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	hartrees
Energy at 0K	-312.008502
Energy at 298.15K
HF Energy	-311.532735
Nuclear repulsion energy	67.280106

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	1129	1065	21.32	0.00	0.33	0.50
2	A₁	428	403	86.19	53826.48	0.32	0.49
3	B₂	687	648	4183.57	1179.28	0.75	0.86

Atom	y (Å)	z (Å)
Na1	0.000	1.236
O2	0.682	-0.850
O3	-0.682	-0.850

	Na1	O2	O3
Na1		2.1940	2.1940
O2	2.1940		1.3639
O3	2.1940	1.3639

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O2	O3	71.891		Na1	O3	O2	71.891
O2	Na1	O3	36.218

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

using model chemistry: MP2/6-311+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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All results from a given calculation for NaO2 (Sodium superoxide)

using model chemistry: MP2/6-311+G(3df,2p)

States and conformations

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