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	hartrees
Energy at 0K	-2997.559499
Energy at 298.15K	-2997.561746
HF Energy	-2996.409431
Nuclear repulsion energy	829.629326

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_1g	736	681	0.00
2	E_g	682	631	0.00
2	E_g	682	631	0.00
3	T_1u	827	765	184.13
3	T_1u	827	765	184.13
3	T_1u	827	765	184.13
4	T_1u	459	425	70.62
4	T_1u	459	425	70.62
4	T_1u	459	425	70.62
5	T_2g	415	384	0.00
5	T_2g	415	384	0.00
5	T_2g	415	384	0.00
6	T_2u	276	256	0.00
6	T_2u	276	256	0.00
6	T_2u	276	256	0.00

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.000
F2	0.000	0.000	1.687
F3	0.000	1.687	0.000
F4	1.687	0.000	0.000
F5	0.000	-1.687	0.000
F6	-1.687	0.000	0.000
F7	0.000	0.000	-1.687

	Se1	F2	F3	F4	F5	F6	F7
Se1		1.6870	1.6870	1.6870	1.6870	1.6870	1.6870
F2	1.6870		2.3858	2.3858	2.3858	2.3858	3.3740
F3	1.6870	2.3858		2.3858	3.3740	2.3858	2.3858
F4	1.6870	2.3858	2.3858		2.3858	3.3740	2.3858
F5	1.6870	2.3858	3.3740	2.3858		2.3858	2.3858
F6	1.6870	2.3858	2.3858	3.3740	2.3858		2.3858
F7	1.6870	3.3740	2.3858	2.3858	2.3858	2.3858

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Se1	F3	90.000	F2	Se1	F4	90.000
F2	Se1	F5	90.000	F2	Se1	F6	90.000
F2	Se1	F7	180.000	F3	Se1	F4	90.000
F3	Se1	F5	180.000	F3	Se1	F6	90.000
F3	Se1	F7	90.000	F4	Se1	F5	90.000
F4	Se1	F6	180.000	F4	Se1	F7	90.000
F5	Se1	F6	90.000	F5	Se1	F7	90.000
F6	Se1	F7	90.000

All results from a given calculation for SeF₆ (Selenium hexafluoride)

using model chemistry: CISD/6-311G*

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 SeF6 (Selenium hexafluoride)

using model chemistry: CISD/6-311G*

States and conformations

All results from a given calculation for SeF₆ (Selenium hexafluoride)