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	hartrees
Energy at 0K	-783.045111
Energy at 298.15K	-783.048408
Nuclear repulsion energy	297.204939

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1125	1015	97.66
2	A₁	884	798	223.62
3	A₁	612	552	16.20
4	E	1371	1237	323.45
4	E	1371	1237	323.45
5	E	636	574	50.52
5	E	636	574	50.52
6	E	434	392	0.53
6	E	434	392	0.53

Atom	x (Å)	y (Å)	z (Å)
F1	0.000	0.000	-1.443
Cl2	0.000	0.000	0.137
O3	0.000	1.368	0.444
O4	-1.184	-0.684	0.444
O5	1.184	-0.684	0.444

	F1	Cl2	O3	O4	O5
F1		1.5795	2.3308	2.3308	2.3308
Cl2	1.5795		1.4019	1.4019	1.4019
O3	2.3308	1.4019		2.3688	2.3688
O4	2.3308	1.4019	2.3688		2.3688
O5	2.3308	1.4019	2.3688	2.3688

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F1	Cl2	O3	102.687	F1	Cl2	O4	102.687
F1	Cl2	O5	102.687	O3	Cl2	O4	115.319
O3	Cl2	O5	115.319	O4	Cl2	O5	115.319

All results from a given calculation for ClFO₃ (Perchloryl fluoride)

using model chemistry: HF/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	CHELPG
1	F	-0.355	-0.142
2	Cl	1.947	1.215
3	O	-0.531	-0.358
4	O	-0.531	-0.358
5	O	-0.531	-0.358

<r²>	90.290
(<r²>)^1/2	9.502

All results from a given calculation for ClFO3 (Perchloryl fluoride)

using model chemistry: HF/6-31G**

States and conformations

All results from a given calculation for ClFO₃ (Perchloryl fluoride)