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	hartrees
Energy at 0K	-50.107926
Energy at 298.15K	-50.107885
HF Energy	-50.107926
Nuclear repulsion energy	15.838336

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	3246	3246	0.00
2	Σ_g	1461	1461	0.00
3	Σ_u	3189	3189	21.49
4	Π_g	593	593	0.00
4	Π_g	593	593	0.00
5	Π_u	652	652	36.20
5	Π_u	652	652	36.20

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.728
B2	0.000	0.000	-0.728
H3	0.000	0.000	1.883
H4	0.000	0.000	-1.883

	B1	B2	H3	H4
B1		1.4550	1.1558	2.6108
B2	1.4550		2.6108	1.1558
H3	1.1558	2.6108		3.7665
H4	2.6108	1.1558	3.7665

Number	Element	Mulliken
1	B	0.042
2	B	0.042
3	H	-0.042
4	H	-0.042

All results from a given calculation for HBBH (Diborane(2))

using model chemistry: M06-2X/STO-3G

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>	19.562
(<r²>)^1/2	4.423