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	hartrees
Energy at 0K	-188.118363
Energy at 298.15K	-188.118405
HF Energy	-187.628413
Nuclear repulsion energy	57.467598

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	1336	1249	0.00	24.87	0.23	0.38
2	Σ_u	2455	2294	455.40	0.00	0.00	0.00
3	Π_u	642	600	25.61	0.00	0.00	0.00
3	Π_u	642	600	25.61	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	1.179
O3	0.000	0.000	-1.179

	C1	O2	O3
C1		1.1787	1.1787
O2	1.1787		2.3573
O3	1.1787	2.3573

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

using model chemistry: MP2=FULL/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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All results from a given calculation for CO2 (Carbon dioxide)

using model chemistry: MP2=FULL/6-31G**

States and conformations

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