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	hartrees
Energy at 0K	-205.036113
Energy at 298.15K	-205.037170
HF Energy	-205.036113
Nuclear repulsion energy	65.325380

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	1458	1401	1.08	18.15	0.20	0.34
2	A₁	774	744	9.14	1.89	0.73	0.84
3	B₂	1804	1734	376.22	5.70	0.75	0.86

Atom	y (Å)	z (Å)
N1	0.000	0.320
O2	1.096	-0.140
O3	-1.096	-0.140

	N1	O2	O3
N1		1.1884	1.1884
O2	1.1884		2.1918
O3	1.1884	2.1918

Number	Element	Mulliken
1	N	0.299
2	O	-0.150
3	O	-0.150

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

using model chemistry: B1B95/cc-pVDZ

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>	30.054
(<r²>)^1/2	5.482

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

using model chemistry: B1B95/cc-pVDZ

States and conformations

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