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	hartrees
Energy at 0K	-51.841509
Energy at 298.15K	-51.843986
HF Energy	-51.636965
Nuclear repulsion energy	21.937144

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2587	2482	0.00
2	A₁	1228	1178	0.00
3	A₁	856	822	0.00
4	B₁	495	475	0.00
5	B₂	2566	2462	90.05
6	B₂	1163	1115	18.50
7	E	2642	2535	97.82
7	E	2642	2535	97.82
8	E	1006	965	23.18
8	E	1006	965	23.18
9	E	439	421	6.15
9	E	439	421	6.15

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.838
B2	0.000	0.000	-0.838
H3	0.000	1.031	1.479
H4	0.000	-1.031	1.479
H5	1.031	0.000	-1.479
H6	-1.031	0.000	-1.479

	B1	B2	H3	H4	H5	H6
B1		1.6766	1.2140	1.2140	2.5361	2.5361
B2	1.6766		2.5361	2.5361	1.2140	1.2140
H3	1.2140	2.5361		2.0627	3.2973	3.2973
H4	1.2140	2.5361	2.0627		3.2973	3.2973
H5	2.5361	1.2140	3.2973	3.2973		2.0627
H6	2.5361	1.2140	3.2973	3.2973	2.0627

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	H5	121.833	B1	B2	H6	121.833
B2	B1	H3	121.833	B2	B1	H4	121.833
H3	B1	H4	116.334	H5	B2	H6	116.334

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

using model chemistry: QCISD/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: QCISD/cc-pVDZ

States and conformations

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