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	hartrees
Energy at 0K	-1588.286809
Energy at 298.15K	-1588.286646
HF Energy	-1588.193462
Nuclear repulsion energy	163.730889

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	241	230	0.00
2	Σ_u	395	377	55.52
3	Π_u	59	56	96.65
3	Π_u	59	56	96.65

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.000
Cl2	0.000	0.000	2.665
Cl3	0.000	0.000	-2.665

	Ca1	Cl2	Cl3
Ca1		2.6648	2.6648
Cl2	2.6648		5.3296
Cl3	2.6648	5.3296

All results from a given calculation for CaCl₂ (Calcium Chloride)

using model chemistry: MP2/3-21G

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 CaCl2 (Calcium Chloride)

using model chemistry: MP2/3-21G

States and conformations

All results from a given calculation for CaCl₂ (Calcium Chloride)