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	hartrees
Energy at 0K	-876.098496
Energy at 298.15K	-876.098719
Nuclear repulsion energy	103.006374

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ_g	511	490
2	Σ_u	671	644
3	Π_u	72	69
3	Π_u	72	69

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.000
F2	0.000	0.000	2.057
F3	0.000	0.000	-2.057

	Ca1	F2	F3
Ca1		2.0574	2.0574
F2	2.0574		4.1148
F3	2.0574	4.1148

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

using model chemistry: CCSD(T)/6-31+G**

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: CCSD(T)/6-31+G**

States and conformations

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