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	hartrees
Energy at 0K	-548.634866
Energy at 298.15K	-548.635751
HF Energy	-548.634866
Nuclear repulsion energy	105.953928

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	1095	1095	22.56	34.16	0.13	0.23
2	A₁	493	493	23.05	2.25	0.59	0.75
3	B₂	1273	1273	185.67	8.72	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.376
O2	1.257	-0.376
O3	-1.257	-0.376

	S1	O2	O3
S1		1.4647	1.4647
O2	1.4647		2.5149
O3	1.4647	2.5149

Number	Element	Mulliken
1	S	1.669
2	O	-0.835
3	O	-0.835

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

using model chemistry: B97D3/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>	44.500
(<r²>)^1/2	6.671

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

using model chemistry: B97D3/daug-cc-pVTZ

States and conformations

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