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	hartrees
Energy at 0K	-935.251671
Energy at 298.15K	-935.251181
HF Energy	-935.251671
Nuclear repulsion energy	81.159192

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	370	356	0.00
2	Σ_u	1127	1083	351.99
3	Π_u	263	253	50.65
3	Π_u	263	253	50.65

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	0.000
Cl2	0.000	0.000	1.829
Cl3	0.000	0.000	-1.829

	Be1	Cl2	Cl3
Be1		1.8289	1.8289
Cl2	1.8289		3.6579
Cl3	1.8289	3.6579

Number	Element	Mulliken
1	Be	0.225
2	Cl	-0.112
3	Cl	-0.112

All results from a given calculation for BeCl₂ (Beryllium chloride)

using model chemistry: B3LYP/SDD

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>	134.021
(<r²>)^1/2	11.577

All results from a given calculation for BeCl2 (Beryllium chloride)

using model chemistry: B3LYP/SDD

States and conformations

All results from a given calculation for BeCl₂ (Beryllium chloride)