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	hartrees
Energy at 0K	-278.228278
Energy at 298.15K	-278.229536
HF Energy	-277.258150
Nuclear repulsion energy	139.009620

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1957	1862	469.18
2	A₁	1153	1096	140.84
3	A₁	911	866	182.99
4	A₁	763	726	77.65
5	B₁	825	785	37.58
6	B₁	310	294	80.22
7	B₂	1253	1191	469.96
8	B₂	815	775	56.60
9	B₂	594	565	1.59

Atom	y (Å)	z (Å)
C1	0.000	0.333
O2	0.000	1.512
Be3	0.000	-1.485
O4	1.095	-0.509
O5	-1.095	-0.509

	C1	O2	Be3	O4	O5
C1		1.1791	1.8176	1.3808	1.3808
O2	1.1791		2.9967	2.2983	2.2983
Be3	1.8176	2.9967		1.4663	1.4663
O4	1.3808	2.2983	1.4663		2.1890
O5	1.3808	2.2983	1.4663	2.1890

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	Be3	79.283	C1	O5	Be3	79.283
O2	C1	O4	127.567	O2	C1	O5	127.567
O4	C1	O5	104.866	O4	Be3	O5	96.567

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

using model chemistry: CCSD=FULL/aug-cc-pVTZ

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: CCSD=FULL/aug-cc-pVTZ

States and conformations

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