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	hartrees
Energy at 0K	-460.705061
Energy at 298.15K	-460.705117
HF Energy	-460.633086
Nuclear repulsion energy	7.043150

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.000	0.000	0.071
H2	0.000	0.000	-1.206

	Cl1	H2
Cl1		1.2773
H2	1.2773

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Cl	-0.134
2	H	0.134

	x	y	z
x	1.928	0.000	0.000
y	0.000	1.928	0.000
z	0.000	0.000	2.436

All results from a given calculation for HCl (Hydrogen chloride)

using model chemistry: B2PLYP/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>	9.550
(<r²>)^1/2	3.090