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	hartrees
Energy at 0K	-2735.448880
Energy at 298.15K	-2735.449542
HF Energy	-2735.448880
Nuclear repulsion energy	624.733513

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	709	686	0.00
2	A₁'	625	605	0.00
3	A₂"	761	736	171.41
4	A₂"	384	372	58.20
5	E'	782	757	125.73
5	E'	782	757	125.72
6	E'	353	342	45.00
6	E'	353	342	45.00
7	E'	125	121	0.25
7	E'	125	121	0.25
8	E"	370	358	0.00
8	E"	370	358	0.00

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.000
F2	0.000	1.694	0.000
F3	1.467	-0.847	0.000
F4	-1.467	-0.847	0.000
F5	0.000	0.000	1.720
F6	0.000	0.000	-1.720

	As1	F2	F3	F4	F5	F6
As1		1.6943	1.6943	1.6943	1.7197	1.7197
F2	1.6943		2.9346	2.9346	2.4141	2.4141
F3	1.6943	2.9346		2.9346	2.4141	2.4141
F4	1.6943	2.9346	2.9346		2.4141	2.4141
F5	1.7197	2.4141	2.4141	2.4141		3.4394
F6	1.7197	2.4141	2.4141	2.4141	3.4394

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	As1	F3	120.000	F2	As1	F4	120.000
F2	As1	F5	90.000	F2	As1	F6	90.000
F3	As1	F4	120.000	F3	As1	F5	90.000
F3	As1	F6	90.000	F4	As1	F5	90.000
F4	As1	F6	90.000	F5	As1	F6	180.000

All results from a given calculation for AsF₅ (Arsenic pentafluoride)

using model chemistry: B3LYPultrafine/aug-cc-pVTZ

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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Number	Element	Mulliken
1	As	2.854
2	F	-0.559
3	F	-0.559
4	F	-0.559
5	F	-0.588
6	F	-0.588

<r²>	157.795
(<r²>)^1/2	12.562

All results from a given calculation for AsF5 (Arsenic pentafluoride)

using model chemistry: B3LYPultrafine/aug-cc-pVTZ

States and conformations

All results from a given calculation for AsF₅ (Arsenic pentafluoride)