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	hartrees
Energy at 0K	-548.710444
Energy at 298.15K	-548.711360
HF Energy	-548.710444
Nuclear repulsion energy	106.935840

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	1157	1119	28.54	34.46	0.14	0.25
2	A₁	514	498	28.82	2.21	0.60	0.75
3	B₂	1338	1295	215.23	9.39	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.373
O2	1.245	-0.373
O3	-1.245	-0.373

	S1	O2	O3
S1		1.4514	1.4514
O2	1.4514		2.4905
O3	1.4514	2.4905

Number	Element	Mulliken
1	S	1.123
2	O	-0.562
3	O	-0.562

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

using model chemistry: B3LYP/aug-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>	44.085
(<r²>)^1/2	6.640

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

using model chemistry: B3LYP/aug-cc-pVTZ

States and conformations

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