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	hartrees
Energy at 0K	-473.350052
Energy at 298.15K
HF Energy	-473.350052
Nuclear repulsion energy	129.887733

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A_g	908	823	0.00	51.06	0.38	0.55
2	A_g	390	353	0.00	4.11	0.18	0.31
3	B_1u	597	540	178.88	0.00	0.15	0.25
4	B_2u	264	239	101.50	0.00	0.72	0.84
5	B_3g	531	481	0.00	4.19	0.75	0.86
6	B_3u	76	69	124.52	0.00	0.75	0.86

Atom	y (Å)	z (Å)
Na1	0.000	1.915
Na2	0.000	-1.915
O3	0.749	0.000
O4	-0.749	0.000

	Na1	Na2	O3	O4
Na1		3.8310	2.0567	2.0567
Na2	3.8310		2.0567	2.0567
O3	2.0567	2.0567		1.4980
O4	2.0567	2.0567	1.4980

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O3	Na2	137.286		Na1	O4	Na2	137.286
O3	Na1	O4	42.714		O3	Na2	O4	42.714

All results from a given calculation for Na₂O₂ (disodium dioxide)

using model chemistry: HF/6-31G(2df,p)

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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Number	Element	Mulliken
1	Na	0.665
2	Na	0.665
3	O	-0.665
4	O	-0.665

<r²>	97.474
(<r²>)^1/2	9.873

All results from a given calculation for Na2O2 (disodium dioxide)

using model chemistry: HF/6-31G(2df,p)

States and conformations

All results from a given calculation for Na₂O₂ (disodium dioxide)