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	hartrees
Energy at 0K	-839.031877
Energy at 298.15K
HF Energy	-838.047219
Nuclear repulsion energy	402.859803

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	813	759	0.00
2	A₁'	690	643	0.00
3	A₂"	1029	959	395.14
4	A₂"	558	521	55.43
5	E'	1057	985	268.30
5	E'	1057	985	268.30
6	E'	520	485	46.73
6	E'	520	485	46.73
7	E'	183	171	0.10
7	E'	183	171	0.10
8	E"	492	459	0.00
8	E"	492	459	0.00

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.000
F2	0.000	1.564	0.000
F3	1.354	-0.782	0.000
F4	-1.354	-0.782	0.000
F5	0.000	0.000	1.593
F6	0.000	0.000	-1.593

	P1	F2	F3	F4	F5	F6
P1		1.5636	1.5636	1.5636	1.5935	1.5935
F2	1.5636		2.7082	2.7082	2.2325	2.2325
F3	1.5636	2.7082		2.7082	2.2325	2.2325
F4	1.5636	2.7082	2.7082		2.2325	2.2325
F5	1.5935	2.2325	2.2325	2.2325		3.1870
F6	1.5935	2.2325	2.2325	2.2325	3.1870

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/6-31G**

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

using model chemistry: CCSD/6-31G**

States and conformations

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