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	hartrees
Energy at 0K	-462.890617
Energy at 298.15K	-462.892533
HF Energy	-462.166874
Nuclear repulsion energy	189.357495

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1865	1768	551.58
2	A₁	956	907	114.88
3	A₁	839	795	14.30
4	A₁	538	510	120.55
5	B₁	830	787	28.29
6	B₁	157	148	56.93
7	B₂	1094	1037	556.28
8	B₂	705	668	0.01
9	B₂	503	477	11.77

Atom	y (Å)	z (Å)
C1	0.000	-0.711
O2	0.000	-1.908
Mg3	0.000	1.547
O4	1.127	0.060
O5	-1.127	0.060

	C1	O2	Mg3	O4	O5
C1		1.1979	2.2577	1.3650	1.3650
O2	1.1979		3.4556	2.2682	2.2682
Mg3	2.2577	3.4556		1.8655	1.8655
O4	1.3650	2.2682	1.8655		2.2531
O5	1.3650	2.2682	1.8655	2.2531

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	Mg3	87.231	C1	O5	Mg3	87.231
O2	C1	O4	124.380	O2	C1	O5	124.380
O4	C1	O5	111.240	O4	Mg3	O5	74.298

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

using model chemistry: CCD/TZVP

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: CCD/TZVP

States and conformations

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