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	hartrees
Energy at 0K	-548.338538
Energy at 298.15K	-548.339407
HF Energy	-548.338538
Nuclear repulsion energy	105.058292

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	1074	1063	24.09	19.53	0.22	0.36
2	A₁	480	475	29.65	4.90	0.72	0.83
3	B₂	1256	1243	158.52	9.47	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.375
O2	1.272	-0.375
O3	-1.272	-0.375

	S1	O2	O3
S1		1.4765	1.4765
O2	1.4765		2.5447
O3	1.4765	2.5447

Number	Element	Mulliken
1	S	0.732
2	O	-0.366
3	O	-0.366

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

using model chemistry: PBEPBE/6-311G*

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>	45.125
(<r²>)^1/2	6.718

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

using model chemistry: PBEPBE/6-311G*

States and conformations

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