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	hartrees
Energy at 0K	-2699.536451
Energy at 298.15K	-2699.538660
HF Energy	-2699.536451
Nuclear repulsion energy	452.120034

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3642	3600	45.89
2	A	1025	1013	77.49
3	A	949	938	57.77
4	A	656	648	79.99
5	A	342	338	82.11
6	A	317	314	3.68
7	A	246	243	0.00
8	A	171	169	84.70
9	B	3639	3596	222.31
10	B	1082	1070	128.82
11	B	1009	997	90.00
12	B	669	661	162.30
13	B	341	337	63.19
14	B	318	314	53.57
15	B	272	269	34.11

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.137
O2	0.000	1.434	0.838
O3	0.000	-1.434	0.838
O4	1.354	0.024	-0.985
O5	-1.354	-0.024	-0.985
H6	1.595	-0.915	-1.144
H7	-1.595	0.915	-1.144

	Se1	O2	O3	O4	O5	H6	H7
Se1		1.5958	1.5958	1.7586	1.7586	2.2413	2.2413
O2	1.5958		2.8675	2.6728	2.6981	3.4624	2.5967
O3	1.5958	2.8675		2.6981	2.6728	2.5967	3.4624
O4	1.7586	2.6728	2.6981		2.7082	0.9819	3.0850
O5	1.7586	2.6981	2.6728	2.7082		3.0850	0.9819
H6	2.2413	3.4624	2.5967	0.9819	3.0850		3.6780
H7	2.2413	2.5967	3.4624	3.0850	0.9819	3.6780

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	O4	H6	106.253	Se1	O5	H7	106.253
O2	Se1	O3	127.904	O2	Se1	O4	105.551
O2	Se1	O5	106.995	O3	Se1	O4	106.995
O3	Se1	O5	105.551	O4	Se1	O5	100.705

All results from a given calculation for H₂SeO₄ (Selenic acid)

using model chemistry: LSDA/TZVP

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken
1	Se	0.900
2	O	-0.410
3	O	-0.410
4	O	-0.365
5	O	-0.365
6	H	0.325
7	H	0.325

	x	y	z	Total
	0.000	0.000	-2.548	2.548
CHELPG
AIM
ESP

	x	y	z
x	5.593	-0.318	0.000
y	-0.318	6.561	0.000
z	0.000	0.000	5.523

<r²>	124.580
(<r²>)^1/2	11.162

All results from a given calculation for H2SeO4 (Selenic acid)

using model chemistry: LSDA/TZVP

States and conformations

All results from a given calculation for H₂SeO₄ (Selenic acid)