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	hartrees
Energy at 0K	-2701.298892
Energy at 298.15K	-2701.301054
HF Energy	-2701.298892
Nuclear repulsion energy	447.306332

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3711	3572	41.54
2	A	1067	1027	66.70
3	A	941	906	61.82
4	A	645	620	78.03
5	A	336	324	77.46
6	A	317	305	3.21
7	A	243	234	0.01
8	A	164	158	84.29
9	B	3707	3568	188.80
10	B	1109	1068	123.30
11	B	1009	972	95.06
12	B	653	629	157.34
13	B	341	328	52.77
14	B	315	303	59.04
15	B	273	263	30.03

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.129
O2	0.000	1.442	0.863
O3	0.000	-1.442	0.863
O4	1.354	-0.002	-1.001
O5	-1.354	0.002	-1.001
H6	1.690	-0.912	-1.087
H7	-1.690	0.912	-1.087

	Se1	O2	O3	O4	O5	H6	H7
Se1		1.6176	1.6176	1.7636	1.7636	2.2731	2.2731
O2	1.6176		2.8834	2.7187	2.7164	3.4926	2.6337
O3	1.6176	2.8834		2.7164	2.7187	2.6337	3.4926
O4	1.7636	2.7187	2.7164		2.7080	0.9742	3.1798
O5	1.7636	2.7164	2.7187	2.7080		3.1798	0.9742
H6	2.2731	3.4926	2.6337	0.9742	3.1798		3.8416
H7	2.2731	2.6337	3.4926	3.1798	0.9742	3.8416

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	O4	H6	108.807	Se1	O5	H7	108.807
O2	Se1	O3	126.060	O2	Se1	O4	106.959
O2	Se1	O5	106.828	O3	Se1	O4	106.828
O3	Se1	O5	106.959	O4	Se1	O5	100.304

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

using model chemistry: TPSSh/6-31+G**

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	1.326
2	O	-0.515
3	O	-0.515
4	O	-0.530
5	O	-0.530
6	H	0.382
7	H	0.382

	x	y	z	Total
	0.000	0.000	-2.583	2.583
CHELPG
AIM
ESP

	x	y	z
x	6.111	-0.231	0.000
y	-0.231	6.891	0.000
z	0.000	0.000	6.058

<r²>	126.830
(<r²>)^1/2	11.262

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

using model chemistry: TPSSh/6-31+G**

States and conformations

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