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	hartrees
Energy at 0K	-113.744446
Energy at 298.15K	-113.744292
HF Energy	-113.744446
Nuclear repulsion energy	25.853472

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'	3508	3508	23.10	308.84	0.32	0.48
2	A'	1435	1435	69.88	4.76	0.75	0.86
3	A'	1151	1151	104.48	21.98	0.48	0.65

Atom	x (Å)	y (Å)
C1	0.060	0.794
O2	0.060	-0.485
H3	-0.837	-0.881

	C1	O2	H3
C1		1.2788	1.8998
O2	1.2788		0.9803
H3	1.8998	0.9803

Number	Element	Mulliken
1	C	0.003
2	O	-0.355
3	H	0.352

All results from a given calculation for COH (Hydroxymethylidyne)

using model chemistry: wB97X-D/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
	-1.700	-2.124	0.000	2.720
CHELPG
AIM
ESP

	x	y	z
x	1.711	0.370	0.000
y	0.370	2.435	0.000
z	0.000	0.000	1.351

<r²>	14.336
(<r²>)^1/2	3.786