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	hartrees
Energy at 0K	-113.774653
Energy at 298.15K
HF Energy	-113.668712
Nuclear repulsion energy	26.291205

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	2699	2699	82.87	229.84	0.35	0.52
2	A'	1869	1869	75.51	14.81	0.57	0.73
3	A'	1097	1097	37.51	6.72	0.30	0.47

Atom	x (Å)	y (Å)
C1	0.062	0.590
H2	-0.871	1.226
O3	0.062	-0.596

	C1	H2	O3
C1		1.1289	1.1864
H2	1.1289		2.0468
O3	1.1864	2.0468

Number	Element	Mulliken
1	C	0.494
2	H	-0.198
3	O	-0.295

All results from a given calculation for HCO (Formyl radical)

using model chemistry: B2PLYP/daug-cc-pVDZ

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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	x	y	z	Total
	-0.971	1.319	0.000	1.637
CHELPG
AIM
ESP

	x	y	z
x	2.631	-0.202	0.001
y	-0.202	3.253	0.001
z	0.001	0.001	1.978

<r²>	14.461
(<r²>)^1/2	3.803