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	hartrees
Energy at 0K	-586.981375
Energy at 298.15K	-586.984205
HF Energy	-586.280660
Nuclear repulsion energy	254.796815

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1349	1298
2	A₁	993	955
3	A₁	697	671
4	A₁	358	344
5	A₁	206	198
6	A₂	108	104
7	B₁	842	810
8	B₁	97	93
9	B₂	1610	1549
10	B₂	737	709
11	B₂	384	369
12	B₂	369	355

Atom	y (Å)	z (Å)
C1	0.000	-0.573
O2	0.000	0.793
O3	1.135	-1.177
O4	-1.135	-1.177
Na5	2.185	0.723
Na6	-2.185	0.723

	C1	O2	O3	O4	Na5	Na6
C1		1.3659	1.2854	1.2854	2.5408	2.5408
O2	1.3659		2.2734	2.2734	2.1866	2.1866
O3	1.2854	2.2734		2.2694	2.1711	3.8253
O4	1.2854	2.2734	2.2694		3.8253	2.1711
Na5	2.5408	2.1866	2.1711	3.8253		4.3710
Na6	2.5408	2.1866	3.8253	2.1711	4.3710

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	Na5	88.163	C1	O2	Na6	88.163
C1	O3	Na5	90.920	C1	O4	Na6	90.920
O2	C1	O3	118.027	O2	C1	O4	118.027
O2	Na5	O3	62.890	O2	Na6	O4	62.890
O3	C1	O4	123.946	Na5	O2	Na6	176.326

All results from a given calculation for Na₂CO₃ (Sodium Carbonate)

using model chemistry: CCSD(T)/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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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All results from a given calculation for Na2CO3 (Sodium Carbonate)

using model chemistry: CCSD(T)/6-31G*

States and conformations

All results from a given calculation for Na₂CO₃ (Sodium Carbonate)