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	hartrees
Energy at 0K	-3068.319933
Energy at 298.15K
Nuclear repulsion energy	648.677439

Atom	x (Å)	y (Å)	z (Å)
Br1	0.000	0.000	0.274
F2	0.000	0.000	-1.422
F3	0.000	1.738	0.089
F4	-1.738	0.000	0.089
F5	0.000	-1.738	0.089
F6	1.738	0.000	0.089

	Br1	F2	F3	F4	F5	F6
Br1		1.6958	1.7478	1.7478	1.7478	1.7478
F2	1.6958		2.3025	2.3025	2.3025	2.3025
F3	1.7478	2.3025		2.4578	3.4758	2.4578
F4	1.7478	2.3025	2.4578		2.4578	3.4758
F5	1.7478	2.3025	3.4758	2.4578		2.4578
F6	1.7478	2.3025	2.4578	3.4758	2.4578

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Br1	F3	83.911	F2	Br1	F4	83.911
F2	Br1	F5	83.911	F2	Br1	F6	83.911
F3	Br1	F4	89.355	F3	Br1	F5	167.823
F3	Br1	F6	89.355	F4	Br1	F5	89.355
F4	Br1	F6	167.823	F5	Br1	F6	89.355

All results from a given calculation for BrF₅ (bromine pentafluoride)

using model chemistry: MP2/6-31G(2df,p)

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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All results from a given calculation for BrF5 (bromine pentafluoride)

using model chemistry: MP2/6-31G(2df,p)

States and conformations

All results from a given calculation for BrF₅ (bromine pentafluoride)