0 B9R1.35 O=C(O)C1CC(O)CN1 Amb5718663 [0,0,0,0,0,0|0,0,0]=0 1 B9R1.35 O=C1CCC(C(=O)O)N1 Amb2694994 [0,0,0,0,0,0|2,0,2]=4 2 B8R1.7 O=C(O)C1CCCN1 Amb2542766 [1,0,0,0,0,0|0,0,0]=1 3 B8R1.7 O=C(O)C1CCCN1 Amb2720569 [1,0,0,0,0,0|0,0,0]=1 4 B8R1.7 O=C(O)C1NCCS1 Amb25920370 [1,0,0,0,0,0|1,0,0]=2 5 B8R0.8 NCCCC(N)C(=O)O Amb6600152 [0,0,1,0,0,0|3,0,0]=4 6 B8R0.8 NCCCC(N)C(=O)O Amb8513279 [0,0,1,0,0,0|3,0,0]=4 7 B8R0.23 CC(C)CC(N)C(=O)O Amb2720579 [0,0,1,0,0,0|1,0,0]=2 8 B8R0.23 CC(C)CC(N)C(=O)O Amb4134814 [0,0,1,0,0,0|1,0,0]=2 9 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,0,1,0,0,0|2,0,1]=4 10 B8R0.23 NC(=O)CC(N)C(=O)O Amb17749060 [0,0,1,0,0,0|1,0,2]=4 11 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940760 [0,0,1,0,0,0|1,0,2]=4 12 B8R0.23 NC(CC(=O)O)C(=O)O Amb3940320 [0,0,1,0,0,0|1,0,1]=3 13 B8R0.23 NC(CC(=O)O)C(=O)O Amb6599992 [0,0,1,0,0,0|1,0,1]=3 14 B8R0.23 NC(CC(=O)O)C(=O)O Amb9825326 [0,0,1,0,0,0|1,0,1]=3 15 B8R0.23 O=C(O)CC(O)C(=O)O Amb4166311 [0,0,1,0,0,0|2,0,1]=4 16 B8R0.23 O=C(O)CC(O)C(=O)O Amb6599993 [0,0,1,0,0,0|2,0,1]=4 17 B8R0.23 O=C(O)CC(O)C(=O)O Amb9702775 [0,0,1,0,0,0|2,0,1]=4 18 B8R0.28 O=C(O)CCCC(=O)O Amb4037276 [0,0,1,0,0,0|2,0,1]=4 19 B7R0.4 CCCCCC(=O)O Amb3939846 [1,0,1,0,0,0|1,0,0]=3 20 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [1,0,1,0,0,0|1,0,1]=4 21 B7R0.4 NCCCCC(=O)O Amb3941646 [1,0,1,0,0,0|0,0,0]=2 22 B7R0.5 CCCC(N)C(=O)O Amb8514700 [1,0,1,0,0,0|0,0,0]=2 23 B7R0.5 CCCC(N)C(=O)O Amb8514701 [1,0,1,0,0,0|0,0,0]=2 24 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [1,0,1,0,0,0|1,0,1]=4 25 B7R0.5 NC(CCO)C(=O)O Amb6600040 [1,0,1,0,0,0|0,0,0]=2 26 B7R0.5 NC(CCO)C(=O)O Amb8514287 [1,0,1,0,0,0|0,0,0]=2 27 B7R0.5 NC(CCS)C(=O)O Amb6600039 [1,0,1,0,0,0|0,1,0]=3 28 B7R0.6 CC(=O)CCC(=O)O Amb534169 [1,0,1,0,0,0|0,0,2]=4 29 B7R1.1 OCC1CCCN1 Amb2237182 [2,0,0,0,0,0|0,0,1]=3 30 B9R0.57 NC(CS(=O)(=O)O)C(=O)O Amb3940873 [0,1,1,0,0,0|2,0,0]=4 31 B9R1.163 [NH3+]C1(C(=O)O)CC[NH2+]C1 Amb22583868 [1,1,0,0,0,0|2,0,0]=4 32 B11R1.3 NCC1CCC(C(=O)O)CC1 Amb3940763 [0,1,0,0,0,1|2,0,0]=4 33 B9R1.6 O=C(O)C1CCCCN1 Amb2690345 [0,0,1,1,0,0|1,0,0]=3 34 B9R1.6 O=C(O)C1CCCCN1 Amb8515100 [0,0,1,1,0,0|1,0,0]=3 35 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [0,0,1,1,0,0|1,0,0]=3 36 B7R0.16 CC(C)C(N)C(=O)O Amb2720566 [0,0,1,0,1,0|1,0,0]=3 37 B7R0.16 CC(O)C(N)C(=O)O Amb6297293 [0,0,1,0,1,0|0,0,0]=2 38 B7R0.16 CC(O)C(N)C(=O)O Amb6599999 [0,0,1,0,1,0|0,0,0]=2 39 B7R0.16 CC(O)C(N)C(=O)O Amb8514159 [0,0,1,0,1,0|0,0,0]=2