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	hartrees
Energy at 0K	-2732.426229
Energy at 298.15K	-2732.426900
Nuclear repulsion energy	627.656119

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	722	715	0.00
2	A₁'	660	653	0.00
3	A₂"	803	794	128.96
4	A₂"	391	387	41.69
5	E'	810	802	98.02
5	E'	810	802	98.03
6	E'	360	356	32.50
6	E'	360	356	32.50
7	E'	104	103	0.71
7	E'	104	103	0.71
8	E"	381	377	0.00
8	E"	381	377	0.00

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.000
F2	0.000	1.690	0.000
F3	1.464	-0.845	0.000
F4	-1.464	-0.845	0.000
F5	0.000	0.000	1.700
F6	0.000	0.000	-1.700

	As1	F2	F3	F4	F5	F6
As1		1.6900	1.6900	1.6900	1.7004	1.7004
F2	1.6900		2.9272	2.9272	2.3974	2.3974
F3	1.6900	2.9272		2.9272	2.3974	2.3974
F4	1.6900	2.9272	2.9272		2.3974	2.3974
F5	1.7004	2.3974	2.3974	2.3974		3.4008
F6	1.7004	2.3974	2.3974	2.3974	3.4008

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: PBEPBE/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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Number	Element	Mulliken
1	As	0.659
2	F	-0.125
3	F	-0.125
4	F	-0.125
5	F	-0.141
6	F	-0.141

<r²>	155.415
(<r²>)^1/2	12.467

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

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

States and conformations

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