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	hartrees
Energy at 0K	-463.358297
Energy at 298.15K
HF Energy	-463.181067
Nuclear repulsion energy	183.627156

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1719	1719	327.49
2	A₁	819	819	80.16
3	A₁	753	753	0.52
4	A₁	500	500	72.46
5	B₁	717	717	16.90
6	B₁	160	160	48.45
7	B₂	831	831	402.89
8	B₂	617	617	13.17
9	B₂	455	455	0.05

Atom	y (Å)	z (Å)
C1	0.000	-0.739
O2	0.000	-1.968
Mg3	0.000	1.582
O4	1.168	0.075
O5	-1.168	0.075

	C1	O2	Mg3	O4	O5
C1		1.2295	2.3206	1.4239	1.4239
O2	1.2295		3.5501	2.3539	2.3539
Mg3	2.3206	3.5501		1.9065	1.9065
O4	1.4239	2.3539	1.9065		2.3366
O5	1.4239	2.3539	1.9065	2.3366

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	Mg3	87.072	C1	O5	Mg3	87.072
O2	C1	O4	124.864	O2	C1	O5	124.864
O4	C1	O5	110.272	O4	Mg3	O5	75.584

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

using model chemistry: B2PLYP=FULLultrafine/6-31G

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: B2PLYP=FULLultrafine/6-31G

States and conformations

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