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	hartrees
Energy at 0K	-40.656404
Energy at 298.15K
HF Energy	-40.656404
Nuclear repulsion energy	30.361800

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'	1681	1628	468.89	11.86	0.31	0.47
2	A'	591	572	103.98	5.86	0.39	0.56
3	A'	346	335	38.04	18.00	0.43	0.60

Atom	x (Å)	y (Å)
Cl1	-0.559	-0.963
N2	0.000	0.995
O3	1.188	1.175

	Cl1	N2	O3
Cl1		2.0360	2.7609
N2	2.0360		1.2013
O3	2.7609	1.2013

Number	Element	Mulliken
1	Cl	-0.082
2	N	-0.024
3	O	0.106

All results from a given calculation for ClNO (Nitrosyl chloride)

using model chemistry: B3LYP/CEP-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
	0.684	1.314	0.000	1.481
CHELPG
AIM
ESP

	x	y	z
x	2.957	2.440	0.000
y	2.440	5.849	0.000
z	0.000	0.000	0.834

<r²>	44.712
(<r²>)^1/2	6.687