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	hartrees
Energy at 0K	-1596.415680
Energy at 298.15K	-1596.415558
HF Energy	-1595.955856
Nuclear repulsion energy	176.113078

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	284	270	0.00
2	Σ_u	437	415	225.53
3	Π_u	45	43	80.27
3	Π_u	45	43	80.27

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.000
Cl2	0.000	0.000	2.452
Cl3	0.000	0.000	-2.452

	Ca1	Cl2	Cl3
Ca1		2.4522	2.4522
Cl2	2.4522		4.9044
Cl3	2.4522	4.9044

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

using model chemistry: MP2/6-311G*

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: MP2/6-311G*

States and conformations

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