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	hartrees
Energy at 0K	-989.887169
Energy at 298.15K
HF Energy	-989.043173
Nuclear repulsion energy	561.906372

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_1g	829	793	0.00
2	E_g	752	719	0.00
2	E_g	752	719	0.00
3	T_1u	1116	1068	391.65
3	T_1u	1116	1068	391.65
3	T_1u	1116	1068	391.65
4	T_1u	617	590	58.92
4	T_1u	617	590	58.92
4	T_1u	617	590	58.92
5	T_2g	525	502	0.00
5	T_2g	525	502	0.00
5	T_2g	525	502	0.00
6	T_2u	356	340	0.00
6	T_2u	356	340	0.00
6	T_2u	356	340	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.000
F2	0.000	0.000	1.575
F3	0.000	1.575	0.000
F4	1.575	0.000	0.000
F5	0.000	-1.575	0.000
F6	-1.575	0.000	0.000
F7	0.000	0.000	-1.575

	S1	F2	F3	F4	F5	F6	F7
S1		1.5754	1.5754	1.5754	1.5754	1.5754	1.5754
F2	1.5754		2.2279	2.2279	2.2279	2.2279	3.1507
F3	1.5754	2.2279		2.2279	3.1507	2.2279	2.2279
F4	1.5754	2.2279	2.2279		2.2279	3.1507	2.2279
F5	1.5754	2.2279	3.1507	2.2279		2.2279	2.2279
F6	1.5754	2.2279	2.2279	3.1507	2.2279		2.2279
F7	1.5754	3.1507	2.2279	2.2279	2.2279	2.2279

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	90.000	F2	S1	F4	90.000
F2	S1	F5	90.000	F2	S1	F6	90.000
F2	S1	F7	180.000	F3	S1	F4	90.000
F3	S1	F5	180.000	F3	S1	F6	90.000
F3	S1	F7	90.000	F4	S1	F5	90.000
F4	S1	F6	180.000	F4	S1	F7	90.000
F5	S1	F6	90.000	F5	S1	F7	90.000
F6	S1	F7	90.000

All results from a given calculation for SF₆ (Sulfur Hexafluoride)

using model chemistry: CCD/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 SF6 (Sulfur Hexafluoride)

using model chemistry: CCD/3-21G*

States and conformations

All results from a given calculation for SF₆ (Sulfur Hexafluoride)