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	hartrees
Energy at 0K	-51.806034
Energy at 298.15K	-51.808513
HF Energy	-51.637072
Nuclear repulsion energy	22.020697

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2628	2498	0.00
2	A₁	1237	1175	0.00
3	A₁	863	820	0.00
4	B₁	513	488	0.00
5	B₂	2608	2479	89.02
6	B₂	1171	1113	15.81
7	E	2690	2557	94.39
7	E	2690	2557	94.39
8	E	1015	964	26.20
8	E	1015	964	26.20
9	E	428	407	5.48
9	E	428	407	5.48

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.835
B2	0.000	0.000	-0.835
H3	0.000	1.028	1.472
H4	0.000	-1.028	1.472
H5	1.028	0.000	-1.472
H6	-1.028	0.000	-1.472

	B1	B2	H3	H4	H5	H6
B1		1.6705	1.2093	1.2093	2.5258	2.5258
B2	1.6705		2.5258	2.5258	1.2093	1.2093
H3	1.2093	2.5258		2.0565	3.2831	3.2831
H4	1.2093	2.5258	2.0565		3.2831	3.2831
H5	2.5258	1.2093	3.2831	3.2831		2.0565
H6	2.5258	1.2093	3.2831	3.2831	2.0565

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	H5	121.758	B1	B2	H6	121.758
B2	B1	H3	121.758	B2	B1	H4	121.758
H3	B1	H4	116.485	H5	B2	H6	116.485

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

using model chemistry: MP2=FULL/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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All results from a given calculation for B2H4 (Diborane(4) D2d)

using model chemistry: MP2=FULL/cc-pVDZ

States and conformations

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