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	hartrees
Energy at 0K	-498.113096
Energy at 298.15K	-498.111628
HF Energy	-498.113096
Nuclear repulsion energy	31.858324

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.252
Cl2	0.000	0.000	0.442

	C1	Cl2
C1		1.6943
Cl2	1.6943

Number	Element	Mulliken	CHELPG	AIM	ESP
1	C	-0.065
2	Cl	0.065

	x	y	z	Total
	0.000	0.000	1.207	1.207
CHELPG
AIM
ESP

All results from a given calculation for CCl (carbon monochloride)

using model chemistry: BLYP/6-31G(2df,p)

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>	24.240
(<r²>)^1/2	4.923