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	hartrees
Energy at 0K	-548.400001
Energy at 298.15K
HF Energy	-548.400001
Nuclear repulsion energy	106.562892

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	1119	1119	23.60	22.21	0.18	0.31
2	A₁	493	493	23.65	3.58	0.68	0.81
3	B₂	1320	1320	166.83	9.15	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.367
O2	1.256	-0.367
O3	-1.256	-0.367

	S1	O2	O3
S1		1.4553	1.4553
O2	1.4553		2.5126
O3	1.4553	2.5126

Number	Element	Mulliken
1	S	0.595
2	O	-0.297
3	O	-0.297

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

using model chemistry: PBEPBEultrafine/cc-pV(T+d)Z

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>	44.062
(<r²>)^1/2	6.638

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

using model chemistry: PBEPBEultrafine/cc-pV(T+d)Z

States and conformations

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