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	hartrees
Energy at 0K	-1356.040269
Energy at 298.15K	-1356.044699
HF Energy	-1354.326831
Nuclear repulsion energy	641.087939

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	894	856	426.71
2	A₁	737	705	18.09
3	A₁	618	591	90.52
4	A₁	418	400	2.33
5	B₁	511	489	0.00
6	B₂	658	630	0.00
7	B₂	345	331	0.00
8	E	959	918	336.62
8	E	959	918	336.62
9	E	589	564	17.25
9	E	589	564	17.25
10	E	447	428	0.89
10	E	447	428	0.89
11	E	272	260	0.00
11	E	272	260	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-0.258
Cl2	0.000	0.000	1.799
F3	0.000	1.572	-0.278
F4	1.572	0.000	-0.278
F5	0.000	-1.572	-0.278
F6	-1.572	0.000	-0.278
F7	0.000	0.000	-1.826

	S1	Cl2	F3	F4	F5	F6	F7
S1		2.0577	1.5726	1.5726	1.5726	1.5726	1.5673
Cl2	2.0577		2.6057	2.6057	2.6057	2.6057	3.6250
F3	1.5726	2.6057		2.2238	3.1450	2.2238	2.2061
F4	1.5726	2.6057	2.2238		2.2238	3.1450	2.2061
F5	1.5726	2.6057	3.1450	2.2238		2.2238	2.2061
F6	1.5726	2.6057	2.2238	3.1450	2.2238		2.2061
F7	1.5673	3.6250	2.2061	2.2061	2.2061	2.2061

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	S1	F3	90.730	Cl2	S1	F4	90.730
Cl2	S1	F5	90.730	Cl2	S1	F6	90.730
Cl2	S1	F7	180.000	F3	S1	F4	89.991
F3	S1	F5	178.540	F3	S1	F6	89.991
F3	S1	F7	89.270	F4	S1	F5	89.991
F4	S1	F6	178.540	F4	S1	F7	89.270
F5	S1	F6	89.991	F5	S1	F7	89.270
F6	S1	F7	89.270

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

using model chemistry: CCD/aug-cc-pVTZ

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 SF5Cl (sulfur chloropentafluoride)

using model chemistry: CCD/aug-cc-pVTZ

States and conformations

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