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	hartrees
Energy at 0K	-37.328726
Energy at 298.15K	-37.328809
HF Energy	-36.915345
Nuclear repulsion energy	29.717222

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	1421	1310	0.00
2	Σ_u	2484	2290	871.73
3	Π_u	683	629	38.72
3	Π_u	683	629	38.72

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
O2	0.000	0.000	1.175
O3	0.000	0.000	-1.175

	C1	O2	O3
C1		1.1753	1.1753
O2	1.1753		2.3505
O3	1.1753	2.3505

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

using model chemistry: CISD/CEP-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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All results from a given calculation for CO2 (Carbon dioxide)

using model chemistry: CISD/CEP-31G*

States and conformations

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