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	hartrees
Energy at 0K	-51.462736
Energy at 298.15K	-51.465303
HF Energy	-51.339397
Nuclear repulsion energy	22.112026

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2596	2444	0.00
2	A₁	1242	1169	0.00
3	A₁	878	826	0.00
4	B₁	546	513	0.00
5	B₂	2574	2423	67.46
6	B₂	1198	1128	9.88
7	E	2648	2493	68.63
7	E	2648	2493	68.63
8	E	1018	958	28.53
8	E	1018	958	28.53
9	E	464	437	2.36
9	E	464	437	2.36

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.829
B2	0.000	0.000	-0.829
H3	0.000	1.024	1.469
H4	0.000	-1.024	1.469
H5	1.024	0.000	-1.469
H6	-1.024	0.000	-1.469

	B1	B2	H3	H4	H5	H6
B1		1.6587	1.2073	1.2073	2.5161	2.5161
B2	1.6587		2.5161	2.5161	1.2073	1.2073
H3	1.2073	2.5161		2.0478	3.2754	3.2754
H4	1.2073	2.5161	2.0478		3.2754	3.2754
H5	2.5161	1.2073	3.2754	3.2754		2.0478
H6	2.5161	1.2073	3.2754	3.2754	2.0478

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	H5	121.995	B1	B2	H6	121.995
B2	B1	H3	121.995	B2	B1	H4	121.995
H3	B1	H4	116.010	H5	B2	H6	116.010

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

using model chemistry: CISD/3-21G

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: CISD/3-21G

States and conformations

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