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	hartrees
Energy at 0K	-548.565006
Energy at 298.15K	-548.565917
HF Energy	-548.565006
Nuclear repulsion energy	105.613964

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	1156	1107	29.80	21.13	0.20	0.33
2	A₁	510	489	34.10	4.23	0.73	0.85
3	B₂	1331	1276	177.85	9.97	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.380
O2	1.258	-0.380
O3	-1.258	-0.380

	S1	O2	O3
S1		1.4700	1.4700
O2	1.4700		2.5167
O3	1.4700	2.5167

Number	Element	Mulliken
1	S	0.718
2	O	-0.359
3	O	-0.359

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

using model chemistry: mPW1PW91/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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<r²>	44.372
(<r²>)^1/2	6.661

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

using model chemistry: mPW1PW91/cc-pVDZ

States and conformations

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