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	hartrees
Energy at 0K	-920.021917
Energy at 298.15K	-920.021868
HF Energy	-919.936404
Nuclear repulsion energy	75.349997

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.000	0.000	1.015
Cl2	0.000	0.000	-1.015

	Cl1	Cl2
Cl1		2.0296
Cl2	2.0296

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Cl	0.000
2	Cl	0.000

	x	y	z	Total
	0.000	0.000	0.000	0.000
CHELPG
AIM
ESP

All results from a given calculation for Cl₂ (Chlorine diatomic)

using model chemistry: B2PLYP/6-31G**

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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<r²>	50.302
(<r²>)^1/2	7.092

All results from a given calculation for Cl2 (Chlorine diatomic)

using model chemistry: B2PLYP/6-31G**

States and conformations

All results from a given calculation for Cl₂ (Chlorine diatomic)