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	hartrees
Energy at 0K	-1355.683653
Energy at 298.15K
HF Energy	-1354.342478
Nuclear repulsion energy	652.176034

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-0.258
Cl2	0.000	0.000	1.775
F3	0.000	1.543	-0.274
F4	1.543	0.000	-0.274
F5	0.000	-1.543	-0.274
F6	-1.543	0.000	-0.274
F7	0.000	0.000	-1.798

	S1	Cl2	F3	F4	F5	F6	F7
S1		2.0334	1.5429	1.5429	1.5429	1.5429	1.5396
Cl2	2.0334		2.5653	2.5653	2.5653	2.5653	3.5730
F3	1.5429	2.5653		2.1819	3.0856	2.1819	2.1682
F4	1.5429	2.5653	2.1819		2.1819	3.0856	2.1682
F5	1.5429	2.5653	3.0856	2.1819		2.1819	2.1682
F6	1.5429	2.5653	2.1819	3.0856	2.1819		2.1682
F7	1.5396	3.5730	2.1682	2.1682	2.1682	2.1682

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	S1	F3	90.598	Cl2	S1	F4	90.598
Cl2	S1	F5	90.598	Cl2	S1	F6	90.598
Cl2	S1	F7	180.000	F3	S1	F4	89.994
F3	S1	F5	178.803	F3	S1	F6	89.994
F3	S1	F7	89.402	F4	S1	F5	89.994
F4	S1	F6	178.803	F4	S1	F7	89.402
F5	S1	F6	89.994	F5	S1	F7	89.402
F6	S1	F7	89.402

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

using model chemistry: CISD/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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All results from a given calculation for SF5Cl (sulfur chloropentafluoride)

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

States and conformations

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