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	hartrees
Energy at 0K	-50.484642
Energy at 298.15K	-50.483907
HF Energy	-50.403610
Nuclear repulsion energy	15.228995

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2850	2708	0.00
2	Σ_g	1266	1203	0.00
3	Σ_u	2809	2669	37.89
4	Π_g	207	197	0.00
4	Π_g	207	197	0.00
5	Π_u	589	560	1.90
5	Π_u	589	560	1.90

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.764
B2	0.000	0.000	-0.764
H3	0.000	0.000	1.945
H4	0.000	0.000	-1.945

	B1	B2	H3	H4
B1		1.5274	1.1816	2.7091
B2	1.5274		2.7091	1.1816
H3	1.1816	2.7091		3.8907
H4	2.7091	1.1816	3.8907

All results from a given calculation for HBBH (Diborane(2))

using model chemistry: MP2=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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