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	hartrees
Energy at 0K	-51.874717
Energy at 298.15K	-51.877230
HF Energy	-51.652816
Nuclear repulsion energy	22.275619

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2629	2629	0.00
2	A₁	1255	1255	0.00
3	A₁	865	865	0.00
4	B₁	513	513	0.00
5	B₂	2609	2609	88.06
6	B₂	1195	1195	17.03
7	E	2683	2683	98.70
7	E	2683	2683	98.70
8	E	1026	1026	28.51
8	E	1026	1026	28.51
9	E	445	445	7.75
9	E	445	445	7.75

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.828
B2	0.000	0.000	-0.828
H3	0.000	1.014	1.456
H4	0.000	-1.014	1.456
H5	1.014	0.000	-1.456
H6	-1.014	0.000	-1.456

	B1	B2	H3	H4	H5	H6
B1		1.6550	1.1930	1.1930	2.4983	2.4983
B2	1.6550		2.4983	2.4983	1.1930	1.1930
H3	1.1930	2.4983		2.0284	3.2454	3.2454
H4	1.1930	2.4983	2.0284		3.2454	3.2454
H5	2.4983	1.1930	3.2454	3.2454		2.0284
H6	2.4983	1.1930	3.2454	3.2454	2.0284

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	H5	121.772	B1	B2	H6	121.772
B2	B1	H3	121.772	B2	B1	H4	121.772
H3	B1	H4	116.455	H5	B2	H6	116.455

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

using model chemistry: CID/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: CID/Def2TZVPP

States and conformations

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