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	hartrees
Energy at 0K	-623.303490
Energy at 298.15K	-623.306216
HF Energy	-622.571424
Nuclear repulsion energy	182.050597

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3755	3675
2	A	1242	1215
3	A	1111	1087
4	A	1029	1007
5	A	714	699
6	A	487	477
7	A	391	383
8	A	389	381
9	A	246	241

Atom	x (Å)	y (Å)	z (Å)
S1	-0.131	0.093	0.263
O2	1.057	-1.041	-0.104
O3	0.378	1.422	-0.192
O4	-1.408	-0.503	-0.208
H5	1.878	-0.518	-0.173

	S1	O2	O3	O4	H5
S1		1.6827	1.4942	1.4854	2.1447
O2	1.6827		2.5558	2.5247	0.9761
O3	1.4942	2.5558		2.6257	2.4518
O4	1.4854	2.5247	2.6257		3.2860
H5	2.1447	0.9761	2.4518	3.2860

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	O2	H5	104.378		O2	S1	O3	106.974
O2	S1	O4	105.501		O3	S1	O4	123.581

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

using model chemistry: CCSD(T)/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: CCSD(T)/cc-pVDZ

States and conformations

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