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	hartrees
Energy at 0K	-1245.249166
Energy at 298.15K	-1245.250202
HF Energy	-1245.249166
Nuclear repulsion energy	209.883343

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	248	245	0.00
2	A_g	130	128	0.00
3	B_1u	273	269	96.87
4	B_2u	214	211	93.64
5	B_3g	224	221	0.00
6	B_3u	90	89	61.08

Atom	y (Å)	z (Å)
Na1	1.625	0.000
Na2	-1.625	0.000
Cl3	0.000	2.025
Cl4	0.000	-2.025

	Na1	Na2	Cl3	Cl4
Na1		3.2506	2.5968	2.5968
Na2	3.2506		2.5968	2.5968
Cl3	2.5968	2.5968		4.0505
Cl4	2.5968	2.5968	4.0505

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Na1	Cl2	Na4	50.737		Na1	Cl3	Na4	39.263
Cl2	Na1	Cl3	50.737		Cl2	Na4	Cl3	39.263

All results from a given calculation for Na₂Cl₂ (Disodium dichloride)

using model chemistry: B97D3/cc-pVTZ

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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Number	Element	Mulliken
1	Na	0.487
2	Na	0.487
3	Cl	-0.487
4	Cl	-0.487

<r²>	221.787
(<r²>)^1/2	14.893

All results from a given calculation for Na2Cl2 (Disodium dichloride)

using model chemistry: B97D3/cc-pVTZ

States and conformations

All results from a given calculation for Na₂Cl₂ (Disodium dichloride)