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	hartrees
Energy at 0K	-8056.110281
Energy at 298.15K	-8056.119008
HF Energy	-8056.110281
Nuclear repulsion energy	862.600457

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	318	315	10.98
2	A₁	124	123	0.32
3	E	328	326	83.75
3	E	328	326	83.76
4	E	88	88	0.01
4	E	88	88	0.01

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.897
Br2	0.000	2.176	-0.128
Br3	1.884	-1.088	-0.128
Br4	-1.884	-1.088	-0.128

	P1	Br2	Br3	Br4
P1		2.4051	2.4051	2.4051
Br2	2.4051		3.7684	3.7684
Br3	2.4051	3.7684		3.7684
Br4	2.4051	3.7684	3.7684

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	P1	Br3	103.146		Br2	P1	Br4	103.146
Br3	P1	Br4	103.146

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

using model chemistry: BLYP/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	P	0.319
2	Br	-0.106
3	Br	-0.106
4	Br	-0.106

	x	y	z	Total
	0.000	0.000	1.071	1.071
CHELPG
AIM
ESP

<r²>	554.117
(<r²>)^1/2	23.540

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

using model chemistry: BLYP/6-31G

States and conformations

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