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	hartrees
Energy at 0K	-1596.294829
Energy at 298.15K	-1596.294675
HF Energy	-1595.927055
Nuclear repulsion energy	167.167954

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	250	238	0.00
2	Σ_u	403	384	89.73
3	Π_u	56	53	89.83
3	Π_u	56	53	89.83

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.000
Cl2	0.000	0.000	2.610
Cl3	0.000	0.000	-2.610

	Ca1	Cl2	Cl3
Ca1		2.6100	2.6100
Cl2	2.6100		5.2200
Cl3	2.6100	5.2200

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

using model chemistry: MP2=FULL/TZVP

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=FULL/TZVP

States and conformations

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