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	hartrees
Energy at 0K	-90.615919
Energy at 298.15K	-90.615724
HF Energy	-90.615919
Nuclear repulsion energy	17.547580

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	4025	3892	137.77
2	A'	1282	1239	122.32
3	A'	342	331	171.20

Atom	x (Å)	y (Å)
O1	0.044	-0.371
Be2	0.044	1.024
H3	-0.531	-1.128

	O1	Be2	H3
O1		1.3944	0.9506
Be2	1.3944		2.2269
H3	0.9506	2.2269

Number	Element	Mulliken
1	O	-0.134
2	Be	-0.069
3	H	0.204

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

using model chemistry: B3LYP/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
	-0.959	-0.647	0.000	1.157
CHELPG
AIM
ESP

	x	y	z
x	5.359	0.060	0.000
y	0.060	4.592	0.000
z	0.000	0.000	5.182

<r²>	14.310
(<r²>)^1/2	3.783