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	hartrees
Energy at 0K	-548.125137
Energy at 298.15K	-548.125820
HF Energy	-548.125137
Nuclear repulsion energy	95.232068

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	860	848	3.18
2	A₁	370	365	21.25
3	B₂	955	942	56.05

Atom	y (Å)	z (Å)
S1	0.000	0.441
O2	1.375	-0.441
O3	-1.375	-0.441

	S1	O2	O3
S1		1.6338	1.6338
O2	1.6338		2.7505
O3	1.6338	2.7505

Number	Element	Mulliken
1	S	0.864
2	O	-0.432
3	O	-0.432

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

using model chemistry: PBEPBEultrafine/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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<r²>	51.719
(<r²>)^1/2	7.192

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

using model chemistry: PBEPBEultrafine/6-31G

States and conformations

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