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	hartrees
Energy at 0K	-124.378044
Energy at 298.15K	-124.376867
HF Energy	-124.114622
Nuclear repulsion energy	18.344486

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-0.834
F2	0.000	0.000	0.464

	B1	F2
B1		1.2981
F2	1.2981

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

using model chemistry: CISD/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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