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	hartrees
Energy at 0K	-51.471271
Energy at 298.15K	-51.473826
HF Energy	-51.339287
Nuclear repulsion energy	22.091687

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	875	856
2	B₁	552	540
3	E	2636	2580
4	E	2636	2580
5	E	2579	2524
6	E	2560	2506
7	E	1233	1206
7	E	1190	1164
8	E	1013	991
8	E	1013	991
9	E	457	447
9	E	457	447

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.829
B2	0.000	0.000	-0.829
H3	0.000	1.025	1.471
H4	0.000	-1.025	1.471
H5	1.025	0.000	-1.471
H6	-1.025	0.000	-1.471

	B1	B2	H3	H4	H5	H6
B1		1.6586	1.2093	1.2093	2.5181	2.5181
B2	1.6586		2.5181	2.5181	1.2093	1.2093
H3	1.2093	2.5181		2.0504	3.2792	3.2792
H4	1.2093	2.5181	2.0504		3.2792	3.2792
H5	2.5181	1.2093	3.2792	3.2792		2.0504
H6	2.5181	1.2093	3.2792	3.2792	2.0504

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	H5	122.029	B1	B2	H6	122.029
B2	B1	H3	122.029	B2	B1	H4	122.029
H3	B1	H4	115.942	H5	B2	H6	115.942

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

using model chemistry: MP4=FULL/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: MP4=FULL/3-21G

States and conformations

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