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	hartrees
Energy at 0K	-559.744041
Energy at 298.15K	-559.744052
HF Energy	-559.634296
Nuclear repulsion energy	48.303638

Atom	x (Å)	y (Å)	z (Å)
F1	0.000	0.000	-1.096
Cl2	0.000	0.000	0.580

	F1	Cl2
F1		1.6762
Cl2	1.6762

Number	Element	Mulliken	CHELPG	AIM	ESP
1	F	-0.248
2	Cl	0.248

	x	y	z	Total
	0.000	0.000	1.163	1.163
CHELPG
AIM
ESP

All results from a given calculation for ClF (Chlorine monofluoride)

using model chemistry: B2PLYP/cc-pCVDZ

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>	26.978
(<r²>)^1/2	5.194