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	hartrees
Energy at 0K	-548.384535
Energy at 298.15K	-548.385420
HF Energy	-548.384535
Nuclear repulsion energy	105.605907

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	1100	1092	21.49	22.32	0.18	0.30
2	A₁	488	484	23.16	3.82	0.67	0.80
3	B₂	1282	1274	162.69	9.37	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.376
O2	1.262	-0.376
O3	-1.262	-0.376

	S1	O2	O3
S1		1.4695	1.4695
O2	1.4695		2.5243
O3	1.4695	2.5243

Number	Element	Mulliken
1	S	0.599
2	O	-0.300
3	O	-0.300

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

using model chemistry: PBEPBE/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>	44.559
(<r²>)^1/2	6.675

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

using model chemistry: PBEPBE/cc-pVTZ

States and conformations

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