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	hartrees
Energy at 0K	-7970.985512
Energy at 298.15K	-7970.994888
HF Energy	-7970.985512
Nuclear repulsion energy	940.432640

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	490	400	26.58
2	A₁	196	160	5.45
3	E	544	444	51.43
3	E	544	444	51.43
4	E	137	112	1.14
4	E	137	112	1.14

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.896
Br2	0.000	1.981	-0.128
Br3	1.716	-0.991	-0.128
Br4	-1.716	-0.991	-0.128

	P1	Br2	Br3	Br4
P1		2.2302	2.2302	2.2302
Br2	2.2302		3.4315	3.4315
Br3	2.2302	3.4315		3.4315
Br4	2.2302	3.4315	3.4315

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	P1	Br3	100.588		Br2	P1	Br4	100.588
Br3	P1	Br4	100.588

All results from a given calculation for PBr₃ (Phosphorus tribromide)

using model chemistry: HF/STO-3G

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	0.452
2	Br	-0.151
3	Br	-0.151
4	Br	-0.151

	x	y	z	Total
	0.000	0.000	1.435	1.435
CHELPG
AIM
ESP

<r²>	465.500
(<r²>)^1/2	21.575

All results from a given calculation for PBr3 (Phosphorus tribromide)

using model chemistry: HF/STO-3G

States and conformations

All results from a given calculation for PBr₃ (Phosphorus tribromide)