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	hartrees
Energy at 0K	-26.916085
Energy at 298.15K	-26.914898
HF Energy	-26.916085
Nuclear repulsion energy	8.374933

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-0.853
F2	0.000	0.000	0.474

	B1	F2
B1		1.3269
F2	1.3269

Number	Element	Mulliken	CHELPG	AIM	ESP
1	B	0.150
2	F	-0.150

	x	y	z	Total
	0.000	0.000	0.402	0.402
CHELPG
AIM
ESP

All results from a given calculation for BF (Boron monofluoride)

using model chemistry: mPW1PW91/CEP-121G

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>	11.127
(<r²>)^1/2	3.336