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	hartrees
Energy at 0K	-143.768205
Energy at 298.15K	-143.772844
HF Energy	-143.768205
Nuclear repulsion energy	238.705968

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	956	859	527.51
2	A₁	777	698	14.55
3	A₁	652	586	110.32
4	A₁	456	409	0.17
5	B₁	534	480	0.00
6	B₂	701	630	0.00
7	B₂	369	331	0.00
8	E	1031	925	450.58
8	E	1031	925	450.58
9	E	615	552	27.41
9	E	615	552	27.41
10	E	469	421	2.00
10	E	469	421	2.00
11	E	287	258	0.07
11	E	287	258	0.07

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-0.257
Cl2	0.000	0.000	1.801
F3	0.000	1.571	-0.280
F4	1.571	0.000	-0.280
F5	0.000	-1.571	-0.280
F6	-1.571	0.000	-0.280
F7	0.000	0.000	-1.825

	S1	Cl2	F3	F4	F5	F6	F7
S1		2.0583	1.5715	1.5715	1.5715	1.5715	1.5680
Cl2	2.0583		2.6080	2.6080	2.6080	2.6080	3.6262
F3	1.5715	2.6080		2.2223	3.1427	2.2223	2.2035
F4	1.5715	2.6080	2.2223		2.2223	3.1427	2.2035
F5	1.5715	2.6080	3.1427	2.2223		2.2223	2.2035
F6	1.5715	2.6080	2.2223	3.1427	2.2223		2.2035
F7	1.5680	3.6262	2.2035	2.2035	2.2035	2.2035

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	S1	F3	90.846	Cl2	S1	F4	90.846
Cl2	S1	F5	90.846	Cl2	S1	F6	90.846
Cl2	S1	F7	180.000	F3	S1	F4	89.988
F3	S1	F5	178.308	F3	S1	F6	89.988
F3	S1	F7	89.154	F4	S1	F5	89.988
F4	S1	F6	178.308	F4	S1	F7	89.154
F5	S1	F6	89.988	F5	S1	F7	89.154
F6	S1	F7	89.154

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

using model chemistry: HF/CEP-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	1.111
2	Cl	-0.038
3	F	-0.215
4	F	-0.215
5	F	-0.215
6	F	-0.215
7	F	-0.212

	x	y	z	Total
	0.000	0.000	0.705	0.705
CHELPG
AIM
ESP

<r²>	148.671
(<r²>)^1/2	12.193

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

using model chemistry: HF/CEP-31G*

States and conformations

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