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	hartrees
Energy at 0K	-1357.583062
Energy at 298.15K
HF Energy	-1357.583062
Nuclear repulsion energy	642.380021

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-0.259
Cl2	0.000	0.000	1.794
F3	0.000	1.570	-0.277
F4	1.570	0.000	-0.277
F5	0.000	-1.570	-0.277
F6	-1.570	0.000	-0.277
F7	0.000	0.000	-1.823

	S1	Cl2	F3	F4	F5	F6	F7
S1		2.0526	1.5699	1.5699	1.5699	1.5699	1.5641
Cl2	2.0526		2.5984	2.5984	2.5984	2.5984	3.6168
F3	1.5699	2.5984		2.2200	3.1395	2.2200	2.2033
F4	1.5699	2.5984	2.2200		2.2200	3.1395	2.2033
F5	1.5699	2.5984	3.1395	2.2200		2.2200	2.2033
F6	1.5699	2.5984	2.2200	3.1395	2.2200		2.2033
F7	1.5641	3.6168	2.2033	2.2033	2.2033	2.2033

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	S1	F3	90.658	Cl2	S1	F4	90.658
Cl2	S1	F5	90.658	Cl2	S1	F6	90.658
Cl2	S1	F7	180.000	F3	S1	F4	89.992
F3	S1	F5	178.684	F3	S1	F6	89.992
F3	S1	F7	89.342	F4	S1	F5	89.992
F4	S1	F6	178.684	F4	S1	F7	89.342
F5	S1	F6	89.992	F5	S1	F7	89.342
F6	S1	F7	89.342

Number	Element	Mulliken
1	S	0.939
2	Cl	-0.075
3	F	-0.174
4	F	-0.174
5	F	-0.174
6	F	-0.174
7	F	-0.169

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

using model chemistry: M06-2X/cc-pV(T+d)Z

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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<r²>	208.353
(<r²>)^1/2	14.434

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

using model chemistry: M06-2X/cc-pV(T+d)Z

States and conformations

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