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	hartrees
Energy at 0K	-188.534479
Energy at 298.15K	-188.534433
HF Energy	-188.534479
Nuclear repulsion energy	56.026894

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	1203	1197	0.00
2	Σ_u	2201	2188	422.87
3	Π_u	577	574	16.83
3	Π_u	577	574	16.83

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
O2	0.000	0.000	1.209
O3	0.000	0.000	-1.209

	C1	O2	O3
C1		1.2090	1.2090
O2	1.2090		2.4179
O3	1.2090	2.4179

Number	Element	Mulliken
1	C	0.269
2	O	-0.134
3	O	-0.134

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

using model chemistry: BLYP/SDD

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>	33.804
(<r²>)^1/2	5.814

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

using model chemistry: BLYP/SDD

States and conformations

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