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	hartrees
Energy at 0K	-2700.961417
Energy at 298.15K	-2700.963927
HF Energy	-2700.961417
Nuclear repulsion energy	458.835219

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3821	3659	34.91
2	A	1093	1047	91.30
3	A	1026	982	43.93
4	A	750	718	68.54
5	A	364	348	72.67
6	A	339	325	1.61
7	A	270	259	3.17
8	A	180	172	77.83
9	B	3817	3655	228.68
10	B	1161	1112	141.63
11	B	1086	1040	73.63
12	B	757	725	143.41
13	B	367	351	68.62
14	B	351	337	43.00
15	B	294	282	31.10

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.130
O2	0.000	1.415	0.833
O3	0.000	-1.415	0.833
O4	1.326	0.019	-0.972
O5	-1.326	-0.019	-0.972
H6	1.596	-0.900	-1.101
H7	-1.596	0.900	-1.101

	Se1	O2	O3	O4	O5	H6	H7
Se1		1.5801	1.5801	1.7238	1.7238	2.2075	2.2075
O2	1.5801		2.8302	2.6388	2.6591	3.4129	2.5597
O3	1.5801	2.8302		2.6591	2.6388	2.5597	3.4129
O4	1.7238	2.6388	2.6591		2.6514	0.9669	3.0544
O5	1.7238	2.6591	2.6388	2.6514		3.0544	0.9669
H6	2.2075	3.4129	2.5597	0.9669	3.0544		3.6650
H7	2.2075	2.5597	3.4129	3.0544	0.9669	3.6650

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	O4	H6	106.855	Se1	O5	H7	106.855
O2	Se1	O3	127.170	O2	Se1	O4	105.931
O2	Se1	O5	107.112	O3	Se1	O4	107.112
O3	Se1	O5	105.931	O4	Se1	O5	100.538

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

using model chemistry: HSEh1PBE/6-31G(2df,p)

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	1.362
2	O	-0.492
3	O	-0.492
4	O	-0.542
5	O	-0.542
6	H	0.353
7	H	0.353

	x	y	z	Total
	0.000	0.000	-2.666	2.666
CHELPG
AIM
ESP

	x	y	z
x	5.179	-0.329	0.000
y	-0.329	5.689	0.000
z	0.000	0.000	5.025

<r²>	120.706
(<r²>)^1/2	10.987

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

using model chemistry: HSEh1PBE/6-31G(2df,p)

States and conformations

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