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	hartrees
Energy at 0K	-463.178881
Energy at 298.15K	-463.173751
HF Energy	-462.074725
Nuclear repulsion energy	191.659869

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2000	2000	728.57
2	A₁	1047	1047	102.62
3	A₁	908	908	38.11
4	A₁	582	582	120.30
5	B₁	937	937	65.01
6	B₁	179	179	53.75
7	B₂	1254	1254	678.25
8	B₂	761	761	0.71
9	B₂	541	541	9.38

Atom	y (Å)	z (Å)
C1	0.000	-0.705
O2	0.000	-1.889
Mg3	0.000	1.535
O4	1.105	0.058
O5	-1.105	0.058

	C1	O2	Mg3	O4	O5
C1		1.1837	2.2401	1.3426	1.3426
O2	1.1837		3.4238	2.2384	2.2384
Mg3	2.2401	3.4238		1.8443	1.8443
O4	1.3426	2.2384	1.8443		2.2093
O5	1.3426	2.2384	1.8443	2.2093

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	Mg3	87.846	C1	O5	Mg3	87.846
O2	C1	O4	124.641	O2	C1	O5	124.641
O4	C1	O5	110.719	O4	Mg3	O5	73.589

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

using model chemistry: CBS-Q

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: CBS-Q

States and conformations

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