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	hartrees
Energy at 0K	-50.552079
Energy at 298.15K	-50.552149
HF Energy	-50.425698
Nuclear repulsion energy	15.180501

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2856	2721	0.00
2	Σ_g	1269	1209	0.00
3	Σ_u	2814	2681	25.06
4	Π_g	579	552	0.00
4	Π_g	579	552	0.00
5	Π_u	632	602	0.84
5	Π_u	632	602	0.84

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.765
B2	0.000	0.000	-0.765
H3	0.000	0.000	1.953
H4	0.000	0.000	-1.953

	B1	B2	H3	H4
B1		1.5308	1.1875	2.7183
B2	1.5308		2.7183	1.1875
H3	1.1875	2.7183		3.9058
H4	2.7183	1.1875	3.9058

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

using model chemistry: MP2/cc-pVDZ

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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