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	hartrees
Energy at 0K	-541.257338
Energy at 298.15K	-541.258542
HF Energy	-540.473206
Nuclear repulsion energy	159.183959

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	715	672	0.00
2	A₂"	308	289	132.11
3	E'	993	933	155.65
3	E'	993	933	155.65
4	E'	229	215	33.54
4	E'	229	215	33.54

Atom	x (Å)	y (Å)
Al1	0.000	0.000
F2	0.000	1.633
F3	1.414	-0.817
F4	-1.414	-0.817

	Al1	F2	F3	F4
Al1		1.6332	1.6332	1.6332
F2	1.6332		2.8288	2.8288
F3	1.6332	2.8288		2.8288
F4	1.6332	2.8288	2.8288

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Al1	F3	120.000		F2	Al1	F4	120.000
F3	Al1	F4	120.000

All results from a given calculation for AlF₃ (Aluminum trifluoride)

using model chemistry: MP2=FULL/6-31G(2df,p)

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 AlF3 (Aluminum trifluoride)

using model chemistry: MP2=FULL/6-31G(2df,p)

States and conformations

All results from a given calculation for AlF₃ (Aluminum trifluoride)