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	hartrees
Energy at 0K	-50.696124
Energy at 298.15K	-50.696148
HF Energy	-50.650169
Nuclear repulsion energy	15.394693

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2881	2881	0.00
2	Σ_g	1285	1285	0.00
3	Σ_u	2841	2841	28.95
4	Π_g	554	554	0.00
4	Π_g	554	554	0.00
5	Π_u	628	628	3.35
5	Π_u	628	628	3.35

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.754
B2	0.000	0.000	-0.754
H3	0.000	0.000	1.927
H4	0.000	0.000	-1.927

	B1	B2	H3	H4
B1		1.5086	1.1723	2.6809
B2	1.5086		2.6809	1.1723
H3	1.1723	2.6809		3.8532
H4	2.6809	1.1723	3.8532

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

using model chemistry: B2PLYP=FULL/6-31G**

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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