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	hartrees
Energy at 0K	-50.624328
Energy at 298.15K	-50.624410
HF Energy	-50.437387
Nuclear repulsion energy	15.354717

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ_g	2827	2668
2	Σ_g	1255	1184
3	Σ_u	2787	2630
4	Π_g	595	562
4	Π_g	595	562
5	Π_u	625	590
5	Π_u	625	590

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.756
B2	0.000	0.000	-0.756
H3	0.000	0.000	1.931
H4	0.000	0.000	-1.931

	B1	B2	H3	H4
B1		1.5125	1.1748	2.6874
B2	1.5125		2.6874	1.1748
H3	1.1748	2.6874		3.8622
H4	2.6874	1.1748	3.8622

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

using model chemistry: MP4/6-311+G(3df,2p)

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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