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	hartrees
Energy at 0K	-214.616452
Energy at 298.15K
HF Energy	-214.575274
Nuclear repulsion energy	5.721562

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	-3.330
Mg2	0.000	0.000	1.110

	Be1	Mg2
Be1		4.4394
Mg2	4.4394

All results from a given calculation for BeMg (Beryllium Magnesium)

using model chemistry: B2PLYP=FULLultrafine/TZVP

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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