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	hartrees
Energy at 0K	-389.249321
Energy at 298.15K	-389.248586
HF Energy	-389.249321
Nuclear repulsion energy	40.032007

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.652
F2	0.000	0.000	-1.014

	Si1	F2
Si1		1.6656
F2	1.6656

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Si	0.438
2	F	-0.438

	x	y	z	Total
	0.000	0.000	1.172	1.172
CHELPG
AIM
ESP

All results from a given calculation for SiF (silicon monofluoride)

using model chemistry: B3PW91/aug-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>	26.689
(<r²>)^1/2	5.166