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	hartrees
Energy at 0K	-205.166581
Energy at 298.15K	-205.167624
HF Energy	-205.166581
Nuclear repulsion energy	64.932129

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	1368	1368	0.00	22.62	0.22	0.36
2	A₁	757	757	4.39	0.55	0.45	0.62
3	B₂	1674	1674	400.04	4.30	0.75	0.86

Atom	y (Å)	z (Å)
N1	0.000	0.323
O2	1.102	-0.141
O3	-1.102	-0.141

	N1	O2	O3
N1		1.1957	1.1957
O2	1.1957		2.2042
O3	1.1957	2.2042

Number	Element	Mulliken
1	N	1.061
2	O	-0.530
3	O	-0.530

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

using model chemistry: TPSSh/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>	30.533
(<r²>)^1/2	5.526

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

using model chemistry: TPSSh/daug-cc-pVTZ

States and conformations

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