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	hartrees
Energy at 0K	-572.246289
Energy at 298.15K	-572.245571
HF Energy	-572.246289
Nuclear repulsion energy	78.648923

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2139	1948	549.74
2	A'	577	526	71.07
3	A'	237	216	82.33

Atom	x (Å)	y (Å)
Cl1	-0.484	-0.918
C2	0.000	0.851
O3	1.029	1.312

	Cl1	C2	O3
Cl1		1.8342	2.6953
C2	1.8342		1.1279
O3	2.6953	1.1279

Number	Element	Mulliken
1	Cl	-0.048
2	C	0.285
3	O	-0.237

All results from a given calculation for ClCO (carbonyl monochloride)

using model chemistry: HF/aug-cc-pVTZ

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
	-0.664	0.047	0.000	0.666
CHELPG
AIM
ESP

	x	y	z
x	4.087	0.935	0.000
y	0.935	5.753	0.000
z	0.000	0.000	3.226

<r²>	59.711
(<r²>)^1/2	7.727