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	hartrees
Energy at 0K	-758.178085
Energy at 298.15K
HF Energy	-757.522866
Nuclear repulsion energy	196.429763

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	823	823	42.95
2	A₁	591	591	1.70
3	A₁	367	367	21.56
4	B₁	355	355	26.64
5	B₂	787	787	520.79
6	B₂	462	462	1.79

Atom	y (Å)	z (Å)
Cl1	0.000	0.370
F2	0.000	-1.239
F3	1.691	0.270
F4	-1.691	0.270

	Cl1	F2	F3	F4
Cl1		1.6090	1.6938	1.6938
F2	1.6090		2.2658	2.2658
F3	1.6938	2.2658		3.3817
F4	1.6938	2.2658	3.3817

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Cl1	F3	86.595		F2	Cl1	F4	86.595
F3	Cl1	F4	173.190

All results from a given calculation for ClF₃ (Chlorine trifluoride)

using model chemistry: CID/cc-pV(D+d)Z

States and conformations

Conformer 1 (D3H)

Conformer 2 (C2V)

	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 ClF3 (Chlorine trifluoride)

using model chemistry: CID/cc-pV(D+d)Z

States and conformations

Conformer 1 (D3H)

Conformer 2 (C2V)

All results from a given calculation for ClF₃ (Chlorine trifluoride)