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	hartrees
Energy at 0K	-113.799615
Energy at 298.15K	-113.799441
HF Energy	-113.799615
Nuclear repulsion energy	25.710978

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'	2795	2784	344.29	1462.14	0.33	0.50
2	A'	1299	1294	9.52	80.69	0.40	0.57
3	A'	1048	1044	47.10	253.65	0.39	0.56

Atom	x (Å)	y (Å)
C1	0.061	0.795
O2	0.061	-0.482
H3	-0.851	-0.920

	C1	O2	H3
C1		1.2769	1.9424
O2	1.2769		1.0116
H3	1.9424	1.0116

Number	Element	Mulliken
1	C	-0.093
2	O	-0.144
3	H	0.237

All results from a given calculation for COH (Hydroxymethylidyne)

using model chemistry: BLYP/6-311G**

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
	-1.560	-2.145	0.000	2.652
CHELPG
AIM
ESP

	x	y	z
x	2.122	0.744	0.000
y	0.744	3.243	0.000
z	0.000	0.000	1.506

<r²>	14.696
(<r²>)^1/2	3.834