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	hartrees
Energy at 0K	-185.283995
Energy at 298.15K	-185.283727
HF Energy	-185.060930
Nuclear repulsion energy	55.032439

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ_g	1276	1113	0.00	15.21	0.26	0.41
2	Σ_u	2598	2265	35.78	0.00	0.00	0.00
3	Π_u	478	417	3.69	0.00	0.00	0.00
3	Π_u	478	417	3.69	0.00	0.00	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
O2	0.000	0.000	1.231
O3	0.000	0.000	-1.231

	C1	O2	O3
C1		1.2308	1.2308
O2	1.2308		2.4616
O3	1.2308	2.4616

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

using model chemistry: MP2/STO-3G

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: MP2/STO-3G

States and conformations

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