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	hartrees
Energy at 0K	-50.738997
Energy at 298.15K	-50.738971
HF Energy	-50.738997
Nuclear repulsion energy	15.231596

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2781	2733	0.00
2	Σ_g	1229	1208	0.00
3	Σ_u	2743	2695	48.68
4	Π_g	551	542	0.00
4	Π_g	551	542	0.00
5	Π_u	588	578	0.72
5	Π_u	588	578	0.72

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.763
B2	0.000	0.000	-0.763
H3	0.000	0.000	1.947
H4	0.000	0.000	-1.947

	B1	B2	H3	H4
B1		1.5253	1.1840	2.7093
B2	1.5253		2.7093	1.1840
H3	1.1840	2.7093		3.8934
H4	2.7093	1.1840	3.8934

Number	Element	Mulliken
1	B	-0.022
2	B	-0.022
3	H	0.022
4	H	0.022

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

using model chemistry: B97D3/6-31+G**

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>	21.863
(<r²>)^1/2	4.676