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	hartrees
Energy at 0K	-214.672380
Energy at 298.15K
HF Energy	-214.062047
Nuclear repulsion energy	51.486043

Atom	y (Å)	z (Å)
Li1	1.100	0.000
Li2	-1.100	0.000
F3	0.000	1.326
F4	0.000	-1.326

	Li1	Li2	F3	F4
Li1		2.2004	1.7233	1.7233
Li2	2.2004		1.7233	1.7233
F3	1.7233	1.7233		2.6528
F4	1.7233	1.7233	2.6528

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Li1	F3	Li2	79.349		Li1	F4	Li2	79.349
F3	Li1	F4	100.651		F3	Li2	F4	100.651

All results from a given calculation for Li₂F₂ (Lithium fluoride dimer)

using model chemistry: CCSD=FULL/cc-pVTZ

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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All results from a given calculation for Li2F2 (Lithium fluoride dimer)

using model chemistry: CCSD=FULL/cc-pVTZ

States and conformations

All results from a given calculation for Li₂F₂ (Lithium fluoride dimer)