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	hartrees
Energy at 0K	-51.898728
Energy at 298.15K	-51.901183
HF Energy	-51.652729
Nuclear repulsion energy	22.248862

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1223	1223
2	A₁	859	859
3	B₁	522	522
4	B₂	1162	1162
5	E	2633	2633
6	E	2633	2633
7	E	2581	2581
7	E	2561	2561
8	E	1004	1004
8	E	1003	1003
9	E	418	418
9	E	418	418

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		1.6513	1.1980	1.1980	2.5004	2.5004
B2	1.6513		2.5004	2.5004	1.1980	1.1980
H3	1.1980	2.5004		2.0343	3.2524	3.2524
H4	1.1980	2.5004	2.0343		3.2524	3.2524
H5	2.5004	1.1980	3.2524	3.2524		2.0343
H6	2.5004	1.1980	3.2524	3.2524	2.0343

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	H5	121.888	B1	B2	H6	121.888
B2	B1	H3	121.888	B2	B1	H4	121.888
H3	B1	H4	116.225	H5	B2	H6	116.225

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

using model chemistry: QCISD(TQ)/Def2TZVPP

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: QCISD(TQ)/Def2TZVPP

States and conformations

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