccea8a12259d922685dc3eba7fd [1,0,0,0,0,1|1,1,0]=4 5719 B11R0.182 CCCN(CC)CC(=O)NCC 1c1c2d47e90249a83899d49de48b7792 [1,0,0,0,0,1|2,0,0]=4 5720 B11R0.182 CCCN(CC)CC(=O)OCC 75dce36f4ac8c907a2aa0311afcb9e26 [1,0,0,0,0,1|1,0,0]=3 5721 B11R0.182 CCCN(CF)CC(=O)OCC f228748a7107b6ed669599f993abe736 [1,0,0,0,0,1|2,0,0]=4 5722 B11R0.182 CCCN(CO)CC(=O)OCC fa66411f60956d3a9b1077820f754d58 [1,0,0,0,0,1|2,0,0]=4 5723 B11R0.182 CCOC(=O)CC(CC)OCC 70c8debd388499f02d36463e08a8736c [1,0,0,0,0,1|1,0,0]=3 5724 B11R0.182 CCOC(=O)CC(CC)OCF 4474a6de3b0ee58430a430d309014eea [1,0,0,0,0,1|2,0,0]=4 5725 B11R0.182 CCOC(=O)CN(CC)CCCl 272ed9542a5e6befd31c231fb22567f2 [1,0,0,0,0,1|2,0,0]=4 5726 B11R0.182 CCOC(=O)CN(CC)CCF e9876f82bab22f445ace94ddcc861eb3 [1,0,0,0,0,1|2,0,0]=4 5727 B11R0.182 CCOC(=O)CN(CC)CCO e8d685d2956349e17b1aa0eaeee33640 [1,0,0,0,0,1|2,0,0]=4 5728 B11R0.182 CCOC(=O)CN(CC)CCS 4d0f48a815e382d93f6c7d36e2c5ab2f [1,0,0,0,0,1|2,0,0]=4 5729 B11R0.182 CCOC(=O)CN(CC)COC a6d02ded02e4050126a934319d5c2325 [1,0,0,0,0,1|2,0,0]=4 5730 B11R0.182 CCOC(=O)CN(CC)CSC 830bf52a276e07d18dfc9c82ee9494d7 [1,0,0,0,0,1|2,0,0]=4 5731 B13R0.305 C#CC(CCCC)OCC(=O)OCC be086772adfefa1b19d4cffe2c93ef23 [0,0,0,0,0,2|0,0,2]=4 5732 B13R0.305 C/C=C/C(=O)NCC(CC)CCCC 6e4f8f8f3e805fa49b9dddf51f37fd0f [0,0,0,0,0,2|1,0,1]=4 5733 B13R0.305 C=CC(CCCC)OCC(=O)OCC dfcdc08cb9131a46ad0bcc8cf55d669c [0,0,0,0,0,2|0,0,2]=4 5734 B13R0.305 C=COC(=O)COC(CC)CCCC b3dc655cd72930104e438f6c59bff67d [0,0,0,0,0,2|0,0,2]=4 5735 B13R0.305 CC#CC(=O)NCC(CC)CCCC 500b20e0c76976f4fdd110fc36db05a9 [0,0,0,0,0,2|1,0,1]=4 5736 B13R0.305 CC#CCC(CC)OCC(=O)OCC 0a776b829283e6b72c690db05e6f8150 [0,0,0,0,0,2|0,0,2]=4 5737 B13R0.305 CCCCC(CC)CNC(=O)CCC 1486dc59c3c319ffbd7dc6841d06839f [0,0,0,0,0,2|1,0,0]=3 5738 B13R0.305 CCCCC(CC)CNC(=O)CCF ad6c4441d3c6450371d5029ecfc937c4 [0,0,0,0,0,2|2,0,0]=4 5739 B13R0.305 CCCCC(CC)CNC(=O)CCO 9280dac2be1bbc7d3a238112cca34c99 [0,0,0,0,0,2|2,0,0]=4 5740 B13R0.305 CCCCC(CC)CNC(=O)CCS c14546665a7ee54bc555595a1ab0687e [0,0,0,0,0,2|2,0,0]=4 5741 B13R0.305 CCCCC(CC)CNC(=O)COC 41cefcf7577613e424e9664a23ca4784 [0,0,0,0,0,2|2,0,0]=4 5742 B13R0.305 CCCCC(CC)CNC(=O)CSC 1b624a2531207fcc6fc8810a76e537a0 [0,0,0,0,0,2|2,0,0]=4 5743 B13R0.305 CCCCC(CC)COC(=S)CCC e04d4593a4cc32cbba68268f5a25439b [0,0,0,0,0,2|1,1,0]=4 5744 B13R0.305 CCCCC(CC)NCC(=O)NCC b3439d92a8d6180360f42f104b5f73e4 [0,0,0,0,0,2|1,0,0]=3 5745 B13R0.305 CCCCC(CC)NCC(=O)OCC 29e7eeb3ffd9cb385fd8486d19b05031 [0,0,0,0,0,2|0,0,0]=2 5746 B13R0.305 CCCCC(CC)NCC(C)OCC ff3d0386de1351940cee5d6d9a9b5db7 [0,0,0,0,0,2|1,0,1]=4 5747 B13R0.305 CCCCC(CC)OCC(=O)CCC 5873f7986798e6fa52fb94e966bd0bbc [0,0,0,0,0,2|1,0,0]=3 5748 B13R0.305 CCCCC(CC)OCC(=O)COC a57a2315dd252ada5112b9fdd5d07cd5 [0,0,0,0,0,2|2,0,0]=4 5749 B13R0.305 CCCCC(CC)OCC(=O)NCC 261ef6018c7fcda19e850024d87b54b0 [0,0,0,0,0,2|1,0,0]=3 5750 B13R0.305 CCCCC(CC)OCC(=O)OCC 7a1b0880e4ca404fa9f406acacdf5eab [0,0,0,0,0,2|0,0,0]=2 5751 B13R0.305 CCCCC(CC)OCC(C)OCC b15dd80ee345d9efa8af52a251e1e529 [0,0,0,0,0,2|1,0,1]=4 5752 B13R0.305 CCCCC(CO)NCC(=O)CCC bb56bef9c31142831cd4e75a638ac42d [0,0,0,0,0,2|2,0,0]=4 5753 B13R0.305 CCCCC(CO)NCC(=O)NCC 0f6fe4ef816550dccdcfd3a0b78786bc [0,0,0,0,0,2|2,0,0]=4 5754 B13R0.305 CCCCC(CO)NCC(=O)OCC 740d2400df7f389491d63d0083ea3bc3 [0,0,0,0,0,2|1,0,0]=3 5755 B13R0.305 CCCCN(CC)CCC(=O)NCC b9eac2d2666314230a4e0a473c4e55d9 [0,0,0,0,0,2|2,0,0]=4 5756 B13R0.305 CCCCN(CC)CCC(=O)OCC e2d5bfd53f8d6604f10ff5a7fffe4365 [0,0,0,0,0,2|1,0,0]=3 5757 B13R0.305 CCCCN(CC)COC(=O)CCC 5142b2482f51297d2670ad5b43109af1 [0,0,0,0,0,2|2,0,0]=4 5758 B13R0.305 CCCCN(CC)COC(=O)OCC 2a3edcb6135c06742d87c3f17b78ac85 [0,0,0,0,0,2|1,0,0]=3 5759 B13R0.305 CCCCN(CC)COC(=O)SCC edd9941be6dada3dcf4e199d6cc3aeb6 [0,0,0,0,0,2|1,1,0]=4 5760 B13R0.305 CCCCN(CF)CCC(=O)OCC f77ed5741fc314fef6621c268d70ed3f [0,0,0,0,0,2|2,0,0]=4 5761 B13R0.305 CCCCN(CO)CCC(=O)OCC 6db412b9b414834db543cd8f419422ac [0,0,0,0,0,2|2,0,0]=4 5762 B13R0.305 CCCC[C@@H](CC)COC(=S)CCC 4f4dcd849408183e6bd8d0516d041420 [0,0,0,0,0,2|1,1,0]=4 5763 B13R0.305 CCCC[C@@H](CO)NCC(=O)CCC db64027e7b8ddae8276da5ee2117de84 [0,0,0,0,0,2|2,0,0]=4 5764 B13R0.305 CCCC[C@@H](CO)NCC(=O)NCC 1e76922922111c48cdee1b88cf9ff24c [0,0,0,0,0,2|2,0,0]=4 5765 B13R0.305 CCCC[C@@H](CO)NCC(=O)OCC a697fa403b5adc82f002e4f60519c061 [0,0,0,0,0,2|1,0,0]=3 5766 B13R0.305 CCCC[C@H](CO)NCC(=O)CCC 616a88f23273142d23ae1e07cdfb0f14 [0,0,0,0,0,2|2,0,0]=4 5767 B13R0.305 CCCC[C@H](CO)NCC(=O)NCC d1d2356c7ec504c056780518b6ded4c5 [0,0,0,0,0,2|2,0,0]=4 5768 B13R0.305 CCCC[C@H](CO)NCC(=O)OCC 0e88c2f9c74a0a482745fef42018bc87 [0,0,0,0,0,2|1,0,0]=3 5769 B13R0.305 CCOC(=O)CCN(CC)CCCF 672c5f96b8615165fc0b0a8507a73dab [0,0,0,0,0,2|2,0,0]=4 5770 B13R0.305 CCOC(=O)CCN(CC)CCCO b173744e1ace2b97db74a77fd9444f83 [0,0,0,0,0,2|2,0,0]=4 5771 B13R0.305 CCOC(=O)CCN(CC)CCOC cdea652325db08e4d49c56bc0c43e2f3 [0,0,0,0,0,2|2,0,0]=4 5772 B13R0.305 CCOC(=O)CCN(CC)CCSC 75a437203174d25c9bea2d95d962f7a4 [0,0,0,0,0,2|2,0,0]=4 5773 B13R0.305 CCOC(=O)CNC(CO)CCCO ed8f0663880ca6cce2cbf3973b889f87 [0,0,0,0,0,2|2,0,0]=4 5774 B13R0.305 CCOC(=O)CNC(CO)CCSC 74a8d906a2bb60bddf6adbe8ccadd498 [0,0,0,0,0,2|2,0,0]=4 5775 B13R0.305 CCOC(=O)CN[C@@H](CO)CCSC 2268f252537b1d29dc3e5a442bed20ad [0,0,0,0,0,2|2,0,0]=4 5776 B13R0.305 CCOC(=O)CN[C@H](CO)CCSC d351cfec9eb1d25b985c26e660449963 [0,0,0,0,0,2|2,0,0]=4 5777 B13R0.305 CCOC(=O)OCN(CC)CCCO b3718a580b54fbc2c1f55979957cf0ae [0,0,0,0,0,2|2,0,0]=4