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	hartrees
Energy at 0K	-1357.507428
Energy at 298.15K
HF Energy	-1357.507428
Nuclear repulsion energy	638.223633

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-0.262
Cl2	0.000	0.000	1.806
F3	0.000	1.579	-0.278
F4	1.579	0.000	-0.278
F5	0.000	-1.579	-0.278
F6	-1.579	0.000	-0.278
F7	0.000	0.000	-1.836

	S1	Cl2	F3	F4	F5	F6	F7
S1		2.0685	1.5795	1.5795	1.5795	1.5795	1.5741
Cl2	2.0685		2.6149	2.6149	2.6149	2.6149	3.6426
F3	1.5795	2.6149		2.2336	3.1588	2.2336	2.2189
F4	1.5795	2.6149	2.2336		2.2336	3.1588	2.2189
F5	1.5795	2.6149	3.1588	2.2336		2.2336	2.2189
F6	1.5795	2.6149	2.2336	3.1588	2.2336		2.2189
F7	1.5741	3.6426	2.2189	2.2189	2.2189	2.2189

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	S1	F3	90.566	Cl2	S1	F4	90.566
Cl2	S1	F5	90.566	Cl2	S1	F6	90.566
Cl2	S1	F7	180.000	F3	S1	F4	89.994
F3	S1	F5	178.869	F3	S1	F6	89.994
F3	S1	F7	89.434	F4	S1	F5	89.994
F4	S1	F6	178.869	F4	S1	F7	89.434
F5	S1	F6	89.994	F5	S1	F7	89.434
F6	S1	F7	89.434

Number	Element	Mulliken
1	S	0.967
2	Cl	-0.094
3	F	-0.175
4	F	-0.175
5	F	-0.175
6	F	-0.175
7	F	-0.171

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

using model chemistry: B3PW91/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>	210.439
(<r²>)^1/2	14.507

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

using model chemistry: B3PW91/cc-pV(T+d)Z

States and conformations

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