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	hartrees
Energy at 0K	-2995.292908
Energy at 298.15K	-2995.294974
HF Energy	-2994.092164
Nuclear repulsion energy	823.992724

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_1g	744	702	0.00
2	E_g	715	675	0.00
2	E_g	715	675	0.00
3	T_1u	826	780	154.99
3	T_1u	826	780	154.99
3	T_1u	826	780	154.99
4	T_1u	436	412	57.99
4	T_1u	436	412	57.99
4	T_1u	436	412	57.99
5	T_2g	397	375	0.00
5	T_2g	397	375	0.00
5	T_2g	397	375	0.00
6	T_2u	259	245	0.00
6	T_2u	259	245	0.00
6	T_2u	259	245	0.00

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.000
F2	0.000	0.000	1.699
F3	0.000	1.699	0.000
F4	1.699	0.000	0.000
F5	0.000	-1.699	0.000
F6	-1.699	0.000	0.000
F7	0.000	0.000	-1.699

	Se1	F2	F3	F4	F5	F6	F7
Se1		1.6985	1.6985	1.6985	1.6985	1.6985	1.6985
F2	1.6985		2.4021	2.4021	2.4021	2.4021	3.3971
F3	1.6985	2.4021		2.4021	3.3971	2.4021	2.4021
F4	1.6985	2.4021	2.4021		2.4021	3.3971	2.4021
F5	1.6985	2.4021	3.3971	2.4021		2.4021	2.4021
F6	1.6985	2.4021	2.4021	3.3971	2.4021		2.4021
F7	1.6985	3.3971	2.4021	2.4021	2.4021	2.4021

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: CCSD/6-31G*

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: CCSD/6-31G*

States and conformations

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