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	hartrees
Energy at 0K	-100.115725
Energy at 298.15K	-100.115714
HF Energy	-99.982629
Nuclear repulsion energy	5.020765

Atom	x (Å)	y (Å)	z (Å)
F1	0.000	0.000	0.095
H2	0.000	0.000	-0.854

	F1	H2
F1		0.9489
H2	0.9489

All results from a given calculation for HF (Hydrogen fluoride)

using model chemistry: QCISD(TQ)/6-31G

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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