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	hartrees
Energy at 0K	-278.411303
Energy at 298.15K
HF Energy	-278.125237
Nuclear repulsion energy	138.079664

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1935	1935	360.02
2	A₁	1130	1130	113.51
3	A₁	861	861	135.01
4	A₁	738	738	84.08
5	B₁	795	795	30.83
6	B₁	307	307	70.86
7	B₂	1232	1232	355.71
8	B₂	725	725	84.82
9	B₂	574	574	1.90

Atom	y (Å)	z (Å)
C1	0.000	0.336
O2	0.000	1.520
Be3	0.000	-1.475
O4	1.107	-0.517
O5	-1.107	-0.517

	C1	O2	Be3	O4	O5
C1		1.1845	1.8106	1.3981	1.3981
O2	1.1845		2.9951	2.3193	2.3193
Be3	1.8106	2.9951		1.4638	1.4638
O4	1.3981	2.3193	1.4638		2.2149
O5	1.3981	2.3193	1.4638	2.2149

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	Be3	78.455	C1	O5	Be3	78.455
O2	C1	O4	127.617	O2	C1	O5	127.617
O4	C1	O5	104.767	O4	Be3	O5	98.323

All results from a given calculation for BeCO₃ (Beryllium Carbonate)

using model chemistry: B2PLYP=FULLultrafine/6-31G(2df,p)

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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All results from a given calculation for BeCO3 (Beryllium Carbonate)

using model chemistry: B2PLYP=FULLultrafine/6-31G(2df,p)

States and conformations

All results from a given calculation for BeCO₃ (Beryllium Carbonate)