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	hartrees
Energy at 0K	-111.690870
Energy at 298.15K	-111.690724
HF Energy	-111.690870
Nuclear repulsion energy	25.235145

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'	4066	3320	3.52	59.44	0.30	0.47
2	A'	1552	1267	40.13	7.94	0.32	0.49
3	A'	1377	1124	141.08	4.95	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.813
O2	0.062	-0.501
H3	-0.865	-0.868

	C1	O2	H3
C1		1.3139	1.9190
O2	1.3139		0.9964
H3	1.9190	0.9964

Number	Element	Mulliken
1	C	0.066
2	O	-0.286
3	H	0.220

All results from a given calculation for COH (Hydroxymethylidyne)

using model chemistry: HF/STO-3G

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
	-1.477	-1.344	0.000	1.997
CHELPG
AIM
ESP

	x	y	z
x	0.980	0.351	0.000
y	0.351	1.270	0.000
z	0.000	0.000	0.668

<r²>	13.908
(<r²>)^1/2	3.729