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	hartrees
Energy at 0K	-150.141260
Energy at 298.15K	-150.141254
HF Energy	-149.677023
Nuclear repulsion energy	27.895720

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.607
O2	0.000	0.000	-0.607

	O1	O2
O1		1.2138
O2	1.2138

All results from a given calculation for O₂ (Oxygen diatomic)

using model chemistry: QCISD(TQ)/aug-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 O2 (Oxygen diatomic)

using model chemistry: QCISD(TQ)/aug-cc-pVTZ

States and conformations

All results from a given calculation for O₂ (Oxygen diatomic)