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	hartrees
Energy at 0K	-2598.441647
Energy at 298.15K
HF Energy	-2598.441647
Nuclear repulsion energy	199.640358

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	694	683	29.83	9.42	0.15	0.26
2	A₁	241	237	4.03	1.60	0.71	0.83
3	B₂	682	670	67.06	5.43	0.75	0.86

Atom	y (Å)	z (Å)
Se1	0.000	0.397
F2	1.339	-0.751
F3	-1.339	-0.751

	Se1	F2	F3
Se1		1.7636	1.7636
F2	1.7636		2.6776
F3	1.7636	2.6776

Number	Element	Mulliken
1	Se	0.604
2	F	-0.302
3	F	-0.302

All results from a given calculation for SeF₂ (Selenium difluoride)

using model chemistry: PBEPBEultrafine/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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<r²>	64.753
(<r²>)^1/2	8.047

All results from a given calculation for SeF2 (Selenium difluoride)

using model chemistry: PBEPBEultrafine/6-31G*

States and conformations

All results from a given calculation for SeF₂ (Selenium difluoride)