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	hartrees
Energy at 0K	-460.688827
Energy at 298.15K	-460.688884
HF Energy	-460.623111
Nuclear repulsion energy	7.051015

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.000	0.000	0.071
H2	0.000	0.000	-1.205

	Cl1	H2
Cl1		1.2758
H2	1.2758

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Cl	-0.149
2	H	0.149

	x	y	z
x	2.425	0.000	0.000
y	0.000	2.425	0.000
z	0.000	0.000	2.570

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

using model chemistry: B2PLYP/6-311+G(3df,2pd)

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>	9.608
(<r²>)^1/2	3.100