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	hartrees
Energy at 0K	-51.871938
Energy at 298.15K	-51.874415
HF Energy	-51.654984
Nuclear repulsion energy	22.339443

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2628	2492	0.00
2	A₁	1240	1176	0.00
3	A₁	864	820	0.00
4	B₁	529	502	0.00
5	B₂	2609	2475	76.42
6	B₂	1178	1117	12.38
7	E	2688	2549	87.29
7	E	2688	2549	87.29
8	E	1014	961	28.88
8	E	1014	961	28.88
9	E	420	398	6.51
9	E	420	398	6.51

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.824
B2	0.000	0.000	-0.824
H3	0.000	1.014	1.450
H4	0.000	-1.014	1.450
H5	1.014	0.000	-1.450
H6	-1.014	0.000	-1.450

	B1	B2	H3	H4	H5	H6
B1		1.6470	1.1919	1.1919	2.4895	2.4895
B2	1.6470		2.4895	2.4895	1.1919	1.1919
H3	1.1919	2.4895		2.0277	3.2355	3.2355
H4	1.1919	2.4895	2.0277		3.2355	3.2355
H5	2.4895	1.1919	3.2355	3.2355		2.0277
H6	2.4895	1.1919	3.2355	3.2355	2.0277

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	H5	121.723	B1	B2	H6	121.723
B2	B1	H3	121.723	B2	B1	H4	121.723
H3	B1	H4	116.554	H5	B2	H6	116.554

All results from a given calculation for B₂H₄ (Diborane(4) D2d)

using model chemistry: MP2/cc-pVQZ

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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All results from a given calculation for B2H4 (Diborane(4) D2d)

using model chemistry: MP2/cc-pVQZ

States and conformations

All results from a given calculation for B₂H₄ (Diborane(4) D2d)