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	hartrees
Energy at 0K	-188.563058
Energy at 298.15K	-188.563052
HF Energy	-188.563058
Nuclear repulsion energy	57.265875

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	1305	1295	0.00	14.92	0.21	0.35
2	Σ_u	2347	2329	428.14	0.00	0.00	0.00
3	Π_u	601	597	21.62	0.00	0.00	0.00
3	Π_u	601	597	21.62	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	1.183
O3	0.000	0.000	-1.183

	C1	O2	O3
C1		1.1828	1.1828
O2	1.1828		2.3656
O3	1.1828	2.3656

Number	Element	Mulliken
1	C	0.666
2	O	-0.333
3	O	-0.333

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

using model chemistry: BLYP/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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<r²>	32.308
(<r²>)^1/2	5.684

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

using model chemistry: BLYP/6-31G**

States and conformations

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