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	hartrees
Energy at 0K	-50.094895
Energy at 298.15K	-50.094896
HF Energy	-50.094895
Nuclear repulsion energy	15.793579

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	3201	3201	0.00
2	Σ_g	1476	1476	0.00
3	Σ_u	3142	3142	19.70
4	Π_g	616	616	0.00
4	Π_g	616	616	0.00
5	Π_u	663	663	26.72
5	Π_u	663	663	26.72

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.729
B2	0.000	0.000	-0.729
H3	0.000	0.000	1.890
H4	0.000	0.000	-1.890

	B1	B2	H3	H4
B1		1.4574	1.1616	2.6190
B2	1.4574		2.6190	1.1616
H3	1.1616	2.6190		3.7805
H4	2.6190	1.1616	3.7805

Number	Element	Mulliken
1	B	0.036
2	B	0.036
3	H	-0.036
4	H	-0.036

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

using model chemistry: wB97X-D/STO-3G

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>	19.617
(<r²>)^1/2	4.429