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	hartrees
Energy at 0K	-876.461573
Energy at 298.15K	-876.462108
Nuclear repulsion energy	105.350864

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	525	506
2	A₁	62	59
3	B₂	647	623

Atom	y (Å)	z (Å)
Ca1	0.000	0.216
F2	1.965	-0.240
F3	-1.965	-0.240

	Ca1	F2	F3
Ca1		2.0171	2.0171
F2	2.0171		3.9301
F3	2.0171	3.9301

All results from a given calculation for CaF₂ (Calcium difluoride)

using model chemistry: QCISD(T)/6-311G*

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 CaF2 (Calcium difluoride)

using model chemistry: QCISD(T)/6-311G*

States and conformations

All results from a given calculation for CaF₂ (Calcium difluoride)