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	hartrees
Energy at 0K	-51.894924
Energy at 298.15K	-51.897393
HF Energy	-51.651738
Nuclear repulsion energy	22.252789

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	858	832
2	B₁	523	507
3	E	2644	2563
4	E	2644	2563
5	E	2588	2508
6	E	2569	2490
7	E	1228	1191
7	E	1167	1131
8	E	1007	976
8	E	1007	976
9	E	420	407
9	E	419	406

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.826
B2	0.000	0.000	-0.826
H3	0.000	1.017	1.458
H4	0.000	-1.017	1.458
H5	1.017	0.000	-1.458
H6	-1.017	0.000	-1.458

	B1	B2	H3	H4	H5	H6
B1		1.6524	1.1969	1.1969	2.5000	2.5000
B2	1.6524		2.5000	2.5000	1.1969	1.1969
H3	1.1969	2.5000		2.0335	3.2507	3.2507
H4	1.1969	2.5000	2.0335		3.2507	3.2507
H5	2.5000	1.1969	3.2507	3.2507		2.0335
H6	2.5000	1.1969	3.2507	3.2507	2.0335

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	H5	121.843	B1	B2	H6	121.843
B2	B1	H3	121.843	B2	B1	H4	121.843
H3	B1	H4	116.313	H5	B2	H6	116.313

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

using model chemistry: MP4/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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All results from a given calculation for B2H4 (Diborane(4) D2d)

using model chemistry: MP4/cc-pVTZ

States and conformations

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