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	hartrees
Energy at 0K	-2535.701697
Energy at 298.15K	-2535.701053
Nuclear repulsion energy	322.198101

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	712	689	73.30
2	A₁	323	313	22.30
3	E	674	652	132.03
3	E	674	652	132.01
4	E	249	241	4.68
4	E	249	241	4.68

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.400
F2	0.000	1.486	-0.489
F3	1.287	-0.743	-0.489
F4	-1.287	-0.743	-0.489

	As1	F2	F3	F4
As1		1.7319	1.7319	1.7319
F2	1.7319		2.5741	2.5741
F3	1.7319	2.5741		2.5741
F4	1.7319	2.5741	2.5741

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	As1	F3	95.999		F2	As1	F4	95.999
F3	As1	F4	95.999

All results from a given calculation for AsF₃ (Arsenic trifluoride)

using model chemistry: B3LYP/aug-cc-pVTZ

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	As	1.780
2	F	-0.593
3	F	-0.593
4	F	-0.593

	x	y	z	Total
	0.000	0.000	2.614	2.614
CHELPG
AIM
ESP

	x	y	z
x	4.673	0.000	0.000
y	0.000	4.674	-0.001
z	0.000	-0.001	4.158

<r²>	92.149
(<r²>)^1/2	9.599

All results from a given calculation for AsF3 (Arsenic trifluoride)

using model chemistry: B3LYP/aug-cc-pVTZ

States and conformations

All results from a given calculation for AsF₃ (Arsenic trifluoride)