0 B6R0.3 CCN(C)C(=O)C ad9227383f4996d412a5ced11e9c5417 [0,0,0,0,0,0|4,0,0]=4 1 B5R0.3 CCN(C)C=O 60ddb02da2ac3e0bbf46f02c328ae40d [1,0,0,0,0,0|3,0,0]=4 2 B7R0.5 CC(=O)C(C)OCF 7c6a7a2752d146ccb367c2a6ec272a5d [0,1,0,0,0,0|3,0,0]=4 3 B7R0.5 CC(=O)N(C)CCO ba457e3be79fea19f791558c60ef2a77 [0,1,0,0,0,0|3,0,0]=4 4 B7R0.5 CC(NC#N)C(=O)O 392de9697c4a5dcddc67adbe8abaabb3 [0,1,0,0,0,0|2,0,1]=4 5 B7R0.5 CC(NCF)C(=O)N f0a5cc6cd244223372790316f7e61f94 [0,1,0,0,0,0|3,0,0]=4 6 B7R0.5 CC(NCF)C(=O)O 678d57d218e04263cf06f7d55d31cd1d [0,1,0,0,0,0|2,0,0]=3 7 B7R0.5 CC(NCO)C(=O)N f8080c17d94f9bd121a85d094899f029 [0,1,0,0,0,0|2,0,0]=3 8 B7R0.5 CC(NCO)C(=O)O fe4a7856b889669392c300fb3cd4873c [0,1,0,0,0,0|1,0,0]=2 9 B7R0.5 CC(O)C(C)NCO f5ad7a8ea3ea402c77cd7eb338910db7 [0,1,0,0,0,0|2,0,1]=4 10 B7R0.5 CC(OCF)C(=O)N 6a877ba17ca7a0aa924ab8a787d3d31c [0,1,0,0,0,0|3,0,0]=4 11 B7R0.5 CC(OCF)C(=O)O 98938b6366d5b1644ffb60bc89cae3d5 [0,1,0,0,0,0|2,0,0]=3 12 B7R0.5 CCNC(C)C(=O)N 7d9101ed45213ee882e4c1680fbf78d8 [0,1,0,0,0,0|3,0,0]=4 13 B7R0.5 CCNC(C)C(=O)O a9b19181316f90f96751c71a39f085a0 [0,1,0,0,0,0|2,0,0]=3 14 B7R0.5 CCNC(O)C(=O)O e57bdce4aa01317f2f019ff8528e5629 [0,1,0,0,0,0|2,0,0]=3 15 B7R0.5 CCN[C@@H](C)C(=O)N d3ef0fda784c6fd3be35dd07570fe081 [0,1,0,0,0,0|3,0,0]=4 16 B7R0.5 CCN[C@@H](C)C(=O)O fcc04b18ffb8702755c5613065d53d85 [0,1,0,0,0,0|2,0,0]=3 17 B7R0.5 CCN[C@H](C)C(=O)N ced1ae1ac0990c4f7a1ff4ddde70a04d [0,1,0,0,0,0|3,0,0]=4 18 B7R0.5 CCN[C@H](C)C(=O)O 461a17ce9e067f5c1d30933bc07d8775 [0,1,0,0,0,0|2,0,0]=3 19 B7R0.5 CCOC(C)C(=O)C 04432572fe22b740e86ca5259d0a3bbf [0,1,0,0,0,0|3,0,0]=4 20 B7R0.5 CCOC(C)C(=O)N 3ce53fe24b247e6bbc8d0161ba8adc8b [0,1,0,0,0,0|3,0,0]=4 21 B7R0.5 CCOC(C)C(=O)O 1968a3bf4eb23bbce80f27001c40e3aa [0,1,0,0,0,0|2,0,0]=3 22 B7R0.5 CCO[C@@H](C)C(=O)N 886b096e99d61dadf66cd020bfb7d1de [0,1,0,0,0,0|3,0,0]=4 23 B7R0.5 CCO[C@@H](C)C(=O)O f2b03ca68b0ab7d2700716b8fff09b6d [0,1,0,0,0,0|2,0,0]=3 24 B7R0.5 CCO[C@H](C)C(=O)N 8689cd95b03a5d9ff73691cd92fc4b07 [0,1,0,0,0,0|3,0,0]=4 25 B7R0.5 CCO[C@H](C)C(=O)O 156314018bee2c048aecc9ba30245a68 [0,1,0,0,0,0|2,0,0]=3 26 B7R0.5 C[C@@H](NC#N)C(=O)O e0e1898c2dc69a65dfbe178be463caf4 [0,1,0,0,0,0|2,0,1]=4 27 B7R0.5 C[C@@H](NCF)C(=O)N fc8e15aaec185b1ab510ce9a3e07d389 [0,1,0,0,0,0|3,0,0]=4 28 B7R0.5 C[C@@H](NCF)C(=O)O 17fa37c81497338871dce635035053b9 [0,1,0,0,0,0|2,0,0]=3 29 B7R0.5 C[C@@H](NCO)C(=O)N 40aeb7a188f95caf183e4558e0c9a7d0 [0,1,0,0,0,0|2,0,0]=3 30 B7R0.5 C[C@@H](NCO)C(=O)O a97b9962f90d67259e383605fc714644 [0,1,0,0,0,0|1,0,0]=2 31 B7R0.5 C[C@@H](OCF)C(=O)N a8a242c6e5e7f1df942e8a00c665aaa2 [0,1,0,0,0,0|3,0,0]=4 32 B7R0.5 C[C@@H](OCF)C(=O)O eca3562769119aefebca30b8cb46ef3d [0,1,0,0,0,0|2,0,0]=3 33 B7R0.5 C[C@H](NC#N)C(=O)O 001f1128fc667ba9af909598a06ab98b [0,1,0,0,0,0|2,0,1]=4 34 B7R0.5 C[C@H](NCF)C(=O)N ec9ad2764694c43582e2759286389cce [0,1,0,0,0,0|3,0,0]=4 35 B7R0.5 C[C@H](NCF)C(=O)O 8f95fb8302879a9840726de50eb63034 [0,1,0,0,0,0|2,0,0]=3 36 B7R0.5 C[C@H](NCO)C(=O)N e220146cab979067711359ee78003370 [0,1,0,0,0,0|2,0,0]=3 37 B7R0.5 C[C@H](NCO)C(=O)O 22dff04db3c7b130eddc4a545a3e505d [0,1,0,0,0,0|1,0,0]=2 38 B7R0.5 C[C@H](OCF)C(=O)N cc20e1724629715f568aafa6de2ccb26 [0,1,0,0,0,0|3,0,0]=4 39 B7R0.5 C[C@H](OCF)C(=O)O 3b1dcb29a34b79a18541896ae618cad0 [0,1,0,0,0,0|2,0,0]=3 40 B7R0.5 O=C(O)C(O)NCF debbdbf9e1d3d8838357ca1b62835c9a [0,1,0,0,0,0|2,0,0]=3 41 B7R0.5 O=C(O)C(O)NCO 6aca03582d286fba98508921a1d70ae3 [0,1,0,0,0,0|1,0,0]=2 42 B7R0.10 CC(CO)N(C)C=O 4659927dd4489ef42e67e78276d3b1b4 [0,1,0,0,0,0|3,0,0]=4 43 B7R0.10 CCN(C)C(=O)CO ed09d31f2cea5da5288bffcd06a685cb [0,1,0,0,0,0|3,0,0]=4 44 B7R0.10 C[C@@H](CO)N(C)C=O b94b965b512745cf284fdc052a9474ae [0,1,0,0,0,0|3,0,0]=4 45 B7R0.10 C[C@H](CO)N(C)C=O c4c1d9e89c0731cbc76ea32ef421fbca [0,1,0,0,0,0|3,0,0]=4 46 B7R0.2 CC(=O)NC(C)CO 5b33fe0ccef9f04a2ffcb97aafaea882 [0,0,0,0,0,1|2,0,0]=3 47 B7R0.2 CC(=O)N[C@@H](C)CO 6858caa5d94a6988c3c1bcaa83d0b2b8 [0,0,0,0,0,1|2,0,0]=3 48 B7R0.2 CC(=O)N[C@H](C)CO 0b20f01b94b45fad0762ce944038f07e [0,0,0,0,0,1|2,0,0]=3 49 B7R0.2 CCC(C)NC(=O)C d52a9bb324dcdb60d53e4e9e2013cb50 [0,0,0,0,0,1|3,0,0]=4 50 B7R0.2 CCN(C)CC(=O)O ed00a192e609f5d5786e1c989c44eb8f [0,0,0,0,0,1|3,0,0]=4 51 B7R0.2 CC[C@@H](C)NC(=O)C c6d5d80303dcfd2ae6eb945ac41b31c0 [0,0,0,0,0,1|3,0,0]=4 52 B7R0.2 CC[C@H](C)NC(=O)C 96d2ad332d2a7d6643a2730e644df4f3 [0,0,0,0,0,1|3,0,0]=4 53 B7R0.2 CN(CF)CC(=O)O 7d1eb1d71c500640f6029a70869bff49 [0,0,0,0,0,1|3,0,0]=4 54 B7R0.2 CN(CO)CC(=O)N 731e626c7cf4b35c02c8b97f3321d2b5 [0,0,0,0,0,1|3,0,0]=4 55 B7R0.2 CN(CO)CC(=O)O e8788fe9a5132c43f9e5136dbe3278ce [0,0,0,0,0,1|2,0,0]=3 56 B6R0.1 CN(C=O)CCO dd7ac64299075a3391875b374e6c88cd [1,1,0,0,0,0|2,0,0]=4 57 B6R0.1 CN(CO)CCO 54f662b94257417f82a22aa2c84d65c3 [1,1,0,0,0,0|2,0,0]=4 58 B6R0.4 C=C(Br)CNCO adc279aef6f40140095a017583e56582 [1,1,0,0,0,0|2,0,0]=4 59 B6R0.4 C=C(C)CNCO aed1efb8ed6b634f66b125805c14e3c3 [1,1,0,0,0,0|2,0,0]=4 60 B6R0.4 CC(=O)CNCF b7881e88fb8b8e6cf10e5a033e11f317 [1,1,0,0,0,0|2,0,0]=4 61 B6R0.4 CC(=O)CNCO 088e087d20fb510bb88def586900e34f [1,1,0,0,0,0|1,0,0]=3 62 B6R0.4 CC(=O)COCF dfbfbe0c756744937aaeae603856ac60 [1,1,0,0,0,0|2,0,0]=4 63 B6R0.4 CC(=O)NCCBr a50b84b8e00a5eea33926a7cde86e5c2 [1,1,0,0,0,0|2,0,0]=4 64 B6R0.4 CC(=O)NCCF 40474d3cc8ff0aef7c3ef76344b9eebb [1,1,0,0,0,0|2,0,0]=4 65 B6R0.4 CC(=O)NCCI baf3590450994f173452759880fb646a [1,1,0,0,0,0|2,0,0]=4 66 B6R0.4 CC(=O)NCCO c7b03ecf194f0f03f4d08fd319920ef5 [1,1,0,0,0,0|1,0,0]=3 67 B6R0.4 CC(=O)NCCS 3cdd66626928bc1a9bac11e682b344a1 [1,1,0,0,0,0|1,1,0]=4 68 B6R0.4 CC(O)CNCO e374449d449cacbe0a46d6d64f7dfbfc [1,1,0,0,0,0|1,0,1]=4 69 B6R0.4 CCCNC(=O)C 2a730f252c249036b45b0d2d9cd73ca4 [1,1,0,0,0,0|2,0,0]=4 70 B6R0.4 CCNCC(=O)C f174d94c45d739e3b909d0bcb7f774b6 [1,1,0,0,0,0|2,0,0]=4 71 B6R0.4 CCNCC(=O)N 9af72e08b410c4df60bd96241a267974 [1,1,0,0,0,0|2,0,0]=4 72 B6R0.4 CCNCC(=O)O 4ff54ca579c6d0dc364629f4b9806db8 [1,1,0,0,0,0|1,0,0]=3 73 B6R0.4 CCOCC(=O)C 810b545b1a0c4af358d406c93928b4de [1,1,0,0,0,0|2,0,0]=4 74 B6R0.4 CCOCC(=O)N 8c3995d7bbe4bbb5793da2590cf6473e [1,1,0,0,0,0|2,0,0]=4 75 B6R0.4 CCOCC(=O)O ebe16b0612391447f19756491b2bd7a3 [1,1,0,0,0,0|1,0,0]=3 76 B6R0.4 CCOCS(=O)O 631a28bb34068ba6343c83c466f36b33 [1,1,0,0,0,0|2,0,0]=4 77 B6R0.4 C[C@@H](O)CNCO 41205defeb3accd5b70255f13cc7fa6b [1,1,0,0,0,0|1,0,1]=4 78 B6R0.4 C[C@H](O)CNCO 9710122b7591011cacd5f47cf98b8818 [1,1,0,0,0,0|1,0,1]=4 79 B6R0.4 N#CNCC(=O)O 43756775e2c27a3310cd33c2c2160b96 [1,1,0,0,0,0|1,0,1]=4 80 B6R0.4 NC(=O)CNCF 1d1f788bdfbf1bf0db2a27d18231d6bd [1,1,0,0,0,0|2,0,0]=4 81 B6R0.4 NC(=O)CNCO d301de02518fc5358c97c5b15c4b68ec [1,1,0,0,0,0|1,0,0]=3 82 B6R0.4 NC(=O)COCF 5fb009cd2e813c9f1f9e35766b0ec8cb [1,1,0,0,0,0|2,0,0]=4 83 B6R0.4 O=C(O)CNCF d8e91f69db1ad3140a3502718cd0d10f [1,1,0,0,0,0|1,0,0]=3 84 B6R0.4 O=C(O)CNCO 03950869097643d435459ad5a0985e95 [1,1,0,0,0,0|0,0,0]=2 85 B6R0.4 O=C(O)COCF 7c32fa44d83e7ce6c73842137b12fe20 [1,1,0,0,0,0|1,0,0]=3 86 B6R0.4 O=S(O)COCF bc49b5a9355facf362625f551c5693d0 [1,1,0,0,0,0|2,0,0]=4 87 B8R0.2 CC(=O)N(C)C(C)CO 954909c32608c887b20279d0f2f3780c [0,1,0,0,0,1|2,0,0]=4 88 B8R0.2 CC(=O)N(C)[C@@H](C)CO 225dc8a4ffcea4cd61a90a38a4080118 [0,1,0,0,0,1|2,0,0]=4 89 B8R0.2 CC(=O)N(C)[C@H](C)CO de33b62e9836c68164793809e4e8e5b1 [0,1,0,0,0,1|2,0,0]=4 90 B8R0.2 CC(C(=O)O)N(C)CO b0a7b81e88a446de30ff43a7aa3ff0e5 [0,1,0,0,0,1|2,0,0]=4 91 B8R0.2 C[C@@H](C(=O)O)N(C)CO c3f75a694235527c6388e6d7e2f17c01 [0,1,0,0,0,1|2,0,0]=4 92 B8R0.2 C[C@H](C(=O)O)N(C)CO 5d794c52438840dfb85878a5327b44ff [0,1,0,0,0,1|2,0,0]=4 93 B8R0.5 CC(=O)NC(C)CCO 31015bb8805fb64762d130a6b4b7d734 [0,1,0,0,0,1|2,0,0]=4 94 B8R0.5 CC(=O)N[C@@H](C)CCO 4818866c214b230552dc5531d2d7dacb [0,1,0,0,0,1|2,0,0]=4 95 B8R0.5 CC(=O)N[C@H](C)CCO d4f1175f550aed36e673eb7917598f76 [0,1,0,0,0,1|2,0,0]=4 96 B8R0.5 CC(CC(=O)O)NCF 84d4be16e4ac304aaa68ed4d36823324 [0,1,0,0,0,1|2,0,0]=4 97 B8R0.5 CC(CC(=O)O)NCO 10996b09f91fab84edb45bd9880e2318 [0,1,0,0,0,1|1,0,0]=3 98 B8R0.5 CC(CC(=O)O)OCF 14e16352da0b978e8e37b50cbc803026 [0,1,0,0,0,1|2,0,0]=4 99 B8R0.5 CCNC(C)CC(=O)O 29ac9bd89e468a34801bb550215ba942 [0,1,0,0,0,1|2,0,0]=4 100 B8R0.5 CCN[C@@H](C)CC(=O)O 40a529d5929c8901c8f2b9599ed898cd [0,1,0,0,0,1|2,0,0]=4 101 B8R0.5 CCN[C@H](C)CC(=O)O 2f28d4f7bc57f1ad1bf5a4eebcdf11f3 [0,1,0,0,0,1|2,0,0]=4 102 B8R0.5 CCOC(C)CC(=O)O 20f52735b4f115013d658aa30fd851a1 [0,1,0,0,0,1|2,0,0]=4 103 B8R0.5 CCO[C@@H](C)CC(=O)O 2297bbd28bfec2b7a3315f1a1eca242e [0,1,0,0,0,1|2,0,0]=4 104 B8R0.5 CCO[C@H](C)CC(=O)O ccc8e46cafa360247330bb81a3001d13 [0,1,0,0,0,1|2,0,0]=4 105 B8R0.5 CN(CCO)CC(=O)O e22eedcab85615a7cb9a01481995f5a1 [0,1,0,0,0,1|2,0,0]=4 106 B8R0.5 COCC(C)NC(=O)C d3030be71efb57415a6640caba792cb5 [0,1,0,0,0,1|2,0,0]=4 107 B8R0.5 COCN(C)CC(=O)O 38182438be3a4fb938d35352c6bcaa17 [0,1,0,0,0,1|2,0,0]=4 108 B8R0.5 COC[C@@H](C)NC(=O)C e26de4ebd7327dac480ea010b3a6df2f [0,1,0,0,0,1|2,0,0]=4 109 B8R0.5 COC[C@H](C)NC(=O)C 4d6a771b34650f584286aeb4b67fe92b [0,1,0,0,0,1|2,0,0]=4 110 B8R0.5 C[C@@H](CC(=O)O)NCF 7b4409b263377324cee992cead4d4496 [0,1,0,0,0,1|2,0,0]=4 111 B8R0.5 C[C@@H](CC(=O)O)NCO 6f9af837429cbf13d74a82abb33116db [0,1,0,0,0,1|1,0,0]=3 112 B8R0.5 C[C@@H](CC(=O)O)OCF 3a1dfbb8c5aec4e4079809a87b6b3981 [0,1,0,0,0,1|2,0,0]=4 113 B8R0.5 C[C@H](CC(=O)O)NCF 6a82f1327e74ba81c2a6e57eb4cb9aac [0,1,0,0,0,1|2,0,0]=4 114 B8R0.5 C[C@H](CC(=O)O)NCO 3ee6882c6b18b0aec7272fad595282f5 [0,1,0,0,0,1|1,0,0]=3 115 B8R0.5 C[C@H](CC(=O)O)OCF 913e08b306bc95c6771408b42aad5ed2 [0,1,0,0,0,1|2,0,0]=4 116 B8R0.16 C=C[C@@H](CO)NC(=O)C aeb66beba94c776e664bf89f304fa11b [0,1,0,0,0,1|2,0,0]=4 117 B8R0.16 CC(=O)NC(CO)CO b933289767d5f896480a48145d3e5dd9 [0,1,0,0,0,1|2,0,0]=4 118 B8R0.16 CCC(CO)NC(=O)C 0fc969f502a685ac3a30dff22859fa62 [0,1,0,0,0,1|2,0,0]=4 119 B8R0.16 CCN(CO)CC(=O)O af04d4435f9e87502f4960e4fa163dc7 [0,1,0,0,0,1|2,0,0]=4 120 B8R0.16 CC[C@@H](CO)NC(=O)C ec21a63ea250126e0e8e11da71f403ff [0,1,0,0,0,1|2,0,0]=4 121 B8R0.16 CC[C@H](CO)NC(=O)C 6d8228e87e113704ba8a910f796088e1 [0,1,0,0,0,1|2,0,0]=4 122 B8R0.19 C#CC(=O)NC(C)CO ef2349063c35b76cf4d00bd3f49935ef [0,1,0,0,0,1|2,0,0]=4 123 B8R0.19 C#CC(=O)N[C@@H](C)CO 53eee74018b9e276710cf6173744a777 [0,1,0,0,0,1|2,0,0]=4 124 B8R0.19 C#CC(=O)N[C@H](C)CO 825248ab113484f971eda1437fa878f2 [0,1,0,0,0,1|2,0,0]=4 125 B8R0.19 C=CC(=O)NC(C)CO 7d704e5b0d02912153bbac9ab1524b4a [0,1,0,0,0,1|2,0,0]=4 126 B8R0.19 C=CC(=O)N[C@@H](C)CO d3eebdfcf0b68fe67805ed6261019c02 [0,1,0,0,0,1|2,0,0]=4 127 B8R0.19 C=CC(=O)N[C@H](C)CO b32e46cc4855adf1cdc7b98fc72ab8f3 [0,1,0,0,0,1|2,0,0]=4 128 B8R0.19 CC(CO)NC(=O)C=O 1c60e6f2c21701253617f70f64f6f106 [0,1,0,0,0,1|1,0,1]=4 129 B8R0.19 CC(CO)NC(=O)CF ef2266eb5061b2bffbd30285b120264a [0,1,0,0,0,1|2,0,0]=4 130 B8R0.19 CC(CO)NC(=O)CO 36e7f0a9d41f765505ec00dee787948b [0,1,0,0,0,1|1,0,0]=3 131 B8R0.19 CC(CO)NC(=O)CS 4ca68b24b40823bba6f492cc34b6d41b [0,1,0,0,0,1|1,1,0]=4 132 B8R0.19 CCC(=O)NC(C)CO 31f73ee0dabaaa5a17015c929f45f2fd [0,1,0,0,0,1|2,0,0]=4 133 B8R0.19 CCC(=O)N[C@@H](C)CO a3bcc6db0615cc40ae6703cd20d3dc45 [0,1,0,0,0,1|2,0,0]=4 134 B8R0.19 CCC(=O)N[C@H](C)CO 3449d5b097ace6785d86df28155e11e4 [0,1,0,0,0,1|2,0,0]=4 135 B8R0.19 CCC(C)NC(=O)CO 33a44afa4449469b04b268f3719a3e59 [0,1,0,0,0,1|2,0,0]=4 136 B8R0.19 CC[C@@H](C)NC(=O)CO 102bc53795a33daa61b0e6c2cdbc40e6 [0,1,0,0,0,1|2,0,0]=4 137 B8R0.19 CC[C@H](C)NC(=O)CO 7070ce3ef500a05442ee4538ea055e46 [0,1,0,0,0,1|2,0,0]=4 138 B8R0.19 COC(=O)CN(C)CO ead5047548ab9512878dca6e9fed3e38 [0,1,0,0,0,1|2,0,0]=4 139 B8R0.19 C[C@@H](CO)NC(=O)C=O 7fc1349ef4b9354cd9836d7dba2b3f46 [0,1,0,0,0,1|1,0,1]=4 140 B8R0.19 C[C@@H](CO)NC(=O)CF 2c1d0a1ab5fcd3bc348406e1eae8d857 [0,1,0,0,0,1|2,0,0]=4 141 B8R0.19 C[C@@H](CO)NC(=O)CO 4ef5922646eca2409cc0528bbe495536 [0,1,0,0,0,1|1,0,0]=3 142 B8R0.19 C[C@@H](CO)NC(=O)CS ecb25931c5ecf30a1072b0ef0c850951 [0,1,0,0,0,1|1,1,0]=4 143 B8R0.19 C[C@H](CO)NC(=O)C=O b148bc237154c303bdab4997b908c1ee [0,1,0,0,0,1|1,0,1]=4 144 B8R0.19 C[C@H](CO)NC(=O)CF 47adba76c977441bf582f65bebd39947 [0,1,0,0,0,1|2,0,0]=4 145 B8R0.19 C[C@H](CO)NC(=O)CO 02a86c975d92184b3a8afd5bdd788d80 [0,1,0,0,0,1|1,0,0]=3 146 B8R0.19 C[C@H](CO)NC(=O)CS ecf3d50d57e6bb41773d96b1c96ed61c [0,1,0,0,0,1|1,1,0]=4 147 B8R0.23 CC(=O)NC(C)C(C)O 82d78b22fd9c1b1cb9a6f73c5b23c29f [0,1,0,0,0,1|2,0,0]=4 148 B8R0.34 CC(=O)NC(C)(C)CO 79003794ec6500404906022922bddeef [0,1,0,0,0,1|2,0,0]=4 149 B8R0.3 CCOC(C)C(=O)OC 80e77c6690e50b9ea6c936f76ec2b497 [0,2,0,0,0,0|2,0,0]=4 150 B8R0.3 CCO[C@@H](C)C(=O)OC 0a1ea57ffacb6be3b6716af86dc8a3ee [0,2,0,0,0,0|2,0,0]=4 151 B8R0.3 CCO[C@H](C)C(=O)OC e42a135486ef83da240a803941dd4003 [0,2,0,0,0,0|2,0,0]=4 152 B8R0.3 CN(CCO)C(=O)CO 8de638bdca0f8ac1cf08b4f0e65806cd [0,2,0,0,0,0|2,0,0]=4 153 B8R0.3 CNC(=O)C(C)NCO a34e41a62dab697e3cedeec3c087b7b0 [0,2,0,0,0,0|2,0,0]=4 154 B8R0.3 COC(=O)C(C)OCF 225188b3064670e98f4e80d2140895bc [0,2,0,0,0,0|2,0,0]=4 155 B8R0.3 COC(=O)[C@@H](C)OCF 91f7505b58320e2d5e72e03fb5b0d0c5 [0,2,0,0,0,0|2,0,0]=4 156 B8R0.3 COC(=O)[C@H](C)OCF 1dbcfe62c201ad25840f7e5329cbdc78 [0,2,0,0,0,0|2,0,0]=4 157 B8R0.3 N#CNC(=O)C(O)CO d96238e8a07ca438831a5b665a7f807d [0,2,0,0,0,0|2,0,0]=4 158 B8R0.3 N#CNC(=O)[C@@H](O)CO ae4b53e979a1363b6b72717d8640536b [0,2,0,0,0,0|2,0,0]=4 159 B8R0.8 C#CCNC(C)C(=O)O 4b99b7020e460036fc14906401430936 [0,2,0,0,0,0|2,0,0]=4 160 B8R0.8 C#CCNC(O)C(=O)O c2f87445089f25c4b184d132413f8006 [0,2,0,0,0,0|2,0,0]=4 161 B8R0.8 C#CCN[C@@H](C)C(=O)O 10bbfb92e2c549f58f291f130d16578f [0,2,0,0,0,0|2,0,0]=4 162 B8R0.8 C#CCN[C@H](C)C(=O)O c45ede9d1e43611c768a8090380c1868 [0,2,0,0,0,0|2,0,0]=4 163 B8R0.8 C#CCOC(C)C(=O)O 1adaa60fa476d6dc220f161b33abd609 [0,2,0,0,0,0|2,0,0]=4 164 B8R0.8 C#CCO[C@@H](C)C(=O)O 79781b9b2e6b822211278354159e2687 [0,2,0,0,0,0|2,0,0]=4 165 B8R0.8 C#CCO[C@H](C)C(=O)O 19885536196a71978196625cd8e9f2d3 [0,2,0,0,0,0|2,0,0]=4 166 B8R0.8 C=C(COCC)C(=O)O b3208edc35f04bc3c761d3282605ef24 [0,2,0,0,0,0|1,0,1]=4 167 B8R0.8 C=C(COCF)C(=O)O 482b63a8a7d21f3e3de9eb1368a89112 [0,2,0,0,0,0|1,0,1]=4 168 B8R0.8 C=CCNC(C)C(=O)O 4027c27acb0fdf3aaf8b355f1a408423 [0,2,0,0,0,0|2,0,0]=4 169 B8R0.8 C=CCNC(O)C(=O)O 0ecf31d72e8de05d5ba28c50354b10f9 [0,2,0,0,0,0|2,0,0]=4 170 B8R0.8 C=CCN[C@@H](C)C(=O)O a2a3215161cedaeb69cecc40398800bc [0,2,0,0,0,0|2,0,0]=4 171 B8R0.8 C=CCN[C@H](C)C(=O)O 9c9e167784ec1fd5265aa094a42d05d8 [0,2,0,0,0,0|2,0,0]=4 172 B8R0.8 C=CCOC(C)C(=O)O 950b3a8c28d6da5c53fb492d3fdc807b [0,2,0,0,0,0|2,0,0]=4 173 B8R0.8 C=CCO[C@@H](C)C(=O)O 25467a59582a2906ce4ce45146ee1287 [0,2,0,0,0,0|2,0,0]=4 174 B8R0.8 C=CCO[C@H](C)C(=O)O 0b91c4aaff97cd63715f015c1d0c9e20 [0,2,0,0,0,0|2,0,0]=4 175 B8R0.8 CC(=O)C(C)COCF c45f8ad47bb47acfc61ca43baa4a6417 [0,2,0,0,0,0|2,0,0]=4 176 B8R0.8 CC(=O)C(C)NCCO 2aeb3f0703a454ddc9d76e39bdb7fb76 [0,2,0,0,0,0|2,0,0]=4 177 B8R0.8 CC(CNC#N)C(=O)O bf116ef387bf30d93fcd9d2397a5d029 [0,2,0,0,0,0|2,0,0]=4 178 B8R0.8 CC(CNCF)C(=O)O 81c40ac360e7f6cce7aa3313199a6d5d [0,2,0,0,0,0|2,0,0]=4 179 B8R0.8 CC(CNCO)C(=O)O e22ad5b294faf2e87974a8321cb31821 [0,2,0,0,0,0|1,0,0]=3 180 B8R0.8 CC(COCF)C(=O)O 415e8d45727d24f32c3b9f930225f08d [0,2,0,0,0,0|1,0,0]=3 181 B8R0.8 CC(NCC#N)C(=O)O 7e0caa8ab91252d82a8f6abf878f244d [0,2,0,0,0,0|2,0,0]=4 182 B8R0.8 CC(NCC=O)C(=O)O 68b69b45ee2126dd65ee50d2916637e9 [0,2,0,0,0,0|1,0,1]=4 183 B8R0.8 CC(NCCF)C(=O)O 826059aa4ee48cb4b37668249087cac6 [0,2,0,0,0,0|2,0,0]=4 184 B8R0.8 CC(NCCI)C(=O)O dee732c464e42a2d1492bb4c77f9d546 [0,2,0,0,0,0|2,0,0]=4 185 B8R0.8 CC(NCCO)C(=O)N 013333cfcf1fc8f500c98b282dda89b3 [0,2,0,0,0,0|2,0,0]=4 186 B8R0.8 CC(NCCO)C(=O)O d02ed597872d2f4c546187db89f2f220 [0,2,0,0,0,0|1,0,0]=3 187 B8R0.8 CC(NCCS)C(=O)O c86172ae088a1a89a361e8a05cbb9a1a [0,2,0,0,0,0|1,1,0]=4 188 B8R0.8 CC(OCC#N)C(=O)O 9e60d39e5d4e06a279fadb11fff707cb [0,2,0,0,0,0|2,0,0]=4 189 B8R0.8 CC(OCC=O)C(=O)O f7d574d73325531577cc3be3ba579ff3 [0,2,0,0,0,0|1,0,1]=4 190 B8R0.8 CC(OCCF)C(=O)O 6fd5e9a19867c7867b238e7d51a1feb1 [0,2,0,0,0,0|2,0,0]=4 191 B8R0.8 CC(OCCS)C(=O)O c6314cdd016da9ce267602a4c2560a24 [0,2,0,0,0,0|1,1,0]=4 192 B8R0.8 CCCNC(C)C(=O)O 0bb3e38e8c1f88931a7fe4405f55b48f [0,2,0,0,0,0|2,0,0]=4 193 B8R0.8 CCCNC(O)C(=O)O cc97d4d167b9765bc7e9641f2f876d2e [0,2,0,0,0,0|2,0,0]=4 194 B8R0.8 CCCN[C@@H](C)C(=O)O ef0370d06100564dc30ac92abf332f2f [0,2,0,0,0,0|2,0,0]=4 195 B8R0.8 CCCN[C@H](C)C(=O)O a8f2478751dbbc6b16132b4c2221ee6f [0,2,0,0,0,0|2,0,0]=4 196 B8R0.8 CCCOC(C)C(=O)O 1322f7b5e7c49e969524d97c6c86e731 [0,2,0,0,0,0|2,0,0]=4 197 B8R0.8 CCCO[C@@H](C)C(=O)O 6d34f6dc5dea70a72e909784584aa3d0 [0,2,0,0,0,0|2,0,0]=4 198 B8R0.8 CCCO[C@H](C)C(=O)O c80966cb853c5464154df7c1b20e2fad [0,2,0,0,0,0|2,0,0]=4 199 B8R0.8 CCNCC(C)C(=O)O f1d53d3e850c3e5f7eacfd1722a00821 [0,2,0,0,0,0|2,0,0]=4 200 B8R0.8 CCNCC(F)C(=O)O 3b295cc4c966015ef89d181bb2cf0fd1 [0,2,0,0,0,0|2,0,0]=4 201 B8R0.8 CCNCC(O)C(=O)O 199a2ff9ee4d2808377aac2de3a1300d [0,2,0,0,0,0|2,0,0]=4 202 B8R0.8 CCNC[C@@H](C)C(=O)O c248e05b45d9e657c31f93c9072982c9 [0,2,0,0,0,0|2,0,0]=4 203 B8R0.8 CCNC[C@@H](O)C(=O)O 0b3a1c0d41c6b74588ef5eb637fd0fb0 [0,2,0,0,0,0|2,0,0]=4 204 B8R0.8 CCNC[C@H](C)C(=O)O 0c2e6d5b0da6964440e6e3ec89c9de07 [0,2,0,0,0,0|2,0,0]=4 205 B8R0.8 CCNC[C@H](O)C(=O)O 8f48edbc7af4278b5a62e9966729660b [0,2,0,0,0,0|2,0,0]=4 206 B8R0.8 CCOCC(C)C(=O)C 7ed02ca7a024702f528cad10b88a8859 [0,2,0,0,0,0|2,0,0]=4 207 B8R0.8 CCOCC(C)C(=O)O c058fb39790cebd08b409e3f0067a53c [0,2,0,0,0,0|1,0,0]=3 208 B8R0.8 CCOC[C@@H](C)C(=O)O caa5ba1722b2330e21dcd6c456bf8574 [0,2,0,0,0,0|1,0,0]=3 209 B8R0.8 CCOC[C@H](C)C(=O)O 3f7f39bbd0ce3dcf45d784eca89b738a [0,2,0,0,0,0|1,0,0]=3 210 B8R0.8 COCNC(C)C(=O)N b4b2ce7b06452726f40d29c12e1e2d45 [0,2,0,0,0,0|2,0,0]=4 211 B8R0.8 COCNC(C)C(=O)O e8a36179375a090804a3295d43a4edc8 [0,2,0,0,0,0|1,0,0]=3 212 B8R0.8 COCNC(O)C(=O)O c63f3dcbd9e54c8057b6fa82b7adfdd8 [0,2,0,0,0,0|1,0,0]=3 213 B8R0.8 COCN[C@@H](C)C(=O)N 8b55f42ca22daaaacb13727c1eeadb78 [0,2,0,0,0,0|2,0,0]=4 214 B8R0.8 COCN[C@@H](C)C(=O)O 97f34448d198c44b13a9de86cde207b4 [0,2,0,0,0,0|1,0,0]=3 215 B8R0.8 COCN[C@H](C)C(=O)N eb2e7ecb7d7c9931c4aafa21b2d3cf84 [0,2,0,0,0,0|2,0,0]=4 216 B8R0.8 COCN[C@H](C)C(=O)O aa63150e151b1d92e3b97d3faa08a6a0 [0,2,0,0,0,0|1,0,0]=3 217 B8R0.8 COCOC(C)C(=O)C 9af88437e924837e1175779254d8725f [0,2,0,0,0,0|2,0,0]=4 218 B8R0.8 COCOC(C)C(=O)N 6aefe489f48a65cd7d148c440618ab78 [0,2,0,0,0,0|2,0,0]=4 219 B8R0.8 COCOC(F)C(=O)N 98a6ca63ec0ae5ce3f5f79ce7b3d2ebf [0,2,0,0,0,0|2,0,0]=4 220 B8R0.8 COCO[C@@H](C)C(=O)N 49acefa7331c8c6665c0cba142f65a5a [0,2,0,0,0,0|2,0,0]=4 221 B8R0.8 COCO[C@H](C)C(=O)N 3b246b4b4317637d3b566960fa55f353 [0,2,0,0,0,0|2,0,0]=4 222 B8R0.8 CSCNC(C)C(=O)O ea815da10516e5245f4fabfad2c1e236 [0,2,0,0,0,0|1,1,0]=4 223 B8R0.8 CSCNC(O)C(=O)O 1719d5d27357fbe544a3b6bde16529a0 [0,2,0,0,0,0|1,1,0]=4 224 B8R0.8 CSCN[C@@H](C)C(=O)O 7e48161f385aeb967c83dfdd3dbc82ac [0,2,0,0,0,0|1,1,0]=4 225 B8R0.8 CSCN[C@H](C)C(=O)O b9423e8ae3b110bd616b166a6c8e3236 [0,2,0,0,0,0|1,1,0]=4 226 B8R0.8 CSCOC(C)C(=O)O 57d7ce1dd854a328c5975793704ea7b1 [0,2,0,0,0,0|1,1,0]=4 227 B8R0.8 CSCO[C@@H](C)C(=O)O 864b5a29ecb73704069778c9f0e179d1 [0,2,0,0,0,0|1,1,0]=4 228 B8R0.8 CSCO[C@H](C)C(=O)O f7ab39fe068e7fa68aead9a01d1128af [0,2,0,0,0,0|1,1,0]=4 229 B8R0.8 C[C@@H](CNCF)C(=O)O 4d9173719fc4f49e4611760c33799bb2 [0,2,0,0,0,0|2,0,0]=4 230 B8R0.8 C[C@@H](CNCO)C(=O)O 129419d76dc5f85eaf247a7f67fc6cef [0,2,0,0,0,0|1,0,0]=3 231 B8R0.8 C[C@@H](COCF)C(=O)O aa505f32f4e5eedb1609c9fa6ceb286b [0,2,0,0,0,0|1,0,0]=3 232 B8R0.8 C[C@@H](NCC#N)C(=O)O 972d08b332f352aa44c3e39d4ac17eb7 [0,2,0,0,0,0|2,0,0]=4 233 B8R0.8 C[C@@H](NCC=O)C(=O)O a9f70b757fe4612e75dea21e3835d008 [0,2,0,0,0,0|1,0,1]=4 234 B8R0.8 C[C@@H](NCCF)C(=O)O c985c930a75dd7ef32b597383fbe6b60 [0,2,0,0,0,0|2,0,0]=4 235 B8R0.8 C[C@@H](NCCI)C(=O)O 8a10c2dc2b0ccfee702f35e3cbddbf0d [0,2,0,0,0,0|2,0,0]=4 236 B8R0.8 C[C@@H](NCCO)C(=O)N 11b4a7b8afa7b38c3221de9b75563071 [0,2,0,0,0,0|2,0,0]=4 237 B8R0.8 C[C@@H](NCCO)C(=O)O 773cefab23e4277c3fec27f25db9fd3e [0,2,0,0,0,0|1,0,0]=3 238 B8R0.8 C[C@@H](NCCS)C(=O)O 19d484937376b7d19ec4ad31c032ffd8 [0,2,0,0,0,0|1,1,0]=4 239 B8R0.8 C[C@@H](OCC#N)C(=O)O c705a7a20d6bb82ff2eff911b8d9b552 [0,2,0,0,0,0|2,0,0]=4 240 B8R0.8 C[C@@H](OCC=O)C(=O)O ec661864679508fe308079c34ba0d948 [0,2,0,0,0,0|1,0,1]=4 241 B8R0.8 C[C@@H](OCCF)C(=O)O c9253212131f04406411165ed9fada60 [0,2,0,0,0,0|2,0,0]=4 242 B8R0.8 C[C@@H](OCCS)C(=O)O ac3bfc55d41f7a030484bfd593511e60 [0,2,0,0,0,0|1,1,0]=4 243 B8R0.8 C[C@H](CNCF)C(=O)O 9d81b94206f75ee21b4db163708e8702 [0,2,0,0,0,0|2,0,0]=4 244 B8R0.8 C[C@H](CNCO)C(=O)O 722d39fe0a80aec373909ca981cc2ac2 [0,2,0,0,0,0|1,0,0]=3 245 B8R0.8 C[C@H](COCF)C(=O)O 45766ea01c28bb0aca00c5be08dc9be3 [0,2,0,0,0,0|1,0,0]=3 246 B8R0.8 C[C@H](NCC#N)C(=O)O e4147ba99646ec3a91b79b66bb7623a1 [0,2,0,0,0,0|2,0,0]=4 247 B8R0.8 C[C@H](NCC=O)C(=O)O 8f3e3a2e655b122b5dbf67e5312baae9 [0,2,0,0,0,0|1,0,1]=4 248 B8R0.8 C[C@H](NCCF)C(=O)O fd1f98b23619529732be37e8295a849a [0,2,0,0,0,0|2,0,0]=4 249 B8R0.8 C[C@H](NCCI)C(=O)O 14879b70406900d3b9c0aef15c8804ba [0,2,0,0,0,0|2,0,0]=4 250 B8R0.8 C[C@H](NCCO)C(=O)N ead3141575cb05538a172d8fe0fd315f [0,2,0,0,0,0|2,0,0]=4 251 B8R0.8 C[C@H](NCCO)C(=O)O 76808623850f5a1065c978caf5c977ca [0,2,0,0,0,0|1,0,0]=3 252 B8R0.8 C[C@H](NCCS)C(=O)O f9c7d821f3499388f2c0c427911263cd [0,2,0,0,0,0|1,1,0]=4 253 B8R0.8 C[C@H](OCC#N)C(=O)O ba12b08c57ed09456d47d6e99832077b [0,2,0,0,0,0|2,0,0]=4 254 B8R0.8 C[C@H](OCC=O)C(=O)O 4ebe59700e459820040abe9c03f70752 [0,2,0,0,0,0|1,0,1]=4 255 B8R0.8 C[C@H](OCCF)C(=O)O 743b16156cee7adc3f15423098970a5c [0,2,0,0,0,0|2,0,0]=4 256 B8R0.8 C[C@H](OCCS)C(=O)O b485ed5c5773edd40292f7e36c453e29 [0,2,0,0,0,0|1,1,0]=4 257 B8R0.8 N#CCNC(O)C(=O)O eec7ef83cf88af6ac7f289ccc2020fe0 [0,2,0,0,0,0|2,0,0]=4 258 B8R0.8 N#CNCC(O)C(=O)O 0943bc10363ee8c75700054dcf2c9843 [0,2,0,0,0,0|2,0,0]=4 259 B8R0.8 N#CNC[C@H](O)C(=O)O c374ceb0d5a55141801d235bcfbf9087 [0,2,0,0,0,0|2,0,0]=4 260 B8R0.8 NC(=O)C(F)NCCO 8ea465c04b3d341359f3e0754df88307 [0,2,0,0,0,0|2,0,0]=4 261 B8R0.8 O=C(O)C(F)CNCF f1a9030b4e84b2808ed1cc96323a1748 [0,2,0,0,0,0|2,0,0]=4 262 B8R0.8 O=C(O)C(F)CNCO c5cb63252e280c78105d540035d06dac [0,2,0,0,0,0|1,0,0]=3 263 B8R0.8 O=C(O)C(O)CNCF b50e1442b5c6266934863854576a8d3d [0,2,0,0,0,0|2,0,0]=4 264 B8R0.8 O=C(O)C(O)CNCO 898dc7e3ebc74408e9fbb99b51d98f75 [0,2,0,0,0,0|1,0,0]=3 265 B8R0.8 O=C(O)C(O)NCCF f448ef4ffbf11843dbee1bb8436d2a0c [0,2,0,0,0,0|2,0,0]=4 266 B8R0.8 O=C(O)C(O)NCCO 698911e1d3457f5b9e37a340d950957a [0,2,0,0,0,0|1,0,0]=3 267 B8R0.8 O=C(O)C(O)NCCS 5346421c4abaa0529702e1282d1c5a95 [0,2,0,0,0,0|1,1,0]=4 268 B8R0.8 O=C(O)[C@@H](O)CNCF dfc3ee5c735555d7aca49144f695826d [0,2,0,0,0,0|2,0,0]=4 269 B8R0.8 O=C(O)[C@@H](O)CNCO cdd1082cc3946b226b2ffbc1066fef89 [0,2,0,0,0,0|1,0,0]=3 270 B8R0.8 O=C(O)[C@H](O)CNCF 5dbad60ab052faf0f2f5f615bfe59344 [0,2,0,0,0,0|2,0,0]=4 271 B8R0.8 O=C(O)[C@H](O)CNCO 71211b0d7c7b20837b97e49988848369 [0,2,0,0,0,0|1,0,0]=3 272 B8R0.8 O=CCNC(O)C(=O)O 8520717b1a1e11d4c35b09a14aaf7e93 [0,2,0,0,0,0|1,0,1]=4 273 B8R0.12 CC(=O)C(C)(C)NCO 3e068c30a895bb404d4fab2097612865 [0,2,0,0,0,0|2,0,0]=4 274 B8R0.12 CC(C)(NCF)C(=O)O f9e92278861b7cfa6593cc57e317672c [0,2,0,0,0,0|2,0,0]=4 275 B8R0.12 CC(C)(NCO)C(=O)N 2bac90466422ccd2972ee0c62ce071d4 [0,2,0,0,0,0|2,0,0]=4 276 B8R0.12 CC(C)(NCO)C(=O)O b9fb05c46397d03ef9aa863b94853bfb [0,2,0,0,0,0|1,0,0]=3 277 B8R0.12 CCNC(C)(C)C(=O)O 6a4bebf8bb98ff706835230f86b4cd13 [0,2,0,0,0,0|2,0,0]=4 278 B8R0.15 C#CC(OCC)C(=O)O ad5f5db2dc84c44b6973fc430054569b [0,2,0,0,0,0|2,0,0]=4 279 B8R0.15 C#CC(OCF)C(=O)O da8616f2b4b95281efb315c25eed2430 [0,2,0,0,0,0|2,0,0]=4 280 B8R0.15 C=CC(NCC)C(=O)O b4ac7d60381bf72b1b23118f771cafec [0,2,0,0,0,0|1,0,1]=4 281 B8R0.15 C=CC(NCF)C(=O)O 3b1cadf10156d31d21dabae90070459b [0,2,0,0,0,0|1,0,1]=4 282 B8R0.15 C=CC(NCO)C(=O)O 02434f0cc2ab88a157fbbfde94d9a490 [0,2,0,0,0,0|1,0,0]=3 283 B8R0.15 C=C[C@H](NCC)C(=O)O 5c2988d6d8a73101b114f1f85def6c90 [0,2,0,0,0,0|1,0,1]=4 284 B8R0.15 C=C[C@H](NCF)C(=O)O d143ab86678a93c80c8a056198d3e9e0 [0,2,0,0,0,0|1,0,1]=4 285 B8R0.15 C=C[C@H](NCO)C(=O)O 91a74614650e784312c5d23758a5a16b [0,2,0,0,0,0|1,0,0]=3 286 B8R0.15 CC(O)C(CO)NC=O a83bc38d243cc7dd66411dfc7cf616cd [0,2,0,0,0,0|1,0,1]=4 287 B8R0.15 CC(O)C(CO)NCF 282b7bce375c8ef68ffaeb9d05e4f222 [0,2,0,0,0,0|1,0,1]=4 288 B8R0.15 CC(O)C(CO)NCO 96053f0b0fe026e99cffa02c8a08ffd7 [0,2,0,0,0,0|1,0,1]=4 289 B8R0.15 CCC(NC#N)C(=O)N 90304cf0fdbbd9c2e320800750845d0a [0,2,0,0,0,0|2,0,0]=4 290 B8R0.15 CCC(NC#N)C(=O)O 76cd02262d29071da13818be79e9be49 [0,2,0,0,0,0|1,0,0]=3 291 B8R0.15 CCC(NC=O)C(=O)N fa6bca91bfe5f27c10adcdffc59e614f [0,2,0,0,0,0|2,0,0]=4 292 B8R0.15 CCC(NCF)C(=O)N 9ab0d3256eb996f9dacf81a5a2263835 [0,2,0,0,0,0|2,0,0]=4 293 B8R0.15 CCC(NCF)C(=O)O 850ee032ff8e5d86c20bab43e234fbb6 [0,2,0,0,0,0|1,0,0]=3 294 B8R0.15 CCC(NCO)C(=O)N 956554908595c50f2bdd7ffbe771073d [0,2,0,0,0,0|2,0,0]=4 295 B8R0.15 CCC(NCO)C(=O)O db363ec4295a86c2fa409aac06a566a2 [0,2,0,0,0,0|1,0,0]=3 296 B8R0.15 CCC(OCF)C(=O)O ef6f04d4d4b7d499812df6ebe4668f47 [0,2,0,0,0,0|2,0,0]=4 297 B8R0.15 CCNC(CC)C(=O)N 4d4bbfd758d3d1406449d11a7d12f485 [0,2,0,0,0,0|2,0,0]=4 298 B8R0.15 CCNC(CC)C(=O)O 811bed40f759e9415b190b45b938f031 [0,2,0,0,0,0|1,0,0]=3 299 B8R0.15 CCNC(CCl)C(=O)O a1a6122a812437e412d0d064cc9dd1e8 [0,2,0,0,0,0|1,0,0]=3 300 B8R0.15 CCNC(CF)C(=O)O 017cf9dba405ee85cd9a648c4507e326 [0,2,0,0,0,0|1,0,0]=3 301 B8R0.15 CCNC(CO)C(=O)N 4333fef656a065c1ba68ae2f13ae5e8b [0,2,0,0,0,0|1,0,0]=3 302 B8R0.15 CCNC(CO)C(=O)O ebf98372f13717a9df2df682387bdc5a [0,2,0,0,0,0|0,0,0]=2 303 B8R0.15 CCNC(CO)C(C)O ad7aae7bb760d2e1b98c8ce7819bdc47 [0,2,0,0,0,0|1,0,1]=4 304 B8R0.15 CCNC(CS)C(=O)O 8d04389a625618eb9889b3cd17b2e8e6 [0,2,0,0,0,0|0,1,0]=3 305 B8R0.15 CCN[C@@H](CC)C(=O)N 2ecd0466ce0392cdd810df37e1818d79 [0,2,0,0,0,0|2,0,0]=4 306 B8R0.15 CCN[C@@H](CC)C(=O)O ad39164e8fc918d5e58308b586171474 [0,2,0,0,0,0|1,0,0]=3 307 B8R0.15 CCN[C@@H](CCl)C(=O)O 81a0c413a80ec8dc4a086548b2e2f8a3 [0,2,0,0,0,0|1,0,0]=3 308 B8R0.15 CCN[C@@H](CO)C(=O)N 3e6763ebcb86b94e60fc4ae0e4be563a [0,2,0,0,0,0|1,0,0]=3 309 B8R0.15 CCN[C@@H](CO)C(=O)O e2d91799e466e2d5ad0fbeab938b0c5a [0,2,0,0,0,0|0,0,0]=2 310 B8R0.15 CCN[C@@H](CO)[C@@H](C)O 5e0a77cb5e13b8d713dfcb4bffbd9580 [0,2,0,0,0,0|1,0,1]=4 311 B8R0.15 CCN[C@@H](CO)[C@H](C)O e989700e5854e8bb09de2d57ba60972e [0,2,0,0,0,0|1,0,1]=4 312 B8R0.15 CCN[C@@H](CS)C(=O)O ecb0401bca4bb7db9d87809814f9d4f3 [0,2,0,0,0,0|0,1,0]=3 313 B8R0.15 CCN[C@H](CC)C(=O)O f7f7d1d8bf30d5fe2da91fe96021fe3c [0,2,0,0,0,0|1,0,0]=3 314 B8R0.15 CCN[C@H](CCl)C(=O)O 26dcc066f21950a5ba1142c74ad60cbc [0,2,0,0,0,0|1,0,0]=3 315 B8R0.15 CCN[C@H](CO)C(=O)O ceca2f5f870f50fddc0292e18011d619 [0,2,0,0,0,0|0,0,0]=2 316 B8R0.15 CCN[C@H](CO)[C@@H](C)O 6b6bcea404a72286553397ddb2dfec02 [0,2,0,0,0,0|1,0,1]=4 317 B8R0.15 CCN[C@H](CO)[C@H](C)O 63a966a5dd9e2873bf611f5e8b1501b7 [0,2,0,0,0,0|1,0,1]=4 318 B8R0.15 CCN[C@H](CS)C(=O)O 7c010ea0d3f5055c0e7214a8d340a87c [0,2,0,0,0,0|0,1,0]=3 319 B8R0.15 CCOC(CC)C(=O)O 382aa920ebdd6f2bbe768902640ad9e2 [0,2,0,0,0,0|2,0,0]=4 320 B8R0.15 CCO[C@@H](CC)C(=O)O 94f5195873e16b29cb1b8369b5daad14 [0,2,0,0,0,0|2,0,0]=4 321 B8R0.15 CCO[C@H](CC)C(=O)O b8c9ca25086a8c61d2a1f7aecbcec13d [0,2,0,0,0,0|2,0,0]=4 322 B8R0.15 CCO[C@H](CF)C(=O)O afbab515ead87d58e6c9f68e24ff80d8 [0,2,0,0,0,0|2,0,0]=4 323 B8R0.15 CC[C@@H](NC#N)C(=O)O 88a898e4203ef234e769571e9f416da9 [0,2,0,0,0,0|1,0,0]=3 324 B8R0.15 CC[C@@H](NCF)C(=O)O 9592ba18488e06d007c56e3bb749b243 [0,2,0,0,0,0|1,0,0]=3 325 B8R0.15 CC[C@@H](NCO)C(=O)O 97715112de1ce5ecb2509133cc9cdaa1 [0,2,0,0,0,0|1,0,0]=3 326 B8R0.15 CC[C@@H](OCF)C(=O)O 04c614c037a7fb2cad756976721bea17 [0,2,0,0,0,0|2,0,0]=4 327 B8R0.15 CC[C@H](NC#N)C(=O)O 980ab87570d499158253b3f0ba64409b [0,2,0,0,0,0|1,0,0]=3 328 B8R0.15 CC[C@H](NC=O)C(=O)N ff26bfc7195f92e7d6df4bcbfb0f184b [0,2,0,0,0,0|2,0,0]=4 329 B8R0.15 CC[C@H](NCF)C(=O)N 75c0f415f49388ef58931a8345c05589 [0,2,0,0,0,0|2,0,0]=4 330 B8R0.15 CC[C@H](NCF)C(=O)O 92c72ae7fc2c9386004189c4ccda19a9 [0,2,0,0,0,0|1,0,0]=3 331 B8R0.15 CC[C@H](NCO)C(=O)N 447f79d1a4a79d049ea2d6100ab9facb [0,2,0,0,0,0|2,0,0]=4 332 B8R0.15 CC[C@H](NCO)C(=O)O 095847387652246d94b75d260940e322 [0,2,0,0,0,0|1,0,0]=3 333 B8R0.15 CC[C@H](OCF)C(=O)O c3e3503168943a92d052ee029c13c59a [0,2,0,0,0,0|2,0,0]=4 334 B8R0.15 C[C@@H](O)[C@@H](CO)NC=O 71ce75effa13d34289145c161a9a07ed [0,2,0,0,0,0|1,0,1]=4 335 B8R0.15 C[C@@H](O)[C@@H](CO)NCF 9bda1fac69da0d6167f612069b3bf8b3 [0,2,0,0,0,0|1,0,1]=4 336 B8R0.15 C[C@@H](O)[C@@H](CO)NCO 7ced69b30dfa8ef695135791e278ca0e [0,2,0,0,0,0|1,0,1]=4 337 B8R0.15 C[C@@H](O)[C@H](CO)NC=O 436bf598ce041da1afe592374d3894b2 [0,2,0,0,0,0|1,0,1]=4 338 B8R0.15 C[C@@H](O)[C@H](CO)NCF b25e4fdf178bdc573b3c8c3e18106264 [0,2,0,0,0,0|1,0,1]=4 339 B8R0.15 C[C@@H](O)[C@H](CO)NCO 7d002bff78c58db3422f26951dbe61e0 [0,2,0,0,0,0|1,0,1]=4 340 B8R0.15 C[C@H](O)[C@@H](CO)NC=O 99a1ba04e6ecf906863dabb1ce42f800 [0,2,0,0,0,0|1,0,1]=4 341 B8R0.15 C[C@H](O)[C@@H](CO)NCF 4b5c76cc4b2681a3d2179eb78119e016 [0,2,0,0,0,0|1,0,1]=4 342 B8R0.15 C[C@H](O)[C@@H](CO)NCO 300e87844d1d429506cf445a2d4a2191 [0,2,0,0,0,0|1,0,1]=4 343 B8R0.15 C[C@H](O)[C@H](CO)NC=O e7ebcffbd2ba75496d597e99f574d8f3 [0,2,0,0,0,0|1,0,1]=4 344 B8R0.15 C[C@H](O)[C@H](CO)NCF a55a7b3ad09c62a2d2971bb99220b82d [0,2,0,0,0,0|1,0,1]=4 345 B8R0.15 C[C@H](O)[C@H](CO)NCO af3f0af477fe0b726ae79665dc4b463f [0,2,0,0,0,0|1,0,1]=4 346 B8R0.15 N#CC(NCO)C(=O)N 08ba5c129b32dd5880e1bfc82664c00b [0,2,0,0,0,0|1,0,1]=4 347 B8R0.15 N#CNC(CF)C(=O)O 1ac94b0909e5a5aec24ef75b1ca0ca1e [0,2,0,0,0,0|1,0,0]=3 348 B8R0.15 N#CNC(CO)C(=O)O 85541225f0b1b83215ba7d69a43d3feb [0,2,0,0,0,0|0,0,0]=2 349 B8R0.15 N#CN[C@@H](CO)C(=O)O 556ac31197e1570c7728b498d8b9b2f2 [0,2,0,0,0,0|0,0,0]=2 350 B8R0.15 N#CN[C@H](CO)C(=O)O 4cda9fa99b7d10a472e331756f21fbbe [0,2,0,0,0,0|0,0,0]=2 351 B8R0.15 NC(=O)C(CO)NC=O 83b16adcaf9fe3d3c4ed5922d9078a28 [0,2,0,0,0,0|1,0,0]=3 352 B8R0.15 NC(=O)C(CO)NCF 1c40122b6c01e2e59939fc3015ef9422 [0,2,0,0,0,0|1,0,0]=3 353 B8R0.15 NC(=O)C(CO)NCO e3c4b26575b76381928138874dd01f53 [0,2,0,0,0,0|1,0,0]=3 354 B8R0.15 NC(=O)[C@H](CO)NC=O 5e6eb5e9c4948482d77cdb3e1de3dbac [0,2,0,0,0,0|1,0,0]=3 355 B8R0.15 NC(=O)[C@H](CO)NCF b5c869e8f2cc447978f8f59cdacbf863 [0,2,0,0,0,0|1,0,0]=3 356 B8R0.15 NC(=O)[C@H](CO)NCO 1ce572a1ecbf5c38dff74acb76ef6193 [0,2,0,0,0,0|1,0,0]=3 357 B8R0.15 O=C(O)C(CCl)NCF 345f20f31e3e9323b766d08f3e4d0312 [0,2,0,0,0,0|1,0,0]=3 358 B8R0.15 O=C(O)C(CCl)NCO 87909341b2a2401adb94a3e449acbeeb [0,2,0,0,0,0|1,0,0]=3 359 B8R0.15 O=C(O)C(CF)NCF 3c68b2ec2d74233cffc4fb4e71bbb94b [0,2,0,0,0,0|1,0,0]=3 360 B8R0.15 O=C(O)C(CF)NCO 8882ba16164d78cec81fe4b00fda2ae1 [0,2,0,0,0,0|1,0,0]=3 361 B8R0.15 O=C(O)C(CO)NCF 9eea1e72a00cd3dd12c33ca4052b702a [0,2,0,0,0,0|0,0,0]=2 362 B8R0.15 O=C(O)C(CO)NCO 81ff67930a96f8f373a876534f5a354d [0,2,0,0,0,0|0,0,0]=2 363 B8R0.15 O=C(O)C(CS)NCF d2bcc921a07d6c66ec8feced8008b3d2 [0,2,0,0,0,0|0,1,0]=3 364 B8R0.15 O=C(O)C(CS)NCO b3a632b39e14452fb76e40a3b45f1330 [0,2,0,0,0,0|0,1,0]=3 365 B8R0.15 O=C(O)[C@@H](CCl)NCF 0f4882ad0f84646d0776c613bf998da9 [0,2,0,0,0,0|1,0,0]=3 366 B8R0.15 O=C(O)[C@@H](CCl)NCO a657e82377b90be09b01db5df6746084 [0,2,0,0,0,0|1,0,0]=3 367 B8R0.15 O=C(O)[C@@H](CF)OCF 5ca8d51c8b5d5b379a86da0372761524 [0,2,0,0,0,0|2,0,0]=4 368 B8R0.15 O=C(O)[C@@H](CO)NCF b58ae15b4649cf9eff033a92ba589b35 [0,2,0,0,0,0|0,0,0]=2 369 B8R0.15 O=C(O)[C@@H](CO)NCO cfec0a60446fa32f24138a7f54bc9bb8 [0,2,0,0,0,0|0,0,0]=2 370 B8R0.15 O=C(O)[C@@H](CS)NCF f755fd948c7a145e65bf11358747b457 [0,2,0,0,0,0|0,1,0]=3 371 B8R0.15 O=C(O)[C@@H](CS)NCO 0f499f5952378dffba3785ff4ae4c019 [0,2,0,0,0,0|0,1,0]=3 372 B8R0.15 O=C(O)[C@H](CCl)NCF 750706009ff6f282f1ca980848f7e16b [0,2,0,0,0,0|1,0,0]=3 373 B8R0.15 O=C(O)[C@H](CCl)NCO 45f6f42413f314b49f1c79dfa3cea815 [0,2,0,0,0,0|1,0,0]=3 374 B8R0.15 O=C(O)[C@H](CO)NCF e3967553d1a093cbd0dce0f9d6a1e608 [0,2,0,0,0,0|0,0,0]=2 375 B8R0.15 O=C(O)[C@H](CO)NCO 08a1cdec07261d180e41b733dfd606d7 [0,2,0,0,0,0|0,0,0]=2 376 B8R0.15 O=C(O)[C@H](CS)NCF acd5dd73331d3e22705923fab1a8feaf [0,2,0,0,0,0|0,1,0]=3 377 B8R0.15 O=C(O)[C@H](CS)NCO 1ed62aac1780461a449b2c14b61eaf37 [0,2,0,0,0,0|0,1,0]=3 378 B8R1.34 CC(=O)NC1COC1 434b9f924b049f8d9fb83819938927c2 [0,0,0,1,0,1|2,0,0]=4 379 B8R1.13 O=C1NC[C@@H]1NCO 13e7ef24d5bda6a447193e9ab8c1b3ed [0,1,0,1,0,0|2,0,0]=4 380 B8R0.9 CC(=O)CNC(C)CO 7f456ce2665c50a288606a55fcadb654 [0,0,0,0,0,2|2,0,0]=4 381 B8R0.9 CC(=O)CN[C@@H](C)CO 3490504cc82c16f891707783a3f5d03b [0,0,0,0,0,2|2,0,0]=4 382 B8R0.9 CC(=O)CN[C@H](C)CO b856683376ccfcef5ca680b8cb827c55 [0,0,0,0,0,2|2,0,0]=4 383 B8R0.9 CC(=O)NCC(C)CO 5107eece73873b4763584dc1449ad61c [0,0,0,0,0,2|2,0,0]=4 384 B8R0.9 CC(=O)NCC(F)CO b8843bcee854bfdd401231e90b011422 [0,0,0,0,0,2|2,0,0]=4 385 B8R0.9 CC(=O)NCC(O)CO a7a306466b1599337a98d4a78b5d781e [0,0,0,0,0,2|2,0,0]=4 386 B8R0.9 CC(=O)NC[C@@H](F)CO 964c0a882da1253a8b823c85e90b43d9 [0,0,0,0,0,2|2,0,0]=4 387 B8R0.9 CC(=O)NC[C@@H](O)CO a8483dbc09c1c7f138b3ed243987530b [0,0,0,0,0,2|2,0,0]=4 388 B8R0.9 CC(=O)NC[C@H](C)CO 5409bde0c2b60b9f7b568586e701b259 [0,0,0,0,0,2|2,0,0]=4 389 B8R0.9 CC(=O)NC[C@H](F)CO 938a8d1e230afccbf699e7334f08d345 [0,0,0,0,0,2|2,0,0]=4 390 B8R0.9 CC(=O)NC[C@H](O)CO 4c725599a6cf504375db5135be307edf [0,0,0,0,0,2|2,0,0]=4 391 B8R0.9 CC(CF)OCC(=O)O 72064f294e73f6a982bc7e430390395e [0,0,0,0,0,2|2,0,0]=4 392 B8R0.9 CC(CO)NCC(=O)N ca275a4ad15d32e500ba974468999137 [0,0,0,0,0,2|2,0,0]=4 393 B8R0.9 CC(CO)NCC(=O)O 3fa1442f69c9dfa3ad5830b54dce922d [0,0,0,0,0,2|1,0,0]=3 394 B8R0.9 CC(CS)OCC(=O)O 6f586a0cfc007fa60414bad735acd25c [0,0,0,0,0,2|1,1,0]=4 395 B8R0.9 CCC(C)NCC(=O)O f2952a77ab3e8bd898813643bd6d2028 [0,0,0,0,0,2|2,0,0]=4 396 B8R0.9 CCC(C)OCC(=O)O ba461bfe27072cdbfb8d74924722a4e4 [0,0,0,0,0,2|2,0,0]=4 397 B8R0.9 CC[C@@H](C)NCC(=O)O 5c12fd5b6d0cdca7f2b2238c17851dd2 [0,0,0,0,0,2|2,0,0]=4 398 B8R0.9 CC[C@@H](C)OCC(=O)O fcbe44d01b8fa575a40781f8929bf942 [0,0,0,0,0,2|2,0,0]=4 399 B8R0.9 CC[C@H](C)NCC(=O)O d0392c98c4a58fa7920a948e7c8055d4 [0,0,0,0,0,2|2,0,0]=4 400 B8R0.9 CC[C@H](C)OCC(=O)O 8b17e83f890f84f235b698dd6e78f10d [0,0,0,0,0,2|2,0,0]=4 401 B8R0.9 CN(CO)CCC(=O)O a563a8e06bffade26f5d2de4c2323adb [0,0,0,0,0,2|2,0,0]=4 402 B8R0.9 C[C@@H](CO)NCC(=O)N 1720c78da7cf8f54c6473f0f0ad3915f [0,0,0,0,0,2|2,0,0]=4 403 B8R0.9 C[C@@H](CO)NCC(=O)O a4ded20e76f16f8cb0ed35de8a1798b1 [0,0,0,0,0,2|1,0,0]=3 404 B8R0.9 C[C@H](CO)NCC(=O)N 280db7eb09d450dda3894db03e34aff2 [0,0,0,0,0,2|2,0,0]=4 405 B8R0.9 C[C@H](CO)NCC(=O)O 3604c50bbfd16fc53504ebc03416b43b [0,0,0,0,0,2|1,0,0]=3 406 B8R0.9 C[C@H](CS)OCC(=O)O ec11162dd59d106eaabeedeed690abec [0,0,0,0,0,2|1,1,0]=4