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	hartrees
Energy at 0K	-150.060624
Energy at 298.15K
HF Energy	-149.794400
Nuclear repulsion energy	26.412260

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	837	806	0.92	0.00	0.33	0.50
2	A₁	412	397	52.97	89978.15	0.33	0.50
3	B₂	625	602	2335.69	1679.79	0.75	0.86

Atom	y (Å)	z (Å)
Na1	0.000	1.241
O2	0.749	-0.853
O3	-0.749	-0.853

	Na1	O2	O3
Na1		2.2248	2.2248
O2	2.2248		1.4981
O3	2.2248	1.4981

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O2	O3	70.325		Na1	O3	O2	70.325
O2	Na1	O3	39.351

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

using model chemistry: MP2/LANL2DZ

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/LANL2DZ

States and conformations

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