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State	Conformation	minimum conformation	conformer description	state description
1	1	yes	CS	²A^'
1	2	no	C*V	²Σ

	hartrees
Energy at 0K	-17.419376
Energy at 298.15K	-17.419282
HF Energy	-17.296328
Nuclear repulsion energy	8.207776

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	4065	3928	182.12
2	Σ	1244	1202	120.54
3	Π	363	351	258.81
3	Π	363	351	258.81

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.363
Be2	0.000	0.000	-1.058
H3	0.000	0.000	1.327

	O1	Be2	H3
O1		1.4206	0.9639
Be2	1.4206		2.3845
H3	0.9639	2.3845

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

using model chemistry: MP2/CEP-31G

States and conformations

Conformer 1 (CS)

Conformer 2 (C*V)

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	4065	3928	182.11
2	Σ	1244	1202	120.54
3	Π	363	351	258.81
3	Π	363	351	258.81