1	FSQ	(1~{S},3~{R},4~{S},5~{R})-3-methyl-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid	1.000
2	L9Z	(1~{S},3~{S},4~{S},5~{R})-3-(aminomethyl)-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid	0.929
3	VAU	(1~{R},3~{R},4~{S},5~{R})-3-methyl-1,3,4,5-tetrakis(oxidanyl)cyclohexane-1-carboxylic acid	0.929
4	3DS	(4s,5r)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylic acid	0.923
5	DHK	3-dehydroshikimate	0.923
6	FQZ	(1~{R},3~{S},4~{R},5~{R})-3-methyl-4,5-bis(hydroxyl)cyclohexane-1-carboxylic acid	0.923
7	FT5	(3~{R})-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid	0.923
8	GDE	3,4,5-trihydroxybenzoic acid	0.923
9	SKM	(3r,4s,5r)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid	0.923
10	DQA	1,3,4-trihydroxy-5-oxo-cyclohexanecarboxylic acid	0.857
11	QIC	(1s,3r,4s,5r)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid	0.857
12	WPL	(1~{S},3~{S},4~{R},5~{R})-3-methyl-1,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid	0.857
13	34D	3,5-dihydroxybenzoate	0.846
14	A1LXW	3-methyl-4-oxidanyl-benzoic acid	0.846
15	AW5	3-methyl-5-oxidanyl-benzoic acid	0.846
16	DHB	3,4-dihydroxybenzoic acid	0.846
17	48P	(1r,4r,5r)-1,4,5-trihydroxy-3-hydroxymethylcyclohex-2-ene-1-carboxylic acid	0.800
18	8I4	(2r,3s,5r,6r)-2,3,4,5,6-pentakis(oxidanyl)cyclohexane-1-carboxylic acid	0.800
19	9C4	(2s)-2-hydroxy-3-epiquinic acid	0.800
20	9PY	(2r)-2-methyl-3-dehydroquinic acid	0.800
21	L9D	(1s,2r,3s,4s,5s,6r)-2-amino-3,4,5,6-tetrahydroxycyclohexane-1-carboxylic acid	0.800
22	DHS	3-amino-4,5-dihydroxy-cyclohex-1-enecarboxylate	0.786
23	FA1	2,3 -anhydro-quinic acid	0.786
24	FDK	(1~{S},2~{S},3~{S},4~{S})-5-(hydroxymethyl)cyclohex-5-ene-1,2,3,4-tetrol	0.786
25	HMC	5-hydroxymethyl-chonduritol	0.786
26	M96	(1~{S},2~{R},3~{S},4~{R},5~{R})-5-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol	0.786
27	PVI	(4r,5r)-3-amino-4,5-dihydroxy-cyclohexene-1-carboxylic acid	0.786
28	SHL	5-hydroxy-6-methyl-4-oxo-4h-pyran-2-carboxylic acid	0.786
29	3HB	3-hydroxybenzoic acid	0.769
30	3OC	(1r)-3-oxocyclohexanecarboxylic acid	0.769
31	H6N	Protocatechuic aldehyde	0.769
32	OVV	3-methylbenzoic acid	0.769
33	PHB	P-hydroxybenzoic acid	0.769
34	ND3	2,2-dimethyl-3-dehydroquinic acid	0.750
35	XH2	(1r,4r,5r)-1,4,5-trihydroxy-3-(2-hydroxy)ethylcyclohex-2-ene-1-carboxylic acid	0.750
36	15L	D-galactaro-1,5-lactone	0.733
37	66U	(1r,2s,3s,4r,5s,6r)-5-amino-6-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol	0.733
38	7D2	(1~{R},2~{S},3~{S},4~{S},5~{S},6~{S})-1-(hydroxymethyl)bicyclo[4.1.0]heptane-2,3,4,5-tetrol	0.733
39	7WR	3-methoxy-4,5-bis(oxidanyl)benzoic acid	0.733
40	ADA	Alpha-D-galactopyranuronic acid	0.733
41	BDP	Beta-D-glucopyranuronic acid	0.733
42	BEM	Beta-D-mannopyranuronic acid	0.733
43	EVA	(2s,3r,4s,5r)-3,4,5-trihydroxy-6-oxopiperidine-2-carboxylic acid	0.733
44	FA3	2-anhydro-3-fluoro-quinic acid	0.733
45	GCB	(2s,3s,4s,5r)-3,4,5-trihydroxy-6-oxo-oxane-2-carboxylic acid	0.733
46	GCU	Alpha-D-glucopyranuronic acid	0.733
47	GTR	Beta-D-galactopyranuronic acid	0.733
48	H62	(1~{R},2~{R},3~{R},4~{S},6~{S})-6-azanyl-2,3,4-tris(oxidanyl)cyclohexane-1-carboxylic acid	0.733
49	IDR	Alpha-L-idopyranuronic acid	0.733
50	JIW	Beta-D-manno-configured cyclophellitol aziridine, reacted form	0.733
51	KGH	(1~{R},2~{S},3~{R},4~{R},5~{S},6~{R})-5-azanyl-6-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol	0.733
52	LGU	Alpha-L-gulopyranuronic acid	0.733
53	MAV	Alpha-D-mannopyranuronic acid	0.733
54	OM0	(1r,2s,3r,4r)-5-bromo-6-(hydroxymethyl)cyclohex-5-ene-1,2,3,4-tetrol	0.733
55	OML	(1r,2s,3r,4r)-5-fluoro-6-(hydroxymethyl)cyclohex-5-ene-1,2,3,4-tetrol	0.733
56	OVU	(1~{S},2~{R},4~{R},5~{S},6~{S})-2,4,5-trihydroxy-7-oxabicyclo[4.1.0]heptane-2-carboxylic acid	0.733
57	PBW	(1~{S},4~{S},5~{R})-6-(hydroxymethyl)cyclohexane-1,2,3,4,5-pentol	0.733
58	PO8	(1~{R},2~{S},3~{S},4~{S},5~{R},6~{R})-5-azanyl-6-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol	0.733
59	UUU	(1s,2s,3s,4s,5r,6r)-5-amino-6-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol	0.733
60	VKN	(1r,2s,4s,5r)-6-(hydroxymethyl)cyclohexane-1,2,3,4,5-pentol	0.733
61	X1X	Alpha-D-talopyranuronic acid	0.733
62	YGX	(1~{S},2~{S},4~{S},5~{R})-6-(hydroxymethyl)cyclohexane-1,2,3,4,5-pentol	0.733
63	YLL	(1r,2s,3s,4s,5r,6r)-6-(hydroxymethyl)cyclohexane-1,2,3,4,5-pentol	0.733
64	3AZ	3-(aminomethyl)benzoic acid	0.714
65	3HA	3-hydroxyanthranilic acid	0.714
66	3M0	2-azanyl-3-methyl-benzoic acid	0.714
67	4A3	4-amino-3-hydroxybenzoic acid	0.714
68	54G	2-hydroxy-5-methylbenzoic acid	0.714
69	5M0	2-azanyl-5-methyl-benzoic acid	0.714
70	A1D71	3-chloranyl-5-oxidanyl-benzoic acid	0.714
71	ADH	1-amino-2,3-dihydroxy-5-hydroxymethyl cyclohex-5-ene	0.714
72	CHB	3-chloro-4-hydroxybenzoic acid	0.714
73	D1X	2,6-dioxo-1,2,3,6-tetrahydropyridine-4-carboxylic acid	0.714
74	DBH	2,3-dihydroxy-benzoic acid	0.714
75	DOB	2,4-dihydroxybenzoic acid	0.714
76	EXO	(1r,2s,3s,4r)-5-methylenecyclohexane-1,2,3,4-tetraol	0.714
77	FHB	3-fluoro-4-hydroxybenzoic acid	0.714
78	G4D	4-deoxy-alpha-D-glucopyranose	0.714
79	GTQ	2,5-dihydroxybenzoic acid	0.714
80	HFO	1-[3,4-bis(oxidanyl)phenyl]ethanone	0.714
81	HHA	(2s,3s)-trans-2,3-dihydro-3-hydroxyanthranilic acid	0.714
82	IHB	3-iodo-4-hydroxybenzoic acid	0.714
83	PF0	3-hydroxy-2-methylbenzoic acid	0.714
84	QSB	3 bromo 4 hydroxybenzoic acid	0.714
85	YTP	1-(4-hydroxy-3-methylphenyl)ethanone	0.714