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	hartrees
Energy at 0K	-176.419988
Energy at 298.15K	-176.419162
HF Energy	-176.419988
Nuclear repulsion energy	7.154770

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	0.868
Be2	0.000	0.000	-2.386

	Na1	Be2
Na1		3.2543
Be2	3.2543

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Na	0.048
2	Be	-0.048

	x	y	z	Total
	0.000	0.000	0.542	0.542
CHELPG
AIM
ESP

All results from a given calculation for NaBe (Sodium Beryllium)

using model chemistry: ROHF/6-311G**

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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<r²>	43.218
(<r²>)^1/2	6.574