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	hartrees
Energy at 0K	-1596.452265
Energy at 298.15K	-1596.452148
HF Energy	-1595.955975
Nuclear repulsion energy	175.758956

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	284	271	0.00
2	Σ_u	437	417	223.45
3	Π_u	47	45	81.69
3	Π_u	47	45	81.69

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.000
Cl2	0.000	0.000	2.482
Cl3	0.000	0.000	-2.482

	Ca1	Cl2	Cl3
Ca1		2.4824	2.4824
Cl2	2.4824		4.9648
Cl3	2.4824	4.9648

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

using model chemistry: CCD/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 CaCl2 (Calcium Chloride)

using model chemistry: CCD/6-311G*

States and conformations

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