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	hartrees
Energy at 0K	-4456.481819
Energy at 298.15K
HF Energy	-4456.481819
Nuclear repulsion energy	258.162714

Atom	x (Å)	y (Å)	z (Å)
Ge1	0.000	0.000	-1.149
Se2	0.000	0.000	1.081

	Ge1	Se2
Ge1		2.2302
Se2	2.2302

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Ge	0.285
2	Se	-0.285

	x	y	z	Total
	0.000	0.000	-1.729	1.729
CHELPG
AIM
ESP

All results from a given calculation for GeSe (Germanium monoselenide)

using model chemistry: PBEPBEultrafine/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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<r²>	104.397
(<r²>)^1/2	10.218