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	hartrees
Energy at 0K	-51.823832
Energy at 298.15K	-51.826330
HF Energy	-51.634211
Nuclear repulsion energy	22.204662

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1241	1241
2	A₁	881	881
3	B₁	528	528
4	B₂	1179	1179
5	E	2659	2659
6	E	2659	2659
7	E	2606	2606
7	E	2585	2585
8	E	1014	1014
8	E	1014	1014
9	E	442	442
9	E	441	441

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.825
B2	0.000	0.000	-0.825
H3	0.000	1.020	1.464
H4	0.000	-1.020	1.464
H5	1.020	0.000	-1.464
H6	-1.020	0.000	-1.464

	B1	B2	H3	H4	H5	H6
B1		1.6494	1.2035	1.2035	2.5057	2.5057
B2	1.6494		2.5057	2.5057	1.2035	1.2035
H3	1.2035	2.5057		2.0392	3.2641	3.2641
H4	1.2035	2.5057	2.0392		3.2641	3.2641
H5	2.5057	1.2035	3.2641	3.2641		2.0392
H6	2.5057	1.2035	3.2641	3.2641	2.0392

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	H5	122.095	B1	B2	H6	122.095
B2	B1	H3	122.095	B2	B1	H4	122.095
H3	B1	H4	115.810	H5	B2	H6	115.810

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

using model chemistry: QCISD(TQ)=FULL/6-31G*

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)=FULL/6-31G*

States and conformations

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