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	hartrees
Energy at 0K	-2382.797632
Energy at 298.15K
HF Energy	-2382.797632
Nuclear repulsion energy	123.388005

Atom	x (Å)	y (Å)	z (Å)
Ga1	0.000	0.000	0.800
Cl2	0.000	0.000	-1.460

	Ga1	Cl2
Ga1		2.2602
Cl2	2.2602

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Ga	0.605
2	Cl	-0.605

	x	y	z	Total
	0.000	0.000	2.849	2.849
CHELPG
AIM
ESP

All results from a given calculation for GaCl (Gallium monochloride)

using model chemistry: HF/aug-cc-pVDZ

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>	74.791
(<r²>)^1/2	8.648