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	hartrees
Energy at 0K	-89.735803
Energy at 298.15K
HF Energy	-89.604671
Nuclear repulsion energy	17.572459

	hartrees
Energy at 0K	-89.737415
Energy at 298.15K	-89.737084
HF Energy	-89.606354
Nuclear repulsion energy	17.426409

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3930	3657	170.19
2	Σ	1432	1332	81.80
3	Π	258	240	237.80
3	Π	258	240	237.80

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.355
Be2	0.000	0.000	-1.040
H3	0.000	0.000	1.318

	O1	Be2	H3
O1		1.3959	0.9626
Be2	1.3959		2.3585
H3	0.9626	2.3585

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

using model chemistry: CID/3-21G*

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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