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	hartrees
Energy at 0K	-623.272481
Energy at 298.15K	-623.275349
HF Energy	-622.573203
Nuclear repulsion energy	182.940051

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3758	3580	120.18
2	A	1444	1376	680.13
3	A	1125	1072	153.63
4	A	1113	1061	22.91
5	A	756	720	160.17
6	A	522	497	41.40
7	A	411	391	60.71
8	A	403	384	12.93
9	A	277	264	80.31

Atom	x (Å)	y (Å)	z (Å)
S1	-0.131	0.092	0.247
O2	1.059	-1.032	-0.104
O3	0.368	1.424	-0.182
O4	-1.402	-0.510	-0.193
H5	1.888	-0.517	-0.122

	S1	O2	O3	O4	H5
S1		1.6739	1.4859	1.4738	2.1409
O2	1.6739		2.5525	2.5173	0.9764
O3	1.4859	2.5525		2.6216	2.4661
O4	1.4738	2.5173	2.6216		3.2910
H5	2.1409	0.9764	2.4661	3.2910

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	O2	H5	104.669		O2	S1	O3	107.613
O2	S1	O4	106.030		O3	S1	O4	124.684

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

using model chemistry: MP2/cc-pVDZ

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/cc-pVDZ

States and conformations

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