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	hartrees
Energy at 0K	-50.567182
Energy at 298.15K	-50.566870
HF Energy	-50.420255
Nuclear repulsion energy	15.313042

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ_g	2838	2731
2	Σ_g	1279	1230
3	Σ_u	2800	2694
4	Π_g	379	365
4	Π_g	379	365
5	Π_u	595	573
5	Π_u	595	573

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	1.940
H4	0.000	0.000	-1.940

	B1	B2	H3	H4
B1		1.5132	1.1830	2.6962
B2	1.5132		2.6962	1.1830
H3	1.1830	2.6962		3.8791
H4	2.6962	1.1830	3.8791

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

using model chemistry: CCSD(T)/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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