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	hartrees
Energy at 0K	-113.756676
Energy at 298.15K	-113.756497
HF Energy	-113.756676
Nuclear repulsion energy	25.515667

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'	2617	2596	398.41	1022.82	0.33	0.50
2	A'	1294	1283	9.82	45.81	0.47	0.64
3	A'	1038	1030	52.66	234.95	0.39	0.56

Atom	x (Å)	y (Å)
C1	0.061	0.801
O2	0.061	-0.484
H3	-0.860	-0.933

	C1	O2	H3
C1		1.2850	1.9632
O2	1.2850		1.0245
H3	1.9632	1.0245

Number	Element	Mulliken
1	C	-0.008
2	O	-0.360
3	H	0.367

All results from a given calculation for COH (Hydroxymethylidyne)

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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	x	y	z	Total
	-1.516	-2.030	0.000	2.533
CHELPG
AIM
ESP

	x	y	z
x	1.962	0.763	0.000
y	0.763	3.034	0.000
z	0.000	0.000	1.321

<r²>	14.587
(<r²>)^1/2	3.819