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	hartrees
Energy at 0K	-50.576380
Energy at 298.15K	-50.575944
HF Energy	-50.425420
Nuclear repulsion energy	15.365227

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2906	2704	0.00
2	Σ_g	1283	1194	0.00
3	Σ_u	2866	2667	31.47
4	Π_g	320	298	0.00
4	Π_g	320	298	0.00
5	Π_u	590	549	0.09
5	Π_u	590	549	0.09

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.757
B2	0.000	0.000	-0.757
H3	0.000	0.000	1.928
H4	0.000	0.000	-1.928

	B1	B2	H3	H4
B1		1.5141	1.1709	2.6850
B2	1.5141		2.6850	1.1709
H3	1.1709	2.6850		3.8559
H4	2.6850	1.1709	3.8559

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

using model chemistry: MP3/6-31+G**

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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