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	hartrees
Energy at 0K	-278.394303
Energy at 298.15K
HF Energy	-278.140800
Nuclear repulsion energy	136.974651

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1871	1800	417.54
2	A₁	1085	1044	122.19
3	A₁	844	812	151.29
4	A₁	718	691	87.13
5	B₁	772	743	30.01
6	B₁	296	285	75.83
7	B₂	1183	1139	417.07
8	B₂	710	683	77.99
9	B₂	560	539	3.64

Atom	y (Å)	z (Å)
C1	0.000	0.338
O2	0.000	1.533
Be3	0.000	-1.501
O4	1.113	-0.518
O5	-1.113	-0.518

	C1	O2	Be3	O4	O5
C1		1.1941	1.8397	1.4044	1.4044
O2	1.1941		3.0338	2.3332	2.3332
Be3	1.8397	3.0338		1.4852	1.4852
O4	1.4044	2.3332	1.4852		2.2263
O5	1.4044	2.3332	1.4852	2.2263

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	Be3	79.028	C1	O5	Be3	79.028
O2	C1	O4	127.572	O2	C1	O5	127.572
O4	C1	O5	104.855	O4	Be3	O5	97.088

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

using model chemistry: B2PLYP=FULLultrafine/aug-cc-pVDZ

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/aug-cc-pVDZ

States and conformations

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