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	hartrees
Energy at 0K	-166.519630
Energy at 298.15K	-166.521073
HF Energy	-166.519630
Nuclear repulsion energy	48.664022

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3909	3909	22.55
2	A	723	723	3.32
3	A	565	565	87.00
4	A	308	308	24.42
5	A	205	205	102.64
6	B	3907	3907	146.93
7	B	1490	1490	355.46
8	B	551	551	305.68
9	B	307	307	66.16

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	-0.003
O2	0.000	1.437	-0.057
O3	0.000	-1.437	-0.057
H4	0.510	2.051	0.466
H5	-0.510	-2.051	0.466

	Be1	O2	O3	H4	H5
Be1		1.4377	1.4377	2.1655	2.1655
O2	1.4377		2.8734	0.9551	3.5639
O3	1.4377	2.8734		3.5639	0.9551
H4	2.1655	0.9551	3.5639		4.2280
H5	2.1655	3.5639	0.9551	4.2280

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Be1	O2	H4	128.514		Be1	O3	H5	128.514
O2	Be1	O3	175.706

All results from a given calculation for Be(OH)₂ (Beryllium hydroxide)

using model chemistry: B97D3/cc-pVQZ

States and conformations

Conformer 1 (C2V)

Conformer 2 (C2)

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken
1	Be	0.763
2	O	-0.612
3	O	-0.612
4	H	0.230
5	H	0.230

	x	y	z	Total
	0.000	0.000	1.703	1.703
CHELPG
AIM
ESP

	x	y	z
x	3.056	0.059	0.000
y	0.059	4.257	0.000
z	0.000	0.000	3.077

<r²>	52.276
(<r²>)^1/2	7.230

All results from a given calculation for Be(OH)2 (Beryllium hydroxide)

using model chemistry: B97D3/cc-pVQZ

States and conformations

Conformer 1 (C2V)

Conformer 2 (C2)

All results from a given calculation for Be(OH)₂ (Beryllium hydroxide)