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	hartrees
Energy at 0K	-204.962921
Energy at 298.15K	-204.963929
HF Energy	-204.962921
Nuclear repulsion energy	62.896895

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	1296	1296	0.71	21.86	0.21	0.35
2	A₁	696	696	10.00	3.11	0.73	0.85
3	B₂	1563	1563	322.49	8.90	0.75	0.86

Atom	y (Å)	z (Å)
N1	0.000	0.337
O2	1.136	-0.147
O3	-1.136	-0.147

	N1	O2	O3
N1		1.2349	1.2349
O2	1.2349		2.2723
O3	1.2349	2.2723

Number	Element	Mulliken
1	N	0.266
2	O	-0.133
3	O	-0.133

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

using model chemistry: wB97X-D/LANL2DZ

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>	32.103
(<r²>)^1/2	5.666

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

using model chemistry: wB97X-D/LANL2DZ

States and conformations

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