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	hartrees
Energy at 0K	-2702.916990
Energy at 298.15K	-2702.919018
HF Energy	-2702.916990
Nuclear repulsion energy	442.656686

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3598	3561	30.58
2	A	1064	1053	70.64
3	A	892	883	55.79
4	A	596	590	67.82
5	A	331	328	87.18
6	A	308	305	0.10
7	A	231	228	0.65
8	A	165	163	80.71
9	B	3596	3558	111.07
10	B	1106	1094	110.58
11	B	965	955	84.22
12	B	611	605	140.15
13	B	330	326	63.97
14	B	312	308	47.93
15	B	262	259	26.77

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.143
O2	0.000	1.456	0.856
O3	0.000	-1.456	0.856
O4	1.393	0.032	-1.012
O5	-1.393	-0.032	-1.012
H6	1.619	-0.908	-1.176
H7	-1.619	0.908	-1.176

	Se1	O2	O3	O4	O5	H6	H7
Se1		1.6209	1.6209	1.8095	1.8095	2.2767	2.2767
O2	1.6209		2.9111	2.7303	2.7647	3.5121	2.6547
O3	1.6209	2.9111		2.7647	2.7303	2.6547	3.5121
O4	1.8095	2.7303	2.7647		2.7864	0.9811	3.1408
O5	1.8095	2.7647	2.7303	2.7864		3.1408	0.9811
H6	2.2767	3.5121	2.6547	0.9811	3.1408		3.7127
H7	2.2767	2.6547	3.5121	3.1408	0.9811	3.7127

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	O4	H6	105.461	Se1	O5	H7	105.461
O2	Se1	O3	127.785	O2	Se1	O4	105.349
O2	Se1	O5	107.272	O3	Se1	O4	107.272
O3	Se1	O5	105.349	O4	Se1	O5	100.697

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

using model chemistry: PBEPBE/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	1.095
2	O	-0.416
3	O	-0.416
4	O	-0.547
5	O	-0.547
6	H	0.417
7	H	0.417

	x	y	z	Total
	0.000	0.000	-2.318	2.318
CHELPG
AIM
ESP

	x	y	z
x	5.497	-0.364	0.000
y	-0.364	6.220	0.000
z	0.000	0.000	5.311

<r²>	128.654
(<r²>)^1/2	11.343

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

using model chemistry: PBEPBE/6-311G*

States and conformations

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