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	hartrees
Energy at 0K	-587.107893
Energy at 298.15K	-587.110792
HF Energy	-586.346349
Nuclear repulsion energy	258.031225

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1340	1340	614.82
2	A₁	1002	1002	91.92
3	A₁	704	704	0.77
4	A₁	362	362	53.44
5	A₁	213	213	28.07
6	A₂	102	102
7	B₁	877	877	17.36
8	B₁	118	118	56.16
9	B₂	1571	1571	809.16
10	B₂	740	740	10.55
11	B₂	389	389	113.22
12	B₂	340	340	0.07

Atom	y (Å)	z (Å)
C1	0.000	-0.557
O2	0.000	0.800
O3	1.132	-1.160
O4	-1.132	-1.160
Na5	2.148	0.704
Na6	-2.148	0.704

	C1	O2	O3	O4	Na5	Na6
C1		1.3570	1.2823	1.2823	2.4913	2.4913
O2	1.3570		2.2630	2.2630	2.1505	2.1505
O3	1.2823	2.2630		2.2636	2.1232	3.7728
O4	1.2823	2.2630	2.2636		3.7728	2.1232
Na5	2.4913	2.1505	2.1232	3.7728		4.2967
Na6	2.4913	2.1505	3.7728	2.1232	4.2967

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	Na5	87.449	C1	O2	Na6	87.449
C1	O3	Na5	90.572	C1	O4	Na6	90.572
O2	C1	O3	118.035	O2	C1	O4	118.035
O2	Na5	O3	63.944	O2	Na6	O4	63.944
O3	C1	O4	123.929	Na5	O2	Na6	174.899

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

using model chemistry: CCSD=FULL/aug-cc-pVDZ

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 Na2CO3 (Sodium Carbonate)

using model chemistry: CCSD=FULL/aug-cc-pVDZ

States and conformations

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