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	hartrees
Energy at 0K	-2703.450431
Energy at 298.15K	-2703.452728
HF Energy	-2703.450431
Nuclear repulsion energy	450.213342

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3752	3612	36.87
2	A	1102	1061	78.37
3	A	938	903	62.85
4	A	655	631	75.80
5	A	356	343	107.02
6	A	327	315	1.57
7	A	252	243	0.01
8	A	183	176	89.41
9	B	3749	3609	159.61
10	B	1142	1100	125.00
11	B	1012	974	89.37
12	B	666	641	155.96
13	B	355	341	86.77
14	B	331	318	45.59
15	B	279	268	36.40

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.137
O2	0.000	1.433	0.848
O3	0.000	-1.433	0.848
O4	1.361	0.020	-0.995
O5	-1.361	-0.020	-0.995
H6	1.615	-0.901	-1.158
H7	-1.615	0.901	-1.158

	Se1	O2	O3	O4	O5	H6	H7
Se1		1.5994	1.5994	1.7701	1.7701	2.2576	2.2576
O2	1.5994		2.8656	2.6912	2.7128	3.4752	2.6295
O3	1.5994	2.8656		2.7128	2.6912	2.6295	3.4752
O4	1.7701	2.6912	2.7128		2.7215	0.9695	3.1073
O5	1.7701	2.7128	2.6912	2.7215		3.1073	0.9695
H6	2.2576	3.4752	2.6295	0.9695	3.1073		3.6983
H7	2.2576	2.6295	3.4752	3.1073	0.9695	3.6983

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	O4	H6	107.349	Se1	O5	H7	107.349
O2	Se1	O3	127.235	O2	Se1	O4	105.896
O2	Se1	O5	107.128	O3	Se1	O4	107.128
O3	Se1	O5	105.896	O4	Se1	O5	100.480

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

using model chemistry: B3PW91/6-311G*

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	1.249
2	O	-0.469
3	O	-0.469
4	O	-0.593
5	O	-0.593
6	H	0.438
7	H	0.438

	x	y	z	Total
	0.000	0.000	-2.516	2.516
CHELPG
AIM
ESP

	x	y	z
x	5.034	-0.335	0.000
y	-0.335	5.825	0.000
z	0.000	0.000	4.913

<r²>	125.169
(<r²>)^1/2	11.188

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

using model chemistry: B3PW91/6-311G*

States and conformations

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