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	hartrees
Energy at 0K	-460.729583
Energy at 298.15K
HF Energy	-460.630556
Nuclear repulsion energy	7.052196

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

	Cl1	H2
Cl1		1.2756
H2	1.2756

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

using model chemistry: B2PLYP=FULLultrafine/aug-cc-pV(T+d)Z

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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