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	hartrees
Energy at 0K	-463.901776
Energy at 298.15K	-463.903717
HF Energy	-463.901776
Nuclear repulsion energy	190.565873

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1838	1758	530.87
2	A₁	950	908	87.74
3	A₁	841	804	21.41
4	A₁	536	512	110.18
5	B₁	836	800	18.16
6	B₁	167	160	46.25
7	B₂	1095	1047	589.32
8	B₂	699	668	0.00
9	B₂	513	491	6.41

Atom	y (Å)	z (Å)
C1	0.000	-0.697
O2	0.000	-1.896
Mg3	0.000	1.522
O4	1.129	0.067
O5	-1.129	0.067

	C1	O2	Mg3	O4	O5
C1		1.1990	2.2190	1.3630	1.3630
O2	1.1990		3.4180	2.2643	2.2643
Mg3	2.2190	3.4180		1.8418	1.8418
O4	1.3630	2.2643	1.8418		2.2579
O5	1.3630	2.2643	1.8418	2.2579

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	Mg3	86.276	C1	O5	Mg3	86.276
O2	C1	O4	124.080	O2	C1	O5	124.080
O4	C1	O5	111.839	O4	Mg3	O5	75.609

All results from a given calculation for MgCO₃ (Magnesium Carbonate)

using model chemistry: wB97X-D/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 MgCO3 (Magnesium Carbonate)

using model chemistry: wB97X-D/cc-pVTZ

States and conformations

All results from a given calculation for MgCO₃ (Magnesium Carbonate)