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	hartrees
Energy at 0K	-166.571747
Energy at 298.15K	-166.573188
HF Energy	-166.571747
Nuclear repulsion energy	48.587892

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3838	3825	18.60
2	A	724	721	1.43
3	A	544	542	78.93
4	A	317	316	22.01
5	A	204	203	125.51
6	B	3836	3823	163.25
7	B	1490	1484	397.71
8	B	540	538	308.88
9	B	313	312	59.37

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	0.011
O2	0.000	1.435	-0.054
O3	0.000	-1.435	-0.054
H4	0.544	2.078	0.412
H5	-0.544	-2.078	0.412

	Be1	O2	O3	H4	H5
Be1		1.4369	1.4369	2.1850	2.1850
O2	1.4369		2.8708	0.9623	3.5857
O3	1.4369	2.8708		3.5857	0.9623
H4	2.1850	0.9623	3.5857		4.2959
H5	2.1850	3.5857	0.9623	4.2959

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Be1	O2	H4	130.168		Be1	O3	H5	130.168
O2	Be1	O3	174.770

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

using model chemistry: BLYP/aug-cc-pVTZ

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	0.380
2	O	-0.296
3	O	-0.296
4	H	0.106
5	H	0.106

	x	y	z	Total
	0.000	0.000	1.569	1.569
CHELPG
AIM
ESP

	x	y	z
x	3.492	0.050	0.000
y	0.050	4.718	0.000
z	0.000	0.000	3.492

<r²>	52.641
(<r²>)^1/2	7.255

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

using model chemistry: BLYP/aug-cc-pVTZ

States and conformations

Conformer 1 (C2V)

Conformer 2 (C2)

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