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	hartrees
Energy at 0K	-1348.382383
Energy at 298.15K	-1348.386803
HF Energy	-1347.492226
Nuclear repulsion energy	637.240364

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	970	932	420.32
2	A₁	764	735	1.96
3	A₁	616	592	151.35
4	A₁	410	394	6.45
5	B₁	498	478	0.00
6	B₂	721	693	0.00
7	B₂	343	330	0.00
8	E	1060	1019	313.24
8	E	1060	1019	313.24
9	E	572	549	34.99
9	E	572	549	34.99
10	E	441	423	3.84
10	E	441	423	3.84
11	E	270	259	0.25
11	E	270	259	0.25

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-0.255
Cl2	0.000	0.000	1.792
F3	0.000	1.588	-0.273
F4	1.588	0.000	-0.273
F5	0.000	-1.588	-0.273
F6	-1.588	0.000	-0.273
F7	0.000	0.000	-1.838

	S1	Cl2	F3	F4	F5	F6	F7
S1		2.0463	1.5882	1.5882	1.5882	1.5882	1.5836
Cl2	2.0463		2.6048	2.6048	2.6048	2.6048	3.6299
F3	1.5882	2.6048		2.2459	3.1762	2.2459	2.2298
F4	1.5882	2.6048	2.2459		2.2459	3.1762	2.2298
F5	1.5882	2.6048	3.1762	2.2459		2.2459	2.2298
F6	1.5882	2.6048	2.2459	3.1762	2.2459		2.2298
F7	1.5836	3.6299	2.2298	2.2298	2.2298	2.2298

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	S1	F3	90.662	Cl2	S1	F4	90.662
Cl2	S1	F5	90.662	Cl2	S1	F6	90.662
Cl2	S1	F7	180.000	F3	S1	F4	89.992
F3	S1	F5	178.677	F3	S1	F6	89.992
F3	S1	F7	89.338	F4	S1	F5	89.992
F4	S1	F6	178.677	F4	S1	F7	89.338
F5	S1	F6	89.992	F5	S1	F7	89.338
F6	S1	F7	89.338

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

using model chemistry: QCISD/3-21G*

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: QCISD/3-21G*

States and conformations

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