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	hartrees
Energy at 0K	-151.248942
Energy at 298.15K	-151.247350
HF Energy	-151.050665
Nuclear repulsion energy	45.946065

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2028	2028	156.33
2	Σ	1092	1092	14.39
3	Π	394	394	40.93
3	Π	394	394	40.93

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.416
C2	0.000	0.000	-0.057
O3	0.000	0.000	1.105

	C1	C2	O3
C1		1.3591	2.5213
C2	1.3591		1.1622
O3	2.5213	1.1622

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

using model chemistry: B2PLYP=FULL/cc-pCVTZ

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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