0 B4R0.1 C(C(=O)N)N HAA6570 [0,0,0,0,0,0|3,0,0]=3 1 B4R0.1 CN(C)C=O SOL-004 [0,0,0,0,0,0|4,0,0]=4 2 B4R0.1 C[C@@H](CN)O FAL1033 [0,0,0,0,0,0|2,0,2]=4 3 B4R0.1 C[C@H](CO)N FAL1004 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.1 C(CN)C(=O)N HAA5550 [0,1,0,0,0,0|2,0,0]=3 5 B5R0.1 C(CN)C(=O)O HAA1003 [0,1,0,0,0,0|2,0,0]=3 6 B5R0.1 C(CS)C(=O)O RL-1000 [0,1,0,0,0,0|2,0,0]=3 7 B5R0.1 CNCC(=O)N HAA1581 [0,1,0,0,0,0|2,0,0]=3 8 B5R0.1 CNCC(=O)O HAA1192 [0,1,0,0,0,0|2,0,0]=3 9 B5R0.3 CNC(=O)CN HAA6580 [0,1,0,0,0,0|1,0,0]=2 10 B5R0.3 COC(=O)CN HAA5530 [0,1,0,0,0,0|0,0,0]=1 11 B5R0.5 *[C@H](N)C(=O)O EZK9040 [0,1,0,0,0,0|3,0,0]=4 12 B5R0.5 C[C@@H](C(=O)N)N HAA5610 [0,1,0,0,0,0|2,0,0]=3 13 B5R0.5 C[C@@H](C(=O)O)N HAA1066 [0,1,0,0,0,0|2,0,0]=3 14 B5R0.5 C[C@H](C(=O)N)N HAA5520 [0,1,0,0,0,0|2,0,0]=3 15 B5R0.5 C[C@H](C(=O)O)N HAA1007 [0,1,0,0,0,0|2,0,0]=3 16 B2R0.1 CC#N SOL-013 [2,0,0,0,0,0|1,0,1]=4 17 B2R0.1 CSC RL-1098 [2,0,0,0,0,0|0,1,0]=3 18 B4R0.2 CCOCC SOL-005 [1,1,0,0,0,0|0,0,1]=3 19 B4R0.2 COCCBr S-30131 [1,1,0,0,0,0|0,0,1]=3 20 B4R0.2 COCCBr S-30901 [1,1,0,0,0,0|0,0,1]=3 21 B4R0.2 COCCN HL12132 [1,1,0,0,0,0|0,0,1]=3 22 B4R0.2 COCCN HL12902 [1,1,0,0,0,0|0,0,1]=3 23 B4R0.2 COCCO S-30130 [1,1,0,0,0,0|0,0,1]=3 24 B4R0.2 COCCO S-30900 [1,1,0,0,0,0|0,0,1]=3 25 B4R0.2 COCCS HL12134 [1,1,0,0,0,0|0,0,1]=3 26 B4R0.2 COCCS HL12904 [1,1,0,0,0,0|0,0,1]=3 27 B6R0.1 CCOC(=O)CN HAA6590 [0,2,0,0,0,0|0,0,0]=2 28 B6R0.1 CNCC(=O)OC HAA7240 [0,2,0,0,0,0|0,0,0]=2 29 B6R0.1 COC(=O)CCN HAA5560 [0,2,0,0,0,0|0,0,0]=2 30 B6R0.2 *[C@@H](C)CC(=O)* EZK9050 [0,2,0,0,0,0|2,0,0]=4 31 B6R0.2 C[C@@H](CC(=O)O)N HAA8470 [0,2,0,0,0,0|2,0,0]=4 32 B6R0.2 C[C@H](CC(=O)O)N HAA8430 [0,2,0,0,0,0|2,0,0]=4 33 B6R0.3 C(C(C(=O)O)N)N HAA7960 [0,2,0,0,0,0|2,0,0]=4 34 B6R0.3 C([C@@H](C(=O)O)N)N HAA1081 [0,2,0,0,0,0|2,0,0]=4 35 B6R0.3 C([C@@H](C(=O)O)N)O HAA1129 [0,2,0,0,0,0|2,0,0]=4 36 B6R0.3 C([C@@H](C(=O)O)N)S HAA1080 [0,2,0,0,0,0|2,0,0]=4 37 B6R0.3 C([C@@H](C(=O)O)O)N HAA1900 [0,2,0,0,0,0|2,0,0]=4 38 B6R0.3 C([C@H](C(=O)O)N)N HAA1019 [0,2,0,0,0,0|2,0,0]=4 39 B6R0.3 C([C@H](C(=O)O)N)O HAA1051 [0,2,0,0,0,0|2,0,0]=4 40 B6R0.3 C([C@H](C(=O)O)N)S HAA1017 [0,2,0,0,0,0|2,0,0]=4 41 B6R0.3 CC[C@@H](C(=O)O)N HAA1247 [0,2,0,0,0,0|2,0,0]=4 42 B6R0.3 CC[C@H](C(=O)O)N HAA1006 [0,2,0,0,0,0|2,0,0]=4 43 B6R0.3 C[C@@H](C(=O)O)NC HAA1206 [0,2,0,0,0,0|1,0,1]=4 44 B6R0.3 C[C@@H](C(=O)OC)N HAA1067 [0,2,0,0,0,0|0,0,0]=2 45 B6R0.3 C[C@H](C(=O)O)NC HAA1193 [0,2,0,0,0,0|1,0,1]=4 46 B6R0.3 C[C@H](C(=O)OC)N HAA5580 [0,2,0,0,0,0|0,0,0]=2 47 B6R0.4 C(CC(=O)O)CN HAA1061 [0,2,0,0,0,0|2,0,0]=4 48 B6R0.7 CC(C)(C(=O)O)N HAA1511 [0,2,0,0,0,0|2,0,0]=4