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	hartrees
Energy at 0K	-1347.050727
Energy at 298.15K	-1347.054544
HF Energy	-1347.050727
Nuclear repulsion energy	610.608370

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1016	920	391.11
2	A₁	759	687	2.28
3	A₁	553	501	263.11
4	A₁	342	309	0.45
5	B₁	427	386	0.00
6	B₂	748	678	0.00
7	B₂	285	258	0.00
8	E	1091	988	276.66
8	E	1091	988	276.66
9	E	502	455	48.66
9	E	502	455	48.66
10	E	365	331	7.63
10	E	365	331	7.63
11	E	209	189	0.78
11	E	209	189	0.78

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-0.307
Cl2	0.000	0.000	1.967
F3	0.000	1.626	-0.314
F4	1.626	0.000	-0.314
F5	0.000	-1.626	-0.314
F6	-1.626	0.000	-0.314
F7	0.000	0.000	-1.916

	S1	Cl2	F3	F4	F5	F6	F7
S1		2.2740	1.6260	1.6260	1.6260	1.6260	1.6090
Cl2	2.2740		2.8013	2.8013	2.8013	2.8013	3.8830
F3	1.6260	2.8013		2.2995	3.2520	2.2995	2.2825
F4	1.6260	2.8013	2.2995		2.2995	3.2520	2.2825
F5	1.6260	2.8013	3.2520	2.2995		2.2995	2.2825
F6	1.6260	2.8013	2.2995	3.2520	2.2995		2.2825
F7	1.6090	3.8830	2.2825	2.2825	2.2825	2.2825

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	S1	F3	90.251	Cl2	S1	F4	90.251
Cl2	S1	F5	90.251	Cl2	S1	F6	90.251
Cl2	S1	F7	180.000	F3	S1	F4	89.999
F3	S1	F5	179.498	F3	S1	F6	89.999
F3	S1	F7	89.749	F4	S1	F5	89.999
F4	S1	F6	179.498	F4	S1	F7	89.749
F5	S1	F6	89.999	F5	S1	F7	89.749
F6	S1	F7	89.749

All results from a given calculation for SF₅Cl (sulfur chloropentafluoride)

using model chemistry: HF/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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Number	Element	Mulliken
1	S	2.251
2	Cl	-0.148
3	F	-0.419
4	F	-0.419
5	F	-0.419
6	F	-0.419
7	F	-0.426

	x	y	z	Total
	0.000	0.000	-0.106	0.106
CHELPG
AIM
ESP

<r²>	232.437
(<r²>)^1/2	15.246

All results from a given calculation for SF5Cl (sulfur chloropentafluoride)

using model chemistry: HF/3-21G

States and conformations

All results from a given calculation for SF₅Cl (sulfur chloropentafluoride)