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	hartrees
Energy at 0K	-311.882464
Energy at 298.15K
HF Energy	-311.495293
Nuclear repulsion energy	67.385906

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1098	1047
2	A₁	439	418
3	B₂	365	347

Atom	y (Å)	z (Å)
Na1	0.000	1.226
O2	0.686	-0.843
O3	-0.686	-0.843

	Na1	O2	O3
Na1		2.1797	2.1797
O2	2.1797		1.3728
O3	2.1797	1.3728

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	O2	O3	71.646		Na1	O3	O2	71.646
O2	Na1	O3	36.709

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

using model chemistry: QCISD(T)/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: QCISD(T)/cc-pVDZ

States and conformations

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