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	hartrees
Energy at 0K	-199.116954
Energy at 298.15K	-199.116221
Nuclear repulsion energy	65.416615

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2015	2004	0.00
2	Σ_g	626	622	0.00
3	Σ_u	1823	1813	37.35
4	Π_g	570	567	0.00
4	Π_g	570	567	0.00
5	Π_u	244	243	24.43
5	Π_u	244	243	24.43

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.803
B2	0.000	0.000	-0.803
O3	0.000	0.000	2.047
O4	0.000	0.000	-2.047

	B1	B2	O3	O4
B1		1.6068	1.2431	2.8500
B2	1.6068		2.8500	1.2431
O3	1.2431	2.8500		4.0931
O4	2.8500	1.2431	4.0931

Number	Element	Mulliken
1	B	0.226
2	B	0.226
3	O	-0.226
4	O	-0.226

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

using model chemistry: BLYP/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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<r²>	88.330
(<r²>)^1/2	9.398

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

using model chemistry: BLYP/3-21G

States and conformations

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