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	hartrees
Energy at 0K	-89.115101
Energy at 298.15K	-89.114185
HF Energy	-88.909725
Nuclear repulsion energy	11.986427

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	-0.942
O2	0.000	0.000	0.471

	Be1	O2
Be1		1.4127
O2	1.4127

All results from a given calculation for BeO (beryllium oxide)

using model chemistry: QCISD/3-21G*

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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