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	hartrees
Energy at 0K	-50.586039
Energy at 298.15K	-50.586290
HF Energy	-50.426876
Nuclear repulsion energy	15.460775

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2917	2741	0.00
2	Σ_g	1293	1216	0.00
3	Σ_u	2875	2702	12.18
4	Π_g	698	656	0.00
4	Π_g	698	656	0.00
5	Π_u	688	646	1.66
5	Π_u	688	646	1.66

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.751
B2	0.000	0.000	-0.751
H3	0.000	0.000	1.919
H4	0.000	0.000	-1.919

	B1	B2	H3	H4
B1		1.5012	1.1686	2.6698
B2	1.5012		2.6698	1.1686
H3	1.1686	2.6698		3.8384
H4	2.6698	1.1686	3.8384

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

using model chemistry: MP2=FULL/6-31G(2df,p)

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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