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	hartrees
Energy at 0K	-1588.294133
Energy at 298.15K	-1588.293973
HF Energy	-1588.193475
Nuclear repulsion energy	163.803319

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	242	228	0.00
2	Σ_u	396	372	56.55
3	Π_u	59	56	97.92
3	Π_u	59	56	97.92

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.000
Cl2	0.000	0.000	2.664
Cl3	0.000	0.000	-2.664

	Ca1	Cl2	Cl3
Ca1		2.6636	2.6636
Cl2	2.6636		5.3272
Cl3	2.6636	5.3272

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

using model chemistry: CISD/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: CISD/3-21G

States and conformations

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