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	hartrees
Energy at 0K	-176.411505
Energy at 298.15K	-176.410663
HF Energy	-176.411505
Nuclear repulsion energy	7.022093

Atom	x (Å)	y (Å)	z (Å)
Na1	0.000	0.000	0.884
Be2	0.000	0.000	-2.432

	Na1	Be2
Na1		3.3158
Be2	3.3158

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Na	-0.044
2	Be	0.044

	x	y	z	Total
	0.000	0.000	-0.126	0.126
CHELPG
AIM
ESP

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

using model chemistry: ROHF/6-31G

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>	44.117
(<r²>)^1/2	6.642