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	hartrees
Energy at 0K	-311.909067
Energy at 298.15K
HF Energy	-311.508243
Nuclear repulsion energy	66.863148

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	1043	1043	8.88	13469.51	0.33	0.50
2	A₁	422	422	75.14	0.00	0.33	0.50
3	B₂	1339	1339	93305.72	0.00	0.75	0.86

Atom	y (Å)	z (Å)
Na1	0.000	1.236
O2	0.692	-0.850
O3	-0.692	-0.850

	Na1	O2	O3
Na1		2.1971	2.1971
O2	2.1971		1.3839
O3	2.1971	1.3839

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O2	O3	71.643		Na1	O3	O2	71.643
O2	Na1	O3	36.714

All results from a given calculation for NaO₂ (Sodium superoxide)

using model chemistry: MP2/daug-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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All results from a given calculation for NaO2 (Sodium superoxide)

using model chemistry: MP2/daug-cc-pVDZ

States and conformations

All results from a given calculation for NaO₂ (Sodium superoxide)