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	hartrees
Energy at 0K	-50.585642
Energy at 298.15K	-50.585053
HF Energy	-50.425329
Nuclear repulsion energy	15.319357

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ_g	2865	2749
2	Σ_g	1265	1214
3	Σ_u	2825	2711
4	Π_g	265	255
4	Π_g	265	255
5	Π_u	576	553
5	Π_u	576	553

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.759
B2	0.000	0.000	-0.759
H3	0.000	0.000	1.933
H4	0.000	0.000	-1.933

	B1	B2	H3	H4
B1		1.5184	1.1742	2.6926
B2	1.5184		2.6926	1.1742
H3	1.1742	2.6926		3.8668
H4	2.6926	1.1742	3.8668

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

using model chemistry: CCSD(T)/6-31+G**

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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