0 B19R0.59662 C=C(Br)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 0d3e3eb55b4a19eb8b86f98f1ad7be7b [0,0,0,0,0,0|2,0,0]=2 1 B19R0.59662 C=C(C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O ba1f565bed54264411611a0548858264 [0,0,0,0,0,0|2,0,0]=2 2 B19R0.59662 C=C(Cl)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 2b73da7d202c18b20aeae6fbd0f214f4 [0,0,0,0,0,0|2,0,0]=2 3 B19R0.59662 C=C(F)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O aaf850ddd3ca8f37e9090d01a884cfe4 [0,0,0,0,0,0|2,0,0]=2 4 B19R0.59662 CC(C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O e4c3571cc92d8e9dbcb761f16386c8d4 [0,0,0,0,0,0|2,0,1]=3 5 B19R0.59662 CC(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O dd653fefda8f77d4b7c275d5fcb45029 [0,0,0,0,0,0|1,0,1]=2 6 B19R0.59662 CN(C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 522d0b873ab6c81b149c5036bd03e172 [0,0,0,0,0,0|3,0,0]=3 7 B19R0.59662 C[C@@H](O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O d5caa6635215e4ef1509899543c554c5 [0,0,0,0,0,0|1,0,1]=2 8 B19R0.59662 C[C@H](O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O d36e9cdeaeae9dc1fc3c5ab42a160083 [0,0,0,0,0,0|1,0,1]=2 9 B19R0.59662 NC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 0d69b0014344baaa8986f07f57f2ffa2 [0,0,0,0,0,0|1,0,0]=1 10 B19R0.59662 O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 97637e45a765705ae20b6ea3951d8ba8 [0,0,0,0,0,0|0,0,0]=0 11 B19R0.59662 O=C(O)CN(CCN(CC(=O)O)CC(F)F)CC(=O)O 19a9af39b78e5cac2fe81a4b9922bc02 [0,0,0,0,0,0|2,0,1]=3 12 B19R0.59662 O=C(O)CN(CCN(CC(=O)O)C[N+](=O)[O-])CC(=O)O fbfa79b538e178ab129695106800a037 [0,0,0,0,0,0|1,0,1]=2 13 B18R0.72578 C#CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O bc055367b83f63d12961e72f4ace5cb6 [1,0,0,0,0,0|1,0,1]=3 14 B18R0.72578 C=CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O c33d4e8ce40c42ca513ad5653ca93483 [1,0,0,0,0,0|1,0,0]=2 15 B18R0.72578 CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 284accbb993acdb53d17f31671a5ef70 [1,0,0,0,0,0|1,0,1]=3 16 B18R0.72578 COCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 9c8434eb7947475ff02db3ff50c9e9e4 [1,0,0,0,0,0|2,0,0]=3 17 B18R0.72578 CSCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 67810538364a6d3f32b32e1fd1b59105 [1,0,0,0,0,0|2,0,0]=3 18 B18R0.72578 N#CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O e67ff169a3c288d708928eaa82325ec4 [1,0,0,0,0,0|1,0,1]=3 19 B18R0.72578 O=C(O)CN(CCF)CCN(CC(=O)O)CC(=O)O 2e314a658e1ea1563570f75c55ca957d [1,0,0,0,0,0|1,0,1]=3 20 B18R0.72578 O=C(O)CN(CCO)CCN(CC(=O)O)CC(=O)O 6a862b3d234b1084c25fff86bc91a504 [1,0,0,0,0,0|0,0,1]=2 21 B18R0.72578 O=C(O)CN(CCS)CCN(CC(=O)O)CC(=O)O f3eef65d2b1303176c237e1601a2dd82 [1,0,0,0,0,0|0,1,1]=3 22 B18R0.72578 O=CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O bad26277bed6ea9a7564fceb6e744d85 [1,0,0,0,0,0|0,0,0]=1 23 B20R0.8185 O=C(O)CC(CC(=O)O)NC(=O)N(CC(=O)O)CC(=O)O f522782ff4af5877bc724ca97080bcb3 [0,1,0,0,0,0|2,0,1]=4 24 B20R0.8185 O=C(O)CC(CC(=O)O)NC(=S)N(CC(=O)O)CC(=O)O 4334374930cb722a979b4f3aba24f457 [0,1,0,0,0,0|2,0,1]=4 25 B20R0.91803 CC(=O)C(C)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O 418cbcb020c4591bce0a917f76239ef8 [0,1,0,0,0,0|1,0,0]=2 26 B20R0.91803 CC(C(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O 38ed645acf4e7956773da2d4459f59e7 [0,1,0,0,0,0|0,0,0]=1 27 B20R0.91803 CC(C)C(C)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O 86f02f697335d29cafebd7d37abcf0e2 [0,1,0,0,0,0|2,0,1]=4 28 B20R0.91803 C[C@@H](C(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O 73004c7afb50281d89d2984ed15df657 [0,1,0,0,0,0|0,0,0]=1 29 B20R0.91803 C[C@H](C(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O 64824a740a10662939022e103792ad16 [0,1,0,0,0,0|0,0,0]=1 30 B20R0.195923 C=C(C#N)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 5788e9845ae307222cee3b46e22514be [0,1,0,0,0,0|2,0,0]=3 31 B20R0.195923 C=C(CC)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O e00a04cd6a4a3c5a4ec7f9c0c452ab51 [0,1,0,0,0,0|2,0,0]=3 32 B20R0.195923 C=C(CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)OC 49d62c1fb9eaa9c7c4afdd056445e700 [0,1,0,0,0,0|1,0,0]=2 33 B20R0.195923 C=C(CO)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 5f6c3467cce3f32c91524f8e663d2c76 [0,1,0,0,0,0|1,0,0]=2 34 B20R0.195923 CC(C#N)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 90d7038b039f2cf5d11597e9f0a43a4b [0,1,0,0,0,0|2,0,1]=4 35 B20R0.195923 CC(CO)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 287d76e37982eb0432e8606c2744c899 [0,1,0,0,0,0|1,0,1]=3 36 B20R0.195923 CCC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O e2a72d0586ff6eb7dd6280723609e202 [0,1,0,0,0,0|1,0,0]=2 37 B20R0.195923 CCC(C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 4c3c9780b5aa066bee7b16d929084087 [0,1,0,0,0,0|2,0,1]=4 38 B20R0.195923 CCC(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 71b179854311c9629f1528d8cf5829f2 [0,1,0,0,0,0|1,0,1]=3 39 B20R0.195923 CC[C@@H](C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 84c601dfead49a99421e4435018432f8 [0,1,0,0,0,0|2,0,1]=4 40 B20R0.195923 CC[C@H](C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 0c80ce06631f8c55db373300e230cea1 [0,1,0,0,0,0|2,0,1]=4 41 B20R0.195923 CNC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 9ee3c991057da9dd267d93c66cf396ce [0,1,0,0,0,0|1,0,0]=2 42 B20R0.195923 COC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O dabdfcae53db7bee688cc9286342f5f5 [0,1,0,0,0,0|0,0,0]=1 43 B20R0.195923 COC(C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O c409cb2534ffccb3da2dacbadb4bc509 [0,1,0,0,0,0|1,0,1]=3 44 B20R0.195923 CO[C@@H](C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 570457d8d422fb8dcd14bfc3cc0668da [0,1,0,0,0,0|1,0,1]=3 45 B20R0.195923 CO[C@H](C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O f692c9f68c8a3e1a0061c53e6aed2bf0 [0,1,0,0,0,0|1,0,1]=3 46 B20R0.195923 C[C@@H](CO)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 940fa7be950ad17505d9080f42837523 [0,1,0,0,0,0|1,0,1]=3 47 B20R0.195923 C[C@H](CO)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O ea5a1f931a2bd456eeb85def285a6ef1 [0,1,0,0,0,0|1,0,1]=3 48 B20R0.195923 O=C(O)CN(CCN(CC(=O)O)C/C(=C/Cl)/Cl)CC(=O)O 25eb835d9a0a94d9053041575e7d99b1 [0,1,0,0,0,0|2,0,0]=3 49 B20R0.195923 O=C(O)CN(CCN(CC(=O)O)CC(=O)CO)CC(=O)O cf7797ee0d73c00923f87b89f40af979 [0,1,0,0,0,0|0,0,0]=1 50 B20R0.195923 O=C(O)CN(CCN(CC(=O)O)CC(O)CF)CC(=O)O 4e4409dd398dd56f74a1e5eed5c13ac6 [0,1,0,0,0,0|1,0,1]=3 51 B20R0.195923 O=C(O)CN(CCN(CC(=O)O)CC(O)CO)CC(=O)O b218942cb509e2220168790159c452aa [0,1,0,0,0,0|0,0,2]=3 52 B20R0.195923 O=C(O)CN(CCN(CC(=O)O)C[C@@H](O)CO)CC(=O)O b991cf66a87fd3f78f09523f59189747 [0,1,0,0,0,0|0,0,2]=3 53 B20R0.195923 O=C(O)CN(CCN(CC(=O)O)C[C@H](O)CO)CC(=O)O 1d9bf10ebe5f73b8e949542311925695 [0,1,0,0,0,0|0,0,2]=3 54 B20R0.432843 CC(C)(C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O c79c575ead1ad982b78cea2bfc58bd90 [0,1,0,0,0,0|2,0,1]=4 55 B20R0.432843 CC(C)(F)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O efbe9cf08cdd582ad4f7f1d76d8492a2 [0,1,0,0,0,0|2,0,1]=4 56 B20R0.432843 CC(C)(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O a5182808cc96aeb30829dc414029fe0b [0,1,0,0,0,0|1,0,1]=3 57 B20R0.432843 CC(F)(F)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 08abe83af094f022a20c8a22da8c6655 [0,1,0,0,0,0|2,0,1]=4 58 B20R0.432843 CS(=O)(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 26086d1606adbd2bd00fe467f0cb8d0b [0,1,0,0,0,0|1,0,1]=3 59 B20R0.432843 O=C(O)CN(CCN(CC(=O)O)CC(F)(F)F)CC(=O)O 714c50eccffc79a9bf9a6cd695e8b5bc [0,1,0,0,0,0|2,0,1]=4 60 B20R0.432843 O=C(O)CN(CCN(CC(=O)O)CS(=O)(=O)O)CC(=O)O 358d437591505cb79b2268b303ab3bb4 [0,1,0,0,0,0|1,0,0]=2 61 B20R1.1952215 O=C(O)CN(CCN(CC(=O)O)CC1CC1)CC(=O)O f17d23f66172b4d5b21332a771e1b624 [0,0,0,1,0,0|2,0,1]=4 62 B18R0.37701 CC(C)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O e763c91a08fe10896e30d66fa2ba2a6f [0,0,0,0,1,0|2,0,1]=4 63 B20R0.90194 C/C(=C/CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)/I 534e7f3c1a9bc27d9fcdc0af1ae6caba [0,0,0,0,0,1|2,0,0]=3 64 B20R0.90194 C/C(=C\CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)/Cl 63ef0252234e56313e45890f8d006453 [0,0,0,0,0,1|2,0,0]=3 65 B20R0.90194 C=C(C)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 2d49c75acdece7f787f2139bce4c8275 [0,0,0,0,0,1|2,0,0]=3 66 B20R0.90194 CC(=CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)C f6432de69ff645d350b9a325ae64b085 [0,0,0,0,0,1|2,0,0]=3 67 B20R0.90194 CC(=CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)Cl 7784fc2ddb1e6b7f2b936eec76dab98e [0,0,0,0,0,1|2,0,0]=3 68 B20R0.90194 CC(=CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)I c51f70425b53fdc2d138a3e1b4193104 [0,0,0,0,0,1|2,0,0]=3 69 B20R0.90194 CC(=O)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 9b05fcb413c28190a754a369baf93dfa [0,0,0,0,0,1|1,0,0]=2 70 B20R0.90194 CC(=O)OCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 2eb79870f47409cbd7d39682a6ada13d [0,0,0,0,0,1|1,0,0]=2 71 B20R0.90194 CC(C)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O a2c943ca650a3c57d2f3c2981c08cc5a [0,0,0,0,0,1|2,0,1]=4 72 B20R0.90194 CC(C)OCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O f2b713b0e52d46ccdb0665b71657abaa [0,0,0,0,0,1|2,0,1]=4 73 B20R0.90194 CC(O)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 927b394379b5d6f7e41778c34f2aca81 [0,0,0,0,0,1|1,0,1]=3 74 B20R0.90194 CN(C)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 885f07722d59ad8a66ed8e418af33f64 [0,0,0,0,0,1|3,0,0]=4 75 B20R0.90194 CS(=O)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O c10b8513a4ce03d23054f7e52fa0e7a3 [0,0,0,0,0,1|2,0,0]=3 76 B20R0.90194 NC(=O)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 1e42c9a22e328ffdf80e79e19308de63 [0,0,0,0,0,1|1,0,0]=2 77 B20R0.90194 NC(=O)SCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 0a20427c6c71dbb7bf997118c1e97e3c [0,0,0,0,0,1|1,0,0]=2 78 B20R0.90194 O=C(O)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 889f7c66597008c425165077236426da [0,0,0,0,0,1|0,0,0]=1 79 B20R0.90194 O=C(O)CN(CC=C(Cl)Cl)CCN(CC(=O)O)CC(=O)O 191f522747bb6c0299e435d3363c912e [0,0,0,0,0,1|2,0,0]=3 80 B17R0.41534 CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 91b12ee95b287e4c7079d38bdd440b7b [2,0,0,0,0,0|0,0,1]=3 81 B17R0.41534 O=C(O)CN(CF)CCN(CC(=O)O)CC(=O)O c1bd7b2ea44edc6f4b88ceae6d9c88ba [2,0,0,0,0,0|1,0,0]=3 82 B17R0.41534 O=C(O)CN(CO)CCN(CC(=O)O)CC(=O)O ddfdccd17b8031225aab2d082c09d714 [2,0,0,0,0,0|0,0,0]=2 83 B19R0.4314 C#CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 72487e9ade72e9109ff7c231dce20e27 [1,1,0,0,0,0|1,0,1]=4 84 B19R0.4314 C/C=C/CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 79e26dbe00a13d7ea91f8790c9846e85 [1,1,0,0,0,0|1,0,0]=3 85 B19R0.4314 C/C=C\CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 588eaa3677e44ec45a34df50083c9b48 [1,1,0,0,0,0|1,0,0]=3 86 B19R0.4314 C=CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 7ed1ba932060bb2ba1f3664eac16cad1 [1,1,0,0,0,0|1,0,0]=3 87 B19R0.4314 CCCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 163e3a2dcf6da9c780ff7cb0c534631c [1,1,0,0,0,0|1,0,1]=4 88 B19R0.4314 CCOCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 74013f23aa589b6bf473f874a1a3acfc [1,1,0,0,0,0|1,0,1]=4 89 B19R0.4314 COCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 6eb5e63db59180920a3c321f615a7903 [1,1,0,0,0,0|0,0,1]=3 90 B19R0.4314 CSCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 33dbe5a7fd10075984cc826f626b477d [1,1,0,0,0,0|0,1,1]=4 91 B19R0.4314 N#CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O a6c87d8b26b77b9e93fec1b92bf401df [1,1,0,0,0,0|1,0,1]=4 92 B19R0.4314 O=C(O)CN(C/C=C/Cl)CCN(CC(=O)O)CC(=O)O 07083eba1f8bb095261c010302d02821 [1,1,0,0,0,0|1,0,0]=3 93 B19R0.4314 O=C(O)CN(C/C=C\Cl)CCN(CC(=O)O)CC(=O)O 7f63377d3751b8dd3d19cff71eca9d75 [1,1,0,0,0,0|1,0,0]=3 94 B19R0.4314 O=C(O)CN(C/C=C\O)CCN(CC(=O)O)CC(=O)O 162446a3d44cab0a9c00cff50878af3a [1,1,0,0,0,0|0,0,0]=2 95 B19R0.4314 O=C(O)CN(CCCF)CCN(CC(=O)O)CC(=O)O 03a87b6fe7f8d420eed2990d3ecb0b42 [1,1,0,0,0,0|1,0,1]=4 96 B19R0.4314 O=C(O)CN(CCCO)CCN(CC(=O)O)CC(=O)O 6abd891cebd175ac334121f49acbf718 [1,1,0,0,0,0|0,0,1]=3 97 B19R0.4314 O=C(O)CN(CCCS)CCN(CC(=O)O)CC(=O)O 761bec51dce368252cf73652ec123a6c [1,1,0,0,0,0|0,1,1]=4 98 B19R0.4314 O=CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 86bbabe2c19f024951b3ea9709016df8 [1,1,0,0,0,0|0,0,0]=2 99 B19R0.152081 C=CC(C)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O 2a8861cd8b9bf6ae77009f1717f805a8 [1,1,0,0,0,0|1,0,0]=3 100 B19R0.152081 CC(C=O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O c2954688d3400c20ff2197b836d6eb21 [1,1,0,0,0,0|0,0,0]=2 101 B19R0.152081 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CCS(=O)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 9ae204029155ba01a5186850780a2f2f [0,1,0,0,0,1|2,0,0]=4 111 B21R0.285614 CNC(=O)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 7c4f1d41e900c5ddc36936c057d84076 [0,1,0,0,0,1|1,0,0]=3 112 B21R0.285614 COC(=O)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O e947a49d815dfcaa75346f9c2f11ccf9 [0,1,0,0,0,1|0,0,0]=2 113 B21R0.285614 COC(=O)OCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O a66ef311f63b4e5e51a91742e033a337 [0,1,0,0,0,1|0,0,0]=2 114 B21R0.793935 C=C(CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)C(=O)O 62aa4af245e841787afbfa947af3322c [0,1,0,0,0,1|0,0,0]=2 115 B21R0.793935 C=C(I)[C@H](C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O dff8a925f3a4fd5023ebc609c843d4c2 [0,1,0,0,0,1|2,0,0]=4 116 B21R0.793935 CC(=O)C(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 19f311254c56c8bb57b50500b7c5a990 [0,1,0,0,0,1|1,0,0]=3 117 B21R0.793935 CC(CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)C(=O)O 497e2973ca7463fcc5c5e2963f00b63e [0,1,0,0,0,1|0,0,0]=2 118 B21R0.793935 O=C(O)CN(CCN(CC(=O)O)CC(=C(Cl)Cl)Cl)CC(=O)O a0cd05fc6b72935025b1aa6347ddf747 [0,1,0,0,0,1|2,0,0]=4 119 B21R0.793935 O=C(O)CN(CCN(CC(=O)O)CC(=O)C(=O)O)CC(=O)O b508b5204c74eaa30ebab2f16c4d4b3e [0,1,0,0,0,1|0,0,0]=2 120 B21R0.793935 O=C(O)CN(CCN(CC(=O)O)CC(O)C(=O)O)CC(=O)O a5c9ebbeac332fc73c1c2264bbe63c76 [0,1,0,0,0,1|0,0,0]=2 121 B21R0.793935 O=C(O)CN(CCN(CC(=O)O)C[C@H](O)C(=O)O)CC(=O)O dc98d812b1eb8e0077d2aac0ffa7f307 [0,1,0,0,0,1|0,0,0]=2 122 B21R0.797026 CC(C)(O)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 00c7a55c0e778c72c168fe6552ad0734 [0,1,0,0,0,1|1,0,1]=4 123 B21R0.797026 CS(=O)(=O)CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 14adeff16e744a6936ef48a4eb3adf0a [0,1,0,0,0,1|1,0,1]=4 124 B21R0.797026 O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CCS(=O)(=O)O 9a0f60613d2afac46927418d39c5e255 [0,1,0,0,0,1|1,0,0]=3 125 B21R0.797026 O=C(O)CN(CCN(CC(=O)O)CC(=O)O)COS(=O)(=O)Cl 93d74885c5b6934fe101d30eb6857424 [0,1,0,0,0,1|1,0,1]=4 126 B21R0.210095 CCC(=O)C(C)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O 45492161c7ef73b8717173fd5df872ad [0,2,0,0,0,0|1,0,0]=3 127 B21R0.210095 COC(=O)C(C)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O 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O=C(O)CN(CCN(CC(=O)O)[C@@H](CO)C(=O)O)CC(=O)O 33bc5dc5a3644241b71cff86fa7b0ebf [0,2,0,0,0,0|0,0,0]=2 137 B21R0.1363258 O=C(O)CN(CCN(CC(=O)O)[C@H](CO)C(=O)O)CC(=O)O 5e954e618d2d19a20e6ba6ac9bd93959 [0,2,0,0,0,0|0,0,0]=2 138 B21R0.2028064 CC(N(CCN(CC(=O)O)CC(=O)O)CC(=O)O)C(C)(C)O caf25f5508037238c287eea55f566f13 [0,2,0,0,0,0|1,0,1]=4 139 B21R0.187906 C=COC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 921c2c9e54ba9988d92351302fb2cb90 [0,2,0,0,0,0|0,0,0]=2 140 B21R0.187906 CCCC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 99110ba40ab5c245646ae9e57b424754 [0,2,0,0,0,0|1,0,0]=3 141 B21R0.187906 CCNC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O e132f2ff04e3418798647b037e7e2a12 [0,2,0,0,0,0|1,0,0]=3 142 B21R0.187906 CCOC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O a67d0549d08d7d39b3e827807546ee28 [0,2,0,0,0,0|0,0,0]=2 143 B21R0.187906 COCC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 650597082da10aa42e283eb8f289a051 [0,2,0,0,0,0|0,0,0]=2 144 B21R0.187906 COCC(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O e245fbfac3d2cf598ea0d4e86815d53f [0,2,0,0,0,0|0,0,2]=4 145 B21R0.187906 N#CCC(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O bb22b2fecc2019562177afebd814f898 [0,2,0,0,0,0|1,0,1]=4 146 B21R0.187906 N#CC[C@@H](O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 16e05c7f3b80a1231dc9d4d7ccad2c44 [0,2,0,0,0,0|1,0,1]=4 147 B21R0.187906 N#CC[C@H](O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O a164b23af73fc29a40f04b438194b451 [0,2,0,0,0,0|1,0,1]=4 148 B21R0.187906 O=C(O)CN(CCN(CC(=O)O)CC(=O)NCO)CC(=O)O 461c7e087d204661547292696049d512 [0,2,0,0,0,0|0,0,0]=2 149 B21R0.187906 O=C(O)CN(CCN(CC(=O)O)C[C@@H](O)CCO)CC(=O)O 6922592febc64ef5132409b143cf4be6 [0,2,0,0,0,0|0,0,2]=4 150 B21R0.375650 CC(C)(CO)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O ed68e86f3c4c8cbfdb3cd12168fea7a8 [0,2,0,0,0,0|1,0,1]=4 151 B21R0.375650 CNS(=O)(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 953a2a05517523b29e63182533aaee81 [0,2,0,0,0,0|1,0,1]=4 152 B21R0.375650 COC(C)(C)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 97861324fc9fb2b8448b2b6a21015d59 [0,2,0,0,0,0|1,0,1]=4 153 B21R0.1381641 CCC(CO)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 42de4336e6ee2865f9f09259f940d0f2 [0,2,0,0,0,0|1,0,1]=4 154 B21R0.1381641 COC(CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)OC fa40fc53729707bad03556445fe941f2 [0,2,0,0,0,0|0,0,2]=4 155 B21R1.5833733 O=C(O)CN(CCN(CC(=O)O)C1CC(C1)O)CC(=O)O 2461287abdf85273969c4dd5eda86dea [0,0,0,1,0,1|1,0,1]=4 156 B21R1.1517276 O=C(O)CN(CCN(CC(=O)O)CC1CCO1)CC(=O)O 6557aaa29044a0f805a7610f3fca9689 [0,1,0,1,0,0|1,0,1]=4 157 B21R1.1517276 O=C(O)CN(CCN(CC(=O)O)CC1COC1)CC(=O)O f572276fedddd2c0d306ace708a58c95 [0,1,0,1,0,0|1,0,1]=4 158 B21R1.1517276 O=C(O)CN(CCN(CC(=O)O)C[C@@H]1CCO1)CC(=O)O 02e4eda44830a759df745a0713199afb [0,1,0,1,0,0|1,0,1]=4 159 B21R1.1517276 O=C(O)CN(CCN(CC(=O)O)C[C@H]1CCO1)CC(=O)O 6d608bc1b1c1cf82bc5e0974ff429f20 [0,1,0,1,0,0|1,0,1]=4 160 B21R1.1954476 O=CC1CC1N(CCN(CC(=O)O)CC(=O)O)CC(=O)O 50396fe5ea8530ca79084b08b4d3f0df [0,1,0,1,0,0|1,0,1]=4 161 B19R0.59288 O=C(O)CC(NCCN(CC(=O)O)CC(=O)O)C(=O)O 327ff14972ec05545e23c0122f0e02b2 [0,0,0,0,1,1|1,0,0]=3 162 B19R0.59288 O=C(O)CC(OCCN(CC(=O)O)CC(=O)O)C(=O)O 66d6fdf02ad2f2f385ffe87de5a8b779 [0,0,0,0,1,1|1,0,0]=3 163 B19R0.59288 O=C(O)C[C@@H](NCCN(CC(=O)O)CC(=O)O)C(=O)O c4c4daf2e780c18b417b1bab1eb6dded [0,0,0,0,1,1|1,0,0]=3 164 B19R0.59288 O=C(O)C[C@H](NCCN(CC(=O)O)CC(=O)O)C(=O)O 53c0503dcc5a95a422600b0637c6c428 [0,0,0,0,1,1|1,0,0]=3 165 B21R0.271287 C=C(C)CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 0e012b6b12ea813fd988a6102204d428 [0,0,0,0,0,2|2,0,0]=4 166 B21R0.271287 CC(=CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O)C 9e87762e3f79cdba03d88bb10b340a4e [0,0,0,0,0,2|2,0,0]=4 167 B21R0.271287 CC(=O)CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O c9ec38f7c81286104161d6f32290f420 [0,0,0,0,0,2|1,0,0]=3 168 B21R0.271287 CC(=O)NCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 2fbc56df3054a93799bddd42bb978c0d [0,0,0,0,0,2|1,0,0]=3 169 B21R0.271287 CC(=O)OCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 4c9b8bc6429ff3e16565d171f4c8456b [0,0,0,0,0,2|1,0,0]=3 170 B21R0.271287 CC(=O)SCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O eff4070c869f9f8f422de460f8b478b4 [0,0,0,0,0,2|1,0,0]=3 171 B21R0.271287 CC(O)CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 615d36ec2ca563e8eebbe8606d128331 [0,0,0,0,0,2|1,0,1]=4 172 B21R0.271287 NC(=O)CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 83b5bf462fb02073134cef48df329ac5 [0,0,0,0,0,2|1,0,0]=3 173 B21R0.271287 NC(=O)NCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 8f4f0c79db18223c43e07190b6b02953 [0,0,0,0,0,2|1,0,0]=3 174 B21R0.271287 O=C(O)/C=C/CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O f8e55aafa9589f1293cdf70561cb7a67 [0,0,0,0,0,2|0,0,0]=2 175 B21R0.271287 O=C(O)C=CCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 795f5bcb319fcfd4ac4e54ed1f9b2de2 [0,0,0,0,0,2|0,0,0]=2 176 B21R0.271287 O=C(O)CCCN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 5997c8f358f8cd26c8db1484c773885e [0,0,0,0,0,2|0,0,0]=2 177 B21R0.271287 O=C(O)CN(CCC=C(F)F)CCN(CC(=O)O)CC(=O)O d2f7064efb110b234a6686ab12920d6c [0,0,0,0,0,2|2,0,0]=4