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	hartrees
Energy at 0K	-7185.004177
Energy at 298.15K
HF Energy	-7184.526014
Nuclear repulsion energy	437.498198

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	714	683	16.43
2	A₁	646	618	0.00
3	A₁	231	221	17.19
4	B₁	214	204	14.20
5	B₂	711	680	133.92
6	B₂	322	308	8.46

Atom	y (Å)	z (Å)
I1	0.000	0.269
F2	0.000	-1.636
F3	1.925	0.026
F4	-1.925	0.026

	I1	F2	F3	F4
I1		1.9048	1.9405	1.9405
F2	1.9048		2.5436	2.5436
F3	1.9405	2.5436		3.8507
F4	1.9405	2.5436	3.8507

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	I1	F3	82.819		F2	I1	F4	82.819
F3	I1	F4	165.638

All results from a given calculation for IF₃ (iodone trifluoride)

using model chemistry: CCD/3-21G*

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 IF3 (iodone trifluoride)

using model chemistry: CCD/3-21G*

States and conformations

All results from a given calculation for IF₃ (iodone trifluoride)