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	hartrees
Energy at 0K	-2500.817755
Energy at 298.15K	-2500.815986
HF Energy	-2500.719438
Nuclear repulsion energy	91.126422

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.372
F2	0.000	0.000	-1.405

	Se1	F2
Se1		1.7770
F2	1.7770

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Se	0.339
2	F	-0.339

	x	y	z	Total
	0.000	0.000	1.727	1.727
CHELPG
AIM
ESP

All results from a given calculation for SeF (Selenium monofluoride)

using model chemistry: B2PLYP/cc-pVDZ

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>	36.680
(<r²>)^1/2	6.056