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	hartrees
Energy at 0K	-623.144572
Energy at 298.15K	-623.147569
HF Energy	-622.559014
Nuclear repulsion energy	187.438724

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3855	3569	159.51
2	A	1394	1291	192.93
3	A	1209	1120	106.27
4	A	1165	1078	88.11
5	A	848	785	170.73
6	A	560	518	56.82
7	A	448	414	24.72
8	A	435	403	39.38
9	A	292	270	117.76

Atom	x (Å)	y (Å)	z (Å)
S1	-0.125	0.087	0.251
O2	1.014	-1.011	-0.098
O3	0.379	1.379	-0.182
O4	-1.377	-0.474	-0.200
H5	1.864	-0.554	-0.190

	S1	O2	O3	O4	H5
S1		1.6203	1.4529	1.4448	2.1356
O2	1.6203		2.4747	2.4528	0.9691
O3	1.4529	2.4747		2.5536	2.4378
O4	1.4448	2.4528	2.5536		3.2418
H5	2.1356	0.9691	2.4378	3.2418

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	O2	H5	108.496		O2	S1	O3	107.142
O2	S1	O4	106.165		O3	S1	O4	123.588

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

using model chemistry: CISD/6-31G*

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: CISD/6-31G*

States and conformations

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