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	hartrees
Energy at 0K	-540.966375
Energy at 298.15K	-540.967679
HF Energy	-540.450065
Nuclear repulsion energy	159.140328

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	728	674	0.00
2	A₂"	309	286	164.08
3	E'	1015	939	176.51
3	E'	1015	939	176.51
4	E'	265	246	39.44
4	E'	265	246	39.44

Atom	x (Å)	y (Å)
Al1	0.000	0.000
F2	0.000	1.634
F3	1.416	-0.817
F4	-1.416	-0.817

	Al1	F2	F3	F4
Al1		1.6345	1.6345	1.6345
F2	1.6345		2.8310	2.8310
F3	1.6345	2.8310		2.8310
F4	1.6345	2.8310	2.8310

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

using model chemistry: CISD/6-31G*

States and conformations

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