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	hartrees
Energy at 0K	-412.142757
Energy at 298.15K	-412.141835
Nuclear repulsion energy	19.616869

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	-1.381
S2	0.000	0.000	0.345

	Be1	S2
Be1		1.7264
S2	1.7264

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Be	0.176
2	S	-0.176

	x	y	z	Total
	0.000	0.000	-6.299	6.299
CHELPG
AIM
ESP

All results from a given calculation for BeS (beryllium sulfide)

using model chemistry: HF/cc-pV(T+d)Z

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>	19.172
(<r²>)^1/2	4.379