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	hartrees
Energy at 0K	-463.693466
Energy at 298.15K
HF Energy	-463.383184
Nuclear repulsion energy	188.452614

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1802	1802	409.36
2	A₁	898	898	82.52
3	A₁	815	815	4.64
4	A₁	531	531	80.30
5	B₁	803	803	15.09
6	B₁	164	164	43.63
7	B₂	965	965	513.73
8	B₂	674	674	0.82
9	B₂	490	490	0.38

Atom	y (Å)	z (Å)
C1	0.000	-0.708
O2	0.000	-1.910
Mg3	0.000	1.545
O4	1.142	0.062
O5	-1.142	0.062

	C1	O2	Mg3	O4	O5
C1		1.2028	2.2524	1.3772	1.3772
O2	1.2028		3.4552	2.2791	2.2791
Mg3	2.2524	3.4552		1.8717	1.8717
O4	1.3772	2.2791	1.8717		2.2842
O5	1.3772	2.2791	1.8717	2.2842

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	Mg3	86.367	C1	O5	Mg3	86.367
O2	C1	O4	123.971	O2	C1	O5	123.971
O4	C1	O5	112.059	O4	Mg3	O5	75.208

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

using model chemistry: B2PLYP=FULLultrafine/6-311G**

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/6-311G**

States and conformations

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