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	hartrees
Energy at 0K	-50.744761
Energy at 298.15K	-50.744791
HF Energy	-50.744761
Nuclear repulsion energy	15.290593

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2757	2757	0.00
2	Σ_g	1232	1232	0.00
3	Σ_u	2715	2715	40.84
4	Π_g	586	586	0.00
4	Π_g	586	586	0.00
5	Π_u	597	597	0.93
5	Π_u	597	597	0.93

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.759
B2	0.000	0.000	-0.759
H3	0.000	0.000	1.941
H4	0.000	0.000	-1.941

	B1	B2	H3	H4
B1		1.5172	1.1826	2.6998
B2	1.5172		2.6998	1.1826
H3	1.1826	2.6998		3.8824
H4	2.6998	1.1826	3.8824

Number	Element	Mulliken
1	B	-0.010
2	B	-0.010
3	H	0.010
4	H	0.010

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

using model chemistry: B97D3/6-311G*

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>	21.698
(<r²>)^1/2	4.658