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	hartrees
Energy at 0K	-200.157958
Energy at 298.15K	-200.157026
HF Energy	-200.157958
Nuclear repulsion energy	66.614836

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2205	2088	0.00
2	Σ_g	625	592	0.00
3	Σ_u	2024	1917	196.85
4	Π_g	497	471	0.00
4	Π_g	497	471	0.00
5	Π_u	214	202	54.00
5	Π_u	214	202	54.00

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.824
B2	0.000	0.000	-0.824
O3	0.000	0.000	2.022
O4	0.000	0.000	-2.022

	B1	B2	O3	O4
B1		1.6483	1.1979	2.8462
B2	1.6483		2.8462	1.1979
O3	1.1979	2.8462		4.0441
O4	2.8462	1.1979	4.0441

Number	Element	Mulliken
1	B	0.267
2	B	0.267
3	O	-0.267
4	O	-0.267

All results from a given calculation for B₂O₂ (Diboron dioxide)

using model chemistry: M06-2X/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>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for B2O2 (Diboron dioxide)

using model chemistry: M06-2X/6-31G*

States and conformations

All results from a given calculation for B₂O₂ (Diboron dioxide)