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	hartrees
Energy at 0K	-2222.350967
Energy at 298.15K
HF Energy	-2222.350967
Nuclear repulsion energy	294.073451

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'	653	628	0.00	12.39	0.05	0.10
2	A₂"	177	171	60.85	0.00	0.75	0.86
3	E'	757	728	63.85	1.84	0.75	0.86
3	E'	757	728	63.85	1.84	0.75	0.86
4	E'	188	181	30.45	1.63	0.75	0.86
4	E'	188	181	30.45	1.63	0.75	0.86

Atom	x (Å)	y (Å)
Ga1	0.000	0.000
F2	0.000	1.759
F3	1.523	-0.879
F4	-1.523	-0.879

	Ga1	F2	F3	F4
Ga1		1.7586	1.7586	1.7586
F2	1.7586		3.0460	3.0460
F3	1.7586	3.0460		3.0460
F4	1.7586	3.0460	3.0460

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: TPSSh/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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Number	Element	Mulliken
1	Ga	1.352
2	F	-0.451
3	F	-0.451
4	F	-0.451

<r²>	103.791
(<r²>)^1/2	10.188

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

using model chemistry: TPSSh/6-31G

States and conformations

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