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	hartrees
Energy at 0K	-2224.515726
Energy at 298.15K
HF Energy	-2224.515726
Nuclear repulsion energy	295.711069

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'	660	640	0.00	10.26	0.06	0.11
2	A₂"	198	192	53.18	0.00	0.75	0.86
3	E'	757	734	69.84	1.74	0.75	0.86
3	E'	757	734	69.84	1.74	0.75	0.86
4	E'	180	175	28.74	0.99	0.75	0.86
4	E'	180	175	28.74	0.99	0.75	0.86

Atom	x (Å)	y (Å)
Ga1	0.000	0.000
F2	0.000	1.749
F3	1.515	-0.874
F4	-1.515	-0.874

	Ga1	F2	F3	F4
Ga1		1.7489	1.7489	1.7489
F2	1.7489		3.0291	3.0291
F3	1.7489	3.0291		3.0291
F4	1.7489	3.0291	3.0291

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/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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Number	Element	Mulliken
1	Ga	1.007
2	F	-0.336
3	F	-0.336
4	F	-0.336

<r²>	102.418
(<r²>)^1/2	10.120

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

using model chemistry: B3LYP/cc-pVDZ

States and conformations

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