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	hartrees
Energy at 0K	-2696.190924
Energy at 298.15K	-2696.189030
HF Energy	-2696.190924
Nuclear repulsion energy	136.659030

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.739
Cl2	0.000	0.000	-1.434

	As1	Cl2
As1		2.1723
Cl2	2.1723

Number	Element	Mulliken	CHELPG	AIM	ESP
1	As	0.274
2	Cl	-0.274

	x	y	z	Total
	0.000	0.000	1.316	1.316
CHELPG
AIM
ESP

All results from a given calculation for AsCl (Arsenic monochloride)

using model chemistry: B3LYP/cc-pVQZ

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>	71.925
(<r²>)^1/2	8.481