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	hartrees
Energy at 0K	-50.420090
Energy at 298.15K	-50.420242
HF Energy	-50.420090
Nuclear repulsion energy	15.439725

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2964	2537	0.00
2	Σ_g	1338	1145	0.00
3	Σ_u	2926	2504	53.67
4	Π_g	614	526	0.00
4	Π_g	614	526	0.00
5	Π_u	673	576	0.34
5	Π_u	673	576	0.34

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.752
B2	0.000	0.000	-0.752
H3	0.000	0.000	1.922
H4	0.000	0.000	-1.922

	B1	B2	H3	H4
B1		1.5031	1.1704	2.6735
B2	1.5031		2.6735	1.1704
H3	1.1704	2.6735		3.8439
H4	2.6735	1.1704	3.8439

Number	Element	Mulliken
1	B	-0.083
2	B	-0.083
3	H	0.083
4	H	0.083

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

using model chemistry: ROHF/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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<r²>	21.716
(<r²>)^1/2	4.660