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	hartrees
Energy at 0K	-548.402160
Energy at 298.15K
HF Energy	-548.402160
Nuclear repulsion energy	106.447559

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	1116	1116	22.96	22.40	0.18	0.30
2	A₁	492	492	23.50	3.57	0.68	0.81
3	B₂	1317	1317	165.12	8.98	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.368
O2	1.257	-0.368
O3	-1.257	-0.368

	S1	O2	O3
S1		1.4570	1.4570
O2	1.4570		2.5147
O3	1.4570	2.5147

Number	Element	Mulliken
1	S	0.556
2	O	-0.278
3	O	-0.278

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

using model chemistry: PBEPBE/cc-pCVTZ

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>	44.117
(<r²>)^1/2	6.642

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

using model chemistry: PBEPBE/cc-pCVTZ

States and conformations

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