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	hartrees
Energy at 0K	-50.597555
Energy at 298.15K	-50.597639
HF Energy	-50.439348
Nuclear repulsion energy	15.388105

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2869	2869	0.00
2	Σ_g	1273	1273	0.00
3	Σ_u	2829	2829	24.04
4	Π_g	595	595	0.00
4	Π_g	595	595	0.00
5	Π_u	632	632	0.06
5	Π_u	632	632	0.06

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.755
B2	0.000	0.000	-0.755
H3	0.000	0.000	1.927
H4	0.000	0.000	-1.927

	B1	B2	H3	H4
B1		1.5099	1.1718	2.6817
B2	1.5099		2.6817	1.1718
H3	1.1718	2.6817		3.8536
H4	2.6817	1.1718	3.8536

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

using model chemistry: MP2/daug-cc-pVTZ

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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