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	hartrees
Energy at 0K	-3070.333558
Energy at 298.15K	-3070.338951
Nuclear repulsion energy	631.118257

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	689	661	41.05
2	A₁	601	577	1.20
3	A₁	384	368	47.97
4	B₁	312	300	0.00
5	B₂	585	561	0.00
6	B₂	235	225	0.00
7	E	705	677	276.07
7	E	705	677	276.07
8	E	402	386	9.31
8	E	402	386	9.31
9	E	246	236	1.10
9	E	246	236	1.10

Atom	x (Å)	y (Å)	z (Å)
Br1	0.000	0.000	0.275
F2	0.000	0.000	-1.476
F3	0.000	1.784	0.102
F4	-1.784	0.000	0.102
F5	0.000	-1.784	0.102
F6	1.784	0.000	0.102

	Br1	F2	F3	F4	F5	F6
Br1		1.7508	1.7926	1.7926	1.7926	1.7926
F2	1.7508		2.3819	2.3819	2.3819	2.3819
F3	1.7926	2.3819		2.5233	3.5685	2.5233
F4	1.7926	2.3819	2.5233		2.5233	3.5685
F5	1.7926	2.3819	3.5685	2.5233		2.5233
F6	1.7926	2.3819	2.5233	3.5685	2.5233

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Br1	F3	84.468	F2	Br1	F4	84.468
F2	Br1	F5	84.468	F2	Br1	F6	84.468
F3	Br1	F4	89.467	F3	Br1	F5	168.936
F3	Br1	F6	89.467	F4	Br1	F5	89.467
F4	Br1	F6	168.936	F5	Br1	F6	89.467

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

using model chemistry: QCISD/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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All results from a given calculation for BrF5 (bromine pentafluoride)

using model chemistry: QCISD/cc-pVDZ

States and conformations

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