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	hartrees
Energy at 0K	-838.184889
Energy at 298.15K
HF Energy	-838.184889
Nuclear repulsion energy	411.372854

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁'	871	792	0.00	5.60	0.00	0.00
2	A₁'	690	626	0.00	1.17	0.73	0.84
3	A₂"	1049	953	520.15	0.00	0.00	0.00
4	A₂"	610	554	84.19	0.00	0.00	0.00
5	E'	1099	999	365.41	0.38	0.75	0.86
5	E'	1099	999	365.41	0.38	0.75	0.86
6	E'	567	516	66.77	0.56	0.75	0.86
6	E'	567	516	66.77	0.56	0.75	0.86
7	E'	186	169	0.46	0.19	0.75	0.86
7	E'	186	169	0.46	0.19	0.75	0.86
8	E"	542	493	0.00	1.10	0.75	0.86
8	E"	542	493	0.00	1.10	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.000
F2	0.000	1.530	0.000
F3	1.325	-0.765	0.000
F4	-1.325	-0.765	0.000
F5	0.000	0.000	1.563
F6	0.000	0.000	-1.563

	P1	F2	F3	F4	F5	F6
P1		1.5295	1.5295	1.5295	1.5631	1.5631
F2	1.5295		2.6492	2.6492	2.1870	2.1870
F3	1.5295	2.6492		2.6492	2.1870	2.1870
F4	1.5295	2.6492	2.6492		2.1870	2.1870
F5	1.5631	2.1870	2.1870	2.1870		3.1262
F6	1.5631	2.1870	2.1870	2.1870	3.1262

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: HF/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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Number	Element	Mulliken
1	P	1.980
2	F	-0.366
3	F	-0.366
4	F	-0.366
5	F	-0.440
6	F	-0.440

<r²>	131.274
(<r²>)^1/2	11.457

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

using model chemistry: HF/6-311G**

States and conformations

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