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	hartrees
Energy at 0K	-619.980512
Energy at 298.15K	-619.983276
HF Energy	-619.486681
Nuclear repulsion energy	184.170025

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3481	3311	61.53
2	A	1544	1469	959.52
3	A	1139	1083	54.64
4	A	1112	1058	90.31
5	A	764	726	177.28
6	A	538	512	48.41
7	A	425	405	21.13
8	A	409	389	48.04
9	A	183	174	138.83

Atom	x (Å)	y (Å)	z (Å)
S1	-0.137	0.081	0.253
O2	1.097	-0.967	-0.087
O3	0.302	1.423	-0.180
O4	-1.369	-0.560	-0.207
H5	1.944	-0.468	-0.265

	S1	O2	O3	O4	H5
S1		1.6544	1.4764	1.4635	2.2130
O2	1.6544		2.5200	2.5027	0.9986
O3	1.4764	2.5200		2.5933	2.5048
O4	1.4635	2.5027	2.5933		3.3146
H5	2.2130	0.9986	2.5048	3.3146

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	O2	H5	110.616		O2	S1	O3	107.069
O2	S1	O4	106.622		O3	S1	O4	123.800

All results from a given calculation for HSO₃ (Hydroxysulfonyl radical)

using model chemistry: MP2/3-21G*

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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All results from a given calculation for HSO3 (Hydroxysulfonyl radical)

using model chemistry: MP2/3-21G*

States and conformations

All results from a given calculation for HSO₃ (Hydroxysulfonyl radical)