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	hartrees
Energy at 0K	-204.862476
Energy at 298.15K	-204.863527
HF Energy	-204.862476
Nuclear repulsion energy	65.037282

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	1456	1388	0.56	20.45	0.18	0.31
2	A₁	766	730	8.38	1.63	0.70	0.82
3	B₂	1808	1723	363.94	5.99	0.75	0.86

Atom	y (Å)	z (Å)
N1	0.000	0.323
O2	1.100	-0.141
O3	-1.100	-0.141

	N1	O2	O3
N1		1.1939	1.1939
O2	1.1939		2.2000
O3	1.1939	2.2000

Number	Element	Mulliken
1	N	0.500
2	O	-0.250
3	O	-0.250

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

using model chemistry: PBE1PBE/6-31G**

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>	30.270
(<r²>)^1/2	5.502

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

using model chemistry: PBE1PBE/6-31G**

States and conformations

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