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	hartrees
Energy at 0K	-204.965840
Energy at 298.15K	-204.966895
HF Energy	-204.965840
Nuclear repulsion energy	65.592512

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	1433	1433	0.06	23.78	0.22	0.36
2	A₁	780	780	5.26	0.40	0.53	0.69
3	B₂	1771	1771	465.10	4.40	0.75	0.86

Atom	y (Å)	z (Å)
N1	0.000	0.316
O2	1.093	-0.138
O3	-1.093	-0.138

	N1	O2	O3
N1		1.1831	1.1831
O2	1.1831		2.1852
O3	1.1831	2.1852

Number	Element	Mulliken
1	N	0.928
2	O	-0.464
3	O	-0.464

All results from a given calculation for NO₂ (Nitrogen dioxide)

using model chemistry: HSEh1PBE/daug-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>	30.170
(<r²>)^1/2	5.493

All results from a given calculation for NO2 (Nitrogen dioxide)

using model chemistry: HSEh1PBE/daug-cc-pVTZ

States and conformations

All results from a given calculation for NO₂ (Nitrogen dioxide)