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	hartrees
Energy at 0K	-311.889911
Energy at 298.15K
HF Energy	-311.494760
Nuclear repulsion energy	67.748162

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1114	1075
2	A₁	424	409
3	B₂	938	905

Atom	y (Å)	z (Å)
Na1	0.000	1.210
O2	0.690	-0.832
O3	-0.690	-0.832

	Na1	O2	O3
Na1		2.1556	2.1556
O2	2.1556		1.3792
O3	2.1556	1.3792

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O2	O3	71.342		Na1	O3	O2	71.342
O2	Na1	O3	37.316

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

using model chemistry: MP4=FULL/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: MP4=FULL/cc-pVDZ

States and conformations

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