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	hartrees
Energy at 0K	-311.806147
Energy at 298.15K
HF Energy	-311.472838
Nuclear repulsion energy	68.313047

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1292	1193	12.82
2	A₁	455	420	73.10
3	B₂	468	432	183.69

Atom	y (Å)	z (Å)
Na1	0.000	1.216
O2	0.672	-0.836
O3	-0.672	-0.836

	Na1	O2	O3
Na1		2.1598	2.1598
O2	2.1598		1.3444
O3	2.1598	1.3444

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O2	O3	71.866		Na1	O3	O2	71.866
O2	Na1	O3	36.268

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

using model chemistry: CID/6-31G*

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: CID/6-31G*

States and conformations

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