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	hartrees
Energy at 0K	-205.058835
Energy at 298.15K	-205.059874
HF Energy	-205.058835
Nuclear repulsion energy	64.705437

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	1332	1311	0.00	20.78	0.22	0.36
2	A₁	749	738	4.01	0.84	0.37	0.54
3	B₂	1641	1616	356.39	4.26	0.75	0.86

Atom	y (Å)	z (Å)
N1	0.000	0.325
O2	1.105	-0.142
O3	-1.105	-0.142

	N1	O2	O3
N1		1.2001	1.2001
O2	1.2001		2.2105
O3	1.2001	2.2105

Number	Element	Mulliken
1	N	0.523
2	O	-0.261
3	O	-0.261

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

using model chemistry: B97D3/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>	30.654
(<r²>)^1/2	5.537

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

using model chemistry: B97D3/aug-cc-pVTZ

States and conformations

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