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	hartrees
Energy at 0K	-50.597608
Energy at 298.15K	-50.597574
HF Energy	-50.433666
Nuclear repulsion energy	15.330693

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2829	2699	0.00
2	Σ_g	1264	1206	0.00
3	Σ_u	2789	2661	25.80
4	Π_g	505	482	0.00
4	Π_g	505	482	0.00
5	Π_u	630	601	0.20
5	Π_u	630	601	0.20

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.757
B2	0.000	0.000	-0.757
H3	0.000	0.000	1.935
H4	0.000	0.000	-1.935

	B1	B2	H3	H4
B1		1.5148	1.1773	2.6921
B2	1.5148		2.6921	1.1773
H3	1.1773	2.6921		3.8695
H4	2.6921	1.1773	3.8695

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

using model chemistry: QCISD/6-311G**

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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