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	hartrees
Energy at 0K	-51.829638
Energy at 298.15K	-51.832117
HF Energy	-51.641175
Nuclear repulsion energy	22.260241

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2658	2510	0.00
2	A₁	1246	1176	0.00
3	A₁	864	816	0.00
4	B₁	524	495	0.00
5	B₂	2640	2494	66.32
6	B₂	1187	1121	12.41
7	E	2721	2570	69.34
7	E	2721	2570	69.34
8	E	1023	966	29.93
8	E	1023	966	29.93
9	E	424	401	4.56
9	E	424	401	4.56

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.828
B2	0.000	0.000	-0.828
H3	0.000	1.014	1.458
H4	0.000	-1.014	1.458
H5	1.014	0.000	-1.458
H6	-1.014	0.000	-1.458

	B1	B2	H3	H4	H5	H6
B1		1.6559	1.1938	1.1938	2.5006	2.5006
B2	1.6559		2.5006	2.5006	1.1938	1.1938
H3	1.1938	2.5006		2.0283	3.2492	3.2492
H4	1.1938	2.5006	2.0283		3.2492	3.2492
H5	2.5006	1.1938	3.2492	3.2492		2.0283
H6	2.5006	1.1938	3.2492	3.2492	2.0283

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	H5	121.840	B1	B2	H6	121.840
B2	B1	H3	121.840	B2	B1	H4	121.840
H3	B1	H4	116.319	H5	B2	H6	116.319

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

using model chemistry: MP2/6-31G(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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All results from a given calculation for B2H4 (Diborane(4) D2d)

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

States and conformations

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