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	hartrees
Energy at 0K	-150.531957
Energy at 298.15K	-150.530558
HF Energy	-150.531957
Nuclear repulsion energy	46.901265

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2221	2221	407.73
2	Σ	1162	1162	0.19
3	Π	502	502	62.66
3	Π	502	502	62.66

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.396
C2	0.000	0.000	-0.046
O3	0.000	0.000	1.081

	C1	C2	O3
C1		1.3499	2.4771
C2	1.3499		1.1272
O3	2.4771	1.1272

Number	Element	Mulliken
1	C	-0.223
2	C	0.650
3	O	-0.427

All results from a given calculation for CCO (Dicarbon monoxide)

using model chemistry: ROHF/aug-cc-pVQZ

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>	32.517
(<r²>)^1/2	5.702