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	hartrees
Energy at 0K	-331.023232
Energy at 298.15K
HF Energy	-331.023232
Nuclear repulsion energy	158.935157

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁'	635	619	0.00	13.57	0.07	0.14
2	A₂"	190	185	64.81	0.00	0.75	0.86
3	E'	727	708	93.13	2.18	0.75	0.86
3	E'	727	708	93.13	2.18	0.75	0.86
4	E'	185	180	31.69	1.67	0.75	0.86
4	E'	185	180	31.69	1.67	0.75	0.86

Atom	x (Å)	y (Å)
Ga1	0.000	0.000
F2	0.000	1.751
F3	1.516	-0.875
F4	-1.516	-0.875

	Ga1	F2	F3	F4
Ga1		1.7509	1.7509	1.7509
F2	1.7509		3.0326	3.0326
F3	1.7509	3.0326		3.0326
F4	1.7509	3.0326	3.0326

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Ga1	F3	120.000		F2	Ga1	F4	120.000
F3	Ga1	F4	120.000

All results from a given calculation for GaF₃ (Gallium trifluoride)

using model chemistry: B3LYP/CEP-121G

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	Ga	1.199
2	F	-0.400
3	F	-0.400
4	F	-0.400

<r²>	84.709
(<r²>)^1/2	9.204

All results from a given calculation for GaF3 (Gallium trifluoride)

using model chemistry: B3LYP/CEP-121G

States and conformations

All results from a given calculation for GaF₃ (Gallium trifluoride)