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	hartrees
Energy at 0K	-541.190930
Energy at 298.15K	-541.192129
HF Energy	-540.504510
Nuclear repulsion energy	156.597506

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	670	649	0.00
2	A₂"	294	285	151.23
3	E'	929	900	190.59
3	E'	929	900	190.59
4	E'	246	239	37.70
4	E'	246	239	37.70

Atom	x (Å)	y (Å)
Al1	0.000	0.000
F2	0.000	1.660
F3	1.438	-0.830
F4	-1.438	-0.830

	Al1	F2	F3	F4
Al1		1.6602	1.6602	1.6602
F2	1.6602		2.8755	2.8755
F3	1.6602	2.8755		2.8755
F4	1.6602	2.8755	2.8755

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: QCISD/aug-cc-pVDZ

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: QCISD/aug-cc-pVDZ

States and conformations

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