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	hartrees
Energy at 0K	-50.612102
Energy at 298.15K	-50.612208
HF Energy	-50.439015
Nuclear repulsion energy	15.414366

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2865	2654	0.00
2	Σ_g	1290	1195	0.00
3	Σ_u	2820	2613	27.17
4	Π_g	600	556	0.00
4	Π_g	600	556	0.00
5	Π_u	638	591	0.23
5	Π_u	638	591	0.23

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.753
B2	0.000	0.000	-0.753
H3	0.000	0.000	1.925
H4	0.000	0.000	-1.925

	B1	B2	H3	H4
B1		1.5062	1.1714	2.6776
B2	1.5062		2.6776	1.1714
H3	1.1714	2.6776		3.8490
H4	2.6776	1.1714	3.8490

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

using model chemistry: CID/cc-pVTZ

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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