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	hartrees
Energy at 0K	-90.492829
Energy at 298.15K	-90.492650
HF Energy	-90.492829
Nuclear repulsion energy	17.420380

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3918	3918	113.48	142.02	0.20	0.33
2	A'	1249	1249	106.05	5.32	0.75	0.86
3	A'	359	359	160.58	4.59	0.72	0.84

Atom	x (Å)	y (Å)
O1	0.048	-0.376
Be2	0.048	1.029
H3	-0.576	-1.104

	O1	Be2	H3
O1		1.4050	0.9589
Be2	1.4050		2.2222
H3	0.9589	2.2222

Number	Element	Mulliken
1	O	-0.121
2	Be	-0.070
3	H	0.192

All results from a given calculation for BeOH (beryllium monohydroxide)

using model chemistry: PBEPBEultrafine/6-311+G(3df,2p)

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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	x	y	z	Total
	-0.991	-0.640	0.000	1.180
CHELPG
AIM
ESP

	x	y	z
x	5.587	0.063	0.000
y	0.063	4.904	0.000
z	0.000	0.000	5.372

<r²>	14.467
(<r²>)^1/2	3.804