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	hartrees
Energy at 0K	-839.326447
Energy at 298.15K
HF Energy	-838.182518
Nuclear repulsion energy	405.448806

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	809	772	0.00
2	A₁'	655	624	0.00
3	A₂"	997	951	454.48
4	A₂"	574	547	70.09
5	E'	1034	986	312.43
5	E'	1034	986	312.43
6	E'	533	508	54.55
6	E'	533	508	54.55
7	E'	174	166	0.26
7	E'	174	166	0.26
8	E"	508	485	0.00
8	E"	508	485	0.00

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.000
F2	0.000	1.553	0.000
F3	1.345	-0.777	0.000
F4	-1.345	-0.777	0.000
F5	0.000	0.000	1.584
F6	0.000	0.000	-1.584

	P1	F2	F3	F4	F5	F6
P1		1.5533	1.5533	1.5533	1.5838	1.5838
F2	1.5533		2.6903	2.6903	2.2184	2.2184
F3	1.5533	2.6903		2.6903	2.2184	2.2184
F4	1.5533	2.6903	2.6903		2.2184	2.2184
F5	1.5838	2.2184	2.2184	2.2184		3.1676
F6	1.5838	2.2184	2.2184	2.2184	3.1676

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	P1	F3	120.000	F2	P1	F4	120.000
F2	P1	F5	90.000	F2	P1	F6	90.000
F3	P1	F4	120.000	F3	P1	F5	90.000
F3	P1	F6	90.000	F4	P1	F5	90.000
F4	P1	F6	90.000	F5	P1	F6	180.000

All results from a given calculation for PF₅ (Phosphorus pentafluoride)

using model chemistry: CCSD/6-311G*

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 PF5 (Phosphorus pentafluoride)

using model chemistry: CCSD/6-311G*

States and conformations

All results from a given calculation for PF₅ (Phosphorus pentafluoride)