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	hartrees
Energy at 0K	-548.429458
Energy at 298.15K	-548.430383
HF Energy	-548.429458
Nuclear repulsion energy	107.506163

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	1193	1193	29.81	33.76	0.14	0.25
2	A₁	524	524	29.44	1.90	0.57	0.72
3	B₂	1380	1380	219.52	8.56	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.371
O2	1.239	-0.371
O3	-1.239	-0.371

	S1	O2	O3
S1		1.4437	1.4437
O2	1.4437		2.4774
O3	1.4437	2.4774

Number	Element	Mulliken
1	S	1.640
2	O	-0.820
3	O	-0.820

All results from a given calculation for SO₂ (Sulfur dioxide)

using model chemistry: HSEh1PBE/daug-cc-pVTZ

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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<r²>	43.654
(<r²>)^1/2	6.607

All results from a given calculation for SO2 (Sulfur dioxide)

using model chemistry: HSEh1PBE/daug-cc-pVTZ

States and conformations

All results from a given calculation for SO₂ (Sulfur dioxide)