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	hartrees
Energy at 0K	-312.083243
Energy at 298.15K
HF Energy	-311.544207
Nuclear repulsion energy	67.718980

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1047	1009
2	A₁	412	397
3	B₂	735	707

Atom	y (Å)	z (Å)
Na1	0.000	1.216
O2	0.687	-0.836
O3	-0.687	-0.836

	Na1	O2	O3
Na1		2.1637	2.1637
O2	2.1637		1.3733
O3	2.1637	1.3733

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O2	O3	71.496		Na1	O3	O2	71.496
O2	Na1	O3	37.007

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

using model chemistry: MP4=FULL/cc-pVTZ

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-pVTZ

States and conformations

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