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	hartrees
Energy at 0K	-473.403315
Energy at 298.15K
HF Energy	-473.403315
Nuclear repulsion energy	129.788342

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	913	830	0.00	57.77	0.46	0.63
2	A_g	378	343	0.00	3.91	0.09	0.17
3	B_1u	581	528	176.13	0.00	0.15	0.27
4	B_2u	252	229	116.59	0.00	0.72	0.84
5	B_3g	516	469	0.00	4.21	0.75	0.86
6	B_3u	73	66	133.02	0.00	0.75	0.86

Atom	y (Å)	z (Å)
Na1	0.000	1.921
Na2	0.000	-1.921
O3	0.746	0.000
O4	-0.746	0.000

	Na1	Na2	O3	O4
Na1		3.8412	2.0603	2.0603
Na2	3.8412		2.0603	2.0603
O3	2.0603	2.0603		1.4913
O4	2.0603	2.0603	1.4913

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O3	Na2	137.563		Na1	O4	Na2	137.563
O3	Na1	O4	42.437		O3	Na2	O4	42.437

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

using model chemistry: HF/6-311+G(3df,2p)

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	0.895
2	Na	0.895
3	O	-0.895
4	O	-0.895

<r²>	97.898
(<r²>)^1/2	9.894

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

using model chemistry: HF/6-311+G(3df,2p)

States and conformations

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