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	hartrees
Energy at 0K	-50.588825
Energy at 298.15K	-50.588844
HF Energy	-50.430448
Nuclear repulsion energy	15.360289

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2861	2709	0.00
2	Σ_g	1272	1205	0.00
3	Σ_u	2818	2669	18.01
4	Π_g	541	513	0.00
4	Π_g	541	513	0.00
5	Π_u	636	602	0.23
5	Π_u	636	602	0.23

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.756
B2	0.000	0.000	-0.756
H3	0.000	0.000	1.932
H4	0.000	0.000	-1.932

	B1	B2	H3	H4
B1		1.5113	1.1759	2.6872
B2	1.5113		2.6872	1.1759
H3	1.1759	2.6872		3.8630
H4	2.6872	1.1759	3.8630

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

using model chemistry: MP2=FULL/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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