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	hartrees
Energy at 0K	-90.254676
Energy at 298.15K	-90.254998
HF Energy	-90.254676
Nuclear repulsion energy	17.087371

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	818	777	0.00
2	Σ_u	1078	1024	372.11
3	Π_u	128	121	185.06
3	Π_u	128	121	185.06

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.000
Li2	0.000	0.000	1.626
Li3	0.000	0.000	-1.626

	O1	Li2	Li3
O1		1.6259	1.6259
Li2	1.6259		3.2517
Li3	1.6259	3.2517

Number	Element	Mulliken
1	O	-0.797
2	Li	0.398
3	Li	0.398

All results from a given calculation for Li₂O (dilithium oxide)

using model chemistry: B1B95/6-31G*

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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<r²>	19.304
(<r²>)^1/2	4.394

All results from a given calculation for Li2O (dilithium oxide)

using model chemistry: B1B95/6-31G*

States and conformations

All results from a given calculation for Li₂O (dilithium oxide)