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	hartrees
Energy at 0K	-548.603374
Energy at 298.15K	-548.604267
HF Energy	-548.603374
Nuclear repulsion energy	104.853032

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	1113	1079	26.40	20.71	0.19	0.33
2	A₁	498	483	31.90	4.37	0.73	0.85
3	B₂	1282	1243	160.17	9.93	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.383
O2	1.267	-0.383
O3	-1.267	-0.383

	S1	O2	O3
S1		1.4808	1.4808
O2	1.4808		2.5338
O3	1.4808	2.5338

Number	Element	Mulliken
1	S	0.703
2	O	-0.351
3	O	-0.351

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

using model chemistry: B3LYPultrafine/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>	44.830
(<r²>)^1/2	6.696

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

using model chemistry: B3LYPultrafine/cc-pVDZ

States and conformations

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