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	hartrees
Energy at 0K	-1357.132941
Energy at 298.15K	-1357.135609
HF Energy	-1357.132941
Nuclear repulsion energy	583.979079

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	803	766	245.78
2	A₁	600	573	0.09
3	A₁	443	422	93.78
4	A₁	304	290	1.16
5	B₁	320	305	0.00
6	B₂	583	556	0.00
7	B₂	226	215	0.00
8	E	877	836	216.12
8	E	877	836	216.12
9	E	378	361	21.46
9	E	378	361	21.46
10	E	281	268	3.28
10	E	281	268	3.28
11	E	173	165	0.07
11	E	173	165	0.07

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-0.278
Cl2	0.000	0.000	1.977
F3	0.000	1.728	-0.311
F4	1.728	0.000	-0.311
F5	0.000	-1.728	-0.311
F6	-1.728	0.000	-0.311
F7	0.000	0.000	-1.994

	S1	Cl2	F3	F4	F5	F6	F7
S1		2.2552	1.7284	1.7284	1.7284	1.7284	1.7155
Cl2	2.2552		2.8672	2.8672	2.8672	2.8672	3.9707
F3	1.7284	2.8672		2.4439	3.4562	2.4439	2.4121
F4	1.7284	2.8672	2.4439		2.4439	3.4562	2.4121
F5	1.7284	2.8672	3.4562	2.4439		2.4439	2.4121
F6	1.7284	2.8672	2.4439	3.4562	2.4439		2.4121
F7	1.7155	3.9707	2.4121	2.4121	2.4121	2.4121

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	S1	F3	91.085	Cl2	S1	F4	91.085
Cl2	S1	F5	91.085	Cl2	S1	F6	91.085
Cl2	S1	F7	180.000	F3	S1	F4	89.979
F3	S1	F5	177.830	F3	S1	F6	89.979
F3	S1	F7	88.915	F4	S1	F5	89.979
F4	S1	F6	177.830	F4	S1	F7	88.915
F5	S1	F6	89.979	F5	S1	F7	88.915
F6	S1	F7	88.915

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

using model chemistry: B1B95/6-31G

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	S	1.540
2	Cl	0.035
3	F	-0.316
4	F	-0.316
5	F	-0.316
6	F	-0.316
7	F	-0.310

	x	y	z	Total
	0.000	0.000	1.217	1.217
CHELPG
AIM
ESP

<r²>	247.308
(<r²>)^1/2	15.726

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

using model chemistry: B1B95/6-31G

States and conformations

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