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	hartrees
Energy at 0K	-2732.911972
Energy at 298.15K	-2732.912664
HF Energy	-2732.911972
Nuclear repulsion energy	624.102977

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	742	712	0.00
2	A₁'	691	663	0.00
3	A₂"	808	776	141.83
4	A₂"	383	367	46.57
5	E'	850	816	104.34
5	E'	850	816	104.28
6	E'	340	326	40.01
6	E'	340	326	39.99
7	E'	132	126	0.14
7	E'	132	126	0.14
8	E"	361	347	0.00
8	E"	361	347	0.00

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.000
F2	0.000	1.835	0.000
F3	1.589	-0.917	0.000
F4	-1.589	-0.917	0.000
F5	0.000	0.000	1.921
F6	0.000	0.000	-1.921

	As1	F2	F3	F4	F5	F6
As1		1.8348	1.8348	1.8348	1.9211	1.9211
F2	1.8348		3.1780	3.1780	2.6565	2.6565
F3	1.8348	3.1780		3.1780	2.6565	2.6565
F4	1.8348	3.1780	3.1780		2.6565	2.6565
F5	1.9211	2.6565	2.6565	2.6565		3.8421
F6	1.9211	2.6565	2.6565	2.6565	3.8421

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: TPSSh/6-31G*

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	1.536
2	F	-0.299
3	F	-0.299
4	F	-0.299
5	F	-0.320
6	F	-0.320

<r²>	156.995
(<r²>)^1/2	12.530

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

using model chemistry: TPSSh/6-31G*

States and conformations

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