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	hartrees
Energy at 0K	-50.631262
Energy at 298.15K	-50.631390
HF Energy	-50.437547
Nuclear repulsion energy	15.433763

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2882	2716	0.00
2	Σ_g	1276	1203	0.00
3	Σ_u	2843	2680	21.61
4	Π_g	620	584	0.00
4	Π_g	620	584	0.00
5	Π_u	639	603	0.04
5	Π_u	639	603	0.04

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.752
B2	0.000	0.000	-0.752
H3	0.000	0.000	1.922
H4	0.000	0.000	-1.922

	B1	B2	H3	H4
B1		1.5048	1.1693	2.6741
B2	1.5048		2.6741	1.1693
H3	1.1693	2.6741		3.8434
H4	2.6741	1.1693	3.8434

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

using model chemistry: MP2=FULL/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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