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	hartrees
Energy at 0K	-42.065154
Energy at 298.15K	-42.066042
HF Energy	-42.065154
Nuclear repulsion energy	33.335670

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1122	1088	30.68
2	A₁	492	477	33.28
3	B₂	1302	1262	200.29

Atom	y (Å)	z (Å)
S1	0.000	0.378
O2	1.268	-0.378
O3	-1.268	-0.378

	S1	O2	O3
S1		1.4756	1.4756
O2	1.4756		2.5352
O3	1.4756	2.5352

Number	Element	Mulliken
1	S	0.632
2	O	-0.316
3	O	-0.316

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

using model chemistry: B3LYPultrafine/CEP-121G*

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>	36.094
(<r²>)^1/2	6.008

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

using model chemistry: B3LYPultrafine/CEP-121G*

States and conformations

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