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	hartrees
Energy at 0K	-935.377718
Energy at 298.15K	-935.377211
HF Energy	-935.377718
Nuclear repulsion energy	82.463448

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	398	385	0.00
2	Σ_u	1127	1091	432.41
3	Π_u	241	234	43.35
3	Π_u	241	234	43.35

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	0.000
Cl2	0.000	0.000	1.800
Cl3	0.000	0.000	-1.800

	Be1	Cl2	Cl3
Be1		1.8000	1.8000
Cl2	1.8000		3.6000
Cl3	1.8000	3.6000

Number	Element	Mulliken
1	Be	0.185
2	Cl	-0.092
3	Cl	-0.092

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

using model chemistry: B3LYPultrafine/aug-cc-pVTZ

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>	129.892
(<r²>)^1/2	11.397

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

using model chemistry: B3LYPultrafine/aug-cc-pVTZ

States and conformations

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