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	hartrees
Energy at 0K	-188.249984
Energy at 298.15K	-188.250072
HF Energy	-187.650856
Nuclear repulsion energy	58.063918

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	1381	1381	0.00
2	Σ_u	2435	2435	656.05
3	Π_u	675	675	32.61
3	Π_u	675	675	32.61

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
O2	0.000	0.000	1.167
O3	0.000	0.000	-1.167

	C1	O2	O3
C1		1.1666	1.1666
O2	1.1666		2.3331
O3	1.1666	2.3331

All results from a given calculation for CO₂ (Carbon dioxide)

using model chemistry: CCSD=FULL/cc-pCVDZ

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 CO2 (Carbon dioxide)

using model chemistry: CCSD=FULL/cc-pCVDZ

States and conformations

All results from a given calculation for CO₂ (Carbon dioxide)