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	hartrees
Energy at 0K	-623.363432
Energy at 298.15K	-623.366410
HF Energy	-622.638485
Nuclear repulsion energy	187.563784

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3885	3710	129.15
2	A	1378	1316	220.71
3	A	1144	1092	103.09
4	A	1137	1086	71.58
5	A	798	762	169.56
6	A	548	524	51.13
7	A	440	420	19.65
8	A	430	411	40.69
9	A	294	281	109.04

Atom	x (Å)	y (Å)	z (Å)
S1	-0.130	0.083	0.251
O2	1.072	-0.953	-0.109
O3	0.290	1.400	-0.186
O4	-1.341	-0.556	-0.195
H5	1.897	-0.456	-0.108

	S1	O2	O3	O4	H5
S1		1.6276	1.4492	1.4406	2.1282
O2	1.6276		2.4809	2.4473	0.9632
O3	1.4492	2.4809		2.5469	2.4563
O4	1.4406	2.4473	2.5469		3.2410
H5	2.1282	0.9632	2.4563	3.2410

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	O2	H5	107.682		O2	S1	O3	107.332
O2	S1	O4	105.646		O3	S1	O4	123.605

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

using model chemistry: CCD/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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All results from a given calculation for HSO3 (Hydroxysulfonyl radical)

using model chemistry: CCD/6-311G**

States and conformations

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